A0A087X844_POEFO Loading...

Ecto-NOX disulfide-thiol exchanger 2

AlphaFold DB , UniProt , Accession A0A087X844, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 684 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	28.3	Very low	242 Å²	242	181.2 Å²	181.2	100%	1.192	88%	0.879	S	S	*	*				0	131.1	0	-76.3	172.1	166.1	0	0	107.8
2	Y	25.2	Very low	28.2	Very low	227 Å²	227	172.1 Å²	172.1	89%	0.89	87%	0.867	S	S	*	*			trans	-69.7	156.9	165.9	-84.1	-108.4	0	0	0	109.8
3	K	30.5	Very low	28.5	Very low	197 Å²	197	171.8 Å²	171.8	86%	0.857	87%	0.869	S	S	*	*			trans	-124.9	119.7	161.1	-95.5	-174	173.7	178.9	0	108.2
4	D	27.5	Very low	28.7	Very low	151 Å²	151	171.1 Å²	171.1	81%	0.807	87%	0.868	S	S	*	*			trans	-66.8	130.1	-179.1	-49.6	-93.9	0	0	0	111.3
5	Y	26.9	Very low	29	Very low	236 Å²	236	166.4 Å²	166.4	93%	0.925	87%	0.866	S	S	*	*			trans	-94.1	113.4	160.6	-104.3	-92.7	0	0	0	109.9
6	R	27	Very low	29.3	Very low	238 Å²	238	165.7 Å²	165.7	90%	0.898	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-82.8	117.8	-170.6	-162.4	-174.8	-153.3	178.7	7.4	109.7	G8	R6-G8 PolarHBondContact O-N 3.21Å
7	S	26.6	Very low	29.7	Very low	124 Å²	124	162.7 Å²	162.7	87%	0.867	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-60.4	119.7	176.4	-176.3	0	0	0	0	111
8	G	26.3	Very low	30.1	Very low	64 Å²	64	164.1 Å²	164.1	66%	0.66	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-95.2	124.3	179.7	0	0	0	0	0	111.3	R6 V10	R6-G8 PolarHBondContact O-N 3.21Å; G8-V10 PolarHBondContact O-N 2.75Å
9	R	28.9	Very low	30.6	Very low	243 Å²	243	160.5 Å²	160.5	92%	0.917	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-68.8	130	167.3	-68.8	-177.1	178	-174.2	-1.1	109.5
10	V	28.6	Very low	30.9	Very low	145 Å²	145	158.6 Å²	158.6	88%	0.879	83%	0.834	S	S	*	*			trans	-117.3	128.3	161.3	-179.6	0	0	0	0	107.6	G8	G8-V10 PolarHBondContact O-N 2.75Å
11	T	29.8	Very low	31.5	Very low	126 Å²	126	154.7 Å²	154.7	77%	0.773	82%	0.824	S	S	*	*			trans	-123.8	125.5	-179.6	47.3	0	0	0	0	110.5
12	G	27.2	Very low	31.9	Very low	72 Å²	72	147.8 Å²	147.8	74%	0.742	80%	0.796	S	S	*	*			trans	90.8	93.8	157.2	0	0	0	0	0	116.7
13	L	32.4	Very low	32.9	Very low	169 Å²	169	142.2 Å²	142.2	89%	0.885	78%	0.781	S	S	*	*			trans	-126.9	159.1	137.9	-76.7	178.7	0	0	0	108.2
14	N	31.9	Very low	34	Very low	161 Å²	161	139.2 Å²	139.2	86%	0.861	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-72.3	148.2	-156.4	-62.9	-59	0	0	0	114.6
15	A	32.1	Very low	34.8	Very low	101 Å²	101	138.1 Å²	138.1	84%	0.835	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-73.6	134.8	174.9	0	0	0	0	0	111.8
16	L	33.8	Very low	35.5	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-82.5	141.2	164	-64.9	172.3	0	0	0	109.1	F18	L16-F18 PolarHBondContact O-N 2.6Å
17	P	37.1	Very low	36	Very low	115 Å²	115	125.9 Å²	125.9	75%	0.747	74%	0.742	S	S	*	*	S	Bend	trans	-83	28.7	-169.4	34.6	-37.8	0	0	0	114.6
18	F	36.9	Very low	36.6	Very low	187 Å²	187	128.9 Å²	128.9	82%	0.82	74%	0.742	S	S	*	*			trans	-139.3	115.9	-179.4	-76.8	-81.2	0	0	0	111.8	L16	L16-F18 PolarHBondContact O-N 2.6Å
19	D	38.6	Very low	36.9	Very low	97 Å²	97	133.4 Å²	133.4	52%	0.519	74%	0.744	S	S	.	*			trans	-102.4	115.8	169.6	177	4.3	0	0	0	109.6	A21 T22	D19-A21 PolarHBondContact O-N 3.44Å; D19-A21 VanDerWaalsContact OD1-CB 3.27Å; D19-A21 WeakPolarHBondContact OD1-CB 3.43Å; D19-A21 PolarHBondContact OD1-N 3.38Å; D19-T22 PolarHBondContact O-OG1 3.28Å; D19-T22 VanDerWaalsContact O-OG1 3.13Å
20	P	37.4	Very low	37.1	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-60	-21.7	177.2	-23.2	34.1	0	0	0	114.7	T22	P20-T22 VanDerWaalsContact C-N 3.26Å; P20-T22 PolarHBondContact O-N 3.21Å
21	A	42.8	Very low	37.5	Very low	77 Å²	77	126.7 Å²	126.7	64%	0.636	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-74.7	-9.1	-172.8	0	0	0	0	0	114.8	D19	D19-A21 PolarHBondContact O-N 3.44Å; D19-A21 VanDerWaalsContact OD1-CB 3.27Å; D19-A21 WeakPolarHBondContact OD1-CB 3.43Å; D19-A21 PolarHBondContact OD1-N 3.38Å
22	T	43.3	Very low	37.5	Very low	96 Å²	96	126.8 Å²	126.8	59%	0.589	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-103.4	-8	-171.5	57.3	0	0	0	0	115.4	D19 P20 N24	D19-T22 PolarHBondContact O-OG1 3.28Å; D19-T22 VanDerWaalsContact O-OG1 3.13Å; P20-T22 VanDerWaalsContact C-N 3.26Å; P20-T22 PolarHBondContact O-N 3.21Å; T22-N24 PolarHBondContact O-N 2.72Å; T22-N24 PolarHBondContact O-ND2 3.03Å
23	N	45.4	Very low	37.7	Very low	110 Å²	110	129.1 Å²	129.1	59%	0.588	75%	0.75	S	S	*	*			trans	-73.5	121.5	177.8	-172.1	9.5	0	0	0	111.3	D25	N23-D25 PolarHBondContact OD1-N 3.19Å; N23-D25 VanDerWaalsContact OD1-N 3.1Å
24	N	52.7	Low	37.5	Very low	135 Å²	135	124.6 Å²	124.6	72%	0.722	75%	0.745	S	S	*	*			trans	-115.2	-0.2	179.3	-73.9	-89.3	0	0	0	113.3	T22	T22-N24 PolarHBondContact O-N 2.72Å; T22-N24 PolarHBondContact O-ND2 3.03Å
25	D	44.8	Very low	37.9	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	74%	0.74	S	S	*	*	S	Bend	trans	-90.1	141.3	-177.3	-75.1	-57.2	0	0	0	112.6	N23	N23-D25 PolarHBondContact OD1-N 3.19Å; N23-D25 VanDerWaalsContact OD1-N 3.1Å
26	P	41.4	Very low	37.7	Very low	94 Å²	94	125.6 Å²	125.6	61%	0.61	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-71.2	137.3	176.9	29.5	-34.2	0	0	0	111.5	Q28	P26-Q28 PolarHBondContact O-N 3.05Å
27	L	37.9	Very low	37.3	Very low	124 Å²	124	122 Å²	122	65%	0.649	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-60	117.7	-178.4	-65.9	173	0	0	0	111.9	F29	L27-F29 HydrophobicContact CB-CE2 4.01Å; L27-F29 HydrophobicContact CD1-CE2 4.49Å
28	Q	38.8	Very low	36.9	Very low	186 Å²	186	122.6 Å²	122.6	87%	0.869	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-93.5	128.7	169.8	-62.1	-169.6	28.4	0	0	110.2	P26	P26-Q28 PolarHBondContact O-N 3.05Å
29	F	33.6	Very low	36.4	Very low	160 Å²	160	122.8 Å²	122.8	70%	0.702	75%	0.747	S	S	*	*			trans	-110.2	114.6	171.1	-72.2	-88.9	0	0	0	109.2	L27	L27-F29 HydrophobicContact CB-CE2 4.01Å; L27-F29 HydrophobicContact CD1-CE2 4.49Å
30	N	32.4	Very low	35.7	Very low	169 Å²	169	124.2 Å²	124.2	90%	0.904	76%	0.763	S	S	*	*			trans	-147.5	129.5	167	-139.6	4.9	0	0	0	108.3
31	G	37.6	Very low	35.2	Very low	78 Å²	78	123.1 Å²	123.1	80%	0.804	76%	0.764	S	S	*	*			trans	-85.1	147.9	-166.4	0	0	0	0	0	114.5
32	S	29.5	Very low	35.1	Very low	127 Å²	127	124.9 Å²	124.9	89%	0.888	77%	0.77	S	S	*	*			trans	-154.4	157	159	-166	0	0	0	0	110.4
33	S	30.7	Very low	34.3	Very low	121 Å²	121	127.4 Å²	127.4	85%	0.846	78%	0.779	S	S	*	*			trans	-110.9	144.2	-174.9	49.7	0	0	0	0	112.3
34	G	27.9	Very low	33.4	Very low	75 Å²	75	128.1 Å²	128.1	77%	0.773	78%	0.782	S	S	*	*			trans	174.4	141.7	175.7	0	0	0	0	0	112.8
35	P	40.4	Very low	32.1	Very low	115 Å²	115	128.3 Å²	128.3	75%	0.747	78%	0.784	S	S	*	*			trans	-130	175.2	-161.9	43.9	-29.7	0	0	0	117.2
36	L	27.8	Very low	31.3	Very low	168 Å²	168	129.4 Å²	129.4	88%	0.88	80%	0.795	S	S	*	*			trans	73.1	146.6	156.3	-74.6	159.5	0	0	0	119.7
37	G	26.7	Very low	30.6	Very low	80 Å²	80	129 Å²	129	83%	0.825	80%	0.8	S	S	*	*			trans	167	61.8	179	0	0	0	0	0	114.3
38	T	28.9	Very low	30.2	Very low	127 Å²	127	131.3 Å²	131.3	78%	0.779	81%	0.807	S	S	*	*			trans	-96.1	135.3	176.8	-51.6	0	0	0	0	111
39	E	25.9	Very low	29.7	Very low	191 Å²	191	127.7 Å²	127.7	89%	0.893	79%	0.794	S	S	*	*			trans	-159.7	155.4	151.5	-124.6	168.7	-168.8	0	0	113.7
40	C	24.5	Very low	29.3	Very low	126 Å²	126	123 Å²	123	85%	0.851	79%	0.791	S	S	*	*			trans	-143.9	141.5	178.8	-73.6	0	0	0	0	109.8
41	A	26.8	Very low	29.3	Very low	99 Å²	99	123.4 Å²	123.4	82%	0.818	79%	0.785	S	S	*	*			trans	-154.7	151.6	163.9	0	0	0	0	0	112.1
42	P	39.8	Very low	28.7	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	79%	0.788	S	S	*	*			trans	-130.3	-153.1	-163.9	37.5	-15.6	0	0	0	114
43	L	27.3	Very low	28.6	Very low	149 Å²	149	134.8 Å²	134.8	78%	0.78	79%	0.789	S	S	*	*			trans	87.6	148.2	170.9	-50.6	175.7	0	0	0	115.8
44	D	26.2	Very low	28.4	Very low	124 Å²	124	138.3 Å²	138.3	66%	0.663	79%	0.789	S	S	*	*			cis	-149.1	-178.4	1.1	-138.7	-42.8	0	0	0	114
45	N	25.8	Very low	28.3	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	79%	0.794	S	S	*	*			trans	-78.9	165.9	-173.8	-66.1	-93	0	0	0	115.7
46	T	26.7	Very low	27.5	Very low	149 Å²	149	144.7 Å²	144.7	91%	0.914	80%	0.795	S	S	*	*				-177.5	159.4	120.8	-70.6	0	0	0	0	110.2
47	A	28	Very low	27.3	Very low	87 Å²	87	142.4 Å²	142.4	72%	0.719	79%	0.793	S	S	*	*			trans	-132.5	167.1	-159.7	0	0	0	0	0	117
48	E	28.3	Very low	27.4	Very low	171 Å²	171	146.7 Å²	146.7	80%	0.799	80%	0.796	S	S	*	*			trans	56.2	161.2	157.6	-73.3	-142.3	108.5	0	0	119.8
49	N	27.9	Very low	27.6	Very low	111 Å²	111	146.2 Å²	146.2	59%	0.594	80%	0.795	S	S	*	*			cis	-156.1	-170.9	12.1	-148.3	-60.7	0	0	0	110
50	G	26.8	Very low	28.5	Very low	62 Å²	62	142.3 Å²	142.3	64%	0.639	79%	0.786	S	S	*	*			trans	147.5	-6.2	136.1	0	0	0	0	0	128.1
51	K	31.1	Very low	28.6	Very low	177 Å²	177	145 Å²	145	77%	0.77	79%	0.786	S	S	*	*			trans	58.3	132.8	156	-72	157.1	-179.4	145.9	0	124.2
52	K	26.7	Very low	28.6	Very low	199 Å²	199	143.9 Å²	143.9	87%	0.865	78%	0.784	S	S	*	*			trans	89.5	149.6	133.9	-76.6	173.8	177	179.6	0	124.8
53	R	26.5	Very low	28	Very low	244 Å²	244	145.4 Å²	145.4	92%	0.921	78%	0.784	S	S	*	*			trans	107.2	146.5	148.2	-158.9	-179.4	-162.8	167.1	4.6	116.9
54	K	26.7	Very low	28	Very low	195 Å²	195	144.7 Å²	144.7	85%	0.848	79%	0.79	S	S	*	*			cis	-163.2	148.2	-38.2	-179.5	177.5	177.6	-174.3	0	110.7
55	R	25.1	Very low	27.9	Very low	233 Å²	233	145.6 Å²	145.6	88%	0.879	80%	0.795	S	S	*	*			trans	-37.3	150.8	174.4	171.2	-170.8	-75	-175	-2.9	118.9
56	A	23.4	Very low	28.1	Very low	92 Å²	92	146 Å²	146	76%	0.76	80%	0.795	S	S	*	*			trans	-120.4	-171.2	161.7	0	0	0	0	0	113.2
57	S	25.1	Very low	28	Very low	120 Å²	120	145.3 Å²	145.3	84%	0.839	79%	0.79	S	S	*	*			trans	-152.3	167.9	-167	52.5	0	0	0	0	116.5
58	L	28.6	Very low	28.1	Very low	169 Å²	169	149 Å²	149	89%	0.885	79%	0.794	S	S	*	*			trans	-105.6	161.7	176.3	-71.8	168.9	0	0	0	113.3
59	P	33.5	Very low	28	Very low	117 Å²	117	148 Å²	148	76%	0.76	80%	0.795	S	S	*	*			trans	-116.2	171.1	159.1	37.9	-25.9	0	0	0	114.3
60	P	43.5	Very low	28	Very low	109 Å²	109	147.2 Å²	147.2	71%	0.708	80%	0.798	S	S	*	*			trans	-139.1	-171.1	-154.5	45.1	-27.2	0	0	0	118.4
61	E	27.6	Very low	28	Very low	184 Å²	184	152 Å²	152	86%	0.86	81%	0.809	S	S	*	*			trans	83.8	148.6	146.8	-85.8	170.6	-155.8	0	0	124
62	G	26.1	Very low	27.8	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	82%	0.815	S	S	*	*			trans	168.7	128.8	174.7	0	0	0	0	0	112.2
63	I	27.8	Very low	28.1	Very low	146 Å²	146	148.8 Å²	148.8	75%	0.749	82%	0.816	S	S	*	*			trans	-141.1	145.8	-167.2	-60.4	167.3	0	0	0	111.7
64	C	25.8	Very low	28.2	Very low	134 Å²	134	144.2 Å²	144.2	91%	0.905	82%	0.815	S	S	*	*			trans	-158.3	171.1	154.8	-101.9	0	0	0	0	112.7
65	N	26.1	Very low	28.6	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	82%	0.817	S	S	*	*			trans	-148.3	143	-143.5	-140.9	15.2	0	0	0	116.5
66	M	28	Very low	29	Very low	149 Å²	149	138.1 Å²	138.1	73%	0.734	81%	0.813	S	S	*	*			trans	59.4	166.4	157.2	-52.2	-147.5	75.4	0	0	118.8
67	T	25.2	Very low	29.5	Very low	134 Å²	134	142.5 Å²	142.5	82%	0.822	82%	0.82	S	S	*	*			cis	-139.3	-169.7	22.4	44.7	0	0	0	0	114.5
68	M	31	Very low	30	Very low	163 Å²	163	142.8 Å²	142.8	80%	0.803	82%	0.822	S	S	*	*			trans	-113.5	178.5	-168.8	-76.9	179	151.8	0	0	115.2
69	D	26.7	Very low	30.1	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	82%	0.818	S	S	*	*			trans	114.2	148.1	151.3	-72	-45.2	0	0	0	118.6
70	S	27	Very low	30.4	Very low	96 Å²	96	141 Å²	141	67%	0.671	81%	0.812	S	S	*	*			cis	-170.6	141	-33.9	-104.8	0	0	0	0	110.6
71	N	27.4	Very low	30.4	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	81%	0.814	S	S	*	*			trans	31.5	128.6	163.4	-75.8	-12.4	0	0	0	122.5
72	S	26.5	Very low	30.9	Very low	128 Å²	128	138.6 Å²	138.6	90%	0.895	81%	0.805	S	S	*	*				-174.2	163.9	114.7	41.3	0	0	0	0	112.3
73	M	32.9	Very low	31.5	Very low	181 Å²	181	145 Å²	145	89%	0.892	81%	0.806	S	S	*	*			trans	-144.6	115.5	-169.8	175.4	170	170.4	0	0	111.6
74	T	27.8	Very low	32.2	Very low	148 Å²	148	141.7 Å²	141.7	91%	0.908	80%	0.8	S	S	*	*			trans	-173.9	152.1	154.5	19.5	0	0	0	0	111.6
75	M	36.2	Very low	33.2	Very low	178 Å²	178	138.7 Å²	138.7	88%	0.877	79%	0.785	S	S	*	*			trans	-88.4	154.2	167.7	-71.9	-78.4	-165.4	0	0	110.5
76	P	33.4	Very low	33.9	Very low	122 Å²	122	135 Å²	135	79%	0.792	78%	0.775	S	S	*	*				-139.2	159.9	110.5	38	-27.5	0	0	0	114.4
77	M	34.2	Very low	34.6	Very low	185 Å²	185	134.6 Å²	134.6	91%	0.911	77%	0.773	S	S	*	*			trans	-78.4	143.6	172.6	-63.2	-175.9	-173.3	0	0	112.2
78	S	34.5	Very low	35.6	Very low	126 Å²	126	135 Å²	135	88%	0.881	77%	0.77	S	S	*	*			trans	-160.7	136.4	144.5	-78.6	0	0	0	0	109.9
79	D	30.3	Very low	36.2	Very low	149 Å²	149	134.6 Å²	134.6	80%	0.797	77%	0.771	S	S	*	*			trans	-83.1	178.8	-179.3	-114.3	-34.8	0	0	0	111.8
80	P	40	Very low	37	Very low	99 Å²	99	134.4 Å²	134.4	64%	0.643	77%	0.767	S	S	*	*			cis	-142.3	113.7	-15.2	30.4	-8.2	0	0	0	114.7
81	N	44.9	Very low	37.7	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	77%	0.77	S	S	*	*			trans	-167	63.7	153.1	-123	-16.8	0	0	0	118.5
82	P	37.1	Very low	38.2	Very low	105 Å²	105	133.6 Å²	133.6	68%	0.682	77%	0.769	S	S	*	*	H	α-helix	trans	-73.8	-31.5	-179.4	-17.5	32.7	0	0	0	115.1	A84 A85 A86	P82-A84 PolarHBondContact O-N 2.89Å; P82-A85 PolarHBondContact O-N 3.18Å; P82-A86 PolarHBondContact O-N 3.31Å
83	W	39.7	Very low	38.6	Very low	208 Å²	208	132.9 Å²	132.9	79%	0.788	76%	0.761	S	S	*	*	H	α-helix	trans	-70.5	-35.5	-162.1	-166.3	23	0	0	0	113.9	A86	W83-A86 PolarHBondContact O-N 3.26Å
84	A	41	Very low	38.7	Very low	77 Å²	77	130.4 Å²	130.4	64%	0.636	76%	0.758	S	S	*	*	H	α-helix	trans	-68.4	-33.8	179.8	0	0	0	0	0	113.2	P82	P82-A84 PolarHBondContact O-N 2.89Å
85	A	47.9	Very low	39.3	Very low	71 Å²	71	131 Å²	131	59%	0.587	75%	0.754	S	S	*	*	H	α-helix	trans	-72.7	-34.4	179	0	0	0	0	0	112.3	P82 M87 N88	P82-A85 PolarHBondContact O-N 3.18Å; A85-M87 VanDerWaalsContact C-N 3.3Å; A85-M87 PolarHBondContact O-N 2.81Å; A85-N88 PolarHBondContact O-N 3.16Å
86	A	41	Very low	39	Very low	66 Å²	66	126.1 Å²	126.1	55%	0.545	75%	0.75	S	S	.	*	H	α-helix	trans	-65.7	-26.3	-175.2	0	0	0	0	0	114.3	P82 W83	P82-A86 PolarHBondContact O-N 3.31Å; W83-A86 PolarHBondContact O-N 3.26Å
87	M	42.8	Very low	38.9	Very low	142 Å²	142	128.8 Å²	128.8	70%	0.7	75%	0.753	S	S	*	*	H	α-helix	trans	-82.9	-22.4	179.8	-75.7	-168.6	149.7	0	0	114.1	A85 N89 M90	A85-M87 VanDerWaalsContact C-N 3.3Å; A85-M87 PolarHBondContact O-N 2.81Å; M87-N89 VanDerWaalsContact C-N 3.26Å; M87-N89 PolarHBondContact O-N 2.98Å; M87-M90 PolarHBondContact O-N 2.99Å
88	N	44.9	Very low	38.7	Very low	143 Å²	143	126.8 Å²	126.8	77%	0.765	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-13	-172.9	-154.1	28	0	0	0	113.9	A85	A85-N88 PolarHBondContact O-N 3.16Å
89	N	44.8	Very low	38.4	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	8.4	176.9	-83.8	-18.5	0	0	0	114.1	M87	M87-N89 VanDerWaalsContact C-N 3.26Å; M87-N89 PolarHBondContact O-N 2.98Å
90	M	42.9	Very low	38.4	Very low	147 Å²	147	126.6 Å²	126.6	72%	0.724	75%	0.754	S	S	*	*	S	Bend	trans	-106.8	13.4	-178	-76.8	-71.4	-72.1	0	0	114.7	M87 M92	M87-M90 PolarHBondContact O-N 2.99Å; M90-M92 PolarHBondContact O-N 2.59Å
91	G	41.8	Very low	38.8	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	75%	0.754	S	S	*	*			trans	62.5	32.1	152.9	0	0	0	0	0	118.3
92	M	36.8	Very low	37.9	Very low	169 Å²	169	128 Å²	128	83%	0.833	76%	0.761	S	S	*	*			trans	-121.4	129.9	178.4	-66.9	-68.1	164	0	0	111.6	M90	M90-M92 PolarHBondContact O-N 2.59Å
93	P	35.9	Very low	37.8	Very low	113 Å²	113	130.6 Å²	130.6	73%	0.734	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-78.8	156.6	-179.6	32.5	-35.4	0	0	0	112.9
94	P	35.2	Very low	37.8	Very low	128 Å²	128	126.1 Å²	126.1	83%	0.831	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.4	154.2	-178.4	31.5	-35.7	0	0	0	113.7
95	I	40.4	Very low	37.1	Very low	162 Å²	162	129.9 Å²	129.9	83%	0.831	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-78.8	141.9	-177.9	-66.1	167.9	0	0	0	111.7
96	G	28.9	Very low	36.1	Very low	75 Å²	75	135 Å²	135	77%	0.773	79%	0.785	S	S	*	*			trans	-119.9	142.1	162.8	0	0	0	0	0	111.6
97	M	31.9	Very low	35.7	Very low	177 Å²	177	136.6 Å²	136.6	87%	0.872	78%	0.784	S	S	*	*			trans	-112.1	119.5	176.8	-72.3	-172.5	71.9	0	0	111.9
98	T	30.3	Very low	35.7	Very low	144 Å²	144	135.6 Å²	135.6	88%	0.883	79%	0.788	S	S	*	*			trans	-160.7	140.1	160.1	44.4	0	0	0	0	111.7
99	G	27.9	Very low	34.8	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	79%	0.79	S	S	*	*			trans	84.4	112.8	146.1	0	0	0	0	0	119.4
100	Q	30.8	Very low	34.3	Very low	190 Å²	190	135.9 Å²	135.9	89%	0.888	79%	0.788	S	S	*	*			trans	-95.9	173.1	145.1	-94	-163.5	0.2	0	0	109.1
101	P	47.5	Very low	33.7	Very low	99 Å²	99	131.6 Å²	131.6	64%	0.643	78%	0.782	S	S	*	*			cis	-128.4	179.7	-14.3	28.8	-8.1	0	0	0	113.2
102	L	25.8	Very low	33.4	Very low	167 Å²	167	137 Å²	137	87%	0.874	79%	0.791	S	S	*	*			trans	152.7	146.7	130.8	-80.8	164.7	0	0	0	113.5
103	L	35.5	Very low	33.1	Very low	160 Å²	160	138.3 Å²	138.3	84%	0.838	80%	0.797	S	S	*	*			trans	-97.9	157.4	168.3	-69.1	164.8	0	0	0	108.4
104	P	40.7	Very low	32.8	Very low	113 Å²	113	137.9 Å²	137.9	73%	0.734	80%	0.803	S	S	*	*				-139.1	-171.2	70.9	40.7	-21.1	0	0	0	112.4
105	D	25.9	Very low	32.5	Very low	156 Å²	156	135 Å²	135	83%	0.834	80%	0.796	S	S	*	*			cis	-149.3	174.2	16.7	-142.8	-20.9	0	0	0	113.7
106	F	26.8	Very low	32.2	Very low	180 Å²	180	135.5 Å²	135.5	79%	0.789	80%	0.799	S	S	*	*			trans	-137.5	129.5	-159.4	-148	-102.8	0	0	0	114.9
107	D	33.2	Very low	32.3	Very low	99 Å²	99	137.5 Å²	137.5	53%	0.529	80%	0.796	S	S	.	*			trans	65.5	164	155.5	-142.3	17.2	0	0	0	116.3	N109 L110	D107-N109 PolarHBondContact OD1-N 3.4Å; D107-N109 PolarHBondContact OD2-N 3.31Å; D107-L110 PolarHBondContact OD2-N 3.14Å
108	P	41	Very low	32.5	Very low	121 Å²	121	135.3 Å²	135.3	79%	0.786	80%	0.795	S	S	*	*	S	Bend		-137.2	131.5	58.6	34	-13.8	0	0	0	115.9
109	N	26.4	Very low	32.8	Very low	153 Å²	153	136 Å²	136	82%	0.818	79%	0.792	S	S	*	*				-165.9	97.7	94.1	-148.3	25.6	0	0	0	114.2	D107	D107-N109 PolarHBondContact OD1-N 3.4Å; D107-N109 PolarHBondContact OD2-N 3.31Å
110	L	35.1	Very low	32.9	Very low	148 Å²	148	139.7 Å²	139.7	78%	0.775	79%	0.792	S	S	*	*			trans	-59.3	156.7	167	-164.3	65.8	0	0	0	112.8	D107	D107-L110 PolarHBondContact OD2-N 3.14Å
111	G	31	Very low	33.4	Very low	57 Å²	57	135.6 Å²	135.6	59%	0.588	78%	0.783	S	S	*	*			cis	-160.9	-173	-0.1	0	0	0	0	0	110.1
112	M	33.4	Very low	32.8	Very low	186 Å²	186	139.9 Å²	139.9	92%	0.916	80%	0.796	S	S	*	*				-164.6	153.9	62.6	-84.4	-78.2	-103.2	0	0	113.1
113	M	31.6	Very low	33.2	Very low	196 Å²	196	140.3 Å²	140.3	97%	0.966	80%	0.796	S	S	*	*			trans	68.4	146.9	163.4	-124.9	169.8	-171.2	0	0	118.2
114	A	29.7	Very low	33.3	Very low	103 Å²	103	138.7 Å²	138.7	85%	0.851	80%	0.795	S	S	*	*			trans	-132	153.2	-167.6	0	0	0	0	0	112.4
115	G	28.3	Very low	32.8	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	79%	0.793	S	S	*	*			trans	173.2	129.5	168.9	0	0	0	0	0	114.9
116	I	34.3	Very low	33.2	Very low	172 Å²	172	137.7 Å²	137.7	88%	0.882	80%	0.799	S	S	*	*			trans	69.8	123.3	159.7	-44.9	172.4	0	0	0	116.5
117	T	32	Very low	33.2	Very low	118 Å²	118	132.1 Å²	132.1	72%	0.724	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-77.6	144.1	171.9	47.8	0	0	0	0	112.2	I119	T117-I119 PolarHBondContact O-N 3.19Å
118	P	36.2	Very low	33.2	Very low	131 Å²	131	136.5 Å²	136.5	85%	0.851	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.6	128.2	-176.9	28.4	-34.6	0	0	0	112.8
119	I	35.5	Very low	32.6	Very low	159 Å²	159	136.3 Å²	136.3	82%	0.815	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-89.1	136.6	166.5	-56.6	166.4	0	0	0	107.3	T117	T117-I119 PolarHBondContact O-N 3.19Å
120	N	31	Very low	32.6	Very low	157 Å²	157	134.6 Å²	134.6	84%	0.84	81%	0.805	S	S	*	*			trans	-132.6	139.9	167.6	-151.5	53.1	0	0	0	110.1
121	P	40.8	Very low	32.1	Very low	105 Å²	105	133 Å²	133	68%	0.682	80%	0.801	S	S	*	*			trans	-92.8	157.8	-158.2	35.7	-36.3	0	0	0	114.4
122	M	33.8	Very low	32.1	Very low	188 Å²	188	135.7 Å²	135.7	93%	0.926	81%	0.809	S	S	*	*			trans	-121.3	153.8	158.8	-71.6	-158.1	73.9	0	0	110.7
123	M	33.9	Very low	31.9	Very low	176 Å²	176	132.2 Å²	132.2	87%	0.867	80%	0.798	S	S	*	*			trans	-70.5	150.5	-168.6	-75.9	-82.1	-78.1	0	0	113.9
124	P	39	Very low	31.9	Very low	126 Å²	126	128.1 Å²	128.1	82%	0.818	79%	0.788	S	S	*	*			trans	-77.4	127.7	170.5	-2	19.8	0	0	0	110.9
125	G	29.5	Very low	32	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	78%	0.78	S	S	*	*			trans	-145.4	101	-179.3	0	0	0	0	0	113.9	G127	G125-G127 PolarHBondContact O-N 3.11Å; G125-G127 VanDerWaalsContact O-N 3.07Å
126	L	33.8	Very low	32.2	Very low	181 Å²	181	134.6 Å²	134.6	95%	0.948	79%	0.788	S	S	*	*			trans	45.5	43.4	152.2	-56.8	179.9	0	0	0	119	M128	L126-M128 PolarHBondContact O-N 2.82Å
127	G	27.1	Very low	32.2	Very low	62 Å²	62	131 Å²	131	64%	0.639	77%	0.773	S	S	*	*			trans	-76.3	114.3	155.2	0	0	0	0	0	110.3	G125 V129	G125-G127 PolarHBondContact O-N 3.11Å; G125-G127 VanDerWaalsContact O-N 3.07Å; G127-V129 PolarHBondContact O-N 3.28Å
128	M	32.9	Very low	32.7	Very low	191 Å²	191	131.1 Å²	131.1	94%	0.941	78%	0.776	S	S	*	*			trans	-71.9	73.4	172.8	-78.8	-73.3	-78	0	0	110.9	L126 P130	L126-M128 PolarHBondContact O-N 2.82Å; M128-P130 WeakPolarHBondContact O-CD 3.41Å
129	V	28.7	Very low	33.6	Very low	118 Å²	118	128.9 Å²	128.9	72%	0.715	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-73.5	119.2	168.4	179.7	0	0	0	0	107.9	G127 T131	G127-V129 PolarHBondContact O-N 3.28Å; V129-T131 PolarHBondContact O-N 3.25Å; V129-T131 VanDerWaalsContact O-N 3.16Å
130	P	27.5	Very low	34.7	Very low	117 Å²	117	127.1 Å²	127.1	76%	0.76	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62	119.3	166.5	-16.1	30.7	0	0	0	107.6	M128	M128-P130 WeakPolarHBondContact O-CD 3.41Å
131	T	25.1	Very low	36.7	Very low	114 Å²	114	122.1 Å²	122.1	70%	0.699	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.3	133.9	174.5	29.4	0	0	0	0	109.3	V129 V133	V129-T131 PolarHBondContact O-N 3.25Å; V129-T131 VanDerWaalsContact O-N 3.16Å; T131-V133 PolarHBondContact O-N 3.14Å
132	P	30.4	Very low	38.4	Very low	114 Å²	114	124.3 Å²	124.3	74%	0.74	73%	0.728	S	S	*	*			trans	-61.9	111.8	176.6	25.4	-32.8	0	0	0	108	S134	P132-S134 PolarHBondContact O-N 3Å
133	V	28.9	Very low	40.7	Very low	113 Å²	113	119.1 Å²	119.1	69%	0.685	70%	0.704	S	S	*	*			trans	-75	97.6	-177.2	-170.4	0	0	0	0	107.8	T131 Q135	T131-V133 PolarHBondContact O-N 3.14Å; V133-Q135 HydrophobicContact CB-CG 4.38Å; V133-Q135 HydrophobicContact CG1-CG 3.74Å; V133-Q135 PolarHBondContact O-N 2.96Å
134	S	30.6	Very low	43	Very low	109 Å²	109	112.8 Å²	112.8	76%	0.762	67%	0.673	S	S	*	*			trans	-63.8	84.3	171.8	-59.1	0	0	0	0	110.3	P132 D136	P132-S134 PolarHBondContact O-N 3Å; S134-D136 PolarHBondContact O-N 3.38Å
135	Q	32.3	Very low	45	Very low	145 Å²	145	113.3 Å²	113.3	68%	0.678	66%	0.664	S	S	*	*			trans	-81.8	67.1	175.6	-68.5	-166.3	-21.7	0	0	110.9	V133 V137	V133-Q135 HydrophobicContact CB-CG 4.38Å; V133-Q135 HydrophobicContact CG1-CG 3.74Å; V133-Q135 PolarHBondContact O-N 2.96Å; Q135-V137 PolarHBondContact O-N 2.92Å
136	D	33.2	Very low	47.4	Very low	162 Å²	162	111 Å²	111	87%	0.866	64%	0.637	S	S	*	*			trans	-73.4	66.9	156.8	-82	-50.1	0	0	0	109.5	S134	S134-D136 PolarHBondContact O-N 3.38Å
137	V	34.2	Very low	49.6	Very low	96 Å²	96	112.3 Å²	112.3	58%	0.582	64%	0.635	S	S	*	*			trans	-118.5	124.8	168.1	-174.9	0	0	0	0	105.9	Q135 V139	Q135-V137 PolarHBondContact O-N 2.92Å; V137-V139 VanDerWaalsContact C-N 3.35Å; V137-V139 WeakPolarHBondContact O-CG2 3.18Å; V137-V139 PolarHBondContact O-N 3.04Å
138	P	41.5	Very low	52	Low	121 Å²	121	111.7 Å²	111.7	79%	0.786	62%	0.621	S	S	*	*			trans	-69.8	90.8	-178.1	27.8	-34.3	0	0	0	110.2	V140	P138-V140 PolarHBondContact O-N 3.4Å
139	V	56.3	Low	54.4	Low	84 Å²	84	102.7 Å²	102.7	51%	0.509	58%	0.577	S	S	.	*			trans	-71.3	105.5	-175.2	-163.7	0	0	0	0	110.1	V137 K141 F223	V137-V139 VanDerWaalsContact C-N 3.35Å; V137-V139 WeakPolarHBondContact O-CG2 3.18Å; V137-V139 PolarHBondContact O-N 3.04Å; V139-K141 PolarHBondContact O-N 3.38Å; V139-F223 HydrophobicContact CB-CE2 4.12Å; V139-F223 HydrophobicContact CB-CZ 4.45Å; V139-F223 HydrophobicContact CG1-CE2 3.62Å; V139-F223 HydrophobicContact CG1-CZ 3.62Å
140	V	58.5	Low	57.1	Low	123 Å²	123	98.3 Å²	98.3	75%	0.745	55%	0.55	S	S	*	*			trans	-64.6	105.8	173.6	-179.6	0	0	0	0	108.6	P138 E142	P138-V140 PolarHBondContact O-N 3.4Å; V140-E142 PolarHBondContact O-N 3.47Å
141	K	72.7	Confident	59.8	Low	51 Å²	51	92.8 Å²	92.8	22%	0.222	52%	0.515	C	S	.	.			trans	-76.4	115.6	174.3	-72.7	-172.8	176.6	-158	0	109	V139 P153 P154 F223 S225 Y227	V139-K141 PolarHBondContact O-N 3.38Å; K141-P153 HydrophobicContact CB-CB 3.59Å; K141-P153 WeakPolarHBondContact O-CB 3.37Å; K141-P153 VanDerWaalsContact O-CG 3.26Å; K141-P153 WeakPolarHBondContact O-CG 3.39Å; K141-P154 HydrophobicContact CD-CG 3.85Å; K141-F223 HydrophobicContact CD-CZ 4.27Å; K141-F223 HydrophobicContact CG-CE1 4.09Å; K141-F223 HydrophobicContact CG-CE2 4.18Å; K141-F223 HydrophobicContact CG-CZ 3.6Å; K141-F223 PolarHBondContact NZ-O 3.25Å; K141-S225 PolarHBondContact NZ-O 2.96Å; K141-Y227 HydrophobicContact CB-CE2 4.25Å; K141-Y227 WeakPolarHBondContact CB-OH 3.21Å; K141-Y227 HydrophobicContact CD-CD2 4.37Å; K141-Y227 HydrophobicContact CD-CE2 3.74Å; K141-Y227 HydrophobicContact CG-CE2 4.2Å
142	E	76.9	Confident	62.6	Low	151 Å²	151	90.4 Å²	90.4	71%	0.706	50%	0.495	S	S	*	.			trans	-84.1	168.2	178.9	-60.7	-168.9	152.5	0	0	112.6	V140 I144 Y227	V140-E142 PolarHBondContact O-N 3.47Å; E142-I144 PolarHBondContact O-N 2.98Å; E142-Y227 VanDerWaalsContact O-CE1 3.23Å; E142-Y227 WeakPolarHBondContact O-CE1 3.33Å; E142-Y227 PolarHBondContact O-OH 2.93Å
143	I	82.1	Confident	65	Low	79 Å²	79	86.9 Å²	86.9	41%	0.405	47%	0.472	S	S	.	.			trans	-82.5	110.3	177	-54.6	174.1	0	0	0	109.7	H145 T150 L151 F152 P153	I143-H145 VanDerWaalsContact CG2-CE1 3.41Å; I143-H145 WeakPolarHBondContact CG2-CE1 3.08Å; I143-H145 PolarHBondContact O-ND1 3.27Å; I143-T150 HydrophobicContact CG2-CG2 3.51Å; I143-L151 WeakPolarHBondContact CA-O 3.14Å; I143-F152 HydrophobicContact CD1-CD1 4.14Å; I143-F152 HydrophobicContact CD1-CE1 4.38Å; I143-F152 HydrophobicContact CG1-CD1 4.35Å; I143-F152 HydrophobicContact CG2-CD1 4Å; I143-F152 HydrophobicContact CG2-CE1 4.12Å; I143-P153 HydrophobicContact CG1-CG 4.47Å
144	I	82.1	Confident	67.3	Low	44 Å²	44	83.2 Å²	83.2	23%	0.226	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.2	-179.1	-52.5	167.9	0	0	0	109	E142 L151 L224 Y227	E142-I144 PolarHBondContact O-N 2.98Å; I144-L151 HydrophobicContact CB-CB 4.13Å; I144-L151 HydrophobicContact CB-CD1 4.23Å; I144-L151 HydrophobicContact CB-CG 4.41Å; I144-L151 HydrophobicContact CD1-CD1 4.25Å; I144-L151 HydrophobicContact CG2-CD1 4.45Å; I144-L151 PolarHBondContact N-O 2.79Å; I144-L151 PolarHBondContact O-N 2.84Å; I144-L224 HydrophobicContact CD1-CD2 3.54Å; I144-Y227 HydrophobicContact CD1-CE1 4.03Å; I144-Y227 HydrophobicContact CG1-CE1 4.22Å
145	H	80.4	Confident	69.1	Low	137 Å²	137	82.4 Å²	82.4	63%	0.634	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.6	-178.8	-66.2	77.5	0	0	0	110.1	I143	I143-H145 VanDerWaalsContact CG2-CE1 3.41Å; I143-H145 WeakPolarHBondContact CG2-CE1 3.08Å; I143-H145 PolarHBondContact O-ND1 3.27Å
146	C	80.6	Confident	70.6	Confident	20 Å²	20	81.1 Å²	81.1	14%	0.135	44%	0.442	C	S	.	.			trans	-105.6	166.7	172.2	-50.7	0	0	0	0	109.6	S148 C149 E189	C146-S148 VanDerWaalsContact C-N 3.28Å; C146-S148 PolarHBondContact O-N 2.98Å; C146-C149 CarbonylContact C-O 3.56Å; C146-C149 WeakPolarHBondContact CA-O 3.48Å; C146-C149 VanDerWaalsContact CB-O 3.3Å; C146-C149 WeakPolarHBondContact CB-O 3.16Å; C146-C149 PolarHBondContact N-O 2.85Å; C146-E189 HydrophobicContact CB-CG 4Å
147	K	79.1	Confident	71.8	Confident	207 Å²	207	80.3 Å²	80.3	90%	0.9	44%	0.437	S	S	*	.	S	Bend	trans	-67.9	-30.9	-179.4	-55.7	161.6	-172.9	168.8	0	111.8	E189	K147-E189 WeakPolarHBondContact CA-OE1 3.15Å; K147-E189 WeakPolarHBondContact CB-OE1 3.48Å; K147-E189 WeakPolarHBondContact CD-OE1 3.33Å; K147-E189 WeakPolarHBondContact CG-OE1 3.25Å; K147-E189 PolarHBondContact N-OE1 2.77Å
148	S	78.2	Confident	73	Confident	49 Å²	49	80.6 Å²	80.6	34%	0.343	44%	0.435	S	S	.	.	S	Bend	trans	-104.4	-14	-180	64.4	0	0	0	0	115.3	C146 L186 E189 G232	C146-S148 VanDerWaalsContact C-N 3.28Å; C146-S148 PolarHBondContact O-N 2.98Å; S148-L186 VanDerWaalsContact OG-CD1 3.23Å; S148-L186 WeakPolarHBondContact OG-CD1 3.37Å; S148-E189 WeakPolarHBondContact CB-OE2 3.49Å; S148-E189 PolarHBondContact N-OE2 2.84Å; S148-E189 VanDerWaalsContact N-OE2 3.14Å; S148-E189 PolarHBondContact OG-OE2 2.85Å; S148-G232 PolarHBondContact O-N 3.35Å
149	C	83.5	Confident	73.9	Confident	2 Å²	2	79.8 Å²	79.8	1%	0.014	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	160.6	-177.6	72.7	0	0	0	0	114.7	C146 L186 I229 R230 L231	C146-C149 CarbonylContact C-O 3.56Å; C146-C149 WeakPolarHBondContact CA-O 3.48Å; C146-C149 VanDerWaalsContact CB-O 3.3Å; C146-C149 WeakPolarHBondContact CB-O 3.16Å; C146-C149 PolarHBondContact N-O 2.85Å; C149-L186 HydrophobicContact CB-CD1 3.74Å; C149-L186 VanDerWaalsContact SG-CD1 3.56Å; C149-I229 HydrophobicContact CB-CD1 4.25Å; C149-I229 HydrophobicContact CB-CG1 4.06Å; C149-R230 CarbonylContact C-O 3.55Å; C149-R230 WeakPolarHBondContact CA-O 3.37Å; C149-R230 WeakPolarHBondContact CB-O 3.34Å; C149-L231 HydrophobicContact CB-CD2 4.09Å
150	T	84.4	Confident	74.1	Confident	26 Å²	26	81.4 Å²	81.4	16%	0.16	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.9	167.1	-47.7	0	0	0	0	110.3	I143 F152 R230	I143-T150 HydrophobicContact CG2-CG2 3.51Å; T150-F152 HydrophobicContact CG2-CD2 4.32Å; T150-F152 HydrophobicContact CG2-CE1 4.08Å; T150-F152 HydrophobicContact CG2-CE2 3.77Å; T150-F152 HydrophobicContact CG2-CZ 3.63Å; T150-R230 PolarHBondContact N-O 3.34Å; T150-R230 PolarHBondContact O-N 3.25Å
151	L	84.3	Confident	74.5	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.01	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111	173.9	-48.5	-179.9	0	0	0	109.7	I143 I144 V190 L224 Y227 R228 I229 L243	I143-L151 WeakPolarHBondContact CA-O 3.14Å; I144-L151 HydrophobicContact CB-CB 4.13Å; I144-L151 HydrophobicContact CB-CD1 4.23Å; I144-L151 HydrophobicContact CB-CG 4.41Å; I144-L151 HydrophobicContact CD1-CD1 4.25Å; I144-L151 HydrophobicContact CG2-CD1 4.45Å; I144-L151 PolarHBondContact N-O 2.79Å; I144-L151 PolarHBondContact O-N 2.84Å; L151-V190 HydrophobicContact CD1-CG1 3.89Å; L151-L224 HydrophobicContact CD1-CD2 4.47Å; L151-Y227 HydrophobicContact CB-CD1 3.64Å; L151-Y227 HydrophobicContact CB-CE1 4.24Å; L151-Y227 HydrophobicContact CB-CG 4.35Å; L151-R228 WeakPolarHBondContact CA-O 3.39Å; L151-I229 HydrophobicContact CD2-CB 3.58Å; L151-I229 HydrophobicContact CD2-CD1 3.87Å; L151-I229 HydrophobicContact CD2-CG1 3.63Å; L151-L243 HydrophobicContact CD1-CD1 4.5Å; L151-L243 HydrophobicContact CD2-CD1 4.04Å
152	F	83.4	Confident	74.2	Confident	64 Å²	64	79 Å²	79	28%	0.281	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137.7	174.8	-59.9	-87.5	0	0	0	110.4	I143 T150 Y227 R228 R230	I143-F152 HydrophobicContact CD1-CD1 4.14Å; I143-F152 HydrophobicContact CD1-CE1 4.38Å; I143-F152 HydrophobicContact CG1-CD1 4.35Å; I143-F152 HydrophobicContact CG2-CD1 4Å; I143-F152 HydrophobicContact CG2-CE1 4.12Å; T150-F152 HydrophobicContact CG2-CD2 4.32Å; T150-F152 HydrophobicContact CG2-CE1 4.08Å; T150-F152 HydrophobicContact CG2-CE2 3.77Å; T150-F152 HydrophobicContact CG2-CZ 3.63Å; F152-Y227 CarbonylContact O-C 3.55Å; F152-Y227 WeakPolarHBondContact O-CA 3.28Å; F152-Y227 VanDerWaalsContact O-CD1 3.29Å; F152-Y227 WeakPolarHBondContact O-CD1 3.18Å; F152-R228 HydrophobicContact CB-CB 4.39Å; F152-R228 PolarHBondContact N-O 3.11Å; F152-R228 PolarHBondContact O-N 3.48Å; F152-R230 HydrophobicContact CE2-CB 4.28Å
153	P	81.5	Confident	74.2	Confident	40 Å²	40	75.5 Å²	75.5	26%	0.26	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-66.4	157.3	-177.8	29.3	-37.5	0	0	0	112.7	K141 I143 Y227	K141-P153 HydrophobicContact CB-CB 3.59Å; K141-P153 WeakPolarHBondContact O-CB 3.37Å; K141-P153 VanDerWaalsContact O-CG 3.26Å; K141-P153 WeakPolarHBondContact O-CG 3.39Å; I143-P153 HydrophobicContact CG1-CG 4.47Å; P153-Y227 HydrophobicContact CB-CE1 4.2Å
154	P	76.6	Confident	74.2	Confident	35 Å²	35	79.8 Å²	79.8	23%	0.227	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-63.7	153.7	167.7	28.1	-33.7	0	0	0	111.4	K141	K141-P154 HydrophobicContact CD-CG 3.85Å
155	N	69	Low	74.2	Confident	93 Å²	93	86.5 Å²	86.5	50%	0.497	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-64.5	125.6	169.8	-179.8	-16.6	0	0	0	109.2	N157 L158	N155-N157 PolarHBondContact O-N 2.99Å; N155-N157 VanDerWaalsContact O-N 3.16Å; N155-N157 WeakPolarHBondContact OD1-CB 3.19Å; N155-N157 PolarHBondContact OD1-N 2.89Å; N155-L158 HydrophobicContact CB-CD1 4.14Å; N155-L158 HydrophobicContact CB-CG 4.32Å; N155-L158 PolarHBondContact O-N 3.01Å
156	P	65	Low	74.7	Confident	118 Å²	118	84.4 Å²	84.4	77%	0.766	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.1	-178	26.3	-36.1	0	0	0	114.1	L158	P156-L158 PolarHBondContact O-N 2.88Å
157	N	56.9	Low	75.1	Confident	144 Å²	144	84.6 Å²	84.6	77%	0.77	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	9.7	177.7	-60.6	-11.1	0	0	0	113.5	N155	N155-N157 PolarHBondContact O-N 2.99Å; N155-N157 VanDerWaalsContact O-N 3.16Å; N155-N157 WeakPolarHBondContact OD1-CB 3.19Å; N155-N157 PolarHBondContact OD1-N 2.89Å
158	L	59.8	Low	75.5	Confident	102 Å²	102	77.9 Å²	77.9	53%	0.534	44%	0.437	S	S	.	.	S	Bend	trans	-107.1	143.3	174.3	-67.8	174.1	0	0	0	110.2	N155 P156	N155-L158 HydrophobicContact CB-CD1 4.14Å; N155-L158 HydrophobicContact CB-CG 4.32Å; N155-L158 PolarHBondContact O-N 3.01Å; P156-L158 PolarHBondContact O-N 2.88Å
159	P	59.9	Low	76	Confident	104 Å²	104	75.6 Å²	75.6	68%	0.675	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-59.5	147.4	176.4	25.7	-34.4	0	0	0	111.2
160	P	61.9	Low	76.4	Confident	118 Å²	118	75.5 Å²	75.5	77%	0.766	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-52.6	145	173.6	-26.7	35.2	0	0	0	111.9	A162	P160-A162 PolarHBondContact O-N 2.83Å
161	P	66.2	Low	76.8	Confident	36 Å²	36	75.9 Å²	75.9	23%	0.234	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-56.8	131.9	169.7	-19.5	31.6	0	0	0	109.8	T163	P161-T163 PolarHBondContact O-N 2.93Å
162	A	66.7	Low	77.3	Confident	88 Å²	88	76.3 Å²	76.3	73%	0.727	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-61.2	130.4	174.4	0	0	0	0	0	110	P160	P160-A162 PolarHBondContact O-N 2.83Å
163	T	75.9	Confident	77.8	Confident	77 Å²	77	73.2 Å²	73.2	47%	0.472	41%	0.409	S	S	.	.			trans	-112.1	151.4	175.8	55.1	0	0	0	0	109.9	P161 L222 D246	P161-T163 PolarHBondContact O-N 2.93Å; T163-L222 HydrophobicContact CG2-CD1 3.95Å; T163-L222 HydrophobicContact CG2-CD2 4.32Å; T163-L222 HydrophobicContact CG2-CG 4.37Å; T163-D246 WeakPolarHBondContact CA-OD1 3.35Å
164	R	82	Confident	78.3	Confident	169 Å²	169	73.7 Å²	73.7	64%	0.638	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-76.2	166.8	172.8	-72.6	169.2	174.2	178.2	-6.4	111.7	D246 F247	R164-D246 WeakPolarHBondContact CD-OD2 3.23Å; R164-D246 VanDerWaalsContact CG-OD2 3.23Å; R164-D246 WeakPolarHBondContact CG-OD2 3.19Å; R164-D246 PolarHBondContact N-OD1 3.44Å; R164-D246 IonicContact NE-OD2 3.03Å; R164-F247 VanDerWaalsContact O-CD2 3.25Å; R164-F247 WeakPolarHBondContact O-CD2 3.11Å; R164-F247 WeakPolarHBondContact O-CE2 3.47Å
165	E	83.4	Confident	79.1	Confident	186 Å²	186	72 Å²	72	87%	0.869	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-62.6	143	161.2	-71.5	-169.7	123.3	0	0	110.3	P167	E165-P167 VanDerWaalsContact O-CD 3.29Å; E165-P167 WeakPolarHBondContact O-CD 3.3Å
166	R	89.4	Confident	80	Confident	92 Å²	92	68 Å²	68	35%	0.347	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-70.7	118.9	179.1	-175.1	-173.6	-155	125.9	3.5	110.4	C170 E215 D219 F247	R166-C170 HydrophobicContact CG-CB 4.12Å; R166-E215 PolarHBondContact NH2-O 3.1Å; R166-D219 IonicContact CZ-OD1 3.61Å; R166-D219 IonicContact CZ-OD2 2.81Å; R166-D219 IonicContact NH1-OD1 2.88Å; R166-D219 PolarHBondContact NH1-OD1 3.42Å; R166-D219 IonicContact NH1-OD2 3.72Å; R166-D219 PolarHBondContact NH1-OD2 2.86Å; R166-D219 IonicContact NH2-OD1 2.7Å; R166-D219 IonicContact NH2-OD2 3.91Å; R166-D219 PolarHBondContact NH2-OD2 3.28Å; R166-F247 HydrophobicContact CB-CD1 4.09Å; R166-F247 HydrophobicContact CB-CD2 4.47Å; R166-F247 HydrophobicContact CB-CE1 3.85Å; R166-F247 HydrophobicContact CB-CE2 4.24Å; R166-F247 HydrophobicContact CB-CG 4.39Å; R166-F247 HydrophobicContact CB-CZ 3.93Å; R166-F247 HydrophobicContact CG-CD1 3.83Å; R166-F247 HydrophobicContact CG-CE1 3.6Å; R166-F247 HydrophobicContact CG-CZ 4.16Å
167	P	89.7	Confident	81.1	Confident	24 Å²	24	64 Å²	64	16%	0.156	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-62.8	147.7	172.7	-21	32.9	0	0	0	111.7	E165 G169 C170 Q249	E165-P167 VanDerWaalsContact O-CD 3.29Å; E165-P167 WeakPolarHBondContact O-CD 3.3Å; P167-G169 PolarHBondContact O-N 3.19Å; P167-C170 HydrophobicContact CB-CB 4.18Å; P167-C170 HydrophobicContact CG-CB 4.36Å; P167-C170 WeakPolarHBondContact O-CB 3.44Å; P167-C170 PolarHBondContact O-N 2.85Å; P167-C170 VanDerWaalsContact O-N 3.11Å; P167-Q249 HydrophobicContact CB-CG 4.42Å; P167-Q249 HydrophobicContact CG-CB 4.1Å; P167-Q249 HydrophobicContact CG-CG 4.42Å
168	P	87.3	Confident	82.5	Confident	66 Å²	66	57.6 Å²	57.6	43%	0.429	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	124.6	177.3	-24.1	33.8	0	0	0	112.1	C170 W257	P168-C170 VanDerWaalsContact C-N 3.32Å; P168-C170 PolarHBondContact O-N 2.8Å; P168-W257 HydrophobicContact CB-CD2 3.64Å; P168-W257 HydrophobicContact CB-CE3 4.01Å; P168-W257 HydrophobicContact CB-CG 4.04Å; P168-W257 HydrophobicContact CB-CH2 4.29Å; P168-W257 HydrophobicContact CB-CZ2 3.95Å; P168-W257 HydrophobicContact CB-CZ3 4.32Å
169	G	88.1	Confident	83.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	78	9.8	-179.8	0	0	0	0	0	115.7	P167 K171 E215	P167-G169 PolarHBondContact O-N 3.19Å; G169-K171 PolarHBondContact O-N 2.8Å; G169-K171 VanDerWaalsContact O-N 3.1Å; G169-E215 WeakPolarHBondContact CA-OE1 3.47Å; G169-E215 PolarHBondContact N-OE1 2.83Å
170	C	92.6	Very high	84.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	29%	0.288	C	S	.	.			trans	-56.9	112	-173.2	-179.4	0	0	0	0	112.4	R166 P167 P168 T172 V218	R166-C170 HydrophobicContact CG-CB 4.12Å; P167-C170 HydrophobicContact CB-CB 4.18Å; P167-C170 HydrophobicContact CG-CB 4.36Å; P167-C170 WeakPolarHBondContact O-CB 3.44Å; P167-C170 PolarHBondContact O-N 2.85Å; P167-C170 VanDerWaalsContact O-N 3.11Å; P168-C170 VanDerWaalsContact C-N 3.32Å; P168-C170 PolarHBondContact O-N 2.8Å; C170-T172 PolarHBondContact SG-O 3.28Å; C170-V218 WeakPolarHBondContact O-CG2 3.48Å
171	K	93.7	Very high	85.8	Confident	34 Å²	34	51.3 Å²	51.3	15%	0.148	27%	0.274	C	S	.	.			trans	-106.5	-11.2	169.2	-64.2	175.3	175.7	-178.4	0	112.4	G169 R211 F212 A213 E215 V218 D253 E256	G169-K171 PolarHBondContact O-N 2.8Å; G169-K171 VanDerWaalsContact O-N 3.1Å; K171-R211 HydrophobicContact CB-CG 4.39Å; K171-F212 PolarHBondContact O-N 2.88Å; K171-A213 VanDerWaalsContact CE-O 3.25Å; K171-A213 WeakPolarHBondContact CE-O 3.47Å; K171-A213 PolarHBondContact NZ-O 2.91Å; K171-E215 HydrophobicContact CG-CB 4.38Å; K171-V218 WeakPolarHBondContact O-CG2 3.32Å; K171-D253 WeakPolarHBondContact CA-OD2 3.12Å; K171-D253 PolarHBondContact N-OD2 2.95Å; K171-E256 IonicContact NZ-OE2 2.72Å; K171-E256 PolarHBondContact NZ-OE2 3.49Å
172	T	93.9	Very high	86.6	Confident	10 Å²	10	49.7 Å²	49.7	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126	-174.4	-49.3	0	0	0	0	111.5	C170 H209 I210 R211 A248 A250 D253	C170-T172 PolarHBondContact SG-O 3.28Å; T172-H209 HydrophobicContact CG2-CB 4.03Å; T172-I210 CarbonylContact C-O 3.6Å; T172-I210 VanDerWaalsContact CA-O 3.28Å; T172-I210 WeakPolarHBondContact CA-O 3.12Å; T172-R211 HydrophobicContact CG2-CB 4.49Å; T172-A248 HydrophobicContact CG2-CB 3.94Å; T172-A248 WeakPolarHBondContact O-CB 3.5Å; T172-A248 PolarHBondContact O-N 2.9Å; T172-A250 HydrophobicContact CG2-CB 4.29Å; T172-A250 WeakPolarHBondContact OG1-CB 3.39Å; T172-D253 WeakPolarHBondContact CB-OD2 3.25Å; T172-D253 PolarHBondContact N-OD2 3.33Å; T172-D253 PolarHBondContact OG1-OD2 3.01Å
173	V	93.4	Very high	87.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	148.2	167.7	-67.4	0	0	0	0	111.5	V175 H209 I210 F212 V218 A221 V245 D246	V173-V175 HydrophobicContact CG2-CG2 4Å; V173-H209 CarbonylContact O-C 3.58Å; V173-H209 VanDerWaalsContact O-CA 3.28Å; V173-H209 WeakPolarHBondContact O-CA 3.3Å; V173-I210 HydrophobicContact CG2-CB 3.82Å; V173-I210 HydrophobicContact CG2-CD1 4.47Å; V173-I210 HydrophobicContact CG2-CG1 4.4Å; V173-I210 PolarHBondContact N-O 2.7Å; V173-I210 PolarHBondContact O-N 3.05Å; V173-F212 HydrophobicContact CG1-CE2 4.2Å; V173-F212 HydrophobicContact CG2-CE2 3.7Å; V173-F212 HydrophobicContact CG2-CZ 4.33Å; V173-V218 HydrophobicContact CG1-CB 4.34Å; V173-V218 HydrophobicContact CG1-CG1 3.8Å; V173-V218 HydrophobicContact CG1-CG2 4.32Å; V173-A221 HydrophobicContact CG1-CB 4.12Å; V173-A221 HydrophobicContact CG2-CB 4.4Å; V173-V245 HydrophobicContact CB-CG1 3.88Å; V173-V245 HydrophobicContact CG1-CG1 4.03Å; V173-V245 HydrophobicContact CG2-CG1 4.3Å; V173-D246 WeakPolarHBondContact CA-O 3.43Å
174	F	93.4	Very high	88.1	Confident	50 Å²	50	50.3 Å²	50.3	22%	0.219	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	134.4	160.3	170.5	-94.7	0	0	0	108.5	F207 H209 V245 D246 A248	F174-F207 HydrophobicContact CD2-CD2 4.16Å; F174-F207 HydrophobicContact CE2-CB 3.69Å; F174-F207 HydrophobicContact CE2-CD1 4.3Å; F174-F207 AromaticContact CE2-CD2 3.58Å; F174-F207 HydrophobicContact CE2-CD2 3.58Å; F174-F207 HydrophobicContact CE2-CE2 4.22Å; F174-F207 AromaticContact CE2-CG 3.64Å; F174-F207 HydrophobicContact CE2-CG 3.64Å; F174-F207 HydrophobicContact CZ-CB 3.85Å; F174-F207 HydrophobicContact CZ-CG 4.17Å; F174-H209 AromaticContact CD2-NE2 3.68Å; F174-V245 VanDerWaalsContact O-CA 3.3Å; F174-V245 WeakPolarHBondContact O-CA 3.5Å; F174-D246 PolarHBondContact N-O 2.88Å; F174-D246 PolarHBondContact O-N 3.48Å; F174-A248 HydrophobicContact CB-CB 4.2Å
175	V	92.1	Very high	88.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	106.5	173.4	-175.3	0	0	0	0	109.1	V173 L178 F191 F207 C208 I210 L243 H244 V245	V173-V175 HydrophobicContact CG2-CG2 4Å; V175-L178 HydrophobicContact CG1-CD2 4.11Å; V175-L178 HydrophobicContact CG1-CG 4.31Å; V175-F191 HydrophobicContact CB-CZ 4.32Å; V175-F191 HydrophobicContact CG1-CE2 3.9Å; V175-F191 HydrophobicContact CG1-CZ 3.65Å; V175-F191 HydrophobicContact CG2-CE1 3.93Å; V175-F191 HydrophobicContact CG2-CE2 4.14Å; V175-F191 HydrophobicContact CG2-CZ 3.66Å; V175-F207 CarbonylContact O-C 3.54Å; V175-F207 WeakPolarHBondContact O-CA 3.28Å; V175-F207 WeakPolarHBondContact O-CB 3.47Å; V175-C208 PolarHBondContact N-O 2.7Å; V175-C208 PolarHBondContact O-N 3.36Å; V175-I210 HydrophobicContact CG2-CD1 3.74Å; V175-I210 HydrophobicContact CG2-CG1 4.25Å; V175-L243 HydrophobicContact CG1-CD2 4.39Å; V175-H244 CarbonylContact C-O 3.53Å; V175-H244 WeakPolarHBondContact CA-O 3.29Å; V175-V245 HydrophobicContact CG1-CG2 4.4Å; V175-V245 HydrophobicContact CG2-CG1 4.29Å; V175-V245 HydrophobicContact CG2-CG2 4.27Å
176	G	89.4	Confident	88.5	Confident	8 Å²	8	41.1 Å²	41.1	8%	0.082	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	164.2	173.6	0	0	0	0	0	113.1	L243 H244	G176-L243 WeakPolarHBondContact O-CA 3.46Å; G176-H244 PolarHBondContact N-O 2.9Å; G176-H244 PolarHBondContact O-N 3.05Å
177	G	86.4	Confident	88.4	Confident	34 Å²	34	36.8 Å²	36.8	35%	0.351	20%	0.2	S	C	.	.			trans	77.1	25.2	173.1	0	0	0	0	0	114.7	N206 G241 R242	G177-N206 PolarHBondContact N-O 2.99Å; G177-G241 WeakPolarHBondContact O-CA 3.23Å; G177-R242 WeakPolarHBondContact CA-O 3.44Å; G177-R242 CarbonylContact O-C 3.54Å; G177-R242 PolarHBondContact O-N 3.45Å; G177-R242 VanDerWaalsContact O-N 3.14Å
178	L	87.8	Confident	88.4	Confident	9 Å²	9	40.6 Å²	40.6	5%	0.047	22%	0.217	C	C	.	.			trans	-65.9	148.4	169.8	-65.4	167.7	0	0	0	110.5	V175 A182 I187 N206 C208 L243	V175-L178 HydrophobicContact CG1-CD2 4.11Å; V175-L178 HydrophobicContact CG1-CG 4.31Å; L178-A182 HydrophobicContact CB-CB 4.13Å; L178-I187 HydrophobicContact CD1-CD1 3.98Å; L178-I187 HydrophobicContact CD1-CG1 4.44Å; L178-I187 HydrophobicContact CD2-CG1 4.49Å; L178-N206 PolarHBondContact N-O 2.85Å; L178-C208 HydrophobicContact CD1-CB 4.3Å; L178-L243 HydrophobicContact CD2-CD2 3.78Å
179	P	85.4	Confident	88.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.013	21%	0.206	C	C	.	.			trans	-63.6	154	171.2	23.4	-28.5	0	0	0	110.9	N181 A182 I229 L231 K238	P179-N181 VanDerWaalsContact C-N 3.25Å; P179-N181 PolarHBondContact O-N 3.37Å; P179-A182 HydrophobicContact CG-CB 4.06Å; P179-A182 WeakPolarHBondContact O-CB 3.3Å; P179-A182 PolarHBondContact O-N 2.96Å; P179-I229 HydrophobicContact CG-CG2 4.3Å; P179-L231 HydrophobicContact CB-CD1 4.16Å; P179-L231 HydrophobicContact CB-CG 4.36Å; P179-L231 HydrophobicContact CG-CD1 3.91Å; P179-L231 HydrophobicContact CG-CD2 3.86Å; P179-L231 HydrophobicContact CG-CG 3.89Å; P179-K238 VanDerWaalsContact CB-O 3.25Å; P179-K238 WeakPolarHBondContact CB-O 3.5Å
180	E	82.6	Confident	88.4	Confident	102 Å²	102	39.8 Å²	39.8	48%	0.477	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-41.1	-176.6	-170.1	172.2	-150.6	0	0	110.9	A182 K238	E180-A182 VanDerWaalsContact C-N 3.26Å; E180-A182 PolarHBondContact O-N 2.84Å; E180-K238 HydrophobicContact CB-CB 4.47Å; E180-K238 PolarHBondContact N-O 3.03Å; E180-K238 WeakPolarHBondContact OE2-CD 3.44Å; E180-K238 WeakPolarHBondContact OE2-CG 3.46Å
181	N	82.2	Confident	88.3	Confident	89 Å²	89	39.9 Å²	39.9	48%	0.476	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	8.2	178.6	-66	-28.6	0	0	0	114.7	P179 T183 L231 D239	P179-N181 VanDerWaalsContact C-N 3.25Å; P179-N181 PolarHBondContact O-N 3.37Å; N181-T183 PolarHBondContact O-N 2.94Å; N181-L231 HydrophobicContact CB-CD1 3.89Å; N181-D239 PolarHBondContact ND2-OD1 2.87Å
182	A	83.9	Confident	88	Confident	2 Å²	2	40 Å²	40	2%	0.017	22%	0.219	C	C	.	.			trans	-61.6	116.6	-180	0	0	0	0	0	112.8	L178 P179 E180 L186 K202	L178-A182 HydrophobicContact CB-CB 4.13Å; P179-A182 HydrophobicContact CG-CB 4.06Å; P179-A182 WeakPolarHBondContact O-CB 3.3Å; P179-A182 PolarHBondContact O-N 2.96Å; E180-A182 VanDerWaalsContact C-N 3.26Å; E180-A182 PolarHBondContact O-N 2.84Å; A182-L186 HydrophobicContact CB-CD2 3.78Å; A182-K202 PolarHBondContact O-NZ 3.38Å
183	T	87.1	Confident	87.5	Confident	72 Å²	72	45.4 Å²	45.4	44%	0.442	24%	0.243	S	C	.	.			trans	-80.1	164.9	171.5	62.5	0	0	0	0	111.5	N181 Q185 L186 I187	N181-T183 PolarHBondContact O-N 2.94Å; T183-Q185 VanDerWaalsContact C-N 3.31Å; T183-L186 WeakPolarHBondContact O-CB 3.33Å; T183-L186 PolarHBondContact O-N 2.82Å; T183-L186 WeakPolarHBondContact OG1-CB 3.38Å; T183-L186 PolarHBondContact OG1-N 3.03Å; T183-L186 VanDerWaalsContact OG1-N 3.16Å; T183-I187 WeakPolarHBondContact O-CG1 3.5Å; T183-I187 PolarHBondContact O-N 3.28Å
184	E	86.6	Confident	87.2	Confident	106 Å²	106	46 Å²	46	50%	0.495	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-35.1	171.5	-172.3	167.4	-172.8	0	0	111.8	L186 I187 M188 I200	E184-L186 VanDerWaalsContact C-N 3.32Å; E184-L186 PolarHBondContact O-N 3.44Å; E184-I187 WeakPolarHBondContact O-CB 3.13Å; E184-I187 PolarHBondContact O-N 3.43Å; E184-M188 WeakPolarHBondContact O-CG 3.42Å; E184-M188 PolarHBondContact O-N 3.19Å; E184-I200 HydrophobicContact CG-CB 4.41Å; E184-I200 HydrophobicContact CG-CD1 3.85Å; E184-I200 HydrophobicContact CG-CG2 4.36Å
185	Q	86.1	Confident	87	Confident	155 Å²	155	44.4 Å²	44.4	72%	0.724	25%	0.245	S	C	*	.	H	α-helix	trans	-59	-39.7	174.5	-66.7	167.3	-20.3	0	0	112.5	T183 M188 E189	T183-Q185 VanDerWaalsContact C-N 3.31Å; Q185-M188 PolarHBondContact O-N 3.16Å; Q185-E189 WeakPolarHBondContact O-CB 3.47Å; Q185-E189 PolarHBondContact O-N 3.22Å
186	L	86.6	Confident	87	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-42.7	172.1	171.9	76.3	0	0	0	111.8	S148 C149 A182 T183 E184 M188 E189 V190 I229 L231	S148-L186 VanDerWaalsContact OG-CD1 3.23Å; S148-L186 WeakPolarHBondContact OG-CD1 3.37Å; C149-L186 HydrophobicContact CB-CD1 3.74Å; C149-L186 VanDerWaalsContact SG-CD1 3.56Å; A182-L186 HydrophobicContact CB-CD2 3.78Å; T183-L186 WeakPolarHBondContact O-CB 3.33Å; T183-L186 PolarHBondContact O-N 2.82Å; T183-L186 WeakPolarHBondContact OG1-CB 3.38Å; T183-L186 PolarHBondContact OG1-N 3.03Å; T183-L186 VanDerWaalsContact OG1-N 3.16Å; E184-L186 VanDerWaalsContact C-N 3.32Å; E184-L186 PolarHBondContact O-N 3.44Å; L186-M188 VanDerWaalsContact C-N 3.33Å; L186-E189 PolarHBondContact O-N 2.77Å; L186-V190 HydrophobicContact CD1-CG2 4.44Å; L186-V190 WeakPolarHBondContact O-CG2 3.42Å; L186-V190 PolarHBondContact O-N 2.95Å; L186-I229 HydrophobicContact CD1-CD1 4.34Å; L186-I229 HydrophobicContact CD2-CD1 4.14Å; L186-I229 HydrophobicContact CG-CD1 4.5Å; L186-L231 HydrophobicContact CD1-CD2 3.93Å; L186-L231 HydrophobicContact CD2-CD2 3.47Å; L186-L231 VanDerWaalsContact CD2-CD2 3.47Å; L186-L231 HydrophobicContact CG-CD2 4.36Å
187	I	88.6	Confident	87.2	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-41	179	-61.8	167.6	0	0	0	109.8	L178 T183 E184 F191 I200 C208 I210	L178-I187 HydrophobicContact CD1-CD1 3.98Å; L178-I187 HydrophobicContact CD1-CG1 4.44Å; L178-I187 HydrophobicContact CD2-CG1 4.49Å; T183-I187 WeakPolarHBondContact O-CG1 3.5Å; T183-I187 PolarHBondContact O-N 3.28Å; E184-I187 WeakPolarHBondContact O-CB 3.13Å; E184-I187 PolarHBondContact O-N 3.43Å; I187-F191 HydrophobicContact CG2-CD2 4.09Å; I187-F191 WeakPolarHBondContact O-CB 3.23Å; I187-F191 PolarHBondContact O-N 3.05Å; I187-I200 HydrophobicContact CB-CD1 4.3Å; I187-I200 HydrophobicContact CG2-CD1 3.91Å; I187-I200 HydrophobicContact CG2-CG2 4.39Å; I187-C208 HydrophobicContact CD1-CB 4.32Å; I187-I210 HydrophobicContact CG2-CD1 3.44Å; I187-I210 VanDerWaalsContact CG2-CD1 3.44Å; I187-I210 HydrophobicContact CG2-CG1 4.03Å
188	M	89.1	Confident	87.5	Confident	104 Å²	104	54.7 Å²	54.7	51%	0.512	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-41.3	172.4	-65	179.7	76.8	0	0	112.5	E184 Q185 L186 V190 G192 I200	E184-M188 WeakPolarHBondContact O-CG 3.42Å; E184-M188 PolarHBondContact O-N 3.19Å; Q185-M188 PolarHBondContact O-N 3.16Å; L186-M188 VanDerWaalsContact C-N 3.33Å; M188-V190 PolarHBondContact O-N 2.99Å; M188-G192 VanDerWaalsContact O-CA 3.27Å; M188-G192 WeakPolarHBondContact O-CA 3.29Å; M188-G192 PolarHBondContact O-N 2.96Å; M188-I200 HydrophobicContact CG-CD1 3.53Å
189	E	88.3	Confident	87.6	Confident	45 Å²	45	56 Å²	56	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-37.5	178.7	-179.8	171.5	-149	0	0	112.6	C146 K147 S148 Q185 L186 Q193	C146-E189 HydrophobicContact CB-CG 4Å; K147-E189 WeakPolarHBondContact CA-OE1 3.15Å; K147-E189 WeakPolarHBondContact CB-OE1 3.48Å; K147-E189 WeakPolarHBondContact CD-OE1 3.33Å; K147-E189 WeakPolarHBondContact CG-OE1 3.25Å; K147-E189 PolarHBondContact N-OE1 2.77Å; S148-E189 WeakPolarHBondContact CB-OE2 3.49Å; S148-E189 PolarHBondContact N-OE2 2.84Å; S148-E189 VanDerWaalsContact N-OE2 3.14Å; S148-E189 PolarHBondContact OG-OE2 2.85Å; Q185-E189 WeakPolarHBondContact O-CB 3.47Å; Q185-E189 PolarHBondContact O-N 3.22Å; L186-E189 PolarHBondContact O-N 2.77Å; E189-Q193 WeakPolarHBondContact O-CG 3.39Å; E189-Q193 PolarHBondContact O-NE2 3.24Å
190	V	87.3	Confident	88	Confident	6 Å²	6	57 Å²	57	4%	0.036	31%	0.31	C	S	.	.	H	α-helix	trans	-79.3	-54.9	178.9	171	0	0	0	0	111.5	L151 L186 M188 L224	L151-V190 HydrophobicContact CD1-CG1 3.89Å; L186-V190 HydrophobicContact CD1-CG2 4.44Å; L186-V190 WeakPolarHBondContact O-CG2 3.42Å; L186-V190 PolarHBondContact O-N 2.95Å; M188-V190 PolarHBondContact O-N 2.99Å; V190-L224 HydrophobicContact CG1-CD1 3.87Å
191	F	90.1	Very high	88.3	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.009	32%	0.316	C	S	.	.	H	α-helix	trans	-87.1	-19.4	-170.9	-71.3	-85.8	0	0	0	113.8	V175 I187 Q193 C194 I197 I210 F212 A221 L224 V245	V175-F191 HydrophobicContact CB-CZ 4.32Å; V175-F191 HydrophobicContact CG1-CE2 3.9Å; V175-F191 HydrophobicContact CG1-CZ 3.65Å; V175-F191 HydrophobicContact CG2-CE1 3.93Å; V175-F191 HydrophobicContact CG2-CE2 4.14Å; V175-F191 HydrophobicContact CG2-CZ 3.66Å; I187-F191 HydrophobicContact CG2-CD2 4.09Å; I187-F191 WeakPolarHBondContact O-CB 3.23Å; I187-F191 PolarHBondContact O-N 3.05Å; F191-Q193 PolarHBondContact O-N 3.29Å; F191-C194 VanDerWaalsContact O-CB 3.28Å; F191-C194 WeakPolarHBondContact O-CB 3.43Å; F191-C194 PolarHBondContact O-N 3.02Å; F191-I197 HydrophobicContact CB-CD1 4.01Å; F191-I210 HydrophobicContact CB-CD1 3.8Å; F191-I210 HydrophobicContact CD1-CD1 3.99Å; F191-I210 HydrophobicContact CD2-CD1 3.52Å; F191-I210 HydrophobicContact CE1-CD1 4.49Å; F191-I210 HydrophobicContact CE2-CD1 4.08Å; F191-I210 HydrophobicContact CG-CD1 3.47Å; F191-I210 VanDerWaalsContact CG-CD1 3.47Å; F191-F212 HydrophobicContact CB-CE1 4.43Å; F191-F212 HydrophobicContact CB-CZ 4.26Å; F191-F212 HydrophobicContact CD1-CZ 4.43Å; F191-A221 HydrophobicContact CD1-CB 4.04Å; F191-A221 HydrophobicContact CE1-CB 4.32Å; F191-L224 HydrophobicContact CD1-CD1 4.02Å; F191-L224 HydrophobicContact CE1-CB 4.34Å; F191-L224 HydrophobicContact CE1-CD1 3.81Å; F191-L224 HydrophobicContact CZ-CD1 4.28Å; F191-V245 HydrophobicContact CE1-CG2 3.83Å; F191-V245 HydrophobicContact CZ-CG2 3.9Å
192	G	87.4	Confident	88.6	Confident	37 Å²	37	59.9 Å²	59.9	38%	0.381	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.7	171.9	0	0	0	0	0	113.2	M188 C194 G195	M188-G192 VanDerWaalsContact O-CA 3.27Å; M188-G192 WeakPolarHBondContact O-CA 3.29Å; M188-G192 PolarHBondContact O-N 2.96Å; G192-C194 PolarHBondContact O-N 3.2Å; G192-G195 PolarHBondContact O-N 2.72Å
193	Q	83.9	Confident	88.7	Confident	123 Å²	123	61.4 Å²	61.4	58%	0.575	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-20.1	170.9	-62	-179.5	39.3	0	0	112.7	E189 F191	E189-Q193 WeakPolarHBondContact O-CG 3.39Å; E189-Q193 PolarHBondContact O-NE2 3.24Å; F191-Q193 PolarHBondContact O-N 3.29Å
194	C	86.7	Confident	88.5	Confident	13 Å²	13	68.1 Å²	68.1	9%	0.088	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-37.6	173.3	-55.8	0	0	0	0	111.3	F191 G192 T217 K220 A221	F191-C194 VanDerWaalsContact O-CB 3.28Å; F191-C194 WeakPolarHBondContact O-CB 3.43Å; F191-C194 PolarHBondContact O-N 3.02Å; G192-C194 PolarHBondContact O-N 3.2Å; C194-T217 HydrophobicContact CB-CG2 3.87Å; C194-K220 HydrophobicContact CB-CB 3.91Å; C194-K220 WeakPolarHBondContact O-CD 3.26Å; C194-A221 HydrophobicContact CB-CB 4.4Å
195	G	88.8	Confident	88.3	Confident	17 Å²	17	71.2 Å²	71.2	18%	0.175	36%	0.358	C	S	.	.	S	Bend	trans	158.4	179.9	178.9	0	0	0	0	0	112.5	G192 I197	G192-G195 PolarHBondContact O-N 2.72Å; G195-I197 PolarHBondContact O-N 2.89Å
196	D	92.3	Very high	88.3	Confident	131 Å²	131	66.5 Å²	66.5	70%	0.701	34%	0.337	S	S	*	.			trans	-65.8	123.5	-168.2	-65.6	-51.9	0	0	0	113.8	F212 A213	D196-F212 CarbonylContact O-C 3.58Å; D196-F212 VanDerWaalsContact O-CA 3.28Å; D196-F212 WeakPolarHBondContact O-CA 3.36Å; D196-A213 HydrophobicContact CB-CB 4.26Å; D196-A213 PolarHBondContact O-N 3.35Å
197	I	93.2	Very high	88.5	Confident	41 Å²	41	68.7 Å²	68.7	21%	0.21	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.2	178.9	-62.1	171.3	0	0	0	109.5	F191 G195 I200 I210 F212	F191-I197 HydrophobicContact CB-CD1 4.01Å; G195-I197 PolarHBondContact O-N 2.89Å; I197-I200 HydrophobicContact CD1-CD1 4.44Å; I197-I200 HydrophobicContact CG2-CD1 4.18Å; I197-I200 HydrophobicContact CG2-CG1 3.67Å; I197-I210 HydrophobicContact CB-CG2 4.38Å; I197-I210 HydrophobicContact CD1-CG2 3.95Å; I197-I210 HydrophobicContact CG1-CG2 3.81Å; I197-I210 HydrophobicContact CG2-CG2 3.72Å; I197-F212 HydrophobicContact CD1-CE1 4.39Å; I197-F212 HydrophobicContact CG1-CD1 3.84Å; I197-F212 HydrophobicContact CG1-CE1 3.63Å
198	T	93	Very high	88.7	Confident	86 Å²	86	68.7 Å²	68.7	53%	0.528	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-34.9	175.2	-51.3	0	0	0	0	112.6	R211 A213	T198-R211 PolarHBondContact N-O 3.38Å; T198-A213 WeakPolarHBondContact OG1-CA 3.27Å; T198-A213 PolarHBondContact OG1-N 3.01Å
199	A	91.2	Very high	88.9	Confident	35 Å²	35	66.8 Å²	66.8	29%	0.289	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	145.8	177.5	0	0	0	0	0	112.8	R211	A199-R211 HydrophobicContact CB-CB 4.34Å; A199-R211 PolarHBondContact N-O 3.44Å; A199-R211 PolarHBondContact O-N 2.98Å
200	I	92.2	Very high	89.2	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.128	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.8	169.4	-58.4	172.4	0	0	0	108.7	E184 I187 M188 I197 C208 H209 I210	E184-I200 HydrophobicContact CG-CB 4.41Å; E184-I200 HydrophobicContact CG-CD1 3.85Å; E184-I200 HydrophobicContact CG-CG2 4.36Å; I187-I200 HydrophobicContact CB-CD1 4.3Å; I187-I200 HydrophobicContact CG2-CD1 3.91Å; I187-I200 HydrophobicContact CG2-CG2 4.39Å; M188-I200 HydrophobicContact CG-CD1 3.53Å; I197-I200 HydrophobicContact CD1-CD1 4.44Å; I197-I200 HydrophobicContact CG2-CD1 4.18Å; I197-I200 HydrophobicContact CG2-CG1 3.67Å; I200-C208 HydrophobicContact CG2-CB 4.31Å; I200-H209 CarbonylContact C-O 3.46Å; I200-H209 WeakPolarHBondContact CA-O 3.4Å; I200-I210 HydrophobicContact CG1-CG2 4.4Å
201	R	90.5	Very high	89.5	Confident	157 Å²	157	66.1 Å²	66.1	59%	0.592	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	87.2	173.3	-57.4	-172.3	-169.4	174.2	11.7	109	C208 H209 D252	R201-C208 WeakPolarHBondContact O-CA 3.48Å; R201-H209 HydrophobicContact CB-CB 4.48Å; R201-H209 PolarHBondContact N-O 2.76Å; R201-H209 PolarHBondContact O-N 3.42Å; R201-D252 IonicContact NH2-OD2 3.07Å; R201-D252 PolarHBondContact NH2-OD2 3.07Å
202	K	87.9	Confident	89.8	Confident	94 Å²	94	66.1 Å²	66.1	41%	0.409	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	137.3	177.3	-172.5	-177.9	176.5	-172.6	0	111.2	A182 C208	A182-K202 PolarHBondContact O-NZ 3.38Å; K202-C208 HydrophobicContact CB-CB 4.29Å
203	S	86.3	Confident	90	Very high	33 Å²	33	66.5 Å²	66.5	23%	0.231	33%	0.331	C	S	.	.			trans	-101.4	155.5	175.8	177.7	0	0	0	0	112	K205 F207	S203-K205 PolarHBondContact O-N 3.25Å; S203-K205 PolarHBondContact OG-N 3.34Å; S203-F207 VanDerWaalsContact CB-CZ 3.43Å; S203-F207 VanDerWaalsContact CB-O 3.3Å; S203-F207 WeakPolarHBondContact CB-O 3.46Å; S203-F207 PolarHBondContact N-O 3.34Å; S203-F207 VanDerWaalsContact OG-CE1 3.23Å; S203-F207 WeakPolarHBondContact OG-CE1 3.41Å; S203-F207 WeakPolarHBondContact OG-CZ 3.44Å
204	K	83.3	Confident	90.3	Very high	213 Å²	213	66.3 Å²	66.3	93%	0.926	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-5.3	171.5	-62.5	-174.2	179.3	-176.9	0	113.9
205	K	82.6	Confident	90.4	Very high	172 Å²	172	68.3 Å²	68.3	75%	0.748	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	38.1	-179.5	-62.8	-173.7	176.9	-175.6	0	113	S203 F207	S203-K205 PolarHBondContact O-N 3.25Å; S203-K205 PolarHBondContact OG-N 3.34Å; K205-F207 HydrophobicContact CB-CD1 3.88Å; K205-F207 HydrophobicContact CB-CE1 3.83Å; K205-F207 WeakPolarHBondContact O-CD1 3.28Å; K205-F207 PolarHBondContact O-N 2.94Å; K205-F207 VanDerWaalsContact O-N 3.11Å
206	N	85.6	Confident	90.4	Very high	55 Å²	55	70 Å²	70	29%	0.294	35%	0.347	S	S	.	.	S	Bend	trans	50.8	37.7	175.9	-63.5	-3.8	0	0	0	115.2	G177 L178	G177-N206 PolarHBondContact N-O 2.99Å; L178-N206 PolarHBondContact N-O 2.85Å
207	F	90.8	Very high	90.3	Very high	53 Å²	53	64 Å²	64	23%	0.232	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	160.1	168.4	71.6	-103.8	0	0	0	110.6	F174 V175 S203 K205 H209	F174-F207 HydrophobicContact CD2-CD2 4.16Å; F174-F207 HydrophobicContact CE2-CB 3.69Å; F174-F207 HydrophobicContact CE2-CD1 4.3Å; F174-F207 AromaticContact CE2-CD2 3.58Å; F174-F207 HydrophobicContact CE2-CD2 3.58Å; F174-F207 HydrophobicContact CE2-CE2 4.22Å; F174-F207 AromaticContact CE2-CG 3.64Å; F174-F207 HydrophobicContact CE2-CG 3.64Å; F174-F207 HydrophobicContact CZ-CB 3.85Å; F174-F207 HydrophobicContact CZ-CG 4.17Å; V175-F207 CarbonylContact O-C 3.54Å; V175-F207 WeakPolarHBondContact O-CA 3.28Å; V175-F207 WeakPolarHBondContact O-CB 3.47Å; S203-F207 VanDerWaalsContact CB-CZ 3.43Å; S203-F207 VanDerWaalsContact CB-O 3.3Å; S203-F207 WeakPolarHBondContact CB-O 3.46Å; S203-F207 PolarHBondContact N-O 3.34Å; S203-F207 VanDerWaalsContact OG-CE1 3.23Å; S203-F207 WeakPolarHBondContact OG-CE1 3.41Å; S203-F207 WeakPolarHBondContact OG-CZ 3.44Å; K205-F207 HydrophobicContact CB-CD1 3.88Å; K205-F207 HydrophobicContact CB-CE1 3.83Å; K205-F207 WeakPolarHBondContact O-CD1 3.28Å; K205-F207 PolarHBondContact O-N 2.94Å; K205-F207 VanDerWaalsContact O-N 3.11Å; F207-H209 AromaticContact CE2-CE1 3.76Å
208	C	92.3	Very high	90.2	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	165.7	165.9	68.3	0	0	0	0	111.2	V175 L178 I187 I200 R201 K202	V175-C208 PolarHBondContact N-O 2.7Å; V175-C208 PolarHBondContact O-N 3.36Å; L178-C208 HydrophobicContact CD1-CB 4.3Å; I187-C208 HydrophobicContact CD1-CB 4.32Å; I200-C208 HydrophobicContact CG2-CB 4.31Å; R201-C208 WeakPolarHBondContact O-CA 3.48Å; K202-C208 HydrophobicContact CB-CB 4.29Å
209	H	93.7	Very high	89.9	Confident	64 Å²	64	61.4 Å²	61.4	30%	0.296	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.9	159.4	-61.6	95.9	0	0	0	108.5	T172 V173 F174 I200 R201 F207	T172-H209 HydrophobicContact CG2-CB 4.03Å; V173-H209 CarbonylContact O-C 3.58Å; V173-H209 VanDerWaalsContact O-CA 3.28Å; V173-H209 WeakPolarHBondContact O-CA 3.3Å; F174-H209 AromaticContact CD2-NE2 3.68Å; I200-H209 CarbonylContact C-O 3.46Å; I200-H209 WeakPolarHBondContact CA-O 3.4Å; R201-H209 HydrophobicContact CB-CB 4.48Å; R201-H209 PolarHBondContact N-O 2.76Å; R201-H209 PolarHBondContact O-N 3.42Å; F207-H209 AromaticContact CE2-CE1 3.76Å
210	I	94	Very high	89.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.6	178.8	-50.5	175.3	0	0	0	107.3	T172 V173 V175 I187 F191 I197 I200 F212	T172-I210 CarbonylContact C-O 3.6Å; T172-I210 VanDerWaalsContact CA-O 3.28Å; T172-I210 WeakPolarHBondContact CA-O 3.12Å; V173-I210 HydrophobicContact CG2-CB 3.82Å; V173-I210 HydrophobicContact CG2-CD1 4.47Å; V173-I210 HydrophobicContact CG2-CG1 4.4Å; V173-I210 PolarHBondContact N-O 2.7Å; V173-I210 PolarHBondContact O-N 3.05Å; V175-I210 HydrophobicContact CG2-CD1 3.74Å; V175-I210 HydrophobicContact CG2-CG1 4.25Å; I187-I210 HydrophobicContact CG2-CD1 3.44Å; I187-I210 VanDerWaalsContact CG2-CD1 3.44Å; I187-I210 HydrophobicContact CG2-CG1 4.03Å; F191-I210 HydrophobicContact CB-CD1 3.8Å; F191-I210 HydrophobicContact CD1-CD1 3.99Å; F191-I210 HydrophobicContact CD2-CD1 3.52Å; F191-I210 HydrophobicContact CE1-CD1 4.49Å; F191-I210 HydrophobicContact CE2-CD1 4.08Å; F191-I210 HydrophobicContact CG-CD1 3.47Å; F191-I210 VanDerWaalsContact CG-CD1 3.47Å; I197-I210 HydrophobicContact CB-CG2 4.38Å; I197-I210 HydrophobicContact CD1-CG2 3.95Å; I197-I210 HydrophobicContact CG1-CG2 3.81Å; I197-I210 HydrophobicContact CG2-CG2 3.72Å; I200-I210 HydrophobicContact CG1-CG2 4.4Å; I210-F212 HydrophobicContact CG2-CD1 4.49Å; I210-F212 HydrophobicContact CG2-CE1 4.03Å; I210-F212 HydrophobicContact CG2-CE2 4.36Å; I210-F212 HydrophobicContact CG2-CZ 3.95Å
211	R	94.3	Very high	89.7	Confident	38 Å²	38	64.2 Å²	64.2	14%	0.143	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.2	174.5	-171.7	-178	-153	-133.6	0.4	109	K171 T172 T198 A199 D253 E256	K171-R211 HydrophobicContact CB-CG 4.39Å; T172-R211 HydrophobicContact CG2-CB 4.49Å; T198-R211 PolarHBondContact N-O 3.38Å; A199-R211 HydrophobicContact CB-CB 4.34Å; A199-R211 PolarHBondContact N-O 3.44Å; A199-R211 PolarHBondContact O-N 2.98Å; R211-D253 IonicContact CZ-OD1 2.78Å; R211-D253 IonicContact NE-OD1 2.73Å; R211-D253 PolarHBondContact NE-OD1 3.27Å; R211-D253 IonicContact NH2-OD1 3.71Å; R211-D253 PolarHBondContact NH2-OD1 3.45Å; R211-E256 IonicContact CZ-OE1 3.67Å; R211-E256 VanDerWaalsContact CZ-OE1 3.24Å; R211-E256 IonicContact NH1-OE1 2.76Å; R211-E256 PolarHBondContact NH1-OE1 2.88Å; R211-E256 VanDerWaalsContact NH2-CD 3.25Å; R211-E256 IonicContact NH2-OE1 2.7Å; R211-E256 PolarHBondContact NH2-OE1 2.7Å; R211-E256 IonicContact NH2-OE2 3.16Å
212	F	94.9	Very high	89.6	Confident	1 Å²	1	58.3 Å²	58.3	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	163.4	173.4	-61.2	-73.5	0	0	0	111.8	K171 V173 F191 D196 I197 I210 T217 V218 A221	K171-F212 PolarHBondContact O-N 2.88Å; V173-F212 HydrophobicContact CG1-CE2 4.2Å; V173-F212 HydrophobicContact CG2-CE2 3.7Å; V173-F212 HydrophobicContact CG2-CZ 4.33Å; F191-F212 HydrophobicContact CB-CE1 4.43Å; F191-F212 HydrophobicContact CB-CZ 4.26Å; F191-F212 HydrophobicContact CD1-CZ 4.43Å; D196-F212 CarbonylContact O-C 3.58Å; D196-F212 VanDerWaalsContact O-CA 3.28Å; D196-F212 WeakPolarHBondContact O-CA 3.36Å; I197-F212 HydrophobicContact CD1-CE1 4.39Å; I197-F212 HydrophobicContact CG1-CD1 3.84Å; I197-F212 HydrophobicContact CG1-CE1 3.63Å; I210-F212 HydrophobicContact CG2-CD1 4.49Å; I210-F212 HydrophobicContact CG2-CE1 4.03Å; I210-F212 HydrophobicContact CG2-CE2 4.36Å; I210-F212 HydrophobicContact CG2-CZ 3.95Å; F212-T217 HydrophobicContact CB-CG2 3.98Å; F212-T217 HydrophobicContact CD1-CG2 3.31Å; F212-T217 HydrophobicContact CD2-CG2 3.81Å; F212-T217 HydrophobicContact CE1-CG2 3.59Å; F212-T217 HydrophobicContact CE2-CG2 4.07Å; F212-T217 HydrophobicContact CG-CG2 3.42Å; F212-T217 VanDerWaalsContact CG-CG2 3.42Å; F212-T217 HydrophobicContact CZ-CG2 3.97Å; F212-V218 HydrophobicContact CD2-CG2 4.15Å; F212-A221 HydrophobicContact CE2-CB 3.6Å; F212-A221 HydrophobicContact CZ-CB 3.69Å
213	A	92.9	Very high	89.5	Confident	45 Å²	45	57.7 Å²	57.7	37%	0.372	28%	0.281	S	S	.	.	S	Bend	trans	-68.4	-43.2	172.8	0	0	0	0	0	111.3	K171 D196 T198	K171-A213 VanDerWaalsContact CE-O 3.25Å; K171-A213 WeakPolarHBondContact CE-O 3.47Å; K171-A213 PolarHBondContact NZ-O 2.91Å; D196-A213 HydrophobicContact CB-CB 4.26Å; D196-A213 PolarHBondContact O-N 3.35Å; T198-A213 WeakPolarHBondContact OG1-CA 3.27Å; T198-A213 PolarHBondContact OG1-N 3.01Å
214	E	90.4	Very high	89.5	Confident	120 Å²	120	56.7 Å²	56.7	56%	0.561	27%	0.273	S	S	*	.	S	Bend	trans	-102.8	149.3	-179.1	-69.1	-166.5	-167.2	0	0	113.7	S216	E214-S216 VanDerWaalsContact C-N 3.31Å; E214-S216 PolarHBondContact OE2-OG 2.85Å
215	E	89	Confident	89.7	Confident	54 Å²	54	46.8 Å²	46.8	25%	0.252	23%	0.23	S	C	.	.	S	Bend	trans	-71.8	-26.8	172	-175.5	157.9	-173.1	0	0	111.6	R166 G169 K171 T217 R260	R166-E215 PolarHBondContact NH2-O 3.1Å; G169-E215 WeakPolarHBondContact CA-OE1 3.47Å; G169-E215 PolarHBondContact N-OE1 2.83Å; K171-E215 HydrophobicContact CG-CB 4.38Å; E215-T217 VanDerWaalsContact C-N 3.34Å; E215-T217 PolarHBondContact O-N 3.23Å; E215-R260 IonicContact OE2-CZ 2.7Å; E215-R260 IonicContact OE2-NH1 3.61Å; E215-R260 PolarHBondContact OE2-NH1 3.37Å; E215-R260 IonicContact OE2-NH2 3.24Å; E215-R260 PolarHBondContact OE2-NH2 2.7Å
216	S	87.9	Confident	89.8	Confident	53 Å²	53	38.6 Å²	38.6	37%	0.371	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.9	177.9	74.5	0	0	0	0	113.9	E214 V218	E214-S216 VanDerWaalsContact C-N 3.31Å; E214-S216 PolarHBondContact OE2-OG 2.85Å; S216-V218 VanDerWaalsContact C-N 3.3Å; S216-V218 PolarHBondContact O-N 3.34Å
217	T	90.5	Very high	89.8	Confident	5 Å²	5	36.1 Å²	36.1	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-72.4	-25.3	-175.6	-61.9	0	0	0	0	112.5	C194 F212 E215 D219 K220 A221	C194-T217 HydrophobicContact CB-CG2 3.87Å; F212-T217 HydrophobicContact CB-CG2 3.98Å; F212-T217 HydrophobicContact CD1-CG2 3.31Å; F212-T217 HydrophobicContact CD2-CG2 3.81Å; F212-T217 HydrophobicContact CE1-CG2 3.59Å; F212-T217 HydrophobicContact CE2-CG2 4.07Å; F212-T217 HydrophobicContact CG-CG2 3.42Å; F212-T217 VanDerWaalsContact CG-CG2 3.42Å; F212-T217 HydrophobicContact CZ-CG2 3.97Å; E215-T217 VanDerWaalsContact C-N 3.34Å; E215-T217 PolarHBondContact O-N 3.23Å; T217-D219 VanDerWaalsContact C-N 3.29Å; T217-D219 PolarHBondContact O-N 3.44Å; T217-K220 WeakPolarHBondContact O-CB 3.47Å; T217-K220 PolarHBondContact O-N 3Å; T217-A221 PolarHBondContact O-N 3.19Å
218	V	90.4	Very high	89.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.4	-40.4	179.9	171	0	0	0	0	111.6	C170 K171 V173 F212 S216 A221 L222 F247	C170-V218 WeakPolarHBondContact O-CG2 3.48Å; K171-V218 WeakPolarHBondContact O-CG2 3.32Å; V173-V218 HydrophobicContact CG1-CB 4.34Å; V173-V218 HydrophobicContact CG1-CG1 3.8Å; V173-V218 HydrophobicContact CG1-CG2 4.32Å; F212-V218 HydrophobicContact CD2-CG2 4.15Å; S216-V218 VanDerWaalsContact C-N 3.3Å; S216-V218 PolarHBondContact O-N 3.34Å; V218-A221 PolarHBondContact O-N 3.19Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 PolarHBondContact O-N 3.02Å; V218-F247 HydrophobicContact CG1-CD1 3.58Å; V218-F247 HydrophobicContact CG1-CE1 3.52Å
219	D	88.1	Confident	89.3	Confident	73 Å²	73	41.3 Å²	41.3	39%	0.39	20%	0.2	S	C	.	.	H	α-helix	trans	-66.8	-39.1	179.2	-58.2	-75.8	0	0	0	112.3	R166 T217 L222 F223	R166-D219 IonicContact CZ-OD1 3.61Å; R166-D219 IonicContact CZ-OD2 2.81Å; R166-D219 IonicContact NH1-OD1 2.88Å; R166-D219 PolarHBondContact NH1-OD1 3.42Å; R166-D219 IonicContact NH1-OD2 3.72Å; R166-D219 PolarHBondContact NH1-OD2 2.86Å; R166-D219 IonicContact NH2-OD1 2.7Å; R166-D219 IonicContact NH2-OD2 3.91Å; R166-D219 PolarHBondContact NH2-OD2 3.28Å; T217-D219 VanDerWaalsContact C-N 3.29Å; T217-D219 PolarHBondContact O-N 3.44Å; D219-L222 PolarHBondContact O-N 3.47Å; D219-F223 PolarHBondContact O-N 3.35Å
220	K	88.4	Confident	88.9	Confident	119 Å²	119	42.5 Å²	42.5	52%	0.517	20%	0.201	S	C	.	.	H	α-helix	trans	-64.7	-40	174.1	-60.7	172	-178.2	171.5	0	111.5	C194 T217 F223	C194-K220 HydrophobicContact CB-CB 3.91Å; C194-K220 WeakPolarHBondContact O-CD 3.26Å; T217-K220 WeakPolarHBondContact O-CB 3.47Å; T217-K220 PolarHBondContact O-N 3Å; K220-F223 WeakPolarHBondContact O-CB 3.39Å; K220-F223 PolarHBondContact O-N 3.46Å
221	A	89.3	Confident	88.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-39.1	176	0	0	0	0	0	111.8	V173 F191 C194 F212 T217 V218 F223 L224	V173-A221 HydrophobicContact CG1-CB 4.12Å; V173-A221 HydrophobicContact CG2-CB 4.4Å; F191-A221 HydrophobicContact CD1-CB 4.04Å; F191-A221 HydrophobicContact CE1-CB 4.32Å; C194-A221 HydrophobicContact CB-CB 4.4Å; F212-A221 HydrophobicContact CE2-CB 3.6Å; F212-A221 HydrophobicContact CZ-CB 3.69Å; T217-A221 PolarHBondContact O-N 3.19Å; V218-A221 PolarHBondContact O-N 3.19Å; A221-F223 PolarHBondContact O-N 3.04Å; A221-L224 WeakPolarHBondContact O-CB 3.28Å; A221-L224 PolarHBondContact O-N 3.04Å
222	L	88.6	Confident	87.8	Confident	32 Å²	32	44.1 Å²	44.1	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-32.4	176.6	-165.9	68.6	0	0	0	112.1	T163 V218 D219 L224 S225 V245 F247	T163-L222 HydrophobicContact CG2-CD1 3.95Å; T163-L222 HydrophobicContact CG2-CD2 4.32Å; T163-L222 HydrophobicContact CG2-CG 4.37Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 PolarHBondContact O-N 3.02Å; D219-L222 PolarHBondContact O-N 3.47Å; L222-L224 PolarHBondContact O-N 2.87Å; L222-S225 WeakPolarHBondContact O-CB 3.47Å; L222-S225 PolarHBondContact O-N 3.48Å; L222-V245 HydrophobicContact CD1-CG1 4.47Å; L222-V245 WeakPolarHBondContact CD1-O 3.25Å; L222-F247 HydrophobicContact CD2-CE1 4.46Å; L222-F247 HydrophobicContact CD2-CE2 3.79Å; L222-F247 HydrophobicContact CD2-CZ 3.67Å
223	F	86.9	Confident	86.7	Confident	82 Å²	82	49.8 Å²	49.8	36%	0.36	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.7	173.9	-170.5	-103.9	0	0	0	113.7	V139 K141 D219 K220 A221 S225	V139-F223 HydrophobicContact CB-CE2 4.12Å; V139-F223 HydrophobicContact CB-CZ 4.45Å; V139-F223 HydrophobicContact CG1-CE2 3.62Å; V139-F223 HydrophobicContact CG1-CZ 3.62Å; K141-F223 HydrophobicContact CD-CZ 4.27Å; K141-F223 HydrophobicContact CG-CE1 4.09Å; K141-F223 HydrophobicContact CG-CE2 4.18Å; K141-F223 HydrophobicContact CG-CZ 3.6Å; K141-F223 PolarHBondContact NZ-O 3.25Å; D219-F223 PolarHBondContact O-N 3.35Å; K220-F223 WeakPolarHBondContact O-CB 3.39Å; K220-F223 PolarHBondContact O-N 3.46Å; A221-F223 PolarHBondContact O-N 3.04Å; F223-S225 PolarHBondContact O-N 3.35Å
224	L	86.6	Confident	85.7	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-4.5	174.8	-58.3	-179.5	0	0	0	113.3	I144 L151 V190 F191 A221 L222 G226 Y227 V245	I144-L224 HydrophobicContact CD1-CD2 3.54Å; L151-L224 HydrophobicContact CD1-CD2 4.47Å; V190-L224 HydrophobicContact CG1-CD1 3.87Å; F191-L224 HydrophobicContact CD1-CD1 4.02Å; F191-L224 HydrophobicContact CE1-CB 4.34Å; F191-L224 HydrophobicContact CE1-CD1 3.81Å; F191-L224 HydrophobicContact CZ-CD1 4.28Å; A221-L224 WeakPolarHBondContact O-CB 3.28Å; A221-L224 PolarHBondContact O-N 3.04Å; L222-L224 PolarHBondContact O-N 2.87Å; L224-G226 PolarHBondContact O-N 3.29Å; L224-Y227 HydrophobicContact CD2-CD2 4.42Å; L224-Y227 HydrophobicContact CD2-CE2 4.26Å; L224-Y227 WeakPolarHBondContact O-CD2 3.45Å; L224-Y227 PolarHBondContact O-N 3.46Å; L224-V245 HydrophobicContact CB-CG2 4.28Å
225	S	86.9	Confident	84.8	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.035	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	131.7	173.5	-151.9	0	0	0	0	111.6	K141 L222 F223 H244 V245	K141-S225 PolarHBondContact NZ-O 2.96Å; L222-S225 WeakPolarHBondContact O-CB 3.47Å; L222-S225 PolarHBondContact O-N 3.48Å; F223-S225 PolarHBondContact O-N 3.35Å; S225-H244 PolarHBondContact OG-ND1 2.84Å; S225-V245 WeakPolarHBondContact CB-O 3.1Å; S225-V245 PolarHBondContact OG-N 3.37Å; S225-V245 PolarHBondContact OG-O 3.46Å
226	G	83.8	Confident	84.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-14.7	-179.7	0	0	0	0	0	115.8	L224 R242 L243	L224-G226 PolarHBondContact O-N 3.29Å; G226-R242 PolarHBondContact O-NE 3.1Å; G226-L243 WeakPolarHBondContact CA-O 3.49Å; G226-L243 PolarHBondContact N-O 3.31Å
227	Y	87.1	Confident	83.7	Confident	3 Å²	3	57 Å²	57	1%	0.012	30%	0.295	C	S	.	.			trans	-64.4	146.9	179.3	-87.9	-95.6	0	0	0	112.8	K141 E142 I144 L151 F152 P153 L224 R242 L243	K141-Y227 HydrophobicContact CB-CE2 4.25Å; K141-Y227 WeakPolarHBondContact CB-OH 3.21Å; K141-Y227 HydrophobicContact CD-CD2 4.37Å; K141-Y227 HydrophobicContact CD-CE2 3.74Å; K141-Y227 HydrophobicContact CG-CE2 4.2Å; E142-Y227 VanDerWaalsContact O-CE1 3.23Å; E142-Y227 WeakPolarHBondContact O-CE1 3.33Å; E142-Y227 PolarHBondContact O-OH 2.93Å; I144-Y227 HydrophobicContact CD1-CE1 4.03Å; I144-Y227 HydrophobicContact CG1-CE1 4.22Å; L151-Y227 HydrophobicContact CB-CD1 3.64Å; L151-Y227 HydrophobicContact CB-CE1 4.24Å; L151-Y227 HydrophobicContact CB-CG 4.35Å; F152-Y227 CarbonylContact O-C 3.55Å; F152-Y227 WeakPolarHBondContact O-CA 3.28Å; F152-Y227 VanDerWaalsContact O-CD1 3.29Å; F152-Y227 WeakPolarHBondContact O-CD1 3.18Å; P153-Y227 HydrophobicContact CB-CE1 4.2Å; L224-Y227 HydrophobicContact CD2-CD2 4.42Å; L224-Y227 HydrophobicContact CD2-CE2 4.26Å; L224-Y227 WeakPolarHBondContact O-CD2 3.45Å; L224-Y227 PolarHBondContact O-N 3.46Å; Y227-R242 CarbonylContact O-C 3.59Å; Y227-R242 WeakPolarHBondContact O-CA 3.23Å; Y227-L243 PolarHBondContact O-N 3.01Å
228	R	84.7	Confident	83.2	Confident	158 Å²	158	61.8 Å²	61.8	60%	0.596	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.1	173.3	-64.7	-177.3	67.5	-178.4	1.2	110.2	L151 F152 G241 R242	L151-R228 WeakPolarHBondContact CA-O 3.39Å; F152-R228 HydrophobicContact CB-CB 4.39Å; F152-R228 PolarHBondContact N-O 3.11Å; F152-R228 PolarHBondContact O-N 3.48Å; R228-G241 CarbonylContact C-O 3.57Å; R228-G241 WeakPolarHBondContact CA-O 3.12Å; R228-R242 HydrophobicContact CG-CG 4.36Å
229	I	87.8	Confident	82.8	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	140.8	178.7	-178.2	166.1	0	0	0	110.8	C149 L151 P179 L186 L231 T240 G241 L243	C149-I229 HydrophobicContact CB-CD1 4.25Å; C149-I229 HydrophobicContact CB-CG1 4.06Å; L151-I229 HydrophobicContact CD2-CB 3.58Å; L151-I229 HydrophobicContact CD2-CD1 3.87Å; L151-I229 HydrophobicContact CD2-CG1 3.63Å; P179-I229 HydrophobicContact CG-CG2 4.3Å; L186-I229 HydrophobicContact CD1-CD1 4.34Å; L186-I229 HydrophobicContact CD2-CD1 4.14Å; L186-I229 HydrophobicContact CG-CD1 4.5Å; I229-L231 HydrophobicContact CD1-CD2 4.38Å; I229-L231 HydrophobicContact CG1-CD2 4.43Å; I229-T240 WeakPolarHBondContact O-CA 3.41Å; I229-G241 PolarHBondContact N-O 2.71Å; I229-G241 PolarHBondContact O-N 3.2Å; I229-L243 HydrophobicContact CB-CD2 4.43Å; I229-L243 HydrophobicContact CB-CG 4.36Å; I229-L243 HydrophobicContact CG2-CD2 3.88Å; I229-L243 HydrophobicContact CG2-CG 4.15Å
230	R	85.4	Confident	82.5	Confident	89 Å²	89	61.7 Å²	61.7	34%	0.336	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.9	171	-178.2	-174.1	-62.3	167.4	4	109.8	C149 T150 F152 S234 D239 T240	C149-R230 CarbonylContact C-O 3.55Å; C149-R230 WeakPolarHBondContact CA-O 3.37Å; C149-R230 WeakPolarHBondContact CB-O 3.34Å; T150-R230 PolarHBondContact N-O 3.34Å; T150-R230 PolarHBondContact O-N 3.25Å; F152-R230 HydrophobicContact CE2-CB 4.28Å; R230-S234 WeakPolarHBondContact CD-O 3.44Å; R230-S234 WeakPolarHBondContact CG-O 3.48Å; R230-D239 WeakPolarHBondContact CA-O 3.48Å; R230-T240 HydrophobicContact CB-CG2 4.19Å; R230-T240 HydrophobicContact CG-CG2 3.99Å
231	L	84.8	Confident	82.4	Confident	28 Å²	28	56.9 Å²	56.9	15%	0.147	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.6	175.8	-51.7	-176	0	0	0	110.6	C149 P179 N181 L186 I229 S233 S234 D239	C149-L231 HydrophobicContact CB-CD2 4.09Å; P179-L231 HydrophobicContact CB-CD1 4.16Å; P179-L231 HydrophobicContact CB-CG 4.36Å; P179-L231 HydrophobicContact CG-CD1 3.91Å; P179-L231 HydrophobicContact CG-CD2 3.86Å; P179-L231 HydrophobicContact CG-CG 3.89Å; N181-L231 HydrophobicContact CB-CD1 3.89Å; L186-L231 HydrophobicContact CD1-CD2 3.93Å; L186-L231 HydrophobicContact CD2-CD2 3.47Å; L186-L231 VanDerWaalsContact CD2-CD2 3.47Å; L186-L231 HydrophobicContact CG-CD2 4.36Å; I229-L231 HydrophobicContact CD1-CD2 4.38Å; I229-L231 HydrophobicContact CG1-CD2 4.43Å; L231-S233 PolarHBondContact O-N 2.72Å; L231-S234 PolarHBondContact O-N 3.25Å; L231-D239 HydrophobicContact CB-CB 4.16Å; L231-D239 HydrophobicContact CG-CB 4.44Å; L231-D239 PolarHBondContact N-O 3.45Å
232	G	78.6	Confident	82.3	Confident	43 Å²	43	62 Å²	62	44%	0.443	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	-134.7	-175.1	0	0	0	0	0	113.4	S148	S148-G232 PolarHBondContact O-N 3.35Å
233	S	73.3	Confident	82.4	Confident	120 Å²	120	60.5 Å²	60.5	84%	0.839	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	1.9	177.8	-53.7	0	0	0	0	114.3	L231	L231-S233 PolarHBondContact O-N 2.72Å
234	S	71.2	Confident	82.5	Confident	40 Å²	40	59.5 Å²	59.5	28%	0.28	31%	0.308	S	S	.	.			trans	-70.7	143.5	-176.1	-174.9	0	0	0	0	111.7	R230 L231 D236 D239	R230-S234 WeakPolarHBondContact CD-O 3.44Å; R230-S234 WeakPolarHBondContact CG-O 3.48Å; L231-S234 PolarHBondContact O-N 3.25Å; S234-D236 PolarHBondContact OG-N 2.72Å; S234-D239 WeakPolarHBondContact CB-OD2 3.38Å; S234-D239 PolarHBondContact OG-OD2 2.72Å
235	T	72.8	Confident	82.7	Confident	115 Å²	115	59 Å²	59	71%	0.706	31%	0.306	S	S	*	.			trans	-114.5	7.1	175.3	53.4	0	0	0	0	112.9
236	D	78.4	Confident	82.9	Confident	79 Å²	79	59.2 Å²	59.2	42%	0.422	31%	0.306	S	S	.	.	S	Bend	trans	-67.7	154.1	177.4	-168.9	20.4	0	0	0	111.9	S234 K238 D239 T240	S234-D236 PolarHBondContact OG-N 2.72Å; D236-K238 PolarHBondContact O-N 2.98Å; D236-D239 PolarHBondContact O-N 2.8Å; D236-T240 PolarHBondContact O-N 2.61Å; D236-T240 PolarHBondContact O-OG1 2.81Å
237	K	74.4	Confident	83.3	Confident	189 Å²	189	60 Å²	60	82%	0.822	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.8	178.3	-63.2	177.5	-178.5	175.6	0	112.9
238	K	79.6	Confident	83.5	Confident	106 Å²	106	60.2 Å²	60.2	46%	0.461	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-28.9	176.2	-60.8	-172.1	172.2	-171.6	0	113.5	P179 E180 D236	P179-K238 VanDerWaalsContact CB-O 3.25Å; P179-K238 WeakPolarHBondContact CB-O 3.5Å; E180-K238 HydrophobicContact CB-CB 4.47Å; E180-K238 PolarHBondContact N-O 3.03Å; E180-K238 WeakPolarHBondContact OE2-CD 3.44Å; E180-K238 WeakPolarHBondContact OE2-CG 3.46Å; D236-K238 PolarHBondContact O-N 2.98Å
239	D	82.4	Confident	83.8	Confident	29 Å²	29	60.3 Å²	60.3	16%	0.155	32%	0.319	C	S	.	.	S	Bend	trans	-100.2	4.6	-177.4	-63.8	-37.6	0	0	0	112.9	N181 R230 L231 S234 D236	N181-D239 PolarHBondContact ND2-OD1 2.87Å; R230-D239 WeakPolarHBondContact CA-O 3.48Å; L231-D239 HydrophobicContact CB-CB 4.16Å; L231-D239 HydrophobicContact CG-CB 4.44Å; L231-D239 PolarHBondContact N-O 3.45Å; S234-D239 WeakPolarHBondContact CB-OD2 3.38Å; S234-D239 PolarHBondContact OG-OD2 2.72Å; D236-D239 PolarHBondContact O-N 2.8Å
240	T	82.6	Confident	84	Confident	42 Å²	42	61.2 Å²	61.2	26%	0.258	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.6	178.8	51.2	0	0	0	0	111.4	I229 R230 D236	I229-T240 WeakPolarHBondContact O-CA 3.41Å; R230-T240 HydrophobicContact CB-CG2 4.19Å; R230-T240 HydrophobicContact CG-CG2 3.99Å; D236-T240 PolarHBondContact O-N 2.61Å; D236-T240 PolarHBondContact O-OG1 2.81Å
241	G	85.3	Confident	84.2	Confident	18 Å²	18	67.2 Å²	67.2	19%	0.186	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	173.6	-178.5	0	0	0	0	0	112.5	G177 R228 I229	G177-G241 WeakPolarHBondContact O-CA 3.23Å; R228-G241 CarbonylContact C-O 3.57Å; R228-G241 WeakPolarHBondContact CA-O 3.12Å; I229-G241 PolarHBondContact N-O 2.71Å; I229-G241 PolarHBondContact O-N 3.2Å
242	R	88.1	Confident	84.5	Confident	108 Å²	108	69.1 Å²	69.1	41%	0.408	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	108.3	168.7	-174.4	-179.2	-173.2	-107.8	8.1	108.3	G177 G226 Y227 R228 H244	G177-R242 WeakPolarHBondContact CA-O 3.44Å; G177-R242 CarbonylContact O-C 3.54Å; G177-R242 PolarHBondContact O-N 3.45Å; G177-R242 VanDerWaalsContact O-N 3.14Å; G226-R242 PolarHBondContact O-NE 3.1Å; Y227-R242 CarbonylContact O-C 3.59Å; Y227-R242 WeakPolarHBondContact O-CA 3.23Å; R228-R242 HydrophobicContact CG-CG 4.36Å; R242-H244 PolarHBondContact O-N 3.06Å
243	L	89.4	Confident	85.1	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.34	C	S	.	.			trans	-62.5	130.5	179.9	-57.6	-177.9	0	0	0	109.9	L151 V175 G176 L178 G226 Y227 I229	L151-L243 HydrophobicContact CD1-CD1 4.5Å; L151-L243 HydrophobicContact CD2-CD1 4.04Å; V175-L243 HydrophobicContact CG1-CD2 4.39Å; G176-L243 WeakPolarHBondContact O-CA 3.46Å; L178-L243 HydrophobicContact CD2-CD2 3.78Å; G226-L243 WeakPolarHBondContact CA-O 3.49Å; G226-L243 PolarHBondContact N-O 3.31Å; Y227-L243 PolarHBondContact O-N 3.01Å; I229-L243 HydrophobicContact CB-CD2 4.43Å; I229-L243 HydrophobicContact CB-CG 4.36Å; I229-L243 HydrophobicContact CG2-CD2 3.88Å; I229-L243 HydrophobicContact CG2-CG 4.15Å
244	H	89.7	Confident	85.9	Confident	61 Å²	61	64.3 Å²	64.3	28%	0.282	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	108.9	164.3	171.2	41.2	0	0	0	107	V175 G176 S225 R242	V175-H244 CarbonylContact C-O 3.53Å; V175-H244 WeakPolarHBondContact CA-O 3.29Å; G176-H244 PolarHBondContact N-O 2.9Å; G176-H244 PolarHBondContact O-N 3.05Å; S225-H244 PolarHBondContact OG-ND1 2.84Å; R242-H244 PolarHBondContact O-N 3.06Å
245	V	91.2	Very high	86.9	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.6	173.4	-168.2	0	0	0	0	108	V173 F174 V175 F191 L222 L224 S225	V173-V245 HydrophobicContact CB-CG1 3.88Å; V173-V245 HydrophobicContact CG1-CG1 4.03Å; V173-V245 HydrophobicContact CG2-CG1 4.3Å; F174-V245 VanDerWaalsContact O-CA 3.3Å; F174-V245 WeakPolarHBondContact O-CA 3.5Å; V175-V245 HydrophobicContact CG1-CG2 4.4Å; V175-V245 HydrophobicContact CG2-CG1 4.29Å; V175-V245 HydrophobicContact CG2-CG2 4.27Å; F191-V245 HydrophobicContact CE1-CG2 3.83Å; F191-V245 HydrophobicContact CZ-CG2 3.9Å; L222-V245 HydrophobicContact CD1-CG1 4.47Å; L222-V245 WeakPolarHBondContact CD1-O 3.25Å; L224-V245 HydrophobicContact CB-CG2 4.28Å; S225-V245 WeakPolarHBondContact CB-O 3.1Å; S225-V245 PolarHBondContact OG-N 3.37Å; S225-V245 PolarHBondContact OG-O 3.46Å
246	D	91.5	Very high	87.8	Confident	9 Å²	9	67 Å²	67	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	166.3	178	-169.5	22.3	0	0	0	110.2	T163 R164 V173 F174	T163-D246 WeakPolarHBondContact CA-OD1 3.35Å; R164-D246 WeakPolarHBondContact CD-OD2 3.23Å; R164-D246 VanDerWaalsContact CG-OD2 3.23Å; R164-D246 WeakPolarHBondContact CG-OD2 3.19Å; R164-D246 PolarHBondContact N-OD1 3.44Å; R164-D246 IonicContact NE-OD2 3.03Å; V173-D246 WeakPolarHBondContact CA-O 3.43Å; F174-D246 PolarHBondContact N-O 2.88Å; F174-D246 PolarHBondContact O-N 3.48Å
247	F	92.2	Very high	88.5	Confident	17 Å²	17	67.1 Å²	67.1	8%	0.075	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	138.2	177.6	-60.2	-79.7	0	0	0	111.9	R164 R166 V218 L222	R164-F247 VanDerWaalsContact O-CD2 3.25Å; R164-F247 WeakPolarHBondContact O-CD2 3.11Å; R164-F247 WeakPolarHBondContact O-CE2 3.47Å; R166-F247 HydrophobicContact CB-CD1 4.09Å; R166-F247 HydrophobicContact CB-CD2 4.47Å; R166-F247 HydrophobicContact CB-CE1 3.85Å; R166-F247 HydrophobicContact CB-CE2 4.24Å; R166-F247 HydrophobicContact CB-CG 4.39Å; R166-F247 HydrophobicContact CB-CZ 3.93Å; R166-F247 HydrophobicContact CG-CD1 3.83Å; R166-F247 HydrophobicContact CG-CE1 3.6Å; R166-F247 HydrophobicContact CG-CZ 4.16Å; V218-F247 HydrophobicContact CG1-CD1 3.58Å; V218-F247 HydrophobicContact CG1-CE1 3.52Å; L222-F247 HydrophobicContact CD2-CE1 4.46Å; L222-F247 HydrophobicContact CD2-CE2 3.79Å; L222-F247 HydrophobicContact CD2-CZ 3.67Å
248	A	91.4	Very high	89.4	Confident	7 Å²	7	61.7 Å²	61.7	6%	0.058	28%	0.282	C	S	.	.			trans	-113.3	127.1	174.8	0	0	0	0	0	112	T172 F174 A250	T172-A248 HydrophobicContact CG2-CB 3.94Å; T172-A248 WeakPolarHBondContact O-CB 3.5Å; T172-A248 PolarHBondContact O-N 2.9Å; F174-A248 HydrophobicContact CB-CB 4.2Å; A248-A250 VanDerWaalsContact C-N 3.33Å; A248-A250 PolarHBondContact O-N 3.26Å
249	Q	90.3	Very high	90	Very high	161 Å²	161	58.5 Å²	58.5	75%	0.752	27%	0.272	S	S	*	.			trans	-77	81.8	175.4	-168.4	178.9	39.3	0	0	110.6	P167	P167-Q249 HydrophobicContact CB-CG 4.42Å; P167-Q249 HydrophobicContact CG-CB 4.1Å; P167-Q249 HydrophobicContact CG-CG 4.42Å
250	A	91.5	Very high	90.4	Very high	23 Å²	23	61.7 Å²	61.7	19%	0.19	28%	0.282	C	S	.	.			trans	-81.2	131.8	173.5	0	0	0	0	0	111.4	T172 A248 D252 D253 L254	T172-A250 HydrophobicContact CG2-CB 4.29Å; T172-A250 WeakPolarHBondContact OG1-CB 3.39Å; A248-A250 VanDerWaalsContact C-N 3.33Å; A248-A250 PolarHBondContact O-N 3.26Å; A250-D252 VanDerWaalsContact C-N 3.26Å; A250-D252 PolarHBondContact O-N 2.87Å; A250-D253 HydrophobicContact CB-CB 4.16Å; A250-D253 PolarHBondContact O-N 2.78Å; A250-L254 PolarHBondContact O-N 3.06Å
251	R	89	Confident	90.9	Very high	216 Å²	216	63.7 Å²	63.7	82%	0.815	29%	0.288	S	S	*	.	H	α-helix	trans	-61	-36.9	176.3	-177	175.2	179	140.4	1.5	112.3	L254 Y255	R251-L254 PolarHBondContact O-N 2.94Å; R251-Y255 WeakPolarHBondContact O-CB 3.48Å; R251-Y255 PolarHBondContact O-N 2.96Å
252	D	91	Very high	91.2	Very high	67 Å²	67	67.6 Å²	67.6	36%	0.358	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-39.3	-177.9	-49.7	-24.3	0	0	0	110.7	R201 A250 E256	R201-D252 IonicContact NH2-OD2 3.07Å; R201-D252 PolarHBondContact NH2-OD2 3.07Å; A250-D252 VanDerWaalsContact C-N 3.26Å; A250-D252 PolarHBondContact O-N 2.87Å; D252-E256 PolarHBondContact O-N 2.75Å
253	D	92.5	Very high	91.3	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.011	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-46	176.9	-67.4	-3	0	0	0	112.1	K171 T172 R211 A250 Y255 E256 W257	K171-D253 WeakPolarHBondContact CA-OD2 3.12Å; K171-D253 PolarHBondContact N-OD2 2.95Å; T172-D253 WeakPolarHBondContact CB-OD2 3.25Å; T172-D253 PolarHBondContact N-OD2 3.33Å; T172-D253 PolarHBondContact OG1-OD2 3.01Å; R211-D253 IonicContact CZ-OD1 2.78Å; R211-D253 IonicContact NE-OD1 2.73Å; R211-D253 PolarHBondContact NE-OD1 3.27Å; R211-D253 IonicContact NH2-OD1 3.71Å; R211-D253 PolarHBondContact NH2-OD1 3.45Å; A250-D253 HydrophobicContact CB-CB 4.16Å; A250-D253 PolarHBondContact O-N 2.78Å; D253-Y255 VanDerWaalsContact C-N 3.34Å; D253-Y255 PolarHBondContact O-N 2.99Å; D253-E256 PolarHBondContact O-N 3.31Å; D253-W257 WeakPolarHBondContact O-CB 3.14Å; D253-W257 PolarHBondContact O-N 2.85Å
254	L	90.3	Very high	91.3	Very high	61 Å²	61	73.3 Å²	73.3	32%	0.319	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-41.6	176.9	179.9	62.2	0	0	0	111.4	A250 R251 W257 E258	A250-L254 PolarHBondContact O-N 3.06Å; R251-L254 PolarHBondContact O-N 2.94Å; L254-W257 HydrophobicContact CD1-CE3 4.28Å; L254-W257 WeakPolarHBondContact O-CB 3.33Å; L254-W257 PolarHBondContact O-N 3.37Å; L254-E258 PolarHBondContact O-N 3Å
255	Y	91.7	Very high	91.3	Very high	146 Å²	146	72.6 Å²	72.6	57%	0.573	34%	0.338	S	S	*	.	H	α-helix	trans	-65.5	-42.3	177.1	-179.8	-101.3	0	0	0	112.3	R251 D253 W257 E258 C259	R251-Y255 WeakPolarHBondContact O-CB 3.48Å; R251-Y255 PolarHBondContact O-N 2.96Å; D253-Y255 VanDerWaalsContact C-N 3.34Å; D253-Y255 PolarHBondContact O-N 2.99Å; Y255-W257 VanDerWaalsContact C-N 3.31Å; Y255-W257 PolarHBondContact O-N 3.41Å; Y255-E258 PolarHBondContact O-N 3.43Å; Y255-C259 WeakPolarHBondContact O-CB 3.27Å; Y255-C259 PolarHBondContact O-N 3.48Å; Y255-C259 PolarHBondContact O-SG 3.48Å
256	E	91.7	Very high	91.3	Very high	64 Å²	64	80 Å²	80	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-60.6	-39	171.7	-82	178.5	-144.6	0	0	112.1	K171 R211 D252 D253 R260	K171-E256 IonicContact NZ-OE2 2.72Å; K171-E256 PolarHBondContact NZ-OE2 3.49Å; R211-E256 IonicContact CZ-OE1 3.67Å; R211-E256 VanDerWaalsContact CZ-OE1 3.24Å; R211-E256 IonicContact NH1-OE1 2.76Å; R211-E256 PolarHBondContact NH1-OE1 2.88Å; R211-E256 VanDerWaalsContact NH2-CD 3.25Å; R211-E256 IonicContact NH2-OE1 2.7Å; R211-E256 PolarHBondContact NH2-OE1 2.7Å; R211-E256 IonicContact NH2-OE2 3.16Å; D252-E256 PolarHBondContact O-N 2.75Å; D253-E256 PolarHBondContact O-N 3.31Å; E256-R260 WeakPolarHBondContact O-CG 3.31Å; E256-R260 PolarHBondContact O-N 2.83Å; E256-R260 PolarHBondContact O-NE 2.82Å
257	W	93.1	Very high	91.1	Very high	82 Å²	82	84.7 Å²	84.7	31%	0.311	39%	0.387	S	S	.	.	H	α-helix	trans	-65.7	-50.3	175.6	-177.8	89.6	0	0	0	112.4	P168 D253 L254 Y255 C259 R260 Q261	P168-W257 HydrophobicContact CB-CD2 3.64Å; P168-W257 HydrophobicContact CB-CE3 4.01Å; P168-W257 HydrophobicContact CB-CG 4.04Å; P168-W257 HydrophobicContact CB-CH2 4.29Å; P168-W257 HydrophobicContact CB-CZ2 3.95Å; P168-W257 HydrophobicContact CB-CZ3 4.32Å; D253-W257 WeakPolarHBondContact O-CB 3.14Å; D253-W257 PolarHBondContact O-N 2.85Å; L254-W257 HydrophobicContact CD1-CE3 4.28Å; L254-W257 WeakPolarHBondContact O-CB 3.33Å; L254-W257 PolarHBondContact O-N 3.37Å; Y255-W257 VanDerWaalsContact C-N 3.31Å; Y255-W257 PolarHBondContact O-N 3.41Å; W257-C259 VanDerWaalsContact C-N 3.27Å; W257-C259 PolarHBondContact O-N 3.11Å; W257-R260 WeakPolarHBondContact O-CB 3.35Å; W257-R260 PolarHBondContact O-N 2.77Å; W257-R260 VanDerWaalsContact O-N 3.1Å; W257-Q261 HydrophobicContact CD2-CG 3.91Å; W257-Q261 HydrophobicContact CE3-CG 4.05Å; W257-Q261 HydrophobicContact CH2-CG 3.83Å; W257-Q261 HydrophobicContact CZ2-CG 3.68Å; W257-Q261 HydrophobicContact CZ3-CG 4.01Å; W257-Q261 WeakPolarHBondContact O-CG 3.44Å; W257-Q261 PolarHBondContact O-N 3.14Å
258	E	93.1	Very high	90.8	Very high	76 Å²	76	89.5 Å²	89.5	36%	0.355	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-37.9	176.7	-71.9	-177	-154.4	0	0	112.1	L254 Y255 Q261 R262	L254-E258 PolarHBondContact O-N 3Å; Y255-E258 PolarHBondContact O-N 3.43Å; E258-Q261 PolarHBondContact O-N 2.91Å; E258-R262 VanDerWaalsContact O-CB 3.31Å; E258-R262 WeakPolarHBondContact O-CB 3.43Å; E258-R262 VanDerWaalsContact O-CG 3.27Å; E258-R262 WeakPolarHBondContact O-CG 3.4Å; E258-R262 PolarHBondContact O-N 3.31Å; E258-R262 IonicContact OE2-CZ 3.34Å; E258-R262 IonicContact OE2-NE 2.72Å; E258-R262 IonicContact OE2-NH2 3.87Å; E258-R262 PolarHBondContact OE2-NH2 3.28Å
259	C	92.4	Very high	90.5	Very high	39 Å²	39	97.2 Å²	97.2	26%	0.264	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-40.6	175.5	-75.3	0	0	0	0	112	Y255 W257 R262 M263	Y255-C259 WeakPolarHBondContact O-CB 3.27Å; Y255-C259 PolarHBondContact O-N 3.48Å; Y255-C259 PolarHBondContact O-SG 3.48Å; W257-C259 VanDerWaalsContact C-N 3.27Å; W257-C259 PolarHBondContact O-N 3.11Å; C259-R262 PolarHBondContact SG-NH1 3.35Å; C259-M263 WeakPolarHBondContact O-CB 3.39Å; C259-M263 PolarHBondContact O-N 3.16Å
260	R	91.2	Very high	90.4	Very high	96 Å²	96	95.6 Å²	95.6	36%	0.362	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-47.7	171.1	-73.6	-179.1	-75.1	161.5	-3.4	111.5	E215 E256 W257 R262 M263 L264	E215-R260 IonicContact OE2-CZ 2.7Å; E215-R260 IonicContact OE2-NH1 3.61Å; E215-R260 PolarHBondContact OE2-NH1 3.37Å; E215-R260 IonicContact OE2-NH2 3.24Å; E215-R260 PolarHBondContact OE2-NH2 2.7Å; E256-R260 WeakPolarHBondContact O-CG 3.31Å; E256-R260 PolarHBondContact O-N 2.83Å; E256-R260 PolarHBondContact O-NE 2.82Å; W257-R260 WeakPolarHBondContact O-CB 3.35Å; W257-R260 PolarHBondContact O-N 2.77Å; W257-R260 VanDerWaalsContact O-N 3.1Å; R260-R262 PolarHBondContact O-N 3.3Å; R260-M263 WeakPolarHBondContact O-CB 3.35Å; R260-M263 PolarHBondContact O-N 3.13Å; R260-L264 WeakPolarHBondContact O-CG 3.48Å; R260-L264 PolarHBondContact O-N 3.07Å
261	Q	91.7	Very high	90.3	Very high	83 Å²	83	100.6 Å²	100.6	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-60.9	-44.8	177.2	-64.1	-55	-31	0	0	112.3	W257 E258 M263 L264 A265	W257-Q261 HydrophobicContact CD2-CG 3.91Å; W257-Q261 HydrophobicContact CE3-CG 4.05Å; W257-Q261 HydrophobicContact CH2-CG 3.83Å; W257-Q261 HydrophobicContact CZ2-CG 3.68Å; W257-Q261 HydrophobicContact CZ3-CG 4.01Å; W257-Q261 WeakPolarHBondContact O-CG 3.44Å; W257-Q261 PolarHBondContact O-N 3.14Å; E258-Q261 PolarHBondContact O-N 2.91Å; Q261-M263 PolarHBondContact O-N 2.94Å; Q261-L264 PolarHBondContact O-N 3.49Å; Q261-A265 WeakPolarHBondContact O-CB 3.43Å; Q261-A265 PolarHBondContact O-N 3.36Å
262	R	92.7	Very high	90	Very high	101 Å²	101	99.1 Å²	99.1	38%	0.381	44%	0.438	S	S	.	.	H	α-helix	trans	-66.4	-19.5	175.7	-70.4	-175	-105.6	104.7	-10.7	112.9	E258 C259 R260 R266	E258-R262 VanDerWaalsContact O-CB 3.31Å; E258-R262 WeakPolarHBondContact O-CB 3.43Å; E258-R262 VanDerWaalsContact O-CG 3.27Å; E258-R262 WeakPolarHBondContact O-CG 3.4Å; E258-R262 PolarHBondContact O-N 3.31Å; E258-R262 IonicContact OE2-CZ 3.34Å; E258-R262 IonicContact OE2-NE 2.72Å; E258-R262 IonicContact OE2-NH2 3.87Å; E258-R262 PolarHBondContact OE2-NH2 3.28Å; C259-R262 PolarHBondContact SG-NH1 3.35Å; R260-R262 PolarHBondContact O-N 3.3Å; R262-R266 WeakPolarHBondContact O-CG 3.5Å; R262-R266 PolarHBondContact O-NH1 3.35Å
263	M	89.4	Confident	89.7	Confident	135 Å²	135	101.8 Å²	101.8	67%	0.665	45%	0.447	S	S	*	.	H	α-helix	trans	-78.7	-52.1	171.4	-175.5	-174.6	-69.4	0	0	110.7	C259 R260 Q261 A265 R266 E267	C259-M263 WeakPolarHBondContact O-CB 3.39Å; C259-M263 PolarHBondContact O-N 3.16Å; R260-M263 WeakPolarHBondContact O-CB 3.35Å; R260-M263 PolarHBondContact O-N 3.13Å; Q261-M263 PolarHBondContact O-N 2.94Å; M263-A265 VanDerWaalsContact C-N 3.34Å; M263-A265 PolarHBondContact O-N 3.45Å; M263-R266 WeakPolarHBondContact O-CA 3.49Å; M263-R266 WeakPolarHBondContact O-CB 3.38Å; M263-R266 PolarHBondContact O-N 2.86Å; M263-E267 PolarHBondContact O-N 3.37Å
264	L	89.9	Confident	89.2	Confident	94 Å²	94	106.9 Å²	106.9	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-56.5	-45.6	177.8	-66.5	169.3	0	0	0	111.7	R260 Q261 R266 E267 E268	R260-L264 WeakPolarHBondContact O-CG 3.48Å; R260-L264 PolarHBondContact O-N 3.07Å; Q261-L264 PolarHBondContact O-N 3.49Å; L264-R266 PolarHBondContact O-N 2.87Å; L264-R266 VanDerWaalsContact O-N 3.11Å; L264-E267 PolarHBondContact O-N 2.88Å; L264-E267 VanDerWaalsContact O-N 3.14Å; L264-E268 WeakPolarHBondContact O-CB 3.4Å; L264-E268 PolarHBondContact O-N 2.68Å
265	A	89.3	Confident	88.8	Confident	46 Å²	46	108.3 Å²	108.3	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-70.4	-1.8	176.3	0	0	0	0	0	114.9	Q261 M263 R269	Q261-A265 WeakPolarHBondContact O-CB 3.43Å; Q261-A265 PolarHBondContact O-N 3.36Å; M263-A265 VanDerWaalsContact C-N 3.34Å; M263-A265 PolarHBondContact O-N 3.45Å; A265-R269 PolarHBondContact O-NE 2.97Å; A265-R269 PolarHBondContact O-NH2 2.76Å
266	R	90.9	Very high	88.2	Confident	155 Å²	155	106.4 Å²	106.4	59%	0.585	48%	0.475	S	S	*	.	H	α-helix	trans	-97.3	-45	164.2	-73.6	178.3	-177.5	103	-14.8	110.8	R262 M263 L264 E268 R269 H270	R262-R266 WeakPolarHBondContact O-CG 3.5Å; R262-R266 PolarHBondContact O-NH1 3.35Å; M263-R266 WeakPolarHBondContact O-CA 3.49Å; M263-R266 WeakPolarHBondContact O-CB 3.38Å; M263-R266 PolarHBondContact O-N 2.86Å; L264-R266 PolarHBondContact O-N 2.87Å; L264-R266 VanDerWaalsContact O-N 3.11Å; R266-E268 PolarHBondContact O-N 3.03Å; R266-R269 PolarHBondContact O-N 3.21Å; R266-H270 WeakPolarHBondContact O-CB 3.34Å; R266-H270 PolarHBondContact O-N 3.47Å
267	E	87.3	Confident	87.4	Confident	108 Å²	108	106.3 Å²	106.3	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-44	177.8	-168.3	-166.2	-107	0	0	111.6	M263 L264 R269 H270 R271	M263-E267 PolarHBondContact O-N 3.37Å; L264-E267 PolarHBondContact O-N 2.88Å; L264-E267 VanDerWaalsContact O-N 3.14Å; E267-R269 PolarHBondContact O-N 3.24Å; E267-H270 CarbonylContact O-C 3.6Å; E267-H270 WeakPolarHBondContact O-CB 3.3Å; E267-H270 PolarHBondContact O-N 2.87Å; E267-H270 VanDerWaalsContact O-N 3.13Å; E267-R271 WeakPolarHBondContact O-CB 3.39Å; E267-R271 PolarHBondContact O-N 3.39Å; E267-R271 IonicContact OE2-CZ 3.76Å; E267-R271 IonicContact OE2-NH2 3.35Å; E267-R271 PolarHBondContact OE2-NH2 2.75Å
268	E	87	Confident	86.5	Confident	118 Å²	118	110.7 Å²	110.7	55%	0.551	49%	0.493	S	S	*	.	H	α-helix	trans	-61.9	-42	177.2	-179.2	172.7	-108.4	0	0	112.5	L264 R266 H270 R271 R272	L264-E268 WeakPolarHBondContact O-CB 3.4Å; L264-E268 PolarHBondContact O-N 2.68Å; R266-E268 PolarHBondContact O-N 3.03Å; E268-H270 VanDerWaalsContact C-N 3.33Å; E268-R271 PolarHBondContact O-N 3.24Å; E268-R272 WeakPolarHBondContact O-CB 3.34Å; E268-R272 PolarHBondContact O-N 2.77Å
269	R	84.2	Confident	85.5	Confident	169 Å²	169	113.4 Å²	113.4	64%	0.638	51%	0.509	S	S	*	.	H	α-helix	trans	-66.9	-34.5	173.5	-76	-173.2	-67.7	147.1	-1.5	112.3	A265 R266 E267 K273	A265-R269 PolarHBondContact O-NE 2.97Å; A265-R269 PolarHBondContact O-NH2 2.76Å; R266-R269 PolarHBondContact O-N 3.21Å; E267-R269 PolarHBondContact O-N 3.24Å; R269-K273 VanDerWaalsContact O-CB 3.26Å; R269-K273 WeakPolarHBondContact O-CB 3.26Å; R269-K273 PolarHBondContact O-N 3.4Å
270	H	89.7	Confident	84.7	Confident	126 Å²	126	117.6 Å²	117.6	58%	0.583	52%	0.519	S	S	*	.	H	α-helix	trans	-67.1	-45.2	173.5	-174.5	-87.5	0	0	0	111.3	R266 E267 E268 K273 L274	R266-H270 WeakPolarHBondContact O-CB 3.34Å; R266-H270 PolarHBondContact O-N 3.47Å; E267-H270 CarbonylContact O-C 3.6Å; E267-H270 WeakPolarHBondContact O-CB 3.3Å; E267-H270 PolarHBondContact O-N 2.87Å; E267-H270 VanDerWaalsContact O-N 3.13Å; E268-H270 VanDerWaalsContact C-N 3.33Å; H270-K273 PolarHBondContact O-N 2.74Å; H270-L274 VanDerWaalsContact O-CB 3.3Å; H270-L274 WeakPolarHBondContact O-CB 3.32Å; H270-L274 PolarHBondContact O-N 3.02Å
271	R	88.9	Confident	83.6	Confident	128 Å²	128	117.9 Å²	117.9	48%	0.483	53%	0.533	S	S	.	.	H	α-helix	trans	-59	-52.2	176.5	-162	-170.9	-51.1	130.4	0.8	110.8	E267 E268 K273 L274 E275	E267-R271 WeakPolarHBondContact O-CB 3.39Å; E267-R271 PolarHBondContact O-N 3.39Å; E267-R271 IonicContact OE2-CZ 3.76Å; E267-R271 IonicContact OE2-NH2 3.35Å; E267-R271 PolarHBondContact OE2-NH2 2.75Å; E268-R271 PolarHBondContact O-N 3.24Å; R271-K273 PolarHBondContact O-N 2.97Å; R271-L274 PolarHBondContact O-N 3.2Å; R271-E275 WeakPolarHBondContact O-CB 3.47Å; R271-E275 PolarHBondContact O-N 3.12Å
272	R	82.1	Confident	82.2	Confident	185 Å²	185	119.6 Å²	119.6	70%	0.698	55%	0.552	S	S	*	*	H	α-helix	trans	-60.3	-43.1	176	-179.3	176	172.3	169.6	0.9	112.3	E268 E275 E276	E268-R272 WeakPolarHBondContact O-CB 3.34Å; E268-R272 PolarHBondContact O-N 2.77Å; R272-E275 PolarHBondContact O-N 3.42Å; R272-E276 WeakPolarHBondContact O-CB 3.09Å; R272-E276 PolarHBondContact O-N 3.43Å
273	K	85.3	Confident	80.5	Confident	124 Å²	124	119.6 Å²	119.6	54%	0.539	57%	0.568	S	S	.	*	H	α-helix	trans	-63.3	-44	175.9	-179.1	-179	172.8	-170.7	0	111.4	R269 H270 R271 E275 E276 D277	R269-K273 VanDerWaalsContact O-CB 3.26Å; R269-K273 WeakPolarHBondContact O-CB 3.26Å; R269-K273 PolarHBondContact O-N 3.4Å; H270-K273 PolarHBondContact O-N 2.74Å; R271-K273 PolarHBondContact O-N 2.97Å; K273-E275 VanDerWaalsContact C-N 3.25Å; K273-E275 PolarHBondContact O-N 3.2Å; K273-E276 PolarHBondContact O-N 3.46Å; K273-D277 WeakPolarHBondContact CE-OD2 3.36Å; K273-D277 VanDerWaalsContact O-CB 3.32Å; K273-D277 WeakPolarHBondContact O-CB 3.49Å; K273-D277 PolarHBondContact O-N 3.42Å
274	L	82.6	Confident	79.3	Confident	108 Å²	108	118.5 Å²	118.5	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-66.4	-31.3	-179.2	-166.9	148.2	0	0	0	111.5	H270 R271 R278	H270-L274 VanDerWaalsContact O-CB 3.3Å; H270-L274 WeakPolarHBondContact O-CB 3.32Å; H270-L274 PolarHBondContact O-N 3.02Å; R271-L274 PolarHBondContact O-N 3.2Å; L274-R278 WeakPolarHBondContact O-CB 3.34Å; L274-R278 PolarHBondContact O-N 3.22Å
275	E	81.8	Confident	77.9	Confident	91 Å²	91	118.6 Å²	118.6	43%	0.425	58%	0.577	S	S	.	*	H	α-helix	trans	-73.1	-40.8	171.1	-176.7	145.1	-117.8	0	0	113.3	R271 R272 K273 R278 L279	R271-E275 WeakPolarHBondContact O-CB 3.47Å; R271-E275 PolarHBondContact O-N 3.12Å; R272-E275 PolarHBondContact O-N 3.42Å; K273-E275 VanDerWaalsContact C-N 3.25Å; K273-E275 PolarHBondContact O-N 3.2Å; E275-R278 WeakPolarHBondContact O-CB 3.3Å; E275-R278 PolarHBondContact O-N 3.26Å; E275-R278 IonicContact OE1-CZ 2.71Å; E275-R278 IonicContact OE1-NH2 2.93Å; E275-R278 PolarHBondContact OE1-NH2 3.44Å; E275-L279 HydrophobicContact CG-CD1 4.34Å; E275-L279 WeakPolarHBondContact O-CG 3.39Å; E275-L279 PolarHBondContact O-N 3.08Å
276	E	78	Confident	76.8	Confident	106 Å²	106	122.5 Å²	122.5	50%	0.495	60%	0.598	S	S	.	*	H	α-helix	trans	-63.9	-42.3	172.6	-172.8	-173.7	148.3	0	0	111.8	R272 K273 R278 L279 R280	R272-E276 WeakPolarHBondContact O-CB 3.09Å; R272-E276 PolarHBondContact O-N 3.43Å; K273-E276 PolarHBondContact O-N 3.46Å; E276-R278 VanDerWaalsContact C-N 3.28Å; E276-R278 PolarHBondContact O-N 3.22Å; E276-L279 PolarHBondContact O-N 3.31Å; E276-R280 PolarHBondContact O-N 3.14Å
277	D	74.6	Confident	75.7	Confident	63 Å²	63	118.4 Å²	118.4	34%	0.337	59%	0.587	S	S	.	*	H	α-helix	trans	-66.4	-28.3	173.8	-74	-24.4	0	0	0	111.8	K273 R280	K273-D277 WeakPolarHBondContact CE-OD2 3.36Å; K273-D277 VanDerWaalsContact O-CB 3.32Å; K273-D277 WeakPolarHBondContact O-CB 3.49Å; K273-D277 PolarHBondContact O-N 3.42Å; D277-R280 IonicContact OD1-CZ 3.32Å; D277-R280 IonicContact OD1-NH1 2.71Å; D277-R280 PolarHBondContact OD1-NH1 2.82Å; D277-R280 IonicContact OD1-NH2 2.72Å; D277-R280 PolarHBondContact OD1-NH2 3.39Å
278	R	75.1	Confident	75.2	Confident	174 Å²	174	115.8 Å²	115.8	66%	0.657	58%	0.578	S	S	*	*	H	α-helix	trans	-74	-34.2	171.6	-179.1	-177.5	70.3	152.5	-4.4	112.7	L274 E275 E276	L274-R278 WeakPolarHBondContact O-CB 3.34Å; L274-R278 PolarHBondContact O-N 3.22Å; E275-R278 WeakPolarHBondContact O-CB 3.3Å; E275-R278 PolarHBondContact O-N 3.26Å; E275-R278 IonicContact OE1-CZ 2.71Å; E275-R278 IonicContact OE1-NH2 2.93Å; E275-R278 PolarHBondContact OE1-NH2 3.44Å; E276-R278 VanDerWaalsContact C-N 3.28Å; E276-R278 PolarHBondContact O-N 3.22Å
279	L	72.5	Confident	75	Confident	132 Å²	132	116.7 Å²	116.7	69%	0.691	58%	0.582	S	S	*	*	H	α-helix	trans	-84.1	-17.6	179.1	-71.2	170.5	0	0	0	113.1	E275 E276	E275-L279 HydrophobicContact CG-CD1 4.34Å; E275-L279 WeakPolarHBondContact O-CG 3.39Å; E275-L279 PolarHBondContact O-N 3.08Å; E276-L279 PolarHBondContact O-N 3.31Å
280	R	75.1	Confident	75.2	Confident	127 Å²	127	111.5 Å²	111.5	48%	0.479	56%	0.563	S	S	.	*	S	Bend	trans	-63.3	129.5	171	-167.1	178.1	-58.2	115.4	13.8	109.4	E276 D277	E276-R280 PolarHBondContact O-N 3.14Å; D277-R280 IonicContact OD1-CZ 3.32Å; D277-R280 IonicContact OD1-NH1 2.71Å; D277-R280 PolarHBondContact OD1-NH1 2.82Å; D277-R280 IonicContact OD1-NH2 2.72Å; D277-R280 PolarHBondContact OD1-NH2 3.39Å
281	P	67.2	Low	75.3	Confident	102 Å²	102	107.8 Å²	107.8	66%	0.662	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-53.5	140.4	171.7	-25.9	34.6	0	0	0	110.6	S283	P281-S283 PolarHBondContact O-N 3.39Å
282	P	62.7	Low	75.3	Confident	119 Å²	119	108.6 Å²	108.6	77%	0.773	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.1	129.8	176.2	24.6	-33.5	0	0	0	109
283	S	58.2	Low	75.8	Confident	102 Å²	102	105.8 Å²	105.8	71%	0.713	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-49.4	131.5	177	-60.3	0	0	0	0	109.5	P281	P281-S283 PolarHBondContact O-N 3.39Å
284	P	62.2	Low	76.2	Confident	111 Å²	111	102.3 Å²	102.3	72%	0.721	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-48.8	132.1	179.9	-30	35.8	0	0	0	110.6
285	P	61.3	Low	76.7	Confident	97 Å²	97	97.4 Å²	97.4	63%	0.63	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-51	140.2	-177.4	-28.9	35.2	0	0	0	111	I287	P285-I287 PolarHBondContact O-N 3.5Å
286	P	67.2	Low	77.3	Confident	127 Å²	127	96.5 Å²	96.5	83%	0.825	52%	0.519	S	S	*	.			trans	-50.7	110.7	179.1	-28.1	35.5	0	0	0	110.3	V288	P286-V288 PolarHBondContact O-N 2.93Å
287	I	65.9	Low	78	Confident	69 Å²	69	94.3 Å²	94.3	35%	0.354	51%	0.509	S	S	.	.			trans	-69.6	107.4	-171.6	-61.8	169.9	0	0	0	107.4	P285 H289 T317 R321	P285-I287 PolarHBondContact O-N 3.5Å; I287-H289 PolarHBondContact O-CD2 3.24Å; I287-H289 PolarHBondContact O-N 2.94Å; I287-T317 HydrophobicContact CD1-CG2 4.23Å; I287-T317 HydrophobicContact CG2-CG2 3.46Å; I287-T317 VanDerWaalsContact CG2-CG2 3.46Å; I287-R321 VanDerWaalsContact CG2-CZ 3.43Å
288	V	77.6	Confident	79	Confident	54 Å²	54	91.7 Å²	91.7	33%	0.327	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-48.6	122.8	178.7	-175.1	0	0	0	0	108.6	P286 E294 V314 W318	P286-V288 PolarHBondContact O-N 2.93Å; V288-E294 HydrophobicContact CG1-CB 4.18Å; V288-E294 HydrophobicContact CG1-CG 3.79Å; V288-V314 HydrophobicContact CB-CG1 4.25Å; V288-W318 HydrophobicContact CG1-CZ2 4.22Å; V288-W318 PolarHBondContact O-NE1 2.74Å
289	H	82.6	Confident	79.9	Confident	137 Å²	137	83.9 Å²	83.9	63%	0.634	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-77.4	149.6	178.2	-73.9	-93.9	0	0	0	110.4	I287 S291	I287-H289 PolarHBondContact O-CD2 3.24Å; I287-H289 PolarHBondContact O-N 2.94Å; H289-S291 PolarHBondContact O-N 2.95Å
290	Y	88.8	Confident	81	Confident	59 Å²	59	82.2 Å²	82.2	23%	0.231	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-61.8	126.9	176.6	179.2	-94.3	0	0	0	111	C295 W318 E323 N328 F332	Y290-C295 HydrophobicContact CE2-CB 3.71Å; Y290-W318 HydrophobicContact CD2-CD2 4.12Å; Y290-W318 AromaticContact CD2-CE3 3.74Å; Y290-W318 HydrophobicContact CD2-CE3 3.74Å; Y290-W318 HydrophobicContact CD2-CH2 4.21Å; Y290-W318 AromaticContact CD2-CZ3 3.78Å; Y290-W318 HydrophobicContact CD2-CZ3 3.78Å; Y290-W318 HydrophobicContact CE2-CE3 4.36Å; Y290-W318 HydrophobicContact CE2-CZ3 4.16Å; Y290-E323 HydrophobicContact CD2-CB 4.47Å; Y290-E323 HydrophobicContact CG-CB 4.2Å; Y290-N328 WeakPolarHBondContact CE1-ND2 3.46Å; Y290-N328 VanDerWaalsContact CZ-ND2 3.27Å; Y290-N328 VanDerWaalsContact OH-CB 3.24Å; Y290-N328 WeakPolarHBondContact OH-CB 3.45Å; Y290-N328 PolarHBondContact OH-ND2 2.94Å; Y290-F332 AromaticContact CD2-CE2 3.9Å; Y290-F332 HydrophobicContact CD2-CE2 3.9Å; Y290-F332 AromaticContact CD2-CZ 3.77Å; Y290-F332 HydrophobicContact CD2-CZ 3.77Å; Y290-F332 AromaticContact CE2-CE2 3.56Å; Y290-F332 HydrophobicContact CE2-CE2 3.56Å; Y290-F332 AromaticContact CE2-CZ 3.87Å; Y290-F332 HydrophobicContact CE2-CZ 3.87Å
291	S	91.3	Very high	81.9	Confident	48 Å²	48	79.6 Å²	79.6	34%	0.336	45%	0.453	S	S	.	.			trans	-145.1	160.6	164.6	72.1	0	0	0	0	109	H289 H293 E294 C295	H289-S291 PolarHBondContact O-N 2.95Å; S291-H293 VanDerWaalsContact C-N 3.31Å; S291-H293 PolarHBondContact O-N 3.09Å; S291-E294 PolarHBondContact O-N 2.98Å; S291-E294 WeakPolarHBondContact OG-CB 3.42Å; S291-E294 WeakPolarHBondContact OG-CG 3.27Å; S291-E294 PolarHBondContact OG-N 2.68Å; S291-C295 WeakPolarHBondContact O-CB 3.38Å; S291-C295 PolarHBondContact O-N 3.44Å
292	E	89.9	Confident	83.3	Confident	145 Å²	145	74.7 Å²	74.7	68%	0.678	42%	0.421	S	S	*	.	H	α-helix	trans	-61.1	-40.9	178.9	-172.3	164.3	-149.6	0	0	111.9	C295 S296	E292-C295 WeakPolarHBondContact O-CB 3.41Å; E292-C295 PolarHBondContact O-N 3.22Å; E292-S296 PolarHBondContact O-N 3.13Å; E292-S296 PolarHBondContact O-OG 2.97Å
293	H	92.1	Very high	84.8	Confident	127 Å²	127	74.7 Å²	74.7	59%	0.588	41%	0.409	S	S	*	.	H	α-helix	trans	-64.8	-47.6	177.2	-179.9	63.4	0	0	0	113	S291 C295 S296 Q297	S291-H293 VanDerWaalsContact C-N 3.31Å; S291-H293 PolarHBondContact O-N 3.09Å; H293-C295 VanDerWaalsContact C-N 3.25Å; H293-C295 PolarHBondContact O-N 3.04Å; H293-S296 PolarHBondContact O-N 2.75Å; H293-Q297 PolarHBondContact CD2-NE2 3.27Å; H293-Q297 PolarHBondContact NE2-NE2 2.76Å; H293-Q297 PolarHBondContact O-N 3.37Å; H293-Q297 VanDerWaalsContact O-N 3.07Å
294	E	92.7	Very high	86.4	Confident	50 Å²	50	72.9 Å²	72.9	23%	0.234	39%	0.391	C	S	.	.	H	α-helix	trans	-65.3	-31.9	174.9	-70.7	-57.3	128.9	0	0	111.3	V288 S291 Q297 L298 W318	V288-E294 HydrophobicContact CG1-CB 4.18Å; V288-E294 HydrophobicContact CG1-CG 3.79Å; S291-E294 PolarHBondContact O-N 2.98Å; S291-E294 WeakPolarHBondContact OG-CB 3.42Å; S291-E294 WeakPolarHBondContact OG-CG 3.27Å; S291-E294 PolarHBondContact OG-N 2.68Å; E294-Q297 PolarHBondContact O-N 3.01Å; E294-Q297 PolarHBondContact OE1-NE2 3.24Å; E294-L298 WeakPolarHBondContact O-CB 3.29Å; E294-L298 PolarHBondContact O-N 3.41Å; E294-W318 HydrophobicContact CB-CH2 3.9Å; E294-W318 HydrophobicContact CB-CZ2 4.08Å
295	C	93.1	Very high	87.7	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.034	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-39.9	176.7	-171.2	0	0	0	0	112.4	Y290 S291 E292 H293 G299 W318 M335	Y290-C295 HydrophobicContact CE2-CB 3.71Å; S291-C295 WeakPolarHBondContact O-CB 3.38Å; S291-C295 PolarHBondContact O-N 3.44Å; E292-C295 WeakPolarHBondContact O-CB 3.41Å; E292-C295 PolarHBondContact O-N 3.22Å; H293-C295 VanDerWaalsContact C-N 3.25Å; H293-C295 PolarHBondContact O-N 3.04Å; C295-G299 PolarHBondContact O-N 3.42Å; C295-W318 HydrophobicContact CB-CH2 4.39Å; C295-W318 HydrophobicContact CB-CZ3 4.09Å; C295-M335 VanDerWaalsContact SG-CE 3.57Å
296	S	94.3	Very high	89.1	Confident	72 Å²	72	69.7 Å²	69.7	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-50.6	172	-60.8	0	0	0	0	111.3	E292 H293 L298 G299 D300	E292-S296 PolarHBondContact O-N 3.13Å; E292-S296 PolarHBondContact O-OG 2.97Å; H293-S296 PolarHBondContact O-N 2.75Å; S296-L298 VanDerWaalsContact C-N 3.27Å; S296-L298 PolarHBondContact O-N 2.89Å; S296-G299 PolarHBondContact O-N 3.35Å; S296-D300 PolarHBondContact O-N 2.94Å
297	Q	94.3	Very high	90.4	Very high	61 Å²	61	68.3 Å²	68.3	29%	0.285	36%	0.359	S	S	.	.	H	α-helix	trans	-56.7	-40.2	176.5	-81	-168.5	64.2	0	0	112.5	H293 E294 D300 K301	H293-Q297 PolarHBondContact CD2-NE2 3.27Å; H293-Q297 PolarHBondContact NE2-NE2 2.76Å; H293-Q297 PolarHBondContact O-N 3.37Å; H293-Q297 VanDerWaalsContact O-N 3.07Å; E294-Q297 PolarHBondContact O-N 3.01Å; E294-Q297 PolarHBondContact OE1-NE2 3.24Å; Q297-D300 PolarHBondContact O-N 2.93Å; Q297-K301 WeakPolarHBondContact O-CB 3.5Å; Q297-K301 WeakPolarHBondContact O-CD 3.33Å; Q297-K301 WeakPolarHBondContact O-CG 3.34Å; Q297-K301 PolarHBondContact O-N 3.1Å
298	L	94.6	Very high	91.7	Very high	7 Å²	7	66.8 Å²	66.8	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-68.2	-41.2	179.7	-171.1	65.2	0	0	0	111.2	E294 S296 D300 K301 I302 A311 V314 L315 W318 M335	E294-L298 WeakPolarHBondContact O-CB 3.29Å; E294-L298 PolarHBondContact O-N 3.41Å; S296-L298 VanDerWaalsContact C-N 3.27Å; S296-L298 PolarHBondContact O-N 2.89Å; L298-D300 PolarHBondContact O-N 2.98Å; L298-K301 PolarHBondContact O-N 3.3Å; L298-I302 HydrophobicContact CG-CD1 4.1Å; L298-I302 HydrophobicContact CG-CG1 4.47Å; L298-I302 VanDerWaalsContact O-CG1 3.27Å; L298-I302 WeakPolarHBondContact O-CG1 3.49Å; L298-I302 PolarHBondContact O-N 3.06Å; L298-A311 HydrophobicContact CD1-CB 3.85Å; L298-A311 WeakPolarHBondContact CD1-O 3.38Å; L298-V314 HydrophobicContact CD1-CB 3.9Å; L298-V314 HydrophobicContact CD1-CG1 4.16Å; L298-V314 HydrophobicContact CD2-CB 4.24Å; L298-V314 HydrophobicContact CD2-CG1 3.94Å; L298-L315 HydrophobicContact CD2-CB 4.2Å; L298-W318 HydrophobicContact CB-CH2 4.29Å; L298-W318 HydrophobicContact CB-CZ3 4.29Å; L298-W318 HydrophobicContact CD2-CD2 4.28Å; L298-W318 HydrophobicContact CD2-CE3 3.64Å; L298-W318 HydrophobicContact CD2-CH2 3.81Å; L298-W318 HydrophobicContact CD2-CZ2 4.41Å; L298-W318 HydrophobicContact CD2-CZ3 3.39Å; L298-W318 HydrophobicContact CG-CZ3 4.47Å; L298-M335 HydrophobicContact CB-SD 4.06Å; L298-M335 HydrophobicContact CD2-SD 3.88Å; L298-M335 HydrophobicContact CG-SD 3.97Å
299	G	94.5	Very high	92.3	Very high	11 Å²	11	67.4 Å²	67.4	11%	0.113	36%	0.355	C	S	.	.	H	α-helix	trans	-58.7	-33.3	175.6	0	0	0	0	0	113.8	C295 S296 K303	C295-G299 PolarHBondContact O-N 3.42Å; S296-G299 PolarHBondContact O-N 3.35Å; G299-K303 VanDerWaalsContact O-CE 3.23Å; G299-K303 WeakPolarHBondContact O-CE 3.44Å; G299-K303 WeakPolarHBondContact O-CG 3.42Å
300	D	95.2	Very high	92.7	Very high	96 Å²	96	65.4 Å²	65.4	51%	0.513	35%	0.346	S	S	.	.	H	α-helix	trans	-82.3	-37.6	174.1	-66.8	-31.1	0	0	0	112.7	S296 Q297 L298 I302 K303 D304	S296-D300 PolarHBondContact O-N 2.94Å; Q297-D300 PolarHBondContact O-N 2.93Å; L298-D300 PolarHBondContact O-N 2.98Å; D300-I302 PolarHBondContact O-N 2.99Å; D300-K303 PolarHBondContact O-N 3.37Å; D300-K303 IonicContact OD1-NZ 3.77Å; D300-K303 PolarHBondContact OD1-NZ 2.94Å; D300-D304 PolarHBondContact O-N 3.49Å
301	K	94.7	Very high	92.9	Very high	72 Å²	72	62.8 Å²	62.8	31%	0.313	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-26.3	173.4	-69.1	163.3	-168.3	168.4	0	113.2	Q297 L298 K307 A311	Q297-K301 WeakPolarHBondContact O-CB 3.5Å; Q297-K301 WeakPolarHBondContact O-CD 3.33Å; Q297-K301 WeakPolarHBondContact O-CG 3.34Å; Q297-K301 PolarHBondContact O-N 3.1Å; L298-K301 PolarHBondContact O-N 3.3Å; K301-K307 HydrophobicContact CB-CB 4.5Å; K301-K307 HydrophobicContact CG-CD 4.46Å; K301-K307 CarbonylContact O-C 3.59Å; K301-A311 HydrophobicContact CB-CB 3.82Å
302	I	95.8	Very high	93	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-68.5	-45.8	174.1	-72.7	163.6	0	0	0	110.6	L298 D300 D304 F308 A311 L315 M335 H342	L298-I302 HydrophobicContact CG-CD1 4.1Å; L298-I302 HydrophobicContact CG-CG1 4.47Å; L298-I302 VanDerWaalsContact O-CG1 3.27Å; L298-I302 WeakPolarHBondContact O-CG1 3.49Å; L298-I302 PolarHBondContact O-N 3.06Å; D300-I302 PolarHBondContact O-N 2.99Å; I302-D304 PolarHBondContact O-N 3.29Å; I302-F308 HydrophobicContact CG2-CD2 4.09Å; I302-F308 HydrophobicContact CG2-CE2 4.18Å; I302-F308 WeakPolarHBondContact O-CD2 3.38Å; I302-A311 HydrophobicContact CG1-CB 3.75Å; I302-L315 HydrophobicContact CD1-CB 4.35Å; I302-L315 HydrophobicContact CD1-CD2 3.92Å; I302-M335 HydrophobicContact CD1-CB 3.63Å; I302-M335 HydrophobicContact CD1-CG 3.73Å; I302-M335 HydrophobicContact CD1-SD 3.88Å; I302-H342 PolarHBondContact O-CE1 3.24Å; I302-H342 PolarHBondContact O-NE2 3.39Å
303	K	93.7	Very high	93.1	Very high	119 Å²	119	62.5 Å²	62.5	52%	0.517	33%	0.327	S	S	.	.	H	α-helix	trans	-65.8	-17.3	-178.4	-59.1	162.6	-164	160.5	0	113.5	G299 D300	G299-K303 VanDerWaalsContact O-CE 3.23Å; G299-K303 WeakPolarHBondContact O-CE 3.44Å; G299-K303 WeakPolarHBondContact O-CG 3.42Å; D300-K303 PolarHBondContact O-N 3.37Å; D300-K303 IonicContact OD1-NZ 3.77Å; D300-K303 PolarHBondContact OD1-NZ 2.94Å
304	D	93.1	Very high	93.1	Very high	63 Å²	63	58.2 Å²	58.2	34%	0.337	31%	0.31	S	S	.	.			trans	-90.1	107.5	-178.9	-175.6	-41.1	0	0	0	109.9	D300 I302 G306 K307 F308	D300-D304 PolarHBondContact O-N 3.49Å; I302-D304 PolarHBondContact O-N 3.29Å; D304-G306 PolarHBondContact O-N 3.26Å; D304-G306 VanDerWaalsContact O-N 3.13Å; D304-G306 PolarHBondContact OD1-N 3.24Å; D304-G306 VanDerWaalsContact OD1-N 3.09Å; D304-K307 HydrophobicContact CB-CB 4.21Å; D304-K307 HydrophobicContact CB-CD 4.39Å; D304-K307 HydrophobicContact CB-CG 4.45Å; D304-K307 VanDerWaalsContact CG-NZ 3.34Å; D304-K307 CarbonylContact O-C 3.59Å; D304-K307 PolarHBondContact O-N 2.97Å; D304-K307 PolarHBondContact OD1-N 3.05Å; D304-K307 IonicContact OD1-NZ 2.74Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å; D304-K307 IonicContact OD2-NZ 3.13Å; D304-K307 PolarHBondContact OD2-NZ 3.32Å; D304-F308 PolarHBondContact O-N 2.85Å
305	D	88.9	Confident	93.2	Very high	76 Å²	76	56.1 Å²	56.1	41%	0.406	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.9	-176.1	-68.9	-47.3	0	0	0	114	K307 H342 R345	D305-K307 VanDerWaalsContact C-N 3.26Å; D305-K307 PolarHBondContact O-N 3.14Å; D305-H342 IonicContact OD1-CE1 3.25Å; D305-H342 PolarHBondContact OD1-CE1 3.24Å; D305-H342 VanDerWaalsContact OD1-CE1 3.27Å; D305-H342 IonicContact OD1-CG 2.76Å; D305-H342 IonicContact OD1-ND1 3.65Å; D305-H342 PolarHBondContact OD1-ND1 2.87Å; D305-R345 IonicContact OD1-CZ 3.58Å; D305-R345 IonicContact OD1-NE 2.74Å; D305-R345 PolarHBondContact OD1-NE 3.16Å; D305-R345 IonicContact OD1-NH2 3.99Å; D305-R345 PolarHBondContact OD1-NH2 2.92Å; D305-R345 WeakPolarHBondContact OD2-CD 3.31Å; D305-R345 IonicContact OD2-CZ 3.58Å; D305-R345 IonicContact OD2-NE 2.71Å; D305-R345 PolarHBondContact OD2-NE 3.42Å; D305-R345 VanDerWaalsContact OD2-NE 3.07Å
306	G	90.9	Very high	93.2	Very high	65 Å²	65	60.2 Å²	60.2	67%	0.67	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.7	176.8	0	0	0	0	0	114.5	D304	D304-G306 PolarHBondContact O-N 3.26Å; D304-G306 VanDerWaalsContact O-N 3.13Å; D304-G306 PolarHBondContact OD1-N 3.24Å; D304-G306 VanDerWaalsContact OD1-N 3.09Å
307	K	93.4	Very high	93.1	Very high	99 Å²	99	58.4 Å²	58.4	43%	0.43	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-8.1	177.9	-59.5	178.1	-171.8	65.1	0	113.1	K301 D304 D305 P309 E310 A311	K301-K307 HydrophobicContact CB-CB 4.5Å; K301-K307 HydrophobicContact CG-CD 4.46Å; K301-K307 CarbonylContact O-C 3.59Å; D304-K307 HydrophobicContact CB-CB 4.21Å; D304-K307 HydrophobicContact CB-CD 4.39Å; D304-K307 HydrophobicContact CB-CG 4.45Å; D304-K307 VanDerWaalsContact CG-NZ 3.34Å; D304-K307 CarbonylContact O-C 3.59Å; D304-K307 PolarHBondContact O-N 2.97Å; D304-K307 PolarHBondContact OD1-N 3.05Å; D304-K307 IonicContact OD1-NZ 2.74Å; D304-K307 PolarHBondContact OD1-NZ 3.03Å; D304-K307 IonicContact OD2-NZ 3.13Å; D304-K307 PolarHBondContact OD2-NZ 3.32Å; D305-K307 VanDerWaalsContact C-N 3.26Å; D305-K307 PolarHBondContact O-N 3.14Å; K307-P309 VanDerWaalsContact C-CD 3.45Å; K307-E310 PolarHBondContact O-N 2.83Å; K307-E310 VanDerWaalsContact O-N 3.14Å; K307-A311 WeakPolarHBondContact O-CB 3.35Å; K307-A311 PolarHBondContact O-N 3.34Å
308	F	93.9	Very high	93	Very high	36 Å²	36	55.5 Å²	55.5	16%	0.158	29%	0.294	C	S	.	.	H	α-helix	trans	-52.6	-42.8	178.3	178.4	-107.2	0	0	0	113.6	I302 D304 E310 A311 V312 H342	I302-F308 HydrophobicContact CG2-CD2 4.09Å; I302-F308 HydrophobicContact CG2-CE2 4.18Å; I302-F308 WeakPolarHBondContact O-CD2 3.38Å; D304-F308 PolarHBondContact O-N 2.85Å; F308-E310 VanDerWaalsContact C-N 3.29Å; F308-E310 PolarHBondContact O-N 3.03Å; F308-A311 PolarHBondContact O-N 2.91Å; F308-V312 HydrophobicContact CD2-CB 4.4Å; F308-V312 HydrophobicContact CE2-CB 4Å; F308-V312 HydrophobicContact CE2-CG2 4.1Å; F308-V312 HydrophobicContact CZ-CB 4.09Å; F308-V312 HydrophobicContact CZ-CG2 3.98Å; F308-V312 WeakPolarHBondContact O-CB 3.37Å; F308-V312 VanDerWaalsContact O-CG1 3.3Å; F308-V312 WeakPolarHBondContact O-CG1 3.41Å; F308-V312 PolarHBondContact O-N 3.08Å; F308-H342 AromaticContact CD2-CD2 3.77Å; F308-H342 AromaticContact CD2-NE2 3.8Å; F308-H342 HydrophobicContact CE1-CB 4.43Å; F308-H342 AromaticContact CE2-CD2 3.66Å; F308-H342 HydrophobicContact CZ-CB 4.41Å
309	P	91.1	Very high	93	Very high	67 Å²	67	58.3 Å²	58.3	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-30.4	178.6	-22.7	35.4	0	0	0	114	K307 R313	K307-P309 VanDerWaalsContact C-CD 3.45Å; P309-R313 WeakPolarHBondContact O-CG 3.36Å; P309-R313 PolarHBondContact O-NE 3.16Å
310	E	90.1	Very high	93	Very high	96 Å²	96	64.6 Å²	64.6	45%	0.449	34%	0.335	S	S	.	.	H	α-helix	trans	-78.7	-45.8	175.1	-71.8	49.9	-110.4	0	0	110.1	K307 F308 R313 V314	K307-E310 PolarHBondContact O-N 2.83Å; K307-E310 VanDerWaalsContact O-N 3.14Å; F308-E310 VanDerWaalsContact C-N 3.29Å; F308-E310 PolarHBondContact O-N 3.03Å; E310-R313 PolarHBondContact O-N 2.94Å; E310-R313 IonicContact OE1-CZ 3.82Å; E310-R313 IonicContact OE1-NH2 2.76Å; E310-R313 PolarHBondContact OE1-NH2 3.22Å; E310-V314 PolarHBondContact O-N 3.32Å
311	A	92.9	Very high	92.7	Very high	4 Å²	4	65 Å²	65	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-44.5	-175.6	0	0	0	0	0	112.4	L298 K301 I302 K307 F308 R313 V314 L315	L298-A311 HydrophobicContact CD1-CB 3.85Å; L298-A311 WeakPolarHBondContact CD1-O 3.38Å; K301-A311 HydrophobicContact CB-CB 3.82Å; I302-A311 HydrophobicContact CG1-CB 3.75Å; K307-A311 WeakPolarHBondContact O-CB 3.35Å; K307-A311 PolarHBondContact O-N 3.34Å; F308-A311 PolarHBondContact O-N 2.91Å; A311-R313 PolarHBondContact O-N 3.03Å; A311-V314 PolarHBondContact O-N 2.98Å; A311-V314 VanDerWaalsContact O-N 3.11Å; A311-L315 PolarHBondContact O-N 3.19Å
312	V	93.6	Very high	92.5	Very high	49 Å²	49	64 Å²	64	30%	0.297	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-29.5	-179.1	77.7	0	0	0	0	112.1	F308 L315 L316	F308-V312 HydrophobicContact CD2-CB 4.4Å; F308-V312 HydrophobicContact CE2-CB 4Å; F308-V312 HydrophobicContact CE2-CG2 4.1Å; F308-V312 HydrophobicContact CZ-CB 4.09Å; F308-V312 HydrophobicContact CZ-CG2 3.98Å; F308-V312 WeakPolarHBondContact O-CB 3.37Å; F308-V312 VanDerWaalsContact O-CG1 3.3Å; F308-V312 WeakPolarHBondContact O-CG1 3.41Å; F308-V312 PolarHBondContact O-N 3.08Å; V312-L315 PolarHBondContact O-N 3.01Å; V312-L316 VanDerWaalsContact O-CB 3.3Å; V312-L316 WeakPolarHBondContact O-CB 3.24Å; V312-L316 PolarHBondContact O-N 3.46Å
313	R	91.6	Very high	92.3	Very high	137 Å²	137	66.6 Å²	66.6	52%	0.517	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	-42.3	173.7	-72.6	-177.6	-73.9	148.6	-10.1	112.2	P309 E310 A311 T317	P309-R313 WeakPolarHBondContact O-CG 3.36Å; P309-R313 PolarHBondContact O-NE 3.16Å; E310-R313 PolarHBondContact O-N 2.94Å; E310-R313 IonicContact OE1-CZ 3.82Å; E310-R313 IonicContact OE1-NH2 2.76Å; E310-R313 PolarHBondContact OE1-NH2 3.22Å; A311-R313 PolarHBondContact O-N 3.03Å; R313-T317 PolarHBondContact O-N 3.12Å; R313-T317 PolarHBondContact O-OG1 3.35Å
314	V	92.6	Very high	92.4	Very high	38 Å²	38	63.7 Å²	63.7	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-66.8	-43.7	175.2	-178.5	0	0	0	0	110.6	V288 L298 E310 A311 L316 T317 W318	V288-V314 HydrophobicContact CB-CG1 4.25Å; L298-V314 HydrophobicContact CD1-CB 3.9Å; L298-V314 HydrophobicContact CD1-CG1 4.16Å; L298-V314 HydrophobicContact CD2-CB 4.24Å; L298-V314 HydrophobicContact CD2-CG1 3.94Å; E310-V314 PolarHBondContact O-N 3.32Å; A311-V314 PolarHBondContact O-N 2.98Å; A311-V314 VanDerWaalsContact O-N 3.11Å; V314-L316 PolarHBondContact O-N 3.36Å; V314-T317 PolarHBondContact O-N 2.97Å; V314-W318 HydrophobicContact CG1-CD2 4.3Å; V314-W318 HydrophobicContact CG1-CZ2 3.97Å; V314-W318 PolarHBondContact O-N 2.94Å
315	L	94.3	Very high	92.4	Very high	6 Å²	6	64.3 Å²	64.3	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-57.3	-50.4	175.5	179.1	66	0	0	0	111.1	L298 I302 A311 V312 T317 W318 L319 F332 M335 I336	L298-L315 HydrophobicContact CD2-CB 4.2Å; I302-L315 HydrophobicContact CD1-CB 4.35Å; I302-L315 HydrophobicContact CD1-CD2 3.92Å; A311-L315 PolarHBondContact O-N 3.19Å; V312-L315 PolarHBondContact O-N 3.01Å; L315-T317 VanDerWaalsContact C-N 3.33Å; L315-T317 PolarHBondContact O-N 2.65Å; L315-W318 PolarHBondContact O-N 2.87Å; L315-L319 HydrophobicContact CD1-CG 4.48Å; L315-L319 HydrophobicContact CG-CD1 4.16Å; L315-L319 WeakPolarHBondContact O-CG 3.4Å; L315-L319 PolarHBondContact O-N 3.29Å; L315-F332 HydrophobicContact CD1-CD1 3.81Å; L315-F332 HydrophobicContact CD1-CE1 4.07Å; L315-M335 HydrophobicContact CD1-CB 3.87Å; L315-M335 HydrophobicContact CD1-CE 3.73Å; L315-M335 HydrophobicContact CD1-SD 4.08Å; L315-M335 HydrophobicContact CD2-CB 4.2Å; L315-I336 HydrophobicContact CD2-CG1 4.42Å
316	L	93.6	Very high	92.6	Very high	90 Å²	90	72.8 Å²	72.8	47%	0.471	37%	0.374	S	S	.	.	H	α-helix	trans	-55.5	-47.7	177	177.1	62.5	0	0	0	111.2	V312 V314 W318 L319 E320	V312-L316 VanDerWaalsContact O-CB 3.3Å; V312-L316 WeakPolarHBondContact O-CB 3.24Å; V312-L316 PolarHBondContact O-N 3.46Å; V314-L316 PolarHBondContact O-N 3.36Å; L316-W318 VanDerWaalsContact C-N 3.3Å; L316-W318 PolarHBondContact O-N 3.44Å; L316-L319 WeakPolarHBondContact O-CB 3.46Å; L316-L319 PolarHBondContact O-N 2.81Å; L316-L319 VanDerWaalsContact O-N 3.14Å; L316-E320 HydrophobicContact CD1-CG 4.04Å; L316-E320 HydrophobicContact CG-CG 4.34Å; L316-E320 WeakPolarHBondContact O-CB 3.19Å; L316-E320 WeakPolarHBondContact O-CG 3.28Å; L316-E320 PolarHBondContact O-N 2.71Å
317	T	91.6	Very high	92.7	Very high	34 Å²	34	81.2 Å²	81.2	21%	0.209	39%	0.385	C	S	.	.	H	α-helix	trans	-64.7	-32.7	-179.3	-52.5	0	0	0	0	112.6	I287 R313 V314 L315 R321	I287-T317 HydrophobicContact CD1-CG2 4.23Å; I287-T317 HydrophobicContact CG2-CG2 3.46Å; I287-T317 VanDerWaalsContact CG2-CG2 3.46Å; R313-T317 PolarHBondContact O-N 3.12Å; R313-T317 PolarHBondContact O-OG1 3.35Å; V314-T317 PolarHBondContact O-N 2.97Å; L315-T317 VanDerWaalsContact C-N 3.33Å; L315-T317 PolarHBondContact O-N 2.65Å; T317-R321 VanDerWaalsContact O-CB 3.29Å; T317-R321 WeakPolarHBondContact O-CB 3.38Å; T317-R321 WeakPolarHBondContact O-CG 3.37Å; T317-R321 PolarHBondContact O-N 3.04Å
318	W	93.8	Very high	92.6	Very high	1 Å²	1	76.8 Å²	76.8	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-71	-37	173.1	-70.2	-2.9	0	0	0	113	V288 Y290 E294 C295 L298 V314 L315 L316 G322 E323 F332 M335	V288-W318 HydrophobicContact CG1-CZ2 4.22Å; V288-W318 PolarHBondContact O-NE1 2.74Å; Y290-W318 HydrophobicContact CD2-CD2 4.12Å; Y290-W318 AromaticContact CD2-CE3 3.74Å; Y290-W318 HydrophobicContact CD2-CE3 3.74Å; Y290-W318 HydrophobicContact CD2-CH2 4.21Å; Y290-W318 AromaticContact CD2-CZ3 3.78Å; Y290-W318 HydrophobicContact CD2-CZ3 3.78Å; Y290-W318 HydrophobicContact CE2-CE3 4.36Å; Y290-W318 HydrophobicContact CE2-CZ3 4.16Å; E294-W318 HydrophobicContact CB-CH2 3.9Å; E294-W318 HydrophobicContact CB-CZ2 4.08Å; C295-W318 HydrophobicContact CB-CH2 4.39Å; C295-W318 HydrophobicContact CB-CZ3 4.09Å; L298-W318 HydrophobicContact CB-CH2 4.29Å; L298-W318 HydrophobicContact CB-CZ3 4.29Å; L298-W318 HydrophobicContact CD2-CD2 4.28Å; L298-W318 HydrophobicContact CD2-CE3 3.64Å; L298-W318 HydrophobicContact CD2-CH2 3.81Å; L298-W318 HydrophobicContact CD2-CZ2 4.41Å; L298-W318 HydrophobicContact CD2-CZ3 3.39Å; L298-W318 HydrophobicContact CG-CZ3 4.47Å; V314-W318 HydrophobicContact CG1-CD2 4.3Å; V314-W318 HydrophobicContact CG1-CZ2 3.97Å; V314-W318 PolarHBondContact O-N 2.94Å; L315-W318 PolarHBondContact O-N 2.87Å; L316-W318 VanDerWaalsContact C-N 3.3Å; L316-W318 PolarHBondContact O-N 3.44Å; W318-G322 PolarHBondContact O-N 3.3Å; W318-E323 HydrophobicContact CB-CB 4.23Å; W318-E323 HydrophobicContact CB-CG 4.03Å; W318-E323 HydrophobicContact CG-CG 4.27Å; W318-E323 WeakPolarHBondContact O-CB 3.47Å; W318-E323 WeakPolarHBondContact O-CG 3.42Å; W318-E323 PolarHBondContact O-N 2.9Å; W318-E323 VanDerWaalsContact O-N 3.09Å; W318-F332 HydrophobicContact CB-CE1 3.71Å; W318-F332 HydrophobicContact CB-CZ 3.9Å; W318-F332 HydrophobicContact CD2-CZ 4.36Å; W318-F332 AromaticContact CE3-CE1 3.86Å; W318-F332 HydrophobicContact CE3-CE1 3.86Å; W318-F332 AromaticContact CE3-CZ 3.73Å; W318-F332 HydrophobicContact CE3-CZ 3.73Å; W318-F332 HydrophobicContact CG-CZ 4.49Å; W318-M335 HydrophobicContact CE3-CE 4.4Å; W318-M335 HydrophobicContact CZ3-CE 4.31Å
319	L	93.9	Very high	92.7	Very high	66 Å²	66	76.8 Å²	76.8	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-47.6	174.2	-66.2	174.7	0	0	0	110.9	L315 L316 R321 G322 V324 F332 I336	L315-L319 HydrophobicContact CD1-CG 4.48Å; L315-L319 HydrophobicContact CG-CD1 4.16Å; L315-L319 WeakPolarHBondContact O-CG 3.4Å; L315-L319 PolarHBondContact O-N 3.29Å; L316-L319 WeakPolarHBondContact O-CB 3.46Å; L316-L319 PolarHBondContact O-N 2.81Å; L316-L319 VanDerWaalsContact O-N 3.14Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.05Å; L319-G322 PolarHBondContact O-N 3.39Å; L319-G322 VanDerWaalsContact O-N 3.13Å; L319-V324 HydrophobicContact CD2-CG2 3.55Å; L319-F332 HydrophobicContact CD2-CD1 3.7Å; L319-F332 HydrophobicContact CD2-CE1 4.17Å; L319-F332 HydrophobicContact CG-CD1 4.45Å; L319-I336 HydrophobicContact CD1-CD1 4.34Å; L319-I336 HydrophobicContact CD2-CD1 4.29Å
320	E	93.8	Very high	92.9	Very high	142 Å²	142	79.7 Å²	79.7	66%	0.664	39%	0.385	S	S	*	.	H	α-helix	trans	-63.1	-34.9	178.1	-71.9	177.4	160.1	0	0	113.1	L316 G322	L316-E320 HydrophobicContact CD1-CG 4.04Å; L316-E320 HydrophobicContact CG-CG 4.34Å; L316-E320 WeakPolarHBondContact O-CB 3.19Å; L316-E320 WeakPolarHBondContact O-CG 3.28Å; L316-E320 PolarHBondContact O-N 2.71Å; E320-G322 VanDerWaalsContact C-N 3.29Å; E320-G322 PolarHBondContact O-N 3.33Å
321	R	89.8	Confident	93.1	Very high	105 Å²	105	78.2 Å²	78.2	40%	0.396	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-14.3	175	-79.1	176.1	169.7	-162.4	-3.4	114.4	I287 T317 L319 E323	I287-R321 VanDerWaalsContact CG2-CZ 3.43Å; T317-R321 VanDerWaalsContact O-CB 3.29Å; T317-R321 WeakPolarHBondContact O-CB 3.38Å; T317-R321 WeakPolarHBondContact O-CG 3.37Å; T317-R321 PolarHBondContact O-N 3.04Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.05Å; R321-E323 HydrophobicContact CB-CG 3.98Å
322	G	91	Very high	93.2	Very high	52 Å²	52	78.2 Å²	78.2	54%	0.536	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	28.2	-175.4	0	0	0	0	0	114.3	W318 L319 E320 V324	W318-G322 PolarHBondContact O-N 3.3Å; L319-G322 PolarHBondContact O-N 3.39Å; L319-G322 VanDerWaalsContact O-N 3.13Å; E320-G322 VanDerWaalsContact C-N 3.29Å; E320-G322 PolarHBondContact O-N 3.33Å; G322-V324 PolarHBondContact O-N 2.74Å; G322-V324 VanDerWaalsContact O-N 3.14Å
323	E	91.7	Very high	93.4	Very high	54 Å²	54	83.2 Å²	83.2	25%	0.252	39%	0.394	S	S	.	.			trans	-63.3	-16.5	175.1	-55.5	-74.9	-173.7	0	0	111.9	Y290 W318 R321 N325 N328 F332	Y290-E323 HydrophobicContact CD2-CB 4.47Å; Y290-E323 HydrophobicContact CG-CB 4.2Å; W318-E323 HydrophobicContact CB-CB 4.23Å; W318-E323 HydrophobicContact CB-CG 4.03Å; W318-E323 HydrophobicContact CG-CG 4.27Å; W318-E323 WeakPolarHBondContact O-CB 3.47Å; W318-E323 WeakPolarHBondContact O-CG 3.42Å; W318-E323 PolarHBondContact O-N 2.9Å; W318-E323 VanDerWaalsContact O-N 3.09Å; R321-E323 HydrophobicContact CB-CG 3.98Å; E323-N325 PolarHBondContact O-N 3.14Å; E323-N325 PolarHBondContact O-ND2 3.12Å; E323-N328 PolarHBondContact O-ND2 3.48Å; E323-F332 HydrophobicContact CB-CZ 4.13Å
324	V	94.3	Very high	93.6	Very high	57 Å²	57	79.6 Å²	79.6	35%	0.345	39%	0.39	S	S	.	.			trans	-72.5	122.6	177.2	-165.7	0	0	0	0	111.4	L319 G322 A329 F332	L319-V324 HydrophobicContact CD2-CG2 3.55Å; G322-V324 PolarHBondContact O-N 2.74Å; G322-V324 VanDerWaalsContact O-N 3.14Å; V324-A329 HydrophobicContact CG1-CB 4.25Å; V324-F332 HydrophobicContact CB-CD2 4.39Å; V324-F332 HydrophobicContact CG1-CB 4.36Å; V324-F332 HydrophobicContact CG1-CD2 4.24Å; V324-F332 HydrophobicContact CG1-CG 4.36Å; V324-F332 HydrophobicContact CG2-CB 4.35Å; V324-F332 HydrophobicContact CG2-CD1 3.8Å; V324-F332 HydrophobicContact CG2-CD2 3.93Å; V324-F332 HydrophobicContact CG2-CE1 3.99Å; V324-F332 HydrophobicContact CG2-CE2 4.12Å; V324-F332 HydrophobicContact CG2-CG 3.76Å; V324-F332 HydrophobicContact CG2-CZ 4.15Å
325	N	93.1	Very high	93.8	Very high	77 Å²	77	78 Å²	78	41%	0.412	38%	0.38	S	S	.	.			trans	-140.2	172	176.3	65.9	76.2	0	0	0	110.6	E323 R327 N328 A329	E323-N325 PolarHBondContact O-N 3.14Å; E323-N325 PolarHBondContact O-ND2 3.12Å; N325-R327 PolarHBondContact O-N 2.84Å; N325-R327 WeakPolarHBondContact OD1-CB 3.49Å; N325-R327 PolarHBondContact OD1-N 3.48Å; N325-N328 PolarHBondContact N-OD1 3.01Å; N325-N328 PolarHBondContact ND2-ND2 3.34Å; N325-N328 PolarHBondContact ND2-OD1 3.4Å; N325-N328 PolarHBondContact O-N 3.36Å; N325-N328 VanDerWaalsContact O-N 3.17Å; N325-N328 PolarHBondContact O-OD1 2.86Å; N325-A329 WeakPolarHBondContact O-CB 3.48Å; N325-A329 PolarHBondContact O-N 3.03Å
326	R	94.4	Very high	93.8	Very high	254 Å²	254	81.4 Å²	81.4	96%	0.958	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.8	-175.6	-72.4	-176.8	178.1	148.6	0.2	115.5
327	R	91.9	Very high	93.9	Very high	241 Å²	241	82.5 Å²	82.5	91%	0.909	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-32.4	178.3	-58.1	-179	179.6	174.3	0.1	113.1	N325	N325-R327 PolarHBondContact O-N 2.84Å; N325-R327 WeakPolarHBondContact OD1-CB 3.49Å; N325-R327 PolarHBondContact OD1-N 3.48Å
328	N	92.2	Very high	94	Very high	6 Å²	6	82.1 Å²	82.1	3%	0.032	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-3.5	-177.1	66.3	7.5	0	0	0	114.4	Y290 E323 N325 N330 N331 F332	Y290-N328 WeakPolarHBondContact CE1-ND2 3.46Å; Y290-N328 VanDerWaalsContact CZ-ND2 3.27Å; Y290-N328 VanDerWaalsContact OH-CB 3.24Å; Y290-N328 WeakPolarHBondContact OH-CB 3.45Å; Y290-N328 PolarHBondContact OH-ND2 2.94Å; E323-N328 PolarHBondContact O-ND2 3.48Å; N325-N328 PolarHBondContact N-OD1 3.01Å; N325-N328 PolarHBondContact ND2-ND2 3.34Å; N325-N328 PolarHBondContact ND2-OD1 3.4Å; N325-N328 PolarHBondContact O-N 3.36Å; N325-N328 VanDerWaalsContact O-N 3.17Å; N325-N328 PolarHBondContact O-OD1 2.86Å; N328-N330 PolarHBondContact O-N 3.03Å; N328-N330 VanDerWaalsContact O-N 3.11Å; N328-N331 WeakPolarHBondContact O-CB 3.35Å; N328-N331 PolarHBondContact O-N 3.37Å; N328-F332 HydrophobicContact CB-CD2 4.39Å; N328-F332 HydrophobicContact CB-CE2 4.47Å; N328-F332 PolarHBondContact O-N 2.9Å
329	A	94.8	Very high	94.1	Very high	37 Å²	37	83 Å²	83	31%	0.306	40%	0.404	S	S	.	.	H	α-helix	trans	-51.4	-35.9	-178.2	0	0	0	0	0	114.1	V324 N325 F332 Y333	V324-A329 HydrophobicContact CG1-CB 4.25Å; N325-A329 WeakPolarHBondContact O-CB 3.48Å; N325-A329 PolarHBondContact O-N 3.03Å; A329-F332 PolarHBondContact O-N 3.17Å; A329-Y333 WeakPolarHBondContact O-CB 3.39Å; A329-Y333 PolarHBondContact O-N 3.27Å
330	N	95.3	Very high	94	Very high	127 Å²	127	83.7 Å²	83.7	68%	0.679	41%	0.409	S	S	*	.	H	α-helix	trans	-63.9	-40.4	176.8	-68.2	-4.6	0	0	0	112.1	N328 Y333 S334	N328-N330 PolarHBondContact O-N 3.03Å; N328-N330 VanDerWaalsContact O-N 3.11Å; N330-Y333 PolarHBondContact O-N 3.42Å; N330-S334 PolarHBondContact O-N 3.42Å; N330-S334 PolarHBondContact O-OG 3.26Å
331	N	95.1	Very high	94	Very high	66 Å²	66	80.6 Å²	80.6	35%	0.353	40%	0.403	S	S	.	.	H	α-helix	trans	-67.1	-42.9	179.1	-58.9	4.2	0	0	0	110.3	N328 Y333 S334 M335	N328-N331 WeakPolarHBondContact O-CB 3.35Å; N328-N331 PolarHBondContact O-N 3.37Å; N331-Y333 VanDerWaalsContact C-N 3.35Å; N331-S334 PolarHBondContact O-N 3.18Å; N331-M335 WeakPolarHBondContact O-CG 3.45Å; N331-M335 PolarHBondContact O-N 2.78Å
332	F	96.2	Very high	94.1	Very high	3 Å²	3	76.1 Å²	76.1	1%	0.013	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-40.2	172.5	-82.1	-83.5	0	0	0	112.4	Y290 L315 W318 L319 E323 V324 N328 A329 M335 I336	Y290-F332 AromaticContact CD2-CE2 3.9Å; Y290-F332 HydrophobicContact CD2-CE2 3.9Å; Y290-F332 AromaticContact CD2-CZ 3.77Å; Y290-F332 HydrophobicContact CD2-CZ 3.77Å; Y290-F332 AromaticContact CE2-CE2 3.56Å; Y290-F332 HydrophobicContact CE2-CE2 3.56Å; Y290-F332 AromaticContact CE2-CZ 3.87Å; Y290-F332 HydrophobicContact CE2-CZ 3.87Å; L315-F332 HydrophobicContact CD1-CD1 3.81Å; L315-F332 HydrophobicContact CD1-CE1 4.07Å; W318-F332 HydrophobicContact CB-CE1 3.71Å; W318-F332 HydrophobicContact CB-CZ 3.9Å; W318-F332 HydrophobicContact CD2-CZ 4.36Å; W318-F332 AromaticContact CE3-CE1 3.86Å; W318-F332 HydrophobicContact CE3-CE1 3.86Å; W318-F332 AromaticContact CE3-CZ 3.73Å; W318-F332 HydrophobicContact CE3-CZ 3.73Å; W318-F332 HydrophobicContact CG-CZ 4.49Å; L319-F332 HydrophobicContact CD2-CD1 3.7Å; L319-F332 HydrophobicContact CD2-CE1 4.17Å; L319-F332 HydrophobicContact CG-CD1 4.45Å; E323-F332 HydrophobicContact CB-CZ 4.13Å; V324-F332 HydrophobicContact CB-CD2 4.39Å; V324-F332 HydrophobicContact CG1-CB 4.36Å; V324-F332 HydrophobicContact CG1-CD2 4.24Å; V324-F332 HydrophobicContact CG1-CG 4.36Å; V324-F332 HydrophobicContact CG2-CB 4.35Å; V324-F332 HydrophobicContact CG2-CD1 3.8Å; V324-F332 HydrophobicContact CG2-CD2 3.93Å; V324-F332 HydrophobicContact CG2-CE1 3.99Å; V324-F332 HydrophobicContact CG2-CE2 4.12Å; V324-F332 HydrophobicContact CG2-CG 3.76Å; V324-F332 HydrophobicContact CG2-CZ 4.15Å; N328-F332 HydrophobicContact CB-CD2 4.39Å; N328-F332 HydrophobicContact CB-CE2 4.47Å; N328-F332 PolarHBondContact O-N 2.9Å; A329-F332 PolarHBondContact O-N 3.17Å; F332-M335 HydrophobicContact CB-CE 4.5Å; F332-M335 HydrophobicContact CD1-CE 3.71Å; F332-M335 HydrophobicContact CD2-CE 4.45Å; F332-M335 HydrophobicContact CE1-CE 3.98Å; F332-M335 HydrophobicContact CG-CE 3.98Å; F332-M335 HydrophobicContact CZ-CE 4.46Å; F332-M335 PolarHBondContact O-N 3.36Å; F332-I336 VanDerWaalsContact O-CG1 3.28Å; F332-I336 WeakPolarHBondContact O-CG1 3.21Å; F332-I336 PolarHBondContact O-N 3.07Å
333	Y	96.3	Very high	94.2	Very high	154 Å²	154	78 Å²	78	60%	0.604	38%	0.383	S	S	*	.	H	α-helix	trans	-62.5	-45.1	174.7	-179.6	-97.2	0	0	0	111.9	A329 N330 N331 M335 I336 Q337	A329-Y333 WeakPolarHBondContact O-CB 3.39Å; A329-Y333 PolarHBondContact O-N 3.27Å; N330-Y333 PolarHBondContact O-N 3.42Å; N331-Y333 VanDerWaalsContact C-N 3.35Å; Y333-M335 VanDerWaalsContact C-N 3.31Å; Y333-M335 PolarHBondContact O-N 3.03Å; Y333-I336 PolarHBondContact O-N 3.44Å; Y333-Q337 VanDerWaalsContact O-CB 3.32Å; Y333-Q337 WeakPolarHBondContact O-CB 3.41Å; Y333-Q337 PolarHBondContact O-N 2.79Å
334	S	96.3	Very high	94.1	Very high	62 Å²	62	84.5 Å²	84.5	43%	0.434	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-34.1	174.6	-62.5	0	0	0	0	113	N330 N331 S338	N330-S334 PolarHBondContact O-N 3.42Å; N330-S334 PolarHBondContact O-OG 3.26Å; N331-S334 PolarHBondContact O-N 3.18Å; S334-S338 WeakPolarHBondContact O-CB 3.32Å; S334-S338 PolarHBondContact O-N 2.66Å; S334-S338 PolarHBondContact O-OG 2.89Å
335	M	96.1	Very high	93.8	Very high	4 Å²	4	85 Å²	85	2%	0.02	40%	0.401	C	S	.	.	H	α-helix	trans	-66	-46.1	172.1	-73.6	-169	-66.2	0	0	111.8	C295 L298 I302 L315 W318 N331 F332 Y333 S338 S339	C295-M335 VanDerWaalsContact SG-CE 3.57Å; L298-M335 HydrophobicContact CB-SD 4.06Å; L298-M335 HydrophobicContact CD2-SD 3.88Å; L298-M335 HydrophobicContact CG-SD 3.97Å; I302-M335 HydrophobicContact CD1-CB 3.63Å; I302-M335 HydrophobicContact CD1-CG 3.73Å; I302-M335 HydrophobicContact CD1-SD 3.88Å; L315-M335 HydrophobicContact CD1-CB 3.87Å; L315-M335 HydrophobicContact CD1-CE 3.73Å; L315-M335 HydrophobicContact CD1-SD 4.08Å; L315-M335 HydrophobicContact CD2-CB 4.2Å; W318-M335 HydrophobicContact CE3-CE 4.4Å; W318-M335 HydrophobicContact CZ3-CE 4.31Å; N331-M335 WeakPolarHBondContact O-CG 3.45Å; N331-M335 PolarHBondContact O-N 2.78Å; F332-M335 HydrophobicContact CB-CE 4.5Å; F332-M335 HydrophobicContact CD1-CE 3.71Å; F332-M335 HydrophobicContact CD2-CE 4.45Å; F332-M335 HydrophobicContact CE1-CE 3.98Å; F332-M335 HydrophobicContact CG-CE 3.98Å; F332-M335 HydrophobicContact CZ-CE 4.46Å; F332-M335 PolarHBondContact O-N 3.36Å; Y333-M335 VanDerWaalsContact C-N 3.31Å; Y333-M335 PolarHBondContact O-N 3.03Å; M335-S338 WeakPolarHBondContact O-CB 3.44Å; M335-S338 PolarHBondContact O-N 2.86Å; M335-S339 PolarHBondContact O-N 2.91Å; M335-S339 PolarHBondContact O-OG 2.68Å; M335-S339 VanDerWaalsContact O-OG 3.08Å
336	I	95.4	Very high	93.8	Very high	77 Å²	77	85.6 Å²	85.6	40%	0.395	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-40.2	175.9	-67.8	162.9	0	0	0	111.4	L315 L319 F332 Y333 S338 S339 N340	L315-I336 HydrophobicContact CD2-CG1 4.42Å; L319-I336 HydrophobicContact CD1-CD1 4.34Å; L319-I336 HydrophobicContact CD2-CD1 4.29Å; F332-I336 VanDerWaalsContact O-CG1 3.28Å; F332-I336 WeakPolarHBondContact O-CG1 3.21Å; F332-I336 PolarHBondContact O-N 3.07Å; Y333-I336 PolarHBondContact O-N 3.44Å; I336-S338 VanDerWaalsContact C-N 3.32Å; I336-S338 PolarHBondContact O-N 3.35Å; I336-S339 WeakPolarHBondContact O-CB 3.5Å; I336-S339 PolarHBondContact O-N 2.99Å; I336-N340 WeakPolarHBondContact O-CB 3.44Å; I336-N340 PolarHBondContact O-N 3.45Å
337	Q	95.1	Very high	93.7	Very high	114 Å²	114	78.6 Å²	78.6	53%	0.533	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-40	174.3	-177	-177.1	-3.8	0	0	111.5	Y333 N340 S341	Y333-Q337 VanDerWaalsContact O-CB 3.32Å; Y333-Q337 WeakPolarHBondContact O-CB 3.41Å; Y333-Q337 PolarHBondContact O-N 2.79Å; Q337-N340 PolarHBondContact O-N 2.93Å; Q337-S341 PolarHBondContact O-N 2.88Å
338	S	94.3	Very high	93.8	Very high	25 Å²	25	69 Å²	69	18%	0.175	36%	0.361	C	S	.	.	H	α-helix	trans	-63.6	-49.2	173.2	-54.6	0	0	0	0	110	S334 M335 I336 N340 S341 H342	S334-S338 WeakPolarHBondContact O-CB 3.32Å; S334-S338 PolarHBondContact O-N 2.66Å; S334-S338 PolarHBondContact O-OG 2.89Å; M335-S338 WeakPolarHBondContact O-CB 3.44Å; M335-S338 PolarHBondContact O-N 2.86Å; I336-S338 VanDerWaalsContact C-N 3.32Å; I336-S338 PolarHBondContact O-N 3.35Å; S338-N340 VanDerWaalsContact C-N 3.27Å; S338-N340 PolarHBondContact O-N 3.39Å; S338-S341 WeakPolarHBondContact O-CA 3.3Å; S338-S341 WeakPolarHBondContact O-CB 3.38Å; S338-S341 PolarHBondContact O-N 3.41Å; S338-H342 PolarHBondContact O-CD2 2.87Å; S338-H342 PolarHBondContact O-NE2 3.05Å
339	S	95.3	Very high	93.9	Very high	19 Å²	19	72.4 Å²	72.4	13%	0.133	38%	0.377	C	S	.	.	H	α-helix	trans	-54	-39.5	174.6	-56.4	0	0	0	0	113.4	M335 I336 S341 H342	M335-S339 PolarHBondContact O-N 2.91Å; M335-S339 PolarHBondContact O-OG 2.68Å; M335-S339 VanDerWaalsContact O-OG 3.08Å; I336-S339 WeakPolarHBondContact O-CB 3.5Å; I336-S339 PolarHBondContact O-N 2.99Å; S339-S341 VanDerWaalsContact C-N 3.27Å; S339-S341 PolarHBondContact O-N 3.45Å; S339-H342 PolarHBondContact O-N 2.95Å
340	N	92.6	Very high	93.8	Very high	82 Å²	82	76.5 Å²	76.5	44%	0.439	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-23.7	176.1	-171.3	40.8	0	0	0	113.2	I336 Q337 S338 I343	I336-N340 WeakPolarHBondContact O-CB 3.44Å; I336-N340 PolarHBondContact O-N 3.45Å; Q337-N340 PolarHBondContact O-N 2.93Å; S338-N340 VanDerWaalsContact C-N 3.27Å; S338-N340 PolarHBondContact O-N 3.39Å; N340-I343 PolarHBondContact O-N 3.19Å
341	S	92.7	Very high	93.8	Very high	77 Å²	77	74 Å²	74	54%	0.538	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-37.8	176.1	-162.8	0	0	0	0	111.9	Q337 S338 S339 I343 R344 R345	Q337-S341 PolarHBondContact O-N 2.88Å; S338-S341 WeakPolarHBondContact O-CA 3.3Å; S338-S341 WeakPolarHBondContact O-CB 3.38Å; S338-S341 PolarHBondContact O-N 3.41Å; S339-S341 VanDerWaalsContact C-N 3.27Å; S339-S341 PolarHBondContact O-N 3.45Å; S341-I343 PolarHBondContact O-N 3.24Å; S341-R344 PolarHBondContact O-N 3.31Å; S341-R345 PolarHBondContact O-N 3.48Å
342	H	92.8	Very high	93.8	Very high	10 Å²	10	75 Å²	75	5%	0.046	38%	0.383	C	S	.	.	H	α-helix	trans	-65.8	-24.3	177.6	-51.5	-90.6	0	0	0	112.4	I302 D305 F308 S338 S339 R344 R345 L346	I302-H342 PolarHBondContact O-CE1 3.24Å; I302-H342 PolarHBondContact O-NE2 3.39Å; D305-H342 IonicContact OD1-CE1 3.25Å; D305-H342 PolarHBondContact OD1-CE1 3.24Å; D305-H342 VanDerWaalsContact OD1-CE1 3.27Å; D305-H342 IonicContact OD1-CG 2.76Å; D305-H342 IonicContact OD1-ND1 3.65Å; D305-H342 PolarHBondContact OD1-ND1 2.87Å; F308-H342 AromaticContact CD2-CD2 3.77Å; F308-H342 AromaticContact CD2-NE2 3.8Å; F308-H342 HydrophobicContact CE1-CB 4.43Å; F308-H342 AromaticContact CE2-CD2 3.66Å; F308-H342 HydrophobicContact CZ-CB 4.41Å; S338-H342 PolarHBondContact O-CD2 2.87Å; S338-H342 PolarHBondContact O-NE2 3.05Å; S339-H342 PolarHBondContact O-N 2.95Å; H342-R344 VanDerWaalsContact C-N 3.34Å; H342-R344 PolarHBondContact O-N 3.13Å; H342-R345 PolarHBondContact O-N 3.09Å; H342-L346 WeakPolarHBondContact O-CB 3.26Å; H342-L346 WeakPolarHBondContact O-CD1 3.44Å; H342-L346 WeakPolarHBondContact O-CG 3.19Å; H342-L346 PolarHBondContact O-N 3.33Å
343	I	92.4	Very high	93.7	Very high	91 Å²	91	80.4 Å²	80.4	47%	0.467	41%	0.407	S	S	.	.	H	α-helix	trans	-62	-43.5	174.9	-61.4	175.2	0	0	0	110.5	N340 S341 L346 I347	N340-I343 PolarHBondContact O-N 3.19Å; S341-I343 PolarHBondContact O-N 3.24Å; I343-L346 PolarHBondContact O-N 2.95Å; I343-I347 HydrophobicContact CG2-CD1 3.89Å; I343-I347 WeakPolarHBondContact O-CD1 3.41Å; I343-I347 VanDerWaalsContact O-CG1 3.28Å; I343-I347 WeakPolarHBondContact O-CG1 3.47Å; I343-I347 PolarHBondContact O-N 3.1Å
344	R	88.8	Confident	93.6	Very high	192 Å²	192	77.4 Å²	77.4	73%	0.725	40%	0.399	S	S	*	.	H	α-helix	trans	-65.4	-40.7	176.5	-57.7	-174.6	-168.9	-83	0.3	111.6	S341 H342 I347 G348	S341-R344 PolarHBondContact O-N 3.31Å; H342-R344 VanDerWaalsContact C-N 3.34Å; H342-R344 PolarHBondContact O-N 3.13Å; R344-I347 PolarHBondContact O-N 2.99Å; R344-G348 PolarHBondContact O-N 2.61Å; R344-G348 VanDerWaalsContact O-N 3.09Å
345	R	88.6	Confident	93.5	Very high	68 Å²	68	80.1 Å²	80.1	26%	0.257	40%	0.403	S	S	.	.	H	α-helix	trans	-62.6	-47.9	176.5	-170.7	-174.1	50	54.4	-7	111.5	D305 S341 H342 I347 G348 E349	D305-R345 IonicContact OD1-CZ 3.58Å; D305-R345 IonicContact OD1-NE 2.74Å; D305-R345 PolarHBondContact OD1-NE 3.16Å; D305-R345 IonicContact OD1-NH2 3.99Å; D305-R345 PolarHBondContact OD1-NH2 2.92Å; D305-R345 WeakPolarHBondContact OD2-CD 3.31Å; D305-R345 IonicContact OD2-CZ 3.58Å; D305-R345 IonicContact OD2-NE 2.71Å; D305-R345 PolarHBondContact OD2-NE 3.42Å; D305-R345 VanDerWaalsContact OD2-NE 3.07Å; S341-R345 PolarHBondContact O-N 3.48Å; H342-R345 PolarHBondContact O-N 3.09Å; R345-I347 VanDerWaalsContact C-N 3.34Å; R345-I347 PolarHBondContact O-N 3.16Å; R345-G348 CarbonylContact O-C 3.55Å; R345-G348 WeakPolarHBondContact O-CA 3.17Å; R345-G348 PolarHBondContact O-N 3.24Å; R345-G348 VanDerWaalsContact O-N 3.12Å; R345-E349 VanDerWaalsContact CD-OE1 3.28Å; R345-E349 WeakPolarHBondContact CD-OE1 3.32Å; R345-E349 VanDerWaalsContact CG-OE1 3.28Å; R345-E349 WeakPolarHBondContact CG-OE1 3.17Å; R345-E349 IonicContact CZ-OE1 3.9Å; R345-E349 IonicContact CZ-OE2 2.81Å; R345-E349 IonicContact NE-OE1 3.84Å; R345-E349 IonicContact NH1-OE1 3.89Å; R345-E349 PolarHBondContact NH1-OE1 3.42Å; R345-E349 IonicContact NH1-OE2 2.72Å; R345-E349 PolarHBondContact NH1-OE2 2.83Å; R345-E349 PolarHBondContact O-N 2.92Å
346	L	92.7	Very high	93.5	Very high	89 Å²	89	84 Å²	84	47%	0.466	42%	0.421	S	S	.	.	H	α-helix	trans	-64.6	-34.2	-180	-71.4	165.9	0	0	0	112.8	H342 I343 K350	H342-L346 WeakPolarHBondContact O-CB 3.26Å; H342-L346 WeakPolarHBondContact O-CD1 3.44Å; H342-L346 WeakPolarHBondContact O-CG 3.19Å; H342-L346 PolarHBondContact O-N 3.33Å; I343-L346 PolarHBondContact O-N 2.95Å; L346-K350 WeakPolarHBondContact O-CB 3.26Å; L346-K350 PolarHBondContact O-N 3.31Å
347	I	92.9	Very high	93.3	Very high	106 Å²	106	84.8 Å²	84.8	54%	0.544	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-42.7	171.7	-68.9	164.9	0	0	0	110.7	I343 R344 R345 K350 S351	I343-I347 HydrophobicContact CG2-CD1 3.89Å; I343-I347 WeakPolarHBondContact O-CD1 3.41Å; I343-I347 VanDerWaalsContact O-CG1 3.28Å; I343-I347 WeakPolarHBondContact O-CG1 3.47Å; I343-I347 PolarHBondContact O-N 3.1Å; R344-I347 PolarHBondContact O-N 2.99Å; R345-I347 VanDerWaalsContact C-N 3.34Å; R345-I347 PolarHBondContact O-N 3.16Å; I347-K350 PolarHBondContact O-N 2.85Å; I347-S351 PolarHBondContact O-N 3.3Å
348	G	93.9	Very high	93.1	Very high	41 Å²	41	82.8 Å²	82.8	42%	0.423	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-41.9	174.7	0	0	0	0	0	113.3	R344 R345 S351 Q352	R344-G348 PolarHBondContact O-N 2.61Å; R344-G348 VanDerWaalsContact O-N 3.09Å; R345-G348 CarbonylContact O-C 3.55Å; R345-G348 WeakPolarHBondContact O-CA 3.17Å; R345-G348 PolarHBondContact O-N 3.24Å; R345-G348 VanDerWaalsContact O-N 3.12Å; G348-S351 PolarHBondContact O-N 3.35Å; G348-Q352 WeakPolarHBondContact O-CB 3.34Å; G348-Q352 PolarHBondContact O-N 3.41Å
349	E	93.3	Very high	93.1	Very high	77 Å²	77	85.6 Å²	85.6	36%	0.36	43%	0.425	S	S	.	.	H	α-helix	trans	-65.7	-40.3	174.9	-77.6	167.1	-164	0	0	112.3	R345 Q352 H353	R345-E349 VanDerWaalsContact CD-OE1 3.28Å; R345-E349 WeakPolarHBondContact CD-OE1 3.32Å; R345-E349 VanDerWaalsContact CG-OE1 3.28Å; R345-E349 WeakPolarHBondContact CG-OE1 3.17Å; R345-E349 IonicContact CZ-OE1 3.9Å; R345-E349 IonicContact CZ-OE2 2.81Å; R345-E349 IonicContact NE-OE1 3.84Å; R345-E349 IonicContact NH1-OE1 3.89Å; R345-E349 PolarHBondContact NH1-OE1 3.42Å; R345-E349 IonicContact NH1-OE2 2.72Å; R345-E349 PolarHBondContact NH1-OE2 2.83Å; R345-E349 PolarHBondContact O-N 2.92Å; E349-Q352 PolarHBondContact O-N 3.09Å; E349-H353 WeakPolarHBondContact O-CB 3.34Å; E349-H353 PolarHBondContact O-CD2 2.7Å; E349-H353 VanDerWaalsContact O-CD2 3.29Å; E349-H353 PolarHBondContact O-N 3.33Å
350	K	93.4	Very high	93	Very high	122 Å²	122	87.2 Å²	87.2	53%	0.53	44%	0.44	S	S	.	.	H	α-helix	trans	-56.3	-54.3	171.9	-179.1	-168.5	170.7	-79.5	0	110.3	L346 I347 Q352 H353 E354	L346-K350 WeakPolarHBondContact O-CB 3.26Å; L346-K350 PolarHBondContact O-N 3.31Å; I347-K350 PolarHBondContact O-N 2.85Å; K350-Q352 VanDerWaalsContact C-N 3.33Å; K350-Q352 PolarHBondContact O-N 2.96Å; K350-H353 PolarHBondContact O-N 3.19Å; K350-E354 WeakPolarHBondContact CE-OE1 3.42Å; K350-E354 WeakPolarHBondContact CG-OE2 3.28Å; K350-E354 IonicContact NZ-OE1 3.88Å; K350-E354 PolarHBondContact NZ-OE1 3.49Å; K350-E354 IonicContact NZ-OE2 2.72Å; K350-E354 PolarHBondContact NZ-OE2 2.93Å; K350-E354 WeakPolarHBondContact O-CG 3.27Å; K350-E354 PolarHBondContact O-N 2.91Å
351	S	94.8	Very high	92.9	Very high	74 Å²	74	86.2 Å²	86.2	52%	0.517	43%	0.431	S	S	.	.	H	α-helix	trans	-61	-39.6	180	177.8	0	0	0	0	112.7	I347 G348 E354 K355	I347-S351 PolarHBondContact O-N 3.3Å; G348-S351 PolarHBondContact O-N 3.35Å; S351-E354 PolarHBondContact O-N 2.96Å; S351-K355 WeakPolarHBondContact O-CB 3.21Å; S351-K355 PolarHBondContact O-N 3.33Å
352	Q	95.8	Very high	92.9	Very high	89 Å²	89	86.3 Å²	86.3	42%	0.416	43%	0.426	S	S	.	.	H	α-helix	trans	-64	-43.5	175.1	177.5	59.1	29.4	0	0	111.9	G348 E349 K350 K355 E356	G348-Q352 WeakPolarHBondContact O-CB 3.34Å; G348-Q352 PolarHBondContact O-N 3.41Å; E349-Q352 PolarHBondContact O-N 3.09Å; K350-Q352 VanDerWaalsContact C-N 3.33Å; K350-Q352 PolarHBondContact O-N 2.96Å; Q352-K355 PolarHBondContact O-N 3.34Å; Q352-E356 PolarHBondContact NE2-OE1 3.11Å; Q352-E356 WeakPolarHBondContact O-CB 3.34Å; Q352-E356 VanDerWaalsContact O-CG 3.27Å; Q352-E356 WeakPolarHBondContact O-CG 3.44Å; Q352-E356 PolarHBondContact O-N 2.9Å
353	H	94.8	Very high	93	Very high	116 Å²	116	92 Å²	92	54%	0.537	45%	0.451	S	S	.	.	H	α-helix	trans	-70.8	-32.9	177	-70.6	-35.5	0	0	0	113.3	E349 K350 E356 M357	E349-H353 WeakPolarHBondContact O-CB 3.34Å; E349-H353 PolarHBondContact O-CD2 2.7Å; E349-H353 VanDerWaalsContact O-CD2 3.29Å; E349-H353 PolarHBondContact O-N 3.33Å; K350-H353 PolarHBondContact O-N 3.19Å; H353-E356 IonicContact CE1-OE2 2.66Å; H353-E356 IonicContact CG-OE2 3.48Å; H353-E356 IonicContact ND1-OE2 2.61Å; H353-E356 PolarHBondContact ND1-OE2 3.41Å; H353-E356 PolarHBondContact O-N 3.02Å; H353-M357 VanDerWaalsContact O-CB 3.27Å; H353-M357 WeakPolarHBondContact O-CB 3.44Å; H353-M357 PolarHBondContact O-N 2.92Å
354	E	93.1	Very high	93	Very high	91 Å²	91	93.7 Å²	93.7	43%	0.425	46%	0.455	S	S	.	.	H	α-helix	trans	-64.2	-43.3	171.9	-74	170.6	144.6	0	0	110.8	K350 S351 M357 E358	K350-E354 WeakPolarHBondContact CE-OE1 3.42Å; K350-E354 WeakPolarHBondContact CG-OE2 3.28Å; K350-E354 IonicContact NZ-OE1 3.88Å; K350-E354 PolarHBondContact NZ-OE1 3.49Å; K350-E354 IonicContact NZ-OE2 2.72Å; K350-E354 PolarHBondContact NZ-OE2 2.93Å; K350-E354 WeakPolarHBondContact O-CG 3.27Å; K350-E354 PolarHBondContact O-N 2.91Å; S351-E354 PolarHBondContact O-N 2.96Å; E354-M357 WeakPolarHBondContact O-CB 3.36Å; E354-M357 PolarHBondContact O-N 3.46Å; E354-E358 PolarHBondContact O-N 3.23Å
355	K	95.8	Very high	93.3	Very high	118 Å²	118	86.5 Å²	86.5	51%	0.513	43%	0.429	S	S	.	.	H	α-helix	trans	-63	-43.5	171.9	-178.1	-179.7	174.5	-177.4	0	112.9	S351 Q352 M357 E358 E359	S351-K355 WeakPolarHBondContact O-CB 3.21Å; S351-K355 PolarHBondContact O-N 3.33Å; Q352-K355 PolarHBondContact O-N 3.34Å; K355-M357 VanDerWaalsContact C-N 3.27Å; K355-M357 PolarHBondContact O-N 3.25Å; K355-E358 PolarHBondContact O-N 3.49Å; K355-E359 VanDerWaalsContact CE-OE1 3.3Å; K355-E359 WeakPolarHBondContact CE-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CB 3.28Å; K355-E359 WeakPolarHBondContact O-CG 3.28Å; K355-E359 PolarHBondContact O-N 3.48Å
356	E	95	Very high	93.6	Very high	86 Å²	86	87.9 Å²	87.9	40%	0.402	45%	0.445	S	S	.	.	H	α-helix	trans	-62.7	-35	177.1	-75.8	166.2	176.8	0	0	112.3	Q352 H353 A360	Q352-E356 PolarHBondContact NE2-OE1 3.11Å; Q352-E356 WeakPolarHBondContact O-CB 3.34Å; Q352-E356 VanDerWaalsContact O-CG 3.27Å; Q352-E356 WeakPolarHBondContact O-CG 3.44Å; Q352-E356 PolarHBondContact O-N 2.9Å; H353-E356 IonicContact CE1-OE2 2.66Å; H353-E356 IonicContact CG-OE2 3.48Å; H353-E356 IonicContact ND1-OE2 2.61Å; H353-E356 PolarHBondContact ND1-OE2 3.41Å; H353-E356 PolarHBondContact O-N 3.02Å; E356-A360 WeakPolarHBondContact O-CB 3.49Å; E356-A360 PolarHBondContact O-N 3.48Å; E356-A360 VanDerWaalsContact O-N 3.09Å
357	M	92	Very high	93.8	Very high	93 Å²	93	86.2 Å²	86.2	46%	0.458	44%	0.444	S	S	.	.	H	α-helix	trans	-67.5	-47	174.5	-177.4	-73.1	-56.4	0	0	111.3	H353 E354 K355 A360 K361	H353-M357 VanDerWaalsContact O-CB 3.27Å; H353-M357 WeakPolarHBondContact O-CB 3.44Å; H353-M357 PolarHBondContact O-N 2.92Å; E354-M357 WeakPolarHBondContact O-CB 3.36Å; E354-M357 PolarHBondContact O-N 3.46Å; K355-M357 VanDerWaalsContact C-N 3.27Å; K355-M357 PolarHBondContact O-N 3.25Å; M357-A360 CarbonylContact O-C 3.5Å; M357-A360 WeakPolarHBondContact O-CA 3.34Å; M357-A360 WeakPolarHBondContact O-CB 3.46Å; M357-A360 PolarHBondContact O-N 2.82Å; M357-K361 HydrophobicContact CE-CD 4.48Å; M357-K361 PolarHBondContact O-N 3.04Å; M357-K361 HydrophobicContact SD-CD 3.85Å; M357-K361 HydrophobicContact SD-CG 4.02Å
358	E	89.4	Confident	93.8	Very high	72 Å²	72	81.4 Å²	81.4	34%	0.336	42%	0.42	S	S	.	.	H	α-helix	trans	-66.9	-43.2	179	-159.7	57.5	-125.3	0	0	111.4	E354 K355 A360 K361 D362	E354-E358 PolarHBondContact O-N 3.23Å; K355-E358 PolarHBondContact O-N 3.49Å; E358-A360 PolarHBondContact O-N 3.18Å; E358-A360 VanDerWaalsContact O-N 3.16Å; E358-K361 VanDerWaalsContact CD-CD 3.42Å; E358-K361 WeakPolarHBondContact O-CB 3.37Å; E358-K361 PolarHBondContact O-N 3.21Å; E358-K361 WeakPolarHBondContact OE1-CD 3.34Å; E358-K361 IonicContact OE1-NZ 3.49Å; E358-K361 PolarHBondContact OE1-NZ 3.29Å; E358-K361 VanDerWaalsContact OE2-CD 3.25Å; E358-K361 WeakPolarHBondContact OE2-CD 3.27Å; E358-K361 WeakPolarHBondContact OE2-CE 3.49Å; E358-K361 IonicContact OE2-NZ 3.11Å; E358-K361 PolarHBondContact OE2-NZ 2.88Å; E358-D362 PolarHBondContact O-N 2.84Å
359	E	94.7	Very high	93.9	Very high	84 Å²	84	81.1 Å²	81.1	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-57.2	-29.7	169.7	-82.9	-164.7	-147.7	0	0	112.7	K355 K363	K355-E359 VanDerWaalsContact CE-OE1 3.3Å; K355-E359 WeakPolarHBondContact CE-OE1 3.38Å; K355-E359 WeakPolarHBondContact O-CB 3.28Å; K355-E359 WeakPolarHBondContact O-CG 3.28Å; K355-E359 PolarHBondContact O-N 3.48Å; E359-K363 WeakPolarHBondContact O-CB 3.3Å; E359-K363 WeakPolarHBondContact O-CD 3.34Å; E359-K363 WeakPolarHBondContact O-CE 3.21Å; E359-K363 WeakPolarHBondContact O-CG 3.47Å; E359-K363 PolarHBondContact O-N 3.31Å; E359-K363 IonicContact OE2-NZ 2.67Å; E359-K363 PolarHBondContact OE2-NZ 2.85Å
360	A	93.5	Very high	94.1	Very high	54 Å²	54	79 Å²	79	45%	0.446	41%	0.412	S	S	.	.	H	α-helix	trans	-79.2	-39.2	176.9	0	0	0	0	0	112.8	E356 M357 E358 D362 K363 F364	E356-A360 WeakPolarHBondContact O-CB 3.49Å; E356-A360 PolarHBondContact O-N 3.48Å; E356-A360 VanDerWaalsContact O-N 3.09Å; M357-A360 CarbonylContact O-C 3.5Å; M357-A360 WeakPolarHBondContact O-CA 3.34Å; M357-A360 WeakPolarHBondContact O-CB 3.46Å; M357-A360 PolarHBondContact O-N 2.82Å; E358-A360 PolarHBondContact O-N 3.18Å; E358-A360 VanDerWaalsContact O-N 3.16Å; A360-D362 VanDerWaalsContact C-N 3.34Å; A360-K363 PolarHBondContact O-N 3.14Å; A360-F364 WeakPolarHBondContact O-CB 3.24Å; A360-F364 PolarHBondContact O-N 3.29Å
361	K	90.4	Very high	94.2	Very high	60 Å²	60	76.4 Å²	76.4	26%	0.261	40%	0.403	S	S	.	.	H	α-helix	trans	-52.8	-52.4	168	-81.3	171.4	166.2	-175.9	0	109.9	M357 E358 K363 F364 K365 E430	M357-K361 HydrophobicContact CE-CD 4.48Å; M357-K361 PolarHBondContact O-N 3.04Å; M357-K361 HydrophobicContact SD-CD 3.85Å; M357-K361 HydrophobicContact SD-CG 4.02Å; E358-K361 VanDerWaalsContact CD-CD 3.42Å; E358-K361 WeakPolarHBondContact O-CB 3.37Å; E358-K361 PolarHBondContact O-N 3.21Å; E358-K361 WeakPolarHBondContact OE1-CD 3.34Å; E358-K361 IonicContact OE1-NZ 3.49Å; E358-K361 PolarHBondContact OE1-NZ 3.29Å; E358-K361 VanDerWaalsContact OE2-CD 3.25Å; E358-K361 WeakPolarHBondContact OE2-CD 3.27Å; E358-K361 WeakPolarHBondContact OE2-CE 3.49Å; E358-K361 IonicContact OE2-NZ 3.11Å; E358-K361 PolarHBondContact OE2-NZ 2.88Å; K361-K363 PolarHBondContact O-N 2.97Å; K361-F364 WeakPolarHBondContact O-CB 2.95Å; K361-F364 PolarHBondContact O-N 2.82Å; K361-F364 VanDerWaalsContact O-N 3.12Å; K361-K365 VanDerWaalsContact O-CB 3.26Å; K361-K365 WeakPolarHBondContact O-CB 3.01Å; K361-K365 PolarHBondContact O-N 3.25Å; K361-E430 IonicContact NZ-OE2 2.59Å; K361-E430 PolarHBondContact NZ-OE2 2.89Å
362	D	92.1	Very high	94.2	Very high	80 Å²	80	73.5 Å²	73.5	43%	0.428	38%	0.382	S	S	.	.	H	α-helix	trans	-65.2	-38.3	-175.5	-123.6	10.9	0	0	0	112.4	E358 A360 K365 T366	E358-D362 PolarHBondContact O-N 2.84Å; A360-D362 VanDerWaalsContact C-N 3.34Å; D362-K365 VanDerWaalsContact OD1-CD 3.28Å; D362-K365 WeakPolarHBondContact OD1-CD 3.38Å; D362-K365 IonicContact OD1-NZ 3.65Å; D362-K365 PolarHBondContact OD1-NZ 2.93Å; D362-T366 VanDerWaalsContact O-CB 3.29Å; D362-T366 WeakPolarHBondContact O-CB 3.35Å; D362-T366 PolarHBondContact O-N 3.33Å; D362-T366 PolarHBondContact O-OG1 3.27Å
363	K	95.7	Very high	94.2	Very high	129 Å²	129	71.3 Å²	71.3	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-63.4	-41.3	172.4	-72.2	159.9	-157.4	164	0	111.6	E359 A360 K361 A367	E359-K363 WeakPolarHBondContact O-CB 3.3Å; E359-K363 WeakPolarHBondContact O-CD 3.34Å; E359-K363 WeakPolarHBondContact O-CE 3.21Å; E359-K363 WeakPolarHBondContact O-CG 3.47Å; E359-K363 PolarHBondContact O-N 3.31Å; E359-K363 IonicContact OE2-NZ 2.67Å; E359-K363 PolarHBondContact OE2-NZ 2.85Å; A360-K363 PolarHBondContact O-N 3.14Å; K361-K363 PolarHBondContact O-N 2.97Å; K363-A367 PolarHBondContact O-N 3.13Å; K363-A367 VanDerWaalsContact O-N 3.11Å
364	F	93.4	Very high	94.3	Very high	126 Å²	126	71.7 Å²	71.7	55%	0.553	38%	0.381	S	S	*	.	H	α-helix	trans	-67.2	-49.4	176.5	173.9	-102.2	0	0	0	112.5	A360 K361 T366 A367 L368 I423	A360-F364 WeakPolarHBondContact O-CB 3.24Å; A360-F364 PolarHBondContact O-N 3.29Å; K361-F364 WeakPolarHBondContact O-CB 2.95Å; K361-F364 PolarHBondContact O-N 2.82Å; K361-F364 VanDerWaalsContact O-N 3.12Å; F364-T366 VanDerWaalsContact C-N 3.31Å; F364-T366 PolarHBondContact O-N 3.41Å; F364-A367 WeakPolarHBondContact O-CB 3.4Å; F364-A367 PolarHBondContact O-N 2.67Å; F364-A367 VanDerWaalsContact O-N 3.1Å; F364-L368 HydrophobicContact CE1-CD2 4.22Å; F364-L368 WeakPolarHBondContact O-CB 3.23Å; F364-L368 PolarHBondContact O-N 3.47Å; F364-I423 HydrophobicContact CD1-CD1 4.32Å; F364-I423 HydrophobicContact CE1-CD1 3.93Å
365	K	93.4	Very high	94.5	Very high	41 Å²	41	69.6 Å²	69.6	18%	0.178	37%	0.371	C	S	.	.	H	α-helix	trans	-54.2	-43.5	174.5	174.2	-167.5	-175.8	176.2	0	112.3	K361 D362 L368 A369 L420 E427	K361-K365 VanDerWaalsContact O-CB 3.26Å; K361-K365 WeakPolarHBondContact O-CB 3.01Å; K361-K365 PolarHBondContact O-N 3.25Å; D362-K365 VanDerWaalsContact OD1-CD 3.28Å; D362-K365 WeakPolarHBondContact OD1-CD 3.38Å; D362-K365 IonicContact OD1-NZ 3.65Å; D362-K365 PolarHBondContact OD1-NZ 2.93Å; K365-L368 PolarHBondContact O-N 3.1Å; K365-A369 WeakPolarHBondContact O-CB 3.44Å; K365-A369 PolarHBondContact O-N 3.1Å; K365-L420 HydrophobicContact CG-CD1 4.11Å; K365-E427 VanDerWaalsContact CD-OE1 3.3Å; K365-E427 WeakPolarHBondContact CD-OE1 3.48Å; K365-E427 WeakPolarHBondContact CE-OE1 3.2Å; K365-E427 WeakPolarHBondContact CE-OE2 3.42Å; K365-E427 IonicContact NZ-OE1 2.64Å; K365-E427 PolarHBondContact NZ-OE1 2.91Å; K365-E427 IonicContact NZ-OE2 3.81Å; K365-E427 PolarHBondContact NZ-OE2 2.93Å
366	T	95.5	Very high	94.4	Very high	97 Å²	97	69.1 Å²	69.1	60%	0.595	37%	0.37	S	S	*	.	H	α-helix	trans	-63.3	-44.7	174.2	-60.2	0	0	0	0	111.9	D362 F364 A369 G370	D362-T366 VanDerWaalsContact O-CB 3.29Å; D362-T366 WeakPolarHBondContact O-CB 3.35Å; D362-T366 PolarHBondContact O-N 3.33Å; D362-T366 PolarHBondContact O-OG1 3.27Å; F364-T366 VanDerWaalsContact C-N 3.31Å; F364-T366 PolarHBondContact O-N 3.41Å; T366-A369 PolarHBondContact O-N 3.3Å; T366-G370 PolarHBondContact O-N 2.84Å
367	A	96.3	Very high	94.5	Very high	54 Å²	54	71.2 Å²	71.2	45%	0.446	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176.2	0	0	0	0	0	112.3	K363 F364 G370 I371	K363-A367 PolarHBondContact O-N 3.13Å; K363-A367 VanDerWaalsContact O-N 3.11Å; F364-A367 WeakPolarHBondContact O-CB 3.4Å; F364-A367 PolarHBondContact O-N 2.67Å; F364-A367 VanDerWaalsContact O-N 3.1Å; A367-G370 PolarHBondContact O-N 2.94Å; A367-I371 WeakPolarHBondContact O-CG1 3.38Å; A367-I371 PolarHBondContact O-N 3Å
368	L	94.6	Very high	94.7	Very high	6 Å²	6	70.5 Å²	70.5	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-63.6	-43.5	176.8	-178.7	59.9	0	0	0	111.8	F364 K365 G370 I371 V372 H416 Q419 L420 I423	F364-L368 HydrophobicContact CE1-CD2 4.22Å; F364-L368 WeakPolarHBondContact O-CB 3.23Å; F364-L368 PolarHBondContact O-N 3.47Å; K365-L368 PolarHBondContact O-N 3.1Å; L368-G370 VanDerWaalsContact C-N 3.3Å; L368-G370 PolarHBondContact O-N 3.11Å; L368-I371 WeakPolarHBondContact O-CB 3.18Å; L368-I371 PolarHBondContact O-N 2.85Å; L368-I371 VanDerWaalsContact O-N 3.14Å; L368-V372 WeakPolarHBondContact O-CG2 3.33Å; L368-V372 PolarHBondContact O-N 3.06Å; L368-H416 HydrophobicContact CD1-CB 4Å; L368-Q419 HydrophobicContact CD2-CB 4.16Å; L368-L420 HydrophobicContact CB-CD1 4.48Å; L368-L420 HydrophobicContact CD2-CB 3.95Å; L368-L420 HydrophobicContact CD2-CD1 4.21Å; L368-L420 HydrophobicContact CG-CB 4.22Å; L368-L420 HydrophobicContact CG-CD1 4.34Å; L368-I423 HydrophobicContact CD2-CD1 4Å
369	A	95.7	Very high	95	Very high	35 Å²	35	67.2 Å²	67.2	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-40.5	172	0	0	0	0	0	112.1	K365 T366 I371 V372 A373 L420	K365-A369 WeakPolarHBondContact O-CB 3.44Å; K365-A369 PolarHBondContact O-N 3.1Å; T366-A369 PolarHBondContact O-N 3.3Å; A369-I371 VanDerWaalsContact C-N 3.34Å; A369-I371 PolarHBondContact O-N 3.24Å; A369-V372 PolarHBondContact O-N 3.09Å; A369-A373 WeakPolarHBondContact O-CB 3.37Å; A369-A373 PolarHBondContact O-N 3.22Å; A369-L420 HydrophobicContact CB-CD1 4.38Å; A369-L420 HydrophobicContact CB-CD2 3.87Å
370	G	96.3	Very high	95.1	Very high	32 Å²	32	66.5 Å²	66.5	33%	0.33	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-37.7	173	0	0	0	0	0	113.8	T366 A367 L368 Q374	T366-G370 PolarHBondContact O-N 2.84Å; A367-G370 PolarHBondContact O-N 2.94Å; L368-G370 VanDerWaalsContact C-N 3.3Å; L368-G370 PolarHBondContact O-N 3.11Å; G370-Q374 WeakPolarHBondContact O-CG 3.35Å; G370-Q374 PolarHBondContact O-N 2.69Å
371	I	95.3	Very high	95.3	Very high	68 Å²	68	68.5 Å²	68.5	35%	0.349	37%	0.373	S	S	.	.	H	α-helix	trans	-67.3	-47	175.1	-70.7	162.1	0	0	0	110.8	A367 L368 A369 A373 Q374 F375	A367-I371 WeakPolarHBondContact O-CG1 3.38Å; A367-I371 PolarHBondContact O-N 3Å; L368-I371 WeakPolarHBondContact O-CB 3.18Å; L368-I371 PolarHBondContact O-N 2.85Å; L368-I371 VanDerWaalsContact O-N 3.14Å; A369-I371 VanDerWaalsContact C-N 3.34Å; A369-I371 PolarHBondContact O-N 3.24Å; I371-A373 VanDerWaalsContact C-N 3.32Å; I371-A373 PolarHBondContact O-N 3.15Å; I371-Q374 PolarHBondContact O-N 3.39Å; I371-F375 HydrophobicContact CG2-CD2 3.78Å; I371-F375 HydrophobicContact CG2-CE2 3.78Å; I371-F375 WeakPolarHBondContact O-CD2 3.49Å; I371-F375 PolarHBondContact O-N 3.1Å
372	V	95.6	Very high	95.5	Very high	13 Å²	13	67.3 Å²	67.3	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-58.2	-44.5	177.3	173.2	0	0	0	0	111.1	L368 A369 Q374 F375 E376 R413 H416 N417	L368-V372 WeakPolarHBondContact O-CG2 3.33Å; L368-V372 PolarHBondContact O-N 3.06Å; A369-V372 PolarHBondContact O-N 3.09Å; V372-Q374 VanDerWaalsContact C-N 3.35Å; V372-Q374 PolarHBondContact O-N 2.99Å; V372-F375 PolarHBondContact O-N 3.33Å; V372-E376 PolarHBondContact O-N 3.45Å; V372-R413 HydrophobicContact CG1-CG 4.48Å; V372-H416 HydrophobicContact CG2-CB 3.67Å; V372-N417 HydrophobicContact CG1-CB 4.05Å; V372-N417 HydrophobicContact CG2-CB 4.32Å
373	A	96.6	Very high	95.6	Very high	42 Å²	42	68.1 Å²	68.1	35%	0.347	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-35.6	177.8	0	0	0	0	0	113.3	A369 I371 Q377	A369-A373 WeakPolarHBondContact O-CB 3.37Å; A369-A373 PolarHBondContact O-N 3.22Å; I371-A373 VanDerWaalsContact C-N 3.32Å; I371-A373 PolarHBondContact O-N 3.15Å; A373-Q377 WeakPolarHBondContact O-CG 3.41Å; A373-Q377 PolarHBondContact O-N 2.91Å
374	Q	96.8	Very high	95.6	Very high	124 Å²	124	64.2 Å²	64.2	58%	0.579	36%	0.36	S	S	*	.	H	α-helix	trans	-67.8	-43.1	173.2	-73.4	176.8	48.4	0	0	111.7	G370 I371 V372 E376 Q377 I378	G370-Q374 WeakPolarHBondContact O-CG 3.35Å; G370-Q374 PolarHBondContact O-N 2.69Å; I371-Q374 PolarHBondContact O-N 3.39Å; V372-Q374 VanDerWaalsContact C-N 3.35Å; V372-Q374 PolarHBondContact O-N 2.99Å; Q374-E376 VanDerWaalsContact C-N 3.32Å; Q374-E376 PolarHBondContact O-N 2.91Å; Q374-Q377 PolarHBondContact O-N 3.27Å; Q374-I378 WeakPolarHBondContact O-CG1 3.35Å; Q374-I378 PolarHBondContact O-N 3.38Å
375	F	95.8	Very high	95.7	Very high	48 Å²	48	59 Å²	59	21%	0.211	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-37.2	174.8	-86.3	-71.2	0	0	0	112.6	I371 V372 Q377 I378 V379 I412 R413	I371-F375 HydrophobicContact CG2-CD2 3.78Å; I371-F375 HydrophobicContact CG2-CE2 3.78Å; I371-F375 WeakPolarHBondContact O-CD2 3.49Å; I371-F375 PolarHBondContact O-N 3.1Å; V372-F375 PolarHBondContact O-N 3.33Å; F375-Q377 VanDerWaalsContact C-N 3.35Å; F375-Q377 PolarHBondContact O-N 3.02Å; F375-I378 PolarHBondContact O-N 3.4Å; F375-V379 WeakPolarHBondContact O-CG2 3.42Å; F375-V379 PolarHBondContact O-N 3.48Å; F375-I412 HydrophobicContact CD1-CG2 4.27Å; F375-I412 HydrophobicContact CD2-CG2 4.41Å; F375-I412 HydrophobicContact CE1-CB 4.19Å; F375-I412 HydrophobicContact CE1-CG2 3.64Å; F375-I412 HydrophobicContact CE2-CG2 3.81Å; F375-I412 HydrophobicContact CZ-CB 4.41Å; F375-I412 HydrophobicContact CZ-CG2 3.39Å; F375-R413 HydrophobicContact CB-CB 3.83Å; F375-R413 HydrophobicContact CB-CG 3.91Å
376	E	95.3	Very high	95.6	Very high	107 Å²	107	58.8 Å²	58.8	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-37.2	174.7	-175.9	165.9	-139.2	0	0	112.9	V372 Q374 S380	V372-E376 PolarHBondContact O-N 3.45Å; Q374-E376 VanDerWaalsContact C-N 3.32Å; Q374-E376 PolarHBondContact O-N 2.91Å; E376-S380 VanDerWaalsContact O-CB 3.31Å; E376-S380 WeakPolarHBondContact O-CB 3.39Å; E376-S380 PolarHBondContact O-N 2.94Å; E376-S380 PolarHBondContact O-OG 3.21Å
377	Q	97	Very high	95.6	Very high	131 Å²	131	60.5 Å²	60.5	61%	0.612	34%	0.344	S	S	*	.	H	α-helix	trans	-64.6	-42.3	171.9	-68.7	171.6	40.8	0	0	111.7	A373 Q374 F375 S380 V381	A373-Q377 WeakPolarHBondContact O-CG 3.41Å; A373-Q377 PolarHBondContact O-N 2.91Å; Q374-Q377 PolarHBondContact O-N 3.27Å; F375-Q377 VanDerWaalsContact C-N 3.35Å; F375-Q377 PolarHBondContact O-N 3.02Å; Q377-S380 WeakPolarHBondContact O-CB 3.29Å; Q377-S380 PolarHBondContact O-N 3.09Å; Q377-V381 WeakPolarHBondContact O-CG2 3.5Å; Q377-V381 PolarHBondContact O-N 3.14Å
378	I	95.8	Very high	95.4	Very high	77 Å²	77	63.7 Å²	63.7	40%	0.395	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-47	177.1	-68.3	165	0	0	0	111.1	Q374 F375 S380 V381 F382 A409	Q374-I378 WeakPolarHBondContact O-CG1 3.35Å; Q374-I378 PolarHBondContact O-N 3.38Å; F375-I378 PolarHBondContact O-N 3.4Å; I378-S380 VanDerWaalsContact C-N 3.27Å; I378-S380 PolarHBondContact O-N 3.13Å; I378-V381 PolarHBondContact O-N 3.07Å; I378-V381 VanDerWaalsContact O-N 3.16Å; I378-F382 HydrophobicContact CG2-CD2 4.04Å; I378-F382 HydrophobicContact CG2-CE2 3.54Å; I378-F382 HydrophobicContact CG2-CZ 4.19Å; I378-F382 WeakPolarHBondContact O-CD2 3.46Å; I378-F382 PolarHBondContact O-N 2.95Å; I378-F382 VanDerWaalsContact O-N 3.09Å; I378-A409 HydrophobicContact CG2-CB 4.23Å
379	V	95.8	Very high	95.4	Very high	4 Å²	4	72.6 Å²	72.6	2%	0.024	39%	0.388	C	S	.	.	H	α-helix	trans	-58.9	-40.2	173.3	171	0	0	0	0	110.8	F375 V381 F382 Q383 A409 E410	F375-V379 WeakPolarHBondContact O-CG2 3.42Å; F375-V379 PolarHBondContact O-N 3.48Å; V379-V381 VanDerWaalsContact C-N 3.35Å; V379-V381 PolarHBondContact O-N 3.17Å; V379-F382 PolarHBondContact O-N 3.34Å; V379-Q383 VanDerWaalsContact O-CB 3.28Å; V379-Q383 WeakPolarHBondContact O-CB 3.49Å; V379-Q383 PolarHBondContact O-N 3.31Å; V379-A409 HydrophobicContact CG2-CB 3.84Å; V379-E410 HydrophobicContact CB-CG 4.43Å; V379-E410 HydrophobicContact CG1-CG 3.68Å; V379-E410 HydrophobicContact CG2-CG 3.78Å
380	S	96.7	Very high	95.2	Very high	68 Å²	68	72.6 Å²	72.6	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-63.5	-35.8	176.2	-63.5	0	0	0	0	113.3	E376 Q377 I378 Q383 A384	E376-S380 VanDerWaalsContact O-CB 3.31Å; E376-S380 WeakPolarHBondContact O-CB 3.39Å; E376-S380 PolarHBondContact O-N 2.94Å; E376-S380 PolarHBondContact O-OG 3.21Å; Q377-S380 WeakPolarHBondContact O-CB 3.29Å; Q377-S380 PolarHBondContact O-N 3.09Å; I378-S380 VanDerWaalsContact C-N 3.27Å; I378-S380 PolarHBondContact O-N 3.13Å; S380-Q383 PolarHBondContact O-N 3.48Å; S380-A384 WeakPolarHBondContact O-CB 3.49Å; S380-A384 PolarHBondContact O-N 3.42Å
381	V	96.6	Very high	95.1	Very high	96 Å²	96	74.1 Å²	74.1	58%	0.582	38%	0.383	S	S	*	.	H	α-helix	trans	-65.4	-47.5	172.7	171.3	0	0	0	0	110.9	Q377 I378 V379 Q383 A384 A385	Q377-V381 WeakPolarHBondContact O-CG2 3.5Å; Q377-V381 PolarHBondContact O-N 3.14Å; I378-V381 PolarHBondContact O-N 3.07Å; I378-V381 VanDerWaalsContact O-N 3.16Å; V379-V381 VanDerWaalsContact C-N 3.35Å; V379-V381 PolarHBondContact O-N 3.17Å; V381-Q383 VanDerWaalsContact C-N 3.28Å; V381-Q383 PolarHBondContact O-N 2.9Å; V381-A384 PolarHBondContact O-N 3.47Å; V381-A385 WeakPolarHBondContact O-CB 3.48Å; V381-A385 PolarHBondContact O-N 3.5Å
382	F	95.3	Very high	95	Very high	35 Å²	35	74.8 Å²	74.8	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-62.1	-36.1	174.7	-64.7	-43.7	0	0	0	112.2	I378 V379 A385 S386 L402 W405 R406 A409	I378-F382 HydrophobicContact CG2-CD2 4.04Å; I378-F382 HydrophobicContact CG2-CE2 3.54Å; I378-F382 HydrophobicContact CG2-CZ 4.19Å; I378-F382 WeakPolarHBondContact O-CD2 3.46Å; I378-F382 PolarHBondContact O-N 2.95Å; I378-F382 VanDerWaalsContact O-N 3.09Å; V379-F382 PolarHBondContact O-N 3.34Å; F382-A385 PolarHBondContact O-N 3Å; F382-S386 WeakPolarHBondContact O-CB 3.37Å; F382-S386 PolarHBondContact O-N 2.79Å; F382-S386 PolarHBondContact O-OG 3.1Å; F382-L402 HydrophobicContact CD1-CD1 3.53Å; F382-L402 HydrophobicContact CD1-CG 4.37Å; F382-L402 HydrophobicContact CE1-CD1 3.89Å; F382-W405 HydrophobicContact CE1-CB 4.16Å; F382-W405 HydrophobicContact CE1-CE3 4.42Å; F382-W405 HydrophobicContact CE2-CB 4.12Å; F382-W405 HydrophobicContact CZ-CB 3.71Å; F382-R406 HydrophobicContact CB-CB 3.92Å; F382-R406 HydrophobicContact CB-CG 3.89Å; F382-R406 HydrophobicContact CD2-CB 4.29Å; F382-R406 HydrophobicContact CG-CB 4.25Å; F382-A409 HydrophobicContact CD2-CB 4.17Å; F382-A409 HydrophobicContact CE2-CB 3.91Å
383	Q	93.8	Very high	95.1	Very high	98 Å²	98	81.9 Å²	81.9	46%	0.458	42%	0.42	S	S	.	.	H	α-helix	trans	-70.8	-29.8	175.9	-175	135.4	-23.6	0	0	113.1	V379 S380 V381 K387	V379-Q383 VanDerWaalsContact O-CB 3.28Å; V379-Q383 WeakPolarHBondContact O-CB 3.49Å; V379-Q383 PolarHBondContact O-N 3.31Å; S380-Q383 PolarHBondContact O-N 3.48Å; V381-Q383 VanDerWaalsContact C-N 3.28Å; V381-Q383 PolarHBondContact O-N 2.9Å; Q383-K387 WeakPolarHBondContact O-CE 3.3Å; Q383-K387 WeakPolarHBondContact O-CG 3.33Å
384	A	96.1	Very high	95.1	Very high	46 Å²	46	83.1 Å²	83.1	38%	0.38	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-44.3	168.2	0	0	0	0	0	111.7	S380 V381 S386 K387	S380-A384 WeakPolarHBondContact O-CB 3.49Å; S380-A384 PolarHBondContact O-N 3.42Å; V381-A384 PolarHBondContact O-N 3.47Å; A384-S386 VanDerWaalsContact C-N 3.32Å; A384-S386 PolarHBondContact O-N 2.87Å; A384-K387 WeakPolarHBondContact O-CB 3.36Å; A384-K387 WeakPolarHBondContact O-CG 3.43Å; A384-K387 PolarHBondContact O-N 3.23Å
385	A	95	Very high	95.1	Very high	18 Å²	18	80 Å²	80	15%	0.149	41%	0.409	C	S	.	.	H	α-helix	trans	-71.6	-23.1	-178.8	0	0	0	0	0	113.8	V381 F382 K387 W391 F394 L402	V381-A385 WeakPolarHBondContact O-CB 3.48Å; V381-A385 PolarHBondContact O-N 3.5Å; F382-A385 PolarHBondContact O-N 3Å; A385-K387 VanDerWaalsContact C-N 3.25Å; A385-K387 PolarHBondContact O-N 3.14Å; A385-W391 PolarHBondContact O-N 3.11Å; A385-F394 HydrophobicContact CB-CE2 4.12Å; A385-F394 HydrophobicContact CB-CZ 4.44Å; A385-L402 HydrophobicContact CB-CD2 3.69Å
386	S	92.5	Very high	95.1	Very high	35 Å²	35	86.8 Å²	86.8	25%	0.245	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.6	170.8	-56.1	0	0	0	0	113.8	F382 A384 R406	F382-S386 WeakPolarHBondContact O-CB 3.37Å; F382-S386 PolarHBondContact O-N 2.79Å; F382-S386 PolarHBondContact O-OG 3.1Å; A384-S386 VanDerWaalsContact C-N 3.32Å; A384-S386 PolarHBondContact O-N 2.87Å; S386-R406 PolarHBondContact OG-NE 2.93Å
387	K	94.4	Very high	95.1	Very high	134 Å²	134	84.8 Å²	84.8	58%	0.583	44%	0.44	S	S	*	.	S	Bend	trans	-73.3	136.7	-179.3	-64.3	169.2	-174.3	173	0	109.8	Q383 A384 A385 K389 A390 W391	Q383-K387 WeakPolarHBondContact O-CE 3.3Å; Q383-K387 WeakPolarHBondContact O-CG 3.33Å; A384-K387 WeakPolarHBondContact O-CB 3.36Å; A384-K387 WeakPolarHBondContact O-CG 3.43Å; A384-K387 PolarHBondContact O-N 3.23Å; A385-K387 VanDerWaalsContact C-N 3.25Å; A385-K387 PolarHBondContact O-N 3.14Å; K387-K389 PolarHBondContact O-N 2.99Å; K387-A390 PolarHBondContact O-N 3.4Å; K387-W391 WeakPolarHBondContact O-CB 3.11Å; K387-W391 PolarHBondContact O-N 2.94Å
388	Q	93.1	Very high	95.1	Very high	121 Å²	121	83.6 Å²	83.6	57%	0.565	44%	0.435	S	S	*	.	H	α-helix	trans	-40.8	-46.3	-174.6	-158.9	72	19.1	0	0	114.4	A390 W391 D392	Q388-A390 VanDerWaalsContact C-N 3.25Å; Q388-A390 PolarHBondContact O-N 3.04Å; Q388-W391 PolarHBondContact O-N 2.89Å; Q388-D392 WeakPolarHBondContact CG-OD2 3.43Å; Q388-D392 VanDerWaalsContact NE2-CG 3.33Å; Q388-D392 PolarHBondContact NE2-OD1 2.96Å; Q388-D392 PolarHBondContact NE2-OD2 3.25Å; Q388-D392 PolarHBondContact O-N 3.35Å
389	K	93.1	Very high	95.1	Very high	193 Å²	193	82.9 Å²	82.9	84%	0.839	43%	0.427	S	S	*	.	H	α-helix	trans	-54.2	-34.9	179.4	-64.7	-173.1	177.5	-175.3	0	114.1	K387 H393	K387-K389 PolarHBondContact O-N 2.99Å; K389-H393 PolarHBondContact O-CE1 2.89Å; K389-H393 PolarHBondContact O-ND1 3.22Å
390	A	92.8	Very high	95	Very high	34 Å²	34	90.1 Å²	90.1	28%	0.281	46%	0.458	S	S	.	.	H	α-helix	trans	-94.4	-45.6	173.8	0	0	0	0	0	111	K387 Q388 D392 H393 F394	K387-A390 PolarHBondContact O-N 3.4Å; Q388-A390 VanDerWaalsContact C-N 3.25Å; Q388-A390 PolarHBondContact O-N 3.04Å; A390-D392 VanDerWaalsContact C-N 3.27Å; A390-D392 PolarHBondContact O-N 3.24Å; A390-D392 VanDerWaalsContact O-N 3.16Å; A390-H393 WeakPolarHBondContact O-CB 3.43Å; A390-H393 PolarHBondContact O-N 3.42Å; A390-F394 HydrophobicContact CB-CE2 4.3Å
391	W	93.8	Very high	94.9	Very high	65 Å²	65	90.1 Å²	90.1	25%	0.246	45%	0.453	C	S	.	.	H	α-helix	trans	-51.3	-40.9	-174.9	-173.5	-114.8	0	0	0	113.6	A385 K387 Q388 H393 F394 R399 L402	A385-W391 PolarHBondContact O-N 3.11Å; K387-W391 WeakPolarHBondContact O-CB 3.11Å; K387-W391 PolarHBondContact O-N 2.94Å; Q388-W391 PolarHBondContact O-N 2.89Å; W391-H393 VanDerWaalsContact C-N 3.27Å; W391-H393 PolarHBondContact O-N 2.75Å; W391-F394 PolarHBondContact O-N 3.08Å; W391-R399 HydrophobicContact CD2-CG 3.94Å; W391-R399 HydrophobicContact CE3-CB 4.42Å; W391-R399 HydrophobicContact CE3-CG 4Å; W391-R399 HydrophobicContact CH2-CB 3.6Å; W391-R399 HydrophobicContact CH2-CG 4.03Å; W391-R399 WeakPolarHBondContact CH2-O 3.28Å; W391-R399 HydrophobicContact CZ2-CB 3.74Å; W391-R399 HydrophobicContact CZ2-CG 3.94Å; W391-R399 HydrophobicContact CZ3-CB 3.95Å; W391-R399 HydrophobicContact CZ3-CG 4.04Å; W391-R399 PolarHBondContact O-NE 3.09Å; W391-R399 VanDerWaalsContact O-NE 3.12Å; W391-R399 PolarHBondContact O-NH1 2.83Å; W391-R399 PolarHBondContact O-NH2 3.18Å; W391-L402 HydrophobicContact CE3-CD2 4.16Å; W391-L402 HydrophobicContact CZ3-CB 4.34Å; W391-L402 HydrophobicContact CZ3-CD2 3.96Å
392	D	94.4	Very high	94.9	Very high	82 Å²	82	86.5 Å²	86.5	44%	0.439	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.6	-177.8	-79.3	-26.8	0	0	0	115.3	Q388 A390 F394 R399	Q388-D392 WeakPolarHBondContact CG-OD2 3.43Å; Q388-D392 VanDerWaalsContact NE2-CG 3.33Å; Q388-D392 PolarHBondContact NE2-OD1 2.96Å; Q388-D392 PolarHBondContact NE2-OD2 3.25Å; Q388-D392 PolarHBondContact O-N 3.35Å; A390-D392 VanDerWaalsContact C-N 3.27Å; A390-D392 PolarHBondContact O-N 3.24Å; A390-D392 VanDerWaalsContact O-N 3.16Å; D392-F394 VanDerWaalsContact C-N 3.35Å; D392-R399 PolarHBondContact O-NH2 2.93Å; D392-R399 IonicContact OD1-CZ 2.7Å; D392-R399 IonicContact OD1-NH1 2.78Å; D392-R399 PolarHBondContact OD1-NH1 3.07Å; D392-R399 IonicContact OD1-NH2 3.93Å
393	H	96.3	Very high	94.8	Very high	162 Å²	162	87.9 Å²	87.9	75%	0.75	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-15.7	175.4	-61.7	92	0	0	0	112.9	K389 A390 W391	K389-H393 PolarHBondContact O-CE1 2.89Å; K389-H393 PolarHBondContact O-ND1 3.22Å; A390-H393 WeakPolarHBondContact O-CB 3.43Å; A390-H393 PolarHBondContact O-N 3.42Å; W391-H393 VanDerWaalsContact C-N 3.27Å; W391-H393 PolarHBondContact O-N 2.75Å
394	F	96.8	Very high	94.8	Very high	68 Å²	68	87.3 Å²	87.3	30%	0.298	44%	0.437	S	S	.	.	S	Bend	trans	-84.3	144.9	177.6	-59.1	-50.6	0	0	0	112.1	A385 A390 W391 D392 Q398 R399 L402	A385-F394 HydrophobicContact CB-CE2 4.12Å; A385-F394 HydrophobicContact CB-CZ 4.44Å; A390-F394 HydrophobicContact CB-CE2 4.3Å; W391-F394 PolarHBondContact O-N 3.08Å; D392-F394 VanDerWaalsContact C-N 3.35Å; F394-Q398 HydrophobicContact CB-CB 4.08Å; F394-R399 HydrophobicContact CB-CG 3.87Å; F394-R399 VanDerWaalsContact O-CZ 3.3Å; F394-R399 PolarHBondContact O-NE 3.27Å; F394-R399 PolarHBondContact O-NH2 2.78Å; F394-L402 HydrophobicContact CD2-CD2 4.17Å; F394-L402 HydrophobicContact CE2-CD2 3.97Å
395	S	97.3	Very high	94.8	Very high	58 Å²	58	91 Å²	91	41%	0.406	44%	0.441	S	S	.	.			trans	-67.6	159.5	171.3	68.6	0	0	0	0	112.1	A397 Q398 R399	S395-A397 PolarHBondContact O-N 3.28Å; S395-A397 VanDerWaalsContact O-N 3.15Å; S395-Q398 VanDerWaalsContact CB-OE1 3.29Å; S395-Q398 PolarHBondContact O-N 2.73Å; S395-Q398 VanDerWaalsContact O-N 3.09Å; S395-Q398 VanDerWaalsContact OG-CD 3.3Å; S395-Q398 WeakPolarHBondContact OG-CG 3.5Å; S395-Q398 PolarHBondContact OG-N 2.97Å; S395-Q398 PolarHBondContact OG-OE1 3.39Å; S395-R399 WeakPolarHBondContact O-CG 3.5Å; S395-R399 PolarHBondContact O-N 3.41Å
396	K	95.4	Very high	94.8	Very high	191 Å²	191	92.2 Å²	92.2	83%	0.83	44%	0.442	S	S	*	.	H	α-helix	trans	-55.7	-31.9	178.2	-169.8	174.1	-178.1	177.3	0	113.3	K400	K396-K400 PolarHBondContact O-N 3.15Å
397	A	95.7	Very high	94.9	Very high	65 Å²	65	95 Å²	95	54%	0.537	45%	0.45	S	S	.	.	H	α-helix	trans	-72.9	-46.6	175.3	0	0	0	0	0	112.1	S395 R399 K400 N401	S395-A397 PolarHBondContact O-N 3.28Å; S395-A397 VanDerWaalsContact O-N 3.15Å; A397-R399 VanDerWaalsContact C-N 3.35Å; A397-R399 PolarHBondContact O-N 2.87Å; A397-K400 PolarHBondContact O-N 2.72Å; A397-N401 PolarHBondContact O-N 2.68Å; A397-N401 VanDerWaalsContact O-N 3.1Å
398	Q	95.6	Very high	94.9	Very high	105 Å²	105	92.9 Å²	92.9	49%	0.491	44%	0.442	S	S	.	.	H	α-helix	trans	-60.9	-42.3	176.1	-73.7	159.6	-43.8	0	0	111.8	F394 S395 K400 N401 L402	F394-Q398 HydrophobicContact CB-CB 4.08Å; S395-Q398 VanDerWaalsContact CB-OE1 3.29Å; S395-Q398 PolarHBondContact O-N 2.73Å; S395-Q398 VanDerWaalsContact O-N 3.09Å; S395-Q398 VanDerWaalsContact OG-CD 3.3Å; S395-Q398 WeakPolarHBondContact OG-CG 3.5Å; S395-Q398 PolarHBondContact OG-N 2.97Å; S395-Q398 PolarHBondContact OG-OE1 3.39Å; Q398-K400 VanDerWaalsContact C-N 3.33Å; Q398-K400 PolarHBondContact O-N 2.69Å; Q398-N401 PolarHBondContact O-N 3.07Å; Q398-L402 WeakPolarHBondContact O-CB 3.1Å; Q398-L402 PolarHBondContact O-N 2.78Å
399	R	96	Very high	95	Very high	62 Å²	62	87.5 Å²	87.5	23%	0.234	42%	0.419	C	S	.	.	H	α-helix	trans	-57.1	-43.1	174.6	-69.2	-177.5	-149.1	-148.4	8.1	112.3	W391 D392 F394 S395 A397 L402 D403	W391-R399 HydrophobicContact CD2-CG 3.94Å; W391-R399 HydrophobicContact CE3-CB 4.42Å; W391-R399 HydrophobicContact CE3-CG 4Å; W391-R399 HydrophobicContact CH2-CB 3.6Å; W391-R399 HydrophobicContact CH2-CG 4.03Å; W391-R399 WeakPolarHBondContact CH2-O 3.28Å; W391-R399 HydrophobicContact CZ2-CB 3.74Å; W391-R399 HydrophobicContact CZ2-CG 3.94Å; W391-R399 HydrophobicContact CZ3-CB 3.95Å; W391-R399 HydrophobicContact CZ3-CG 4.04Å; W391-R399 PolarHBondContact O-NE 3.09Å; W391-R399 VanDerWaalsContact O-NE 3.12Å; W391-R399 PolarHBondContact O-NH1 2.83Å; W391-R399 PolarHBondContact O-NH2 3.18Å; D392-R399 PolarHBondContact O-NH2 2.93Å; D392-R399 IonicContact OD1-CZ 2.7Å; D392-R399 IonicContact OD1-NH1 2.78Å; D392-R399 PolarHBondContact OD1-NH1 3.07Å; D392-R399 IonicContact OD1-NH2 3.93Å; F394-R399 HydrophobicContact CB-CG 3.87Å; F394-R399 VanDerWaalsContact O-CZ 3.3Å; F394-R399 PolarHBondContact O-NE 3.27Å; F394-R399 PolarHBondContact O-NH2 2.78Å; S395-R399 WeakPolarHBondContact O-CG 3.5Å; S395-R399 PolarHBondContact O-N 3.41Å; A397-R399 VanDerWaalsContact C-N 3.35Å; A397-R399 PolarHBondContact O-N 2.87Å; R399-L402 PolarHBondContact O-N 2.73Å; R399-D403 PolarHBondContact O-N 2.72Å; R399-D403 VanDerWaalsContact O-N 3.08Å
400	K	94.6	Very high	95.1	Very high	156 Å²	156	80.6 Å²	80.6	68%	0.678	39%	0.389	S	S	*	.	H	α-helix	trans	-63.8	-43.9	176.9	-170.8	-172.8	176.9	-170.8	0	112	K396 A397 Q398 L402 M404	K396-K400 PolarHBondContact O-N 3.15Å; A397-K400 PolarHBondContact O-N 2.72Å; Q398-K400 VanDerWaalsContact C-N 3.33Å; Q398-K400 PolarHBondContact O-N 2.69Å; K400-L402 VanDerWaalsContact C-N 3.35Å; K400-M404 WeakPolarHBondContact O-CB 3.16Å; K400-M404 PolarHBondContact O-N 2.7Å; K400-M404 VanDerWaalsContact O-N 3.14Å
401	N	95.1	Very high	95.2	Very high	68 Å²	68	84.9 Å²	84.9	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-66.2	-39.2	178	-68.3	0.7	0	0	0	111.5	A397 Q398 M404 W405	A397-N401 PolarHBondContact O-N 2.68Å; A397-N401 VanDerWaalsContact O-N 3.1Å; Q398-N401 PolarHBondContact O-N 3.07Å; N401-M404 PolarHBondContact O-N 2.81Å; N401-W405 HydrophobicContact CB-CD2 4.42Å; N401-W405 HydrophobicContact CB-CE3 4.41Å; N401-W405 HydrophobicContact CB-CH2 4.11Å; N401-W405 HydrophobicContact CB-CZ2 4.09Å; N401-W405 HydrophobicContact CB-CZ3 4.27Å; N401-W405 WeakPolarHBondContact O-CB 3.42Å; N401-W405 VanDerWaalsContact O-CD2 3.3Å; N401-W405 PolarHBondContact O-N 3.37Å
402	L	95	Very high	95.2	Very high	21 Å²	21	85 Å²	85	11%	0.11	41%	0.408	C	S	.	.	H	α-helix	trans	-65.9	-41.2	-180	-163.1	69.8	0	0	0	112.3	F382 A385 W391 F394 Q398 R399 K400 R406	F382-L402 HydrophobicContact CD1-CD1 3.53Å; F382-L402 HydrophobicContact CD1-CG 4.37Å; F382-L402 HydrophobicContact CE1-CD1 3.89Å; A385-L402 HydrophobicContact CB-CD2 3.69Å; W391-L402 HydrophobicContact CE3-CD2 4.16Å; W391-L402 HydrophobicContact CZ3-CB 4.34Å; W391-L402 HydrophobicContact CZ3-CD2 3.96Å; F394-L402 HydrophobicContact CD2-CD2 4.17Å; F394-L402 HydrophobicContact CE2-CD2 3.97Å; Q398-L402 WeakPolarHBondContact O-CB 3.1Å; Q398-L402 PolarHBondContact O-N 2.78Å; R399-L402 PolarHBondContact O-N 2.73Å; K400-L402 VanDerWaalsContact C-N 3.35Å; L402-R406 VanDerWaalsContact O-CB 3.25Å; L402-R406 WeakPolarHBondContact O-CB 3.28Å; L402-R406 PolarHBondContact O-N 3.24Å
403	D	93.8	Very high	95.3	Very high	64 Å²	64	83.9 Å²	83.9	34%	0.342	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-40.6	173.2	174.7	72	0	0	0	112.4	R399 K407	R399-D403 PolarHBondContact O-N 2.72Å; R399-D403 VanDerWaalsContact O-N 3.08Å; D403-K407 WeakPolarHBondContact O-CG 3.38Å; D403-K407 PolarHBondContact O-N 3.04Å; D403-K407 VanDerWaalsContact O-N 3.17Å; D403-K407 VanDerWaalsContact OD1-CE 3.26Å; D403-K407 WeakPolarHBondContact OD1-CE 3.37Å; D403-K407 IonicContact OD1-NZ 3.99Å; D403-K407 PolarHBondContact OD1-NZ 3.31Å; D403-K407 IonicContact OD2-NZ 3.27Å; D403-K407 PolarHBondContact OD2-NZ 3.45Å
404	M	94.9	Very high	95.2	Very high	85 Å²	85	80 Å²	80	42%	0.419	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-50.1	175.7	-177.1	-175.2	75.7	0	0	112.1	K400 N401 R406 K407 Q408	K400-M404 WeakPolarHBondContact O-CB 3.16Å; K400-M404 PolarHBondContact O-N 2.7Å; K400-M404 VanDerWaalsContact O-N 3.14Å; N401-M404 PolarHBondContact O-N 2.81Å; M404-R406 VanDerWaalsContact C-N 3.33Å; M404-R406 PolarHBondContact O-N 3.29Å; M404-K407 PolarHBondContact O-N 2.77Å; M404-Q408 WeakPolarHBondContact O-CG 3.47Å; M404-Q408 PolarHBondContact O-N 2.97Å
405	W	95.8	Very high	95.1	Very high	123 Å²	123	81.1 Å²	81.1	47%	0.466	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-34.9	179.1	-63.2	-31	0	0	0	112.7	F382 N401 A409	F382-W405 HydrophobicContact CE1-CB 4.16Å; F382-W405 HydrophobicContact CE1-CE3 4.42Å; F382-W405 HydrophobicContact CE2-CB 4.12Å; F382-W405 HydrophobicContact CZ-CB 3.71Å; N401-W405 HydrophobicContact CB-CD2 4.42Å; N401-W405 HydrophobicContact CB-CE3 4.41Å; N401-W405 HydrophobicContact CB-CH2 4.11Å; N401-W405 HydrophobicContact CB-CZ2 4.09Å; N401-W405 HydrophobicContact CB-CZ3 4.27Å; N401-W405 WeakPolarHBondContact O-CB 3.42Å; N401-W405 VanDerWaalsContact O-CD2 3.3Å; N401-W405 PolarHBondContact O-N 3.37Å; W405-A409 VanDerWaalsContact O-CB 3.32Å; W405-A409 WeakPolarHBondContact O-CB 3.41Å; W405-A409 PolarHBondContact O-N 2.89Å
406	R	94.4	Very high	94.8	Very high	44 Å²	44	80.2 Å²	80.2	17%	0.166	38%	0.379	C	S	.	.	H	α-helix	trans	-58.6	-51.8	173	-174.3	-152.4	-119.6	-89.6	17.8	110.9	F382 S386 L402 M404 A409 E410	F382-R406 HydrophobicContact CB-CB 3.92Å; F382-R406 HydrophobicContact CB-CG 3.89Å; F382-R406 HydrophobicContact CD2-CB 4.29Å; F382-R406 HydrophobicContact CG-CB 4.25Å; S386-R406 PolarHBondContact OG-NE 2.93Å; L402-R406 VanDerWaalsContact O-CB 3.25Å; L402-R406 WeakPolarHBondContact O-CB 3.28Å; L402-R406 PolarHBondContact O-N 3.24Å; M404-R406 VanDerWaalsContact C-N 3.33Å; M404-R406 PolarHBondContact O-N 3.29Å; R406-A409 PolarHBondContact O-N 3.32Å; R406-E410 WeakPolarHBondContact CD-OE1 3.36Å; R406-E410 WeakPolarHBondContact CG-OE1 3.39Å; R406-E410 IonicContact CZ-OE1 2.84Å; R406-E410 IonicContact NE-OE1 3.2Å; R406-E410 IonicContact NH1-OE1 2.83Å; R406-E410 PolarHBondContact NH1-OE1 3.4Å; R406-E410 WeakPolarHBondContact O-CG 3.39Å; R406-E410 PolarHBondContact O-N 3.08Å
407	K	94.9	Very high	94.8	Very high	95 Å²	95	74 Å²	74	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-46.7	180	-73.4	164.1	-178.4	163.2	0	111.8	D403 M404 A409 E410 E411	D403-K407 WeakPolarHBondContact O-CG 3.38Å; D403-K407 PolarHBondContact O-N 3.04Å; D403-K407 VanDerWaalsContact O-N 3.17Å; D403-K407 VanDerWaalsContact OD1-CE 3.26Å; D403-K407 WeakPolarHBondContact OD1-CE 3.37Å; D403-K407 IonicContact OD1-NZ 3.99Å; D403-K407 PolarHBondContact OD1-NZ 3.31Å; D403-K407 IonicContact OD2-NZ 3.27Å; D403-K407 PolarHBondContact OD2-NZ 3.45Å; M404-K407 PolarHBondContact O-N 2.77Å; K407-A409 VanDerWaalsContact C-N 3.33Å; K407-A409 PolarHBondContact O-N 3.14Å; K407-E410 PolarHBondContact O-N 3.41Å; K407-E411 WeakPolarHBondContact O-CB 3.32Å; K407-E411 VanDerWaalsContact O-CG 3.27Å; K407-E411 WeakPolarHBondContact O-CG 3.43Å; K407-E411 PolarHBondContact O-N 3.16Å
408	Q	95.2	Very high	94.7	Very high	89 Å²	89	78 Å²	78	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-59	-42	175.4	-70.1	175.1	-40.9	0	0	112.2	M404 I412	M404-Q408 WeakPolarHBondContact O-CG 3.47Å; M404-Q408 PolarHBondContact O-N 2.97Å; Q408-I412 WeakPolarHBondContact O-CB 3.48Å; Q408-I412 WeakPolarHBondContact O-CD1 3.4Å; Q408-I412 WeakPolarHBondContact O-CG1 3.25Å; Q408-I412 PolarHBondContact O-N 2.93Å
409	A	94.4	Very high	94.5	Very high	8 Å²	8	77.3 Å²	77.3	7%	0.066	36%	0.359	C	S	.	.	H	α-helix	trans	-68.7	-36.3	176.6	0	0	0	0	0	112.8	I378 V379 F382 W405 R406 K407 R413	I378-A409 HydrophobicContact CG2-CB 4.23Å; V379-A409 HydrophobicContact CG2-CB 3.84Å; F382-A409 HydrophobicContact CD2-CB 4.17Å; F382-A409 HydrophobicContact CE2-CB 3.91Å; W405-A409 VanDerWaalsContact O-CB 3.32Å; W405-A409 WeakPolarHBondContact O-CB 3.41Å; W405-A409 PolarHBondContact O-N 2.89Å; R406-A409 PolarHBondContact O-N 3.32Å; K407-A409 VanDerWaalsContact C-N 3.33Å; K407-A409 PolarHBondContact O-N 3.14Å; A409-R413 WeakPolarHBondContact O-CB 3.49Å; A409-R413 PolarHBondContact O-N 3.37Å
410	E	94.9	Very high	94.3	Very high	48 Å²	48	74.6 Å²	74.6	22%	0.224	35%	0.35	C	S	.	.	H	α-helix	trans	-67.5	-45.9	174.7	-76.1	168.5	-162.5	0	0	112.1	V379 R406 K407 R413 N414	V379-E410 HydrophobicContact CB-CG 4.43Å; V379-E410 HydrophobicContact CG1-CG 3.68Å; V379-E410 HydrophobicContact CG2-CG 3.78Å; R406-E410 WeakPolarHBondContact CD-OE1 3.36Å; R406-E410 WeakPolarHBondContact CG-OE1 3.39Å; R406-E410 IonicContact CZ-OE1 2.84Å; R406-E410 IonicContact NE-OE1 3.2Å; R406-E410 IonicContact NH1-OE1 2.83Å; R406-E410 PolarHBondContact NH1-OE1 3.4Å; R406-E410 WeakPolarHBondContact O-CG 3.39Å; R406-E410 PolarHBondContact O-N 3.08Å; K407-E410 PolarHBondContact O-N 3.41Å; E410-R413 PolarHBondContact O-N 2.96Å; E410-N414 VanDerWaalsContact O-CB 3.32Å; E410-N414 WeakPolarHBondContact O-CB 3.49Å; E410-N414 PolarHBondContact O-N 2.9Å; E410-N414 PolarHBondContact O-ND2 3.22Å; E410-N414 PolarHBondContact O-OD1 3.33Å; E410-N414 VanDerWaalsContact O-OD1 3.14Å
411	E	95.8	Very high	94	Very high	123 Å²	123	71.2 Å²	71.2	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-57.8	-50.3	175.1	-72.8	160.7	-165.7	0	0	111	K407 N414 M415	K407-E411 WeakPolarHBondContact O-CB 3.32Å; K407-E411 VanDerWaalsContact O-CG 3.27Å; K407-E411 WeakPolarHBondContact O-CG 3.43Å; K407-E411 PolarHBondContact O-N 3.16Å; E411-N414 PolarHBondContact O-N 3.03Å; E411-M415 PolarHBondContact O-N 2.81Å
412	I	93.4	Very high	93.6	Very high	67 Å²	67	69.3 Å²	69.3	34%	0.344	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-42.4	179.2	-65.8	166.1	0	0	0	111.2	F375 Q408 M415 H416	F375-I412 HydrophobicContact CD1-CG2 4.27Å; F375-I412 HydrophobicContact CD2-CG2 4.41Å; F375-I412 HydrophobicContact CE1-CB 4.19Å; F375-I412 HydrophobicContact CE1-CG2 3.64Å; F375-I412 HydrophobicContact CE2-CG2 3.81Å; F375-I412 HydrophobicContact CZ-CB 4.41Å; F375-I412 HydrophobicContact CZ-CG2 3.39Å; Q408-I412 WeakPolarHBondContact O-CB 3.48Å; Q408-I412 WeakPolarHBondContact O-CD1 3.4Å; Q408-I412 WeakPolarHBondContact O-CG1 3.25Å; Q408-I412 PolarHBondContact O-N 2.93Å; I412-M415 PolarHBondContact O-N 3.12Å; I412-H416 PolarHBondContact O-N 2.92Å; I412-H416 PolarHBondContact O-ND1 2.76Å
413	R	95.4	Very high	93.2	Very high	60 Å²	60	70.1 Å²	70.1	23%	0.226	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-48.4	174.8	-174	-161.4	62.1	-178.7	-7	111.1	V372 F375 A409 E410 M415 H416 N417	V372-R413 HydrophobicContact CG1-CG 4.48Å; F375-R413 HydrophobicContact CB-CB 3.83Å; F375-R413 HydrophobicContact CB-CG 3.91Å; A409-R413 WeakPolarHBondContact O-CB 3.49Å; A409-R413 PolarHBondContact O-N 3.37Å; E410-R413 PolarHBondContact O-N 2.96Å; R413-M415 VanDerWaalsContact C-N 3.34Å; R413-M415 PolarHBondContact O-N 3.21Å; R413-H416 PolarHBondContact O-N 3.19Å; R413-N417 WeakPolarHBondContact O-CB 3.38Å; R413-N417 PolarHBondContact O-N 3.11Å
414	N	94.5	Very high	92.6	Very high	80 Å²	80	71.8 Å²	71.8	43%	0.428	34%	0.339	S	S	.	.	H	α-helix	trans	-62.4	-43.1	-176.3	-67.2	-6.2	0	0	0	110.6	E410 E411 N417 E418	E410-N414 VanDerWaalsContact O-CB 3.32Å; E410-N414 WeakPolarHBondContact O-CB 3.49Å; E410-N414 PolarHBondContact O-N 2.9Å; E410-N414 PolarHBondContact O-ND2 3.22Å; E410-N414 PolarHBondContact O-OD1 3.33Å; E410-N414 VanDerWaalsContact O-OD1 3.14Å; E411-N414 PolarHBondContact O-N 3.03Å; N414-N417 PolarHBondContact O-N 3.07Å; N414-E418 WeakPolarHBondContact O-CB 3.15Å; N414-E418 PolarHBondContact O-N 3.48Å
415	M	94.1	Very high	91.9	Very high	92 Å²	92	74.6 Å²	74.6	45%	0.453	35%	0.345	S	S	.	.	H	α-helix	trans	-59	-47.4	175.4	-178.2	-174	69.8	0	0	112.8	E411 I412 R413 N417 E418 Q419	E411-M415 PolarHBondContact O-N 2.81Å; I412-M415 PolarHBondContact O-N 3.12Å; R413-M415 VanDerWaalsContact C-N 3.34Å; R413-M415 PolarHBondContact O-N 3.21Å; M415-N417 VanDerWaalsContact C-N 3.34Å; M415-E418 PolarHBondContact O-N 3.38Å; M415-Q419 WeakPolarHBondContact O-CG 3.4Å; M415-Q419 PolarHBondContact O-N 3.32Å
416	H	92.8	Very high	90.8	Very high	38 Å²	38	74.7 Å²	74.7	18%	0.176	35%	0.351	C	S	.	.	H	α-helix	trans	-69.3	-32.9	178.5	-70.4	82.8	0	0	0	112.2	L368 V372 I412 R413 L420	L368-H416 HydrophobicContact CD1-CB 4Å; V372-H416 HydrophobicContact CG2-CB 3.67Å; I412-H416 PolarHBondContact O-N 2.92Å; I412-H416 PolarHBondContact O-ND1 2.76Å; R413-H416 PolarHBondContact O-N 3.19Å; H416-L420 WeakPolarHBondContact O-CB 3.38Å; H416-L420 PolarHBondContact O-N 2.91Å
417	N	94.1	Very high	89.5	Confident	62 Å²	62	74.1 Å²	74.1	33%	0.332	35%	0.35	S	S	.	.	H	α-helix	trans	-70.7	-37.6	174.7	-176.5	83.9	0	0	0	112.1	V372 R413 N414 M415 L420 M421	V372-N417 HydrophobicContact CG1-CB 4.05Å; V372-N417 HydrophobicContact CG2-CB 4.32Å; R413-N417 WeakPolarHBondContact O-CB 3.38Å; R413-N417 PolarHBondContact O-N 3.11Å; N414-N417 PolarHBondContact O-N 3.07Å; M415-N417 VanDerWaalsContact C-N 3.34Å; N417-L420 PolarHBondContact O-N 3.09Å; N417-M421 WeakPolarHBondContact O-CB 3.35Å; N417-M421 VanDerWaalsContact O-CG 3.29Å; N417-M421 WeakPolarHBondContact O-CG 3.37Å; N417-M421 PolarHBondContact O-N 3.32Å
418	E	93.3	Very high	88.1	Confident	147 Å²	147	76.6 Å²	76.6	69%	0.687	36%	0.363	S	S	*	.	H	α-helix	trans	-64.6	-42.1	174	-177.2	168	-146.9	0	0	111.4	N414 M415 L420 M421 G422	N414-E418 WeakPolarHBondContact O-CB 3.15Å; N414-E418 PolarHBondContact O-N 3.48Å; M415-E418 PolarHBondContact O-N 3.38Å; E418-L420 PolarHBondContact O-N 2.97Å; E418-M421 PolarHBondContact O-N 2.89Å; E418-G422 PolarHBondContact O-N 3.41Å
419	Q	92	Very high	86.6	Confident	91 Å²	91	78.9 Å²	78.9	43%	0.425	38%	0.375	S	S	.	.	H	α-helix	trans	-58.5	-46.8	171.3	-71.5	169.4	3.3	0	0	111.9	L368 M415 M421 G422 I423	L368-Q419 HydrophobicContact CD2-CB 4.16Å; M415-Q419 WeakPolarHBondContact O-CG 3.4Å; M415-Q419 PolarHBondContact O-N 3.32Å; Q419-M421 VanDerWaalsContact C-N 3.33Å; Q419-M421 PolarHBondContact O-N 2.84Å; Q419-G422 PolarHBondContact O-N 3.06Å; Q419-I423 WeakPolarHBondContact O-CG1 3.32Å; Q419-I423 PolarHBondContact O-N 2.96Å; Q419-I423 VanDerWaalsContact O-N 3.1Å
420	L	92.1	Very high	85	Confident	6 Å²	6	83.9 Å²	83.9	3%	0.031	40%	0.397	C	S	.	.	H	α-helix	trans	-63.2	-36.6	178.1	-175.8	65.2	0	0	0	113	K365 L368 A369 H416 N417 E418 R424	K365-L420 HydrophobicContact CG-CD1 4.11Å; L368-L420 HydrophobicContact CB-CD1 4.48Å; L368-L420 HydrophobicContact CD2-CB 3.95Å; L368-L420 HydrophobicContact CD2-CD1 4.21Å; L368-L420 HydrophobicContact CG-CB 4.22Å; L368-L420 HydrophobicContact CG-CD1 4.34Å; A369-L420 HydrophobicContact CB-CD1 4.38Å; A369-L420 HydrophobicContact CB-CD2 3.87Å; H416-L420 WeakPolarHBondContact O-CB 3.38Å; H416-L420 PolarHBondContact O-N 2.91Å; N417-L420 PolarHBondContact O-N 3.09Å; E418-L420 PolarHBondContact O-N 2.97Å; L420-R424 WeakPolarHBondContact O-CG 3.28Å; L420-R424 PolarHBondContact O-N 2.96Å
421	M	88.8	Confident	82.8	Confident	85 Å²	85	89 Å²	89	42%	0.419	42%	0.423	S	S	.	.	H	α-helix	trans	-77.8	-23.6	175.3	-67.6	-62.3	-156.6	0	0	113.1	N417 E418 Q419 R425	N417-M421 WeakPolarHBondContact O-CB 3.35Å; N417-M421 VanDerWaalsContact O-CG 3.29Å; N417-M421 WeakPolarHBondContact O-CG 3.37Å; N417-M421 PolarHBondContact O-N 3.32Å; E418-M421 PolarHBondContact O-N 2.89Å; Q419-M421 VanDerWaalsContact C-N 3.33Å; Q419-M421 PolarHBondContact O-N 2.84Å; M421-R425 PolarHBondContact O-N 2.9Å
422	G	87.1	Confident	80.6	Confident	28 Å²	28	88 Å²	88	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-53.9	169.8	0	0	0	0	0	111	E418 Q419 R424 R425 E426	E418-G422 PolarHBondContact O-N 3.41Å; Q419-G422 PolarHBondContact O-N 3.06Å; G422-R424 VanDerWaalsContact C-N 3.34Å; G422-R424 PolarHBondContact O-N 2.84Å; G422-R425 WeakPolarHBondContact O-CB 3.43Å; G422-R425 PolarHBondContact O-N 3.26Å; G422-E426 PolarHBondContact O-N 3.25Å
423	I	85.4	Confident	78.4	Confident	38 Å²	38	92.1 Å²	92.1	20%	0.195	45%	0.452	C	S	.	.	H	α-helix	trans	-54.9	-47.7	178.7	-65.5	162.4	0	0	0	111.2	F364 L368 Q419 R425 E426 E427	F364-I423 HydrophobicContact CD1-CD1 4.32Å; F364-I423 HydrophobicContact CE1-CD1 3.93Å; L368-I423 HydrophobicContact CD2-CD1 4Å; Q419-I423 WeakPolarHBondContact O-CG1 3.32Å; Q419-I423 PolarHBondContact O-N 2.96Å; Q419-I423 VanDerWaalsContact O-N 3.1Å; I423-R425 VanDerWaalsContact C-N 3.3Å; I423-R425 PolarHBondContact O-N 2.79Å; I423-E426 WeakPolarHBondContact O-CB 3.15Å; I423-E426 PolarHBondContact O-N 2.89Å; I423-E426 VanDerWaalsContact O-N 3.14Å; I423-E427 HydrophobicContact CG2-CG 4.49Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.46Å; I423-E427 WeakPolarHBondContact O-CG 3.48Å; I423-E427 PolarHBondContact O-N 3.43Å
424	R	80.9	Confident	76.3	Confident	99 Å²	99	96.2 Å²	96.2	37%	0.374	48%	0.479	S	S	.	.	H	α-helix	trans	-59.8	-36.7	177.4	-73.3	173.1	177.9	169.9	-2.3	113.9	L420 G422 E426 E428	L420-R424 WeakPolarHBondContact O-CG 3.28Å; L420-R424 PolarHBondContact O-N 2.96Å; G422-R424 VanDerWaalsContact C-N 3.34Å; G422-R424 PolarHBondContact O-N 2.84Å; R424-E426 VanDerWaalsContact C-N 3.34Å; R424-E428 WeakPolarHBondContact O-CB 3.45Å; R424-E428 VanDerWaalsContact O-CG 3.26Å; R424-E428 WeakPolarHBondContact O-CG 3.44Å; R424-E428 PolarHBondContact O-N 3.26Å
425	R	81.1	Confident	74.3	Confident	143 Å²	143	100.5 Å²	100.5	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-72.2	-31.7	178.2	-169.2	-172.2	-56.3	123	6.3	111.9	M421 G422 I423 M429	M421-R425 PolarHBondContact O-N 2.9Å; G422-R425 WeakPolarHBondContact O-CB 3.43Å; G422-R425 PolarHBondContact O-N 3.26Å; I423-R425 VanDerWaalsContact C-N 3.3Å; I423-R425 PolarHBondContact O-N 2.79Å; R425-M429 HydrophobicContact CG-CE 3.85Å; R425-M429 VanDerWaalsContact O-CG 3.29Å; R425-M429 WeakPolarHBondContact O-CG 3.33Å; R425-M429 PolarHBondContact O-N 3.01Å
426	E	72.9	Confident	72.3	Confident	126 Å²	126	104 Å²	104	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-66.7	-49.4	174	-159.9	161	-146	0	0	109.5	G422 I423 R424 E428 M429 E430	G422-E426 PolarHBondContact O-N 3.25Å; I423-E426 WeakPolarHBondContact O-CB 3.15Å; I423-E426 PolarHBondContact O-N 2.89Å; I423-E426 VanDerWaalsContact O-N 3.14Å; R424-E426 VanDerWaalsContact C-N 3.34Å; E426-E428 PolarHBondContact O-N 2.89Å; E426-M429 PolarHBondContact O-N 3.27Å; E426-E430 PolarHBondContact O-N 3.49Å
427	E	66.5	Low	70.4	Confident	32 Å²	32	111.3 Å²	111.3	15%	0.15	55%	0.553	C	S	.	*	H	α-helix	trans	-57.1	-45.8	172.8	-64.9	165.2	173.9	0	0	113.1	K365 I423 M429 E430 M431	K365-E427 VanDerWaalsContact CD-OE1 3.3Å; K365-E427 WeakPolarHBondContact CD-OE1 3.48Å; K365-E427 WeakPolarHBondContact CE-OE1 3.2Å; K365-E427 WeakPolarHBondContact CE-OE2 3.42Å; K365-E427 IonicContact NZ-OE1 2.64Å; K365-E427 PolarHBondContact NZ-OE1 2.91Å; K365-E427 IonicContact NZ-OE2 3.81Å; K365-E427 PolarHBondContact NZ-OE2 2.93Å; I423-E427 HydrophobicContact CG2-CG 4.49Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.46Å; I423-E427 WeakPolarHBondContact O-CG 3.48Å; I423-E427 PolarHBondContact O-N 3.43Å; E427-M429 PolarHBondContact O-N 2.96Å; E427-M429 VanDerWaalsContact O-N 3.13Å; E427-E430 PolarHBondContact O-N 3.39Å; E427-M431 VanDerWaalsContact O-CG 3.26Å; E427-M431 WeakPolarHBondContact O-CG 3.35Å; E427-M431 PolarHBondContact O-N 3.25Å; E427-M431 VanDerWaalsContact O-N 3.09Å
428	E	66.3	Low	68	Low	146 Å²	146	115.1 Å²	115.1	68%	0.682	57%	0.574	S	S	*	*	H	α-helix	trans	-61.2	-17.7	176	-78.6	169.7	-171.8	0	0	113.4	R424 E426	R424-E428 WeakPolarHBondContact O-CB 3.45Å; R424-E428 VanDerWaalsContact O-CG 3.26Å; R424-E428 WeakPolarHBondContact O-CG 3.44Å; R424-E428 PolarHBondContact O-N 3.26Å; E426-E428 PolarHBondContact O-N 2.89Å
429	M	62.5	Low	65.5	Low	138 Å²	138	114.7 Å²	114.7	68%	0.68	58%	0.581	S	S	*	*	H	α-helix	trans	-98.8	-28.7	175.3	-68.1	175.4	-178.2	0	0	112.8	R425 E426 E427	R425-M429 HydrophobicContact CG-CE 3.85Å; R425-M429 VanDerWaalsContact O-CG 3.29Å; R425-M429 WeakPolarHBondContact O-CG 3.33Å; R425-M429 PolarHBondContact O-N 3.01Å; E426-M429 PolarHBondContact O-N 3.27Å; E427-M429 PolarHBondContact O-N 2.96Å; E427-M429 VanDerWaalsContact O-N 3.13Å
430	E	60.3	Low	63.5	Low	113 Å²	113	115 Å²	115	53%	0.528	59%	0.591	S	S	.	*	H	α-helix	trans	-70.5	-34.1	173.9	-69.8	-174.9	151.7	0	0	111.9	K361 E426 E427 S432	K361-E430 IonicContact NZ-OE2 2.59Å; K361-E430 PolarHBondContact NZ-OE2 2.89Å; E426-E430 PolarHBondContact O-N 3.49Å; E427-E430 PolarHBondContact O-N 3.39Å; E430-S432 PolarHBondContact O-N 3.34Å; E430-S432 VanDerWaalsContact O-N 3.16Å
431	M	50.5	Low	61.1	Low	155 Å²	155	122.4 Å²	122.4	76%	0.764	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	2.5	-176.7	-68.9	-72.9	-61.4	0	0	115.9	E427	E427-M431 VanDerWaalsContact O-CG 3.26Å; E427-M431 WeakPolarHBondContact O-CG 3.35Å; E427-M431 PolarHBondContact O-N 3.25Å; E427-M431 VanDerWaalsContact O-N 3.09Å
432	S	49.2	Very low	58.8	Low	103 Å²	103	123.6 Å²	123.6	72%	0.72	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-2.7	-169.3	-170.5	0	0	0	0	115.6	E430	E430-S432 PolarHBondContact O-N 3.34Å; E430-S432 VanDerWaalsContact O-N 3.16Å
433	D	47.8	Very low	56.8	Low	152 Å²	152	130.4 Å²	130.4	81%	0.813	67%	0.668	S	S	*	*	S	Bend	trans	-116.4	-6.2	-170.3	-145.5	26.5	0	0	0	113.5
434	D	50.8	Low	54.6	Low	147 Å²	147	135.3 Å²	135.3	79%	0.786	70%	0.695	S	S	*	*			trans	-87.2	-11.6	-166.7	-144.6	37.4	0	0	0	114.1	M436	D434-M436 PolarHBondContact O-N 3.23Å; D434-M436 VanDerWaalsContact O-N 3.17Å
435	D	51.5	Low	52.7	Low	169 Å²	169	135.7 Å²	135.7	90%	0.904	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	12	-175.2	-103.4	-15.8	0	0	0	114.4
436	M	53.5	Low	51	Low	165 Å²	165	138.5 Å²	138.5	81%	0.813	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	-10	-168.5	-86.1	-68.9	-59.5	0	0	117.7	D434	D434-M436 PolarHBondContact O-N 3.23Å; D434-M436 VanDerWaalsContact O-N 3.17Å
437	E	52.5	Low	49.8	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	74%	0.735	S	S	*	*	S	Bend	trans	-139.2	75.9	177.9	-72.3	-159.6	178.1	0	0	115.2
438	D	42.9	Very low	48.9	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	76%	0.756	S	S	*	*				-157.8	128.2	126.6	-146.8	-16.7	0	0	0	113.1
439	V	40.2	Very low	48.1	Very low	138 Å²	138	136.6 Å²	136.6	84%	0.836	75%	0.752	S	S	*	*			trans	-137.7	93	166	-179.2	0	0	0	0	107.5	D441	V439-D441 PolarHBondContact O-N 3.4Å; V439-D441 VanDerWaalsContact O-N 3.16Å
440	P	49.9	Very low	47.7	Very low	97 Å²	97	133.9 Å²	133.9	63%	0.63	74%	0.743	S	S	*	*			trans	-75.2	108.1	-173.4	27.4	-34	0	0	0	111.8	S442	P440-S442 PolarHBondContact O-N 3.37Å
441	D	43.3	Very low	47.5	Very low	162 Å²	162	132.1 Å²	132.1	87%	0.866	74%	0.743	S	S	*	*			trans	-59.8	101.5	170.9	-179.6	21.6	0	0	0	110.7	V439	V439-D441 PolarHBondContact O-N 3.4Å; V439-D441 VanDerWaalsContact O-N 3.16Å
442	S	39.6	Very low	48	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	74%	0.735	S	S	*	*			trans	-145.1	146.7	169	65.2	0	0	0	0	109.9	P440	P440-S442 PolarHBondContact O-N 3.37Å
443	K	45.5	Very low	48.9	Very low	171 Å²	171	128.8 Å²	128.8	74%	0.743	72%	0.724	S	S	*	*			trans	-135.2	143.9	-153.2	-173.6	-163.8	166.9	-167.4	0	112.1
444	D	38.7	Very low	49.9	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	71%	0.712	S	S	*	*			trans	109.4	159.8	164.6	-62.1	-37.9	0	0	0	116.1
445	S	41.3	Very low	51	Low	106 Å²	106	122.9 Å²	122.9	74%	0.741	70%	0.697	S	S	*	*			trans	86.9	58.3	176	-160.3	0	0	0	0	119.7	D447	S445-D447 PolarHBondContact O-N 3.28Å
446	E	46.1	Very low	52	Low	203 Å²	203	119.5 Å²	119.5	95%	0.949	68%	0.678	S	S	*	*	S	Bend		52.7	18.2	129	-54.1	-160.5	131.3	0	0	122.7
447	D	47.7	Very low	53.3	Low	122 Å²	122	117.9 Å²	117.9	65%	0.652	67%	0.667	S	S	*	*			trans	-114.3	-1.9	168.3	-156.2	26.3	0	0	0	114.1	S445 G449 V450	S445-D447 PolarHBondContact O-N 3.28Å; D447-G449 PolarHBondContact O-N 2.83Å; D447-V450 PolarHBondContact O-N 3.28Å
448	S	46.8	Very low	54.6	Low	84 Å²	84	115.8 Å²	115.8	59%	0.587	66%	0.657	S	S	*	*	H	α-helix	trans	-59.4	-21.5	-172.7	-179.2	0	0	0	0	115.4	V450 Q452	S448-V450 VanDerWaalsContact C-N 3.33Å; S448-V450 PolarHBondContact O-N 3.34Å; S448-Q452 WeakPolarHBondContact O-CB 3.34Å; S448-Q452 PolarHBondContact O-N 3.46Å
449	G	48.6	Very low	56.4	Low	57 Å²	57	114.2 Å²	114.2	59%	0.588	65%	0.645	S	S	*	*	H	α-helix	trans	-66.5	-28.3	-175.9	0	0	0	0	0	114.7	D447 A453	D447-G449 PolarHBondContact O-N 2.83Å; G449-A453 WeakPolarHBondContact O-CB 3.5Å; G449-A453 PolarHBondContact O-N 3.19Å
450	V	54.3	Low	58.5	Low	82 Å²	82	111.2 Å²	111.2	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-77	-52.6	177.4	-176.4	0	0	0	0	110	D447 S448 Q452 A453 E454	D447-V450 PolarHBondContact O-N 3.28Å; S448-V450 VanDerWaalsContact C-N 3.33Å; S448-V450 PolarHBondContact O-N 3.34Å; V450-Q452 VanDerWaalsContact C-N 3.31Å; V450-Q452 PolarHBondContact O-N 3.05Å; V450-A453 WeakPolarHBondContact O-CA 3.27Å; V450-A453 WeakPolarHBondContact O-CB 3.48Å; V450-A453 PolarHBondContact O-N 3.46Å; V450-E454 PolarHBondContact O-N 2.83Å
451	S	57.5	Low	60.3	Low	75 Å²	75	109.5 Å²	109.5	52%	0.524	61%	0.61	S	S	.	*	H	α-helix	trans	-62.6	-34.5	-179.4	-49.5	0	0	0	0	113.1	E454 A455	S451-E454 PolarHBondContact O-N 3.42Å; S451-A455 WeakPolarHBondContact O-CB 3.46Å; S451-A455 PolarHBondContact O-N 3.49Å
452	Q	60.3	Low	62.4	Low	127 Å²	127	105.4 Å²	105.4	59%	0.593	59%	0.594	S	S	*	*	H	α-helix	trans	-67.8	-36.3	173.1	-178.1	167	83.7	0	0	112.2	S448 V450 L456	S448-Q452 WeakPolarHBondContact O-CB 3.34Å; S448-Q452 PolarHBondContact O-N 3.46Å; V450-Q452 VanDerWaalsContact C-N 3.31Å; V450-Q452 PolarHBondContact O-N 3.05Å; Q452-L456 HydrophobicContact CG-CD1 3.98Å; Q452-L456 HydrophobicContact CG-CG 4.49Å; Q452-L456 WeakPolarHBondContact O-CB 3.35Å; Q452-L456 VanDerWaalsContact O-CG 3.25Å; Q452-L456 WeakPolarHBondContact O-CG 3.27Å; Q452-L456 PolarHBondContact O-N 2.92Å
453	A	67.6	Low	64.6	Low	61 Å²	61	103.7 Å²	103.7	50%	0.504	58%	0.576	S	S	.	*	H	α-helix	trans	-70.4	-32.8	174.9	0	0	0	0	0	112.4	G449 V450 K457	G449-A453 WeakPolarHBondContact O-CB 3.5Å; G449-A453 PolarHBondContact O-N 3.19Å; V450-A453 WeakPolarHBondContact O-CA 3.27Å; V450-A453 WeakPolarHBondContact O-CB 3.48Å; V450-A453 PolarHBondContact O-N 3.46Å; A453-K457 VanDerWaalsContact O-CB 3.22Å; A453-K457 WeakPolarHBondContact O-CB 3.47Å; A453-K457 PolarHBondContact O-N 3.2Å; A453-K457 VanDerWaalsContact O-N 3.1Å
454	E	69.4	Low	66.5	Low	119 Å²	119	102 Å²	102	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-73.3	-43.8	174.8	-69.2	-172.9	134.7	0	0	112.1	V450 S451 K457 E458	V450-E454 PolarHBondContact O-N 2.83Å; S451-E454 PolarHBondContact O-N 3.42Å; E454-K457 WeakPolarHBondContact O-CB 3.36Å; E454-K457 PolarHBondContact O-N 2.91Å; E454-K457 VanDerWaalsContact O-N 3.14Å; E454-E458 PolarHBondContact O-N 3.4Å
455	A	73.3	Confident	68.8	Low	56 Å²	56	99.7 Å²	99.7	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-61.2	-45.4	174.3	0	0	0	0	0	112.3	S451 K457 E458 E459	S451-A455 WeakPolarHBondContact O-CB 3.46Å; S451-A455 PolarHBondContact O-N 3.49Å; A455-K457 PolarHBondContact O-N 3.41Å; A455-E458 PolarHBondContact O-N 2.88Å; A455-E459 WeakPolarHBondContact O-CB 3.48Å; A455-E459 PolarHBondContact O-N 3.12Å
456	L	73.3	Confident	70.6	Confident	99 Å²	99	99.3 Å²	99.3	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-26.3	175.3	-72.9	170.5	0	0	0	112.8	Q452 N460	Q452-L456 HydrophobicContact CG-CD1 3.98Å; Q452-L456 HydrophobicContact CG-CG 4.49Å; Q452-L456 WeakPolarHBondContact O-CB 3.35Å; Q452-L456 VanDerWaalsContact O-CG 3.25Å; Q452-L456 WeakPolarHBondContact O-CG 3.27Å; Q452-L456 PolarHBondContact O-N 2.92Å; L456-N460 WeakPolarHBondContact O-CB 3.43Å; L456-N460 PolarHBondContact O-N 2.92Å
457	K	81.3	Confident	72.5	Confident	130 Å²	130	95.2 Å²	95.2	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-75.5	-42.8	173.5	177.1	-165.6	165.1	-148.5	0	111.1	A453 E454 A455 N460 D461	A453-K457 VanDerWaalsContact O-CB 3.22Å; A453-K457 WeakPolarHBondContact O-CB 3.47Å; A453-K457 PolarHBondContact O-N 3.2Å; A453-K457 VanDerWaalsContact O-N 3.1Å; E454-K457 WeakPolarHBondContact O-CB 3.36Å; E454-K457 PolarHBondContact O-N 2.91Å; E454-K457 VanDerWaalsContact O-N 3.14Å; A455-K457 PolarHBondContact O-N 3.41Å; K457-N460 PolarHBondContact O-N 3.39Å; K457-N460 VanDerWaalsContact O-N 3.15Å; K457-D461 PolarHBondContact O-N 3.4Å
458	E	79.4	Confident	74.2	Confident	148 Å²	148	93.2 Å²	93.2	69%	0.692	52%	0.518	S	S	*	.	H	α-helix	trans	-63.2	-41.7	174.6	-176.3	165.4	-150.7	0	0	111.3	E454 A455 N460 D461 S462	E454-E458 PolarHBondContact O-N 3.4Å; A455-E458 PolarHBondContact O-N 2.88Å; E458-N460 VanDerWaalsContact C-N 3.35Å; E458-N460 PolarHBondContact O-N 2.88Å; E458-D461 PolarHBondContact O-N 3.42Å; E458-S462 VanDerWaalsContact O-CB 3.22Å; E458-S462 WeakPolarHBondContact O-CB 3.36Å; E458-S462 PolarHBondContact O-N 3.44Å
459	E	79.6	Confident	75.9	Confident	110 Å²	110	91.9 Å²	91.9	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-59.9	-42.9	169.3	-169.3	-174.7	-179.9	0	0	111.3	A455 S462 L463	A455-E459 WeakPolarHBondContact O-CB 3.48Å; A455-E459 PolarHBondContact O-N 3.12Å; E459-S462 PolarHBondContact O-N 2.88Å; E459-L463 HydrophobicContact CG-CD1 4.06Å; E459-L463 WeakPolarHBondContact O-CB 3.36Å; E459-L463 VanDerWaalsContact O-CG 3.24Å; E459-L463 WeakPolarHBondContact O-CG 3.2Å; E459-L463 PolarHBondContact O-N 2.98Å
460	N	84.3	Confident	77.6	Confident	75 Å²	75	95.2 Å²	95.2	40%	0.401	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-39.3	178.2	-154.8	-109.9	0	0	0	113.1	L456 K457 E458 R464	L456-N460 WeakPolarHBondContact O-CB 3.43Å; L456-N460 PolarHBondContact O-N 2.92Å; K457-N460 PolarHBondContact O-N 3.39Å; K457-N460 VanDerWaalsContact O-N 3.15Å; E458-N460 VanDerWaalsContact C-N 3.35Å; E458-N460 PolarHBondContact O-N 2.88Å; N460-R464 WeakPolarHBondContact O-CB 3.35Å; N460-R464 WeakPolarHBondContact O-CD 3.06Å; N460-R464 WeakPolarHBondContact O-CG 3.3Å; N460-R464 PolarHBondContact O-N 3.02Å; N460-R464 PolarHBondContact OD1-NE 3.4Å; N460-R464 VanDerWaalsContact OD1-NE 3.1Å; N460-R464 PolarHBondContact OD1-NH2 2.89Å
461	D	87.9	Confident	79.1	Confident	62 Å²	62	98.8 Å²	98.8	33%	0.332	51%	0.513	S	S	.	.	H	α-helix	trans	-73.6	-33.4	177	-74.6	-30.3	0	0	0	111.6	K457 E458 R464 C465	K457-D461 PolarHBondContact O-N 3.4Å; E458-D461 PolarHBondContact O-N 3.42Å; D461-R464 WeakPolarHBondContact O-CB 3.44Å; D461-R464 PolarHBondContact O-N 2.71Å; D461-R464 WeakPolarHBondContact OD1-CD 3.47Å; D461-R464 IonicContact OD1-CZ 3.48Å; D461-R464 IonicContact OD1-NE 2.68Å; D461-R464 IonicContact OD1-NH1 3.98Å; D461-R464 PolarHBondContact OD1-NH1 3.09Å; D461-C465 PolarHBondContact O-N 3.42Å; D461-C465 PolarHBondContact O-SG 3.34Å
462	S	87.3	Confident	80.2	Confident	75 Å²	75	100.5 Å²	100.5	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-49.3	168.9	-176.6	0	0	0	0	111.9	E458 E459 R464 C465 Q466	E458-S462 VanDerWaalsContact O-CB 3.22Å; E458-S462 WeakPolarHBondContact O-CB 3.36Å; E458-S462 PolarHBondContact O-N 3.44Å; E459-S462 PolarHBondContact O-N 2.88Å; S462-R464 VanDerWaalsContact C-N 3.28Å; S462-R464 PolarHBondContact O-N 3.34Å; S462-C465 WeakPolarHBondContact O-CB 3.09Å; S462-C465 PolarHBondContact O-N 2.91Å; S462-C465 VanDerWaalsContact O-N 3.16Å; S462-Q466 PolarHBondContact O-N 3.19Å
463	L	87.6	Confident	81.2	Confident	74 Å²	74	99.4 Å²	99.4	39%	0.387	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-32.8	175.2	-72.8	168.9	0	0	0	112.4	E459 L467	E459-L463 HydrophobicContact CG-CD1 4.06Å; E459-L463 WeakPolarHBondContact O-CB 3.36Å; E459-L463 VanDerWaalsContact O-CG 3.24Å; E459-L463 WeakPolarHBondContact O-CG 3.2Å; E459-L463 PolarHBondContact O-N 2.98Å; L463-L467 VanDerWaalsContact O-CB 3.32Å; L463-L467 WeakPolarHBondContact O-CB 3.47Å; L463-L467 VanDerWaalsContact O-CG 3.24Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.2Å
464	R	85.4	Confident	81.7	Confident	136 Å²	136	99.9 Å²	99.9	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-48.7	170.8	-76.3	164.3	-174	174.6	1.4	111.7	N460 D461 S462 Q466 L467 D468	N460-R464 WeakPolarHBondContact O-CB 3.35Å; N460-R464 WeakPolarHBondContact O-CD 3.06Å; N460-R464 WeakPolarHBondContact O-CG 3.3Å; N460-R464 PolarHBondContact O-N 3.02Å; N460-R464 PolarHBondContact OD1-NE 3.4Å; N460-R464 VanDerWaalsContact OD1-NE 3.1Å; N460-R464 PolarHBondContact OD1-NH2 2.89Å; D461-R464 WeakPolarHBondContact O-CB 3.44Å; D461-R464 PolarHBondContact O-N 2.71Å; D461-R464 WeakPolarHBondContact OD1-CD 3.47Å; D461-R464 IonicContact OD1-CZ 3.48Å; D461-R464 IonicContact OD1-NE 2.68Å; D461-R464 IonicContact OD1-NH1 3.98Å; D461-R464 PolarHBondContact OD1-NH1 3.09Å; S462-R464 VanDerWaalsContact C-N 3.28Å; S462-R464 PolarHBondContact O-N 3.34Å; R464-Q466 VanDerWaalsContact C-N 3.27Å; R464-Q466 PolarHBondContact O-N 3.44Å; R464-L467 PolarHBondContact O-N 3.42Å; R464-D468 PolarHBondContact O-N 2.99Å
465	C	85	Confident	82.2	Confident	93 Å²	93	99 Å²	99	63%	0.628	50%	0.503	S	S	*	.	H	α-helix	trans	-58.8	-39.6	175.5	-74.3	0	0	0	0	111.9	D461 S462 A469	D461-C465 PolarHBondContact O-N 3.42Å; D461-C465 PolarHBondContact O-SG 3.34Å; S462-C465 WeakPolarHBondContact O-CB 3.09Å; S462-C465 PolarHBondContact O-N 2.91Å; S462-C465 VanDerWaalsContact O-N 3.16Å; C465-A469 WeakPolarHBondContact O-CB 3.42Å; C465-A469 PolarHBondContact O-N 3.16Å
466	Q	80.3	Confident	82.1	Confident	97 Å²	97	101.6 Å²	101.6	45%	0.453	51%	0.509	S	S	.	.	H	α-helix	trans	-68.7	-39.7	176.3	-160.2	179.2	37.3	0	0	112.3	S462 R464 A469 Y470	S462-Q466 PolarHBondContact O-N 3.19Å; R464-Q466 VanDerWaalsContact C-N 3.27Å; R464-Q466 PolarHBondContact O-N 3.44Å; Q466-A469 WeakPolarHBondContact O-CB 3.27Å; Q466-A469 PolarHBondContact O-N 2.84Å; Q466-Y470 HydrophobicContact CG-CD2 4.19Å; Q466-Y470 HydrophobicContact CG-CE2 3.75Å; Q466-Y470 WeakPolarHBondContact O-CD2 3.48Å; Q466-Y470 PolarHBondContact O-N 3.12Å
467	L	85.7	Confident	81.8	Confident	117 Å²	117	100.7 Å²	100.7	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-39.3	174.7	-77.2	169	0	0	0	112.8	L463 R464 A469 Y470 R471	L463-L467 VanDerWaalsContact O-CB 3.32Å; L463-L467 WeakPolarHBondContact O-CB 3.47Å; L463-L467 VanDerWaalsContact O-CG 3.24Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.2Å; R464-L467 PolarHBondContact O-N 3.42Å; L467-A469 VanDerWaalsContact C-N 3.35Å; L467-Y470 PolarHBondContact O-N 2.8Å; L467-R471 WeakPolarHBondContact O-CB 3.2Å; L467-R471 PolarHBondContact O-N 3.4Å
468	D	84.4	Confident	81.3	Confident	80 Å²	80	100.3 Å²	100.3	43%	0.428	50%	0.502	S	S	.	.	H	α-helix	trans	-72.8	-27.4	173.9	-86.1	-28.9	0	0	0	112	R464 R471 N472	R464-D468 PolarHBondContact O-N 2.99Å; D468-R471 PolarHBondContact O-N 3.05Å; D468-R471 WeakPolarHBondContact OD1-CD 3.26Å; D468-R471 IonicContact OD1-NH1 3.93Å; D468-R471 PolarHBondContact OD1-NH1 3.46Å; D468-N472 WeakPolarHBondContact O-CB 3.47Å; D468-N472 VanDerWaalsContact O-CG 3.24Å; D468-N472 PolarHBondContact O-N 3.05Å; D468-N472 PolarHBondContact O-ND2 3.11Å
469	A	82.4	Confident	80.5	Confident	56 Å²	56	98.8 Å²	98.8	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-52.7	167.9	0	0	0	0	0	111.4	C465 Q466 L467 R471 N472 E473	C465-A469 WeakPolarHBondContact O-CB 3.42Å; C465-A469 PolarHBondContact O-N 3.16Å; Q466-A469 WeakPolarHBondContact O-CB 3.27Å; Q466-A469 PolarHBondContact O-N 2.84Å; L467-A469 VanDerWaalsContact C-N 3.35Å; A469-R471 VanDerWaalsContact C-N 3.25Å; A469-R471 PolarHBondContact O-N 3.1Å; A469-N472 PolarHBondContact O-N 3.38Å; A469-E473 PolarHBondContact O-N 2.82Å
470	Y	83.3	Confident	79.4	Confident	128 Å²	128	99.9 Å²	99.9	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-32.4	174.3	-72.4	-50	0	0	0	112.8	Q466 L467 E473 V474	Q466-Y470 HydrophobicContact CG-CD2 4.19Å; Q466-Y470 HydrophobicContact CG-CE2 3.75Å; Q466-Y470 WeakPolarHBondContact O-CD2 3.48Å; Q466-Y470 PolarHBondContact O-N 3.12Å; L467-Y470 PolarHBondContact O-N 2.8Å; Y470-E473 WeakPolarHBondContact CD1-OE2 3.43Å; Y470-E473 PolarHBondContact O-N 3.18Å; Y470-V474 WeakPolarHBondContact O-CB 3.29Å; Y470-V474 VanDerWaalsContact O-CG2 3.28Å; Y470-V474 WeakPolarHBondContact O-CG2 3.39Å; Y470-V474 PolarHBondContact O-N 3.33Å
471	R	86.3	Confident	77.8	Confident	156 Å²	156	103.4 Å²	103.4	59%	0.589	51%	0.514	S	S	*	.	H	α-helix	trans	-65.8	-45.7	173.9	-173.5	-176.7	-174.1	171.1	3.1	111.5	L467 D468 A469 E473 V474 E475	L467-R471 WeakPolarHBondContact O-CB 3.2Å; L467-R471 PolarHBondContact O-N 3.4Å; D468-R471 PolarHBondContact O-N 3.05Å; D468-R471 WeakPolarHBondContact OD1-CD 3.26Å; D468-R471 IonicContact OD1-NH1 3.93Å; D468-R471 PolarHBondContact OD1-NH1 3.46Å; A469-R471 VanDerWaalsContact C-N 3.25Å; A469-R471 PolarHBondContact O-N 3.1Å; R471-E473 VanDerWaalsContact C-N 3.34Å; R471-V474 PolarHBondContact O-N 3.14Å; R471-E475 WeakPolarHBondContact O-CB 3.26Å; R471-E475 PolarHBondContact O-N 3.48Å
472	N	81.1	Confident	75.9	Confident	111 Å²	111	103.6 Å²	103.6	59%	0.594	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-39.4	175.1	-75.2	-38.6	0	0	0	111.6	D468 A469 E475 L476	D468-N472 WeakPolarHBondContact O-CB 3.47Å; D468-N472 VanDerWaalsContact O-CG 3.24Å; D468-N472 PolarHBondContact O-N 3.05Å; D468-N472 PolarHBondContact O-ND2 3.11Å; A469-N472 PolarHBondContact O-N 3.38Å; N472-E475 PolarHBondContact O-N 3.03Å; N472-L476 VanDerWaalsContact O-CB 3.3Å; N472-L476 WeakPolarHBondContact O-CB 3.43Å; N472-L476 PolarHBondContact O-N 3.33Å
473	E	80.1	Confident	73.9	Confident	104 Å²	104	107.1 Å²	107.1	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-43.8	173.7	-171.7	176.7	-160.9	0	0	111.6	A469 Y470 R471 L476 L477	A469-E473 PolarHBondContact O-N 2.82Å; Y470-E473 WeakPolarHBondContact CD1-OE2 3.43Å; Y470-E473 PolarHBondContact O-N 3.18Å; R471-E473 VanDerWaalsContact C-N 3.34Å; E473-L476 WeakPolarHBondContact O-CB 3.47Å; E473-L476 PolarHBondContact O-N 2.94Å; E473-L477 HydrophobicContact CG-CD1 4.2Å; E473-L477 WeakPolarHBondContact O-CB 3.38Å; E473-L477 VanDerWaalsContact O-CG 3.26Å; E473-L477 WeakPolarHBondContact O-CG 3.48Å; E473-L477 PolarHBondContact O-N 2.76Å
474	V	79	Confident	72.1	Confident	71 Å²	71	110.3 Å²	110.3	43%	0.43	55%	0.554	S	S	.	*	H	α-helix	trans	-67.8	-34.2	174.4	167.6	0	0	0	0	112.5	Y470 R471 K478	Y470-V474 WeakPolarHBondContact O-CB 3.29Å; Y470-V474 VanDerWaalsContact O-CG2 3.28Å; Y470-V474 WeakPolarHBondContact O-CG2 3.39Å; Y470-V474 PolarHBondContact O-N 3.33Å; R471-V474 PolarHBondContact O-N 3.14Å; V474-K478 HydrophobicContact CG1-CD 4.36Å; V474-K478 WeakPolarHBondContact O-CB 3.31Å; V474-K478 VanDerWaalsContact O-CG 3.23Å; V474-K478 WeakPolarHBondContact O-CG 3.49Å; V474-K478 PolarHBondContact O-N 2.96Å
475	E	79.9	Confident	69.9	Low	100 Å²	100	112.6 Å²	112.6	47%	0.467	57%	0.571	S	S	.	*	H	α-helix	trans	-68.7	-37.8	173.7	-146.3	73.2	-104.6	0	0	111	R471 N472 K478 Q479	R471-E475 WeakPolarHBondContact O-CB 3.26Å; R471-E475 PolarHBondContact O-N 3.48Å; N472-E475 PolarHBondContact O-N 3.03Å; E475-K478 PolarHBondContact O-N 2.94Å; E475-K478 IonicContact OE1-NZ 2.68Å; E475-Q479 WeakPolarHBondContact O-CB 3.35Å; E475-Q479 PolarHBondContact O-N 3.42Å
476	L	70.4	Confident	68.4	Low	112 Å²	112	113.8 Å²	113.8	59%	0.586	58%	0.577	S	S	*	*	H	α-helix	trans	-65.3	-49.5	174	-172.3	69.2	0	0	0	111.2	N472 E473 K478 Q479 E480	N472-L476 VanDerWaalsContact O-CB 3.3Å; N472-L476 WeakPolarHBondContact O-CB 3.43Å; N472-L476 PolarHBondContact O-N 3.33Å; E473-L476 WeakPolarHBondContact O-CB 3.47Å; E473-L476 PolarHBondContact O-N 2.94Å; L476-K478 VanDerWaalsContact C-N 3.29Å; L476-K478 PolarHBondContact O-N 3.42Å; L476-Q479 CarbonylContact O-C 3.57Å; L476-Q479 WeakPolarHBondContact O-CA 3.42Å; L476-Q479 WeakPolarHBondContact O-CB 3.39Å; L476-Q479 PolarHBondContact O-N 3.19Å; L476-E480 WeakPolarHBondContact O-CB 3.21Å; L476-E480 PolarHBondContact O-N 3.47Å
477	L	67.7	Low	66.3	Low	80 Å²	80	115.9 Å²	115.9	42%	0.419	60%	0.597	S	S	.	*	H	α-helix	trans	-61.4	-34.5	176.5	-71.8	166.4	0	0	0	112.3	E473 Q481	E473-L477 HydrophobicContact CG-CD1 4.2Å; E473-L477 WeakPolarHBondContact O-CB 3.38Å; E473-L477 VanDerWaalsContact O-CG 3.26Å; E473-L477 WeakPolarHBondContact O-CG 3.48Å; E473-L477 PolarHBondContact O-N 2.76Å; L477-Q481 WeakPolarHBondContact O-CB 3.45Å; L477-Q481 WeakPolarHBondContact O-CG 3.32Å; L477-Q481 PolarHBondContact O-N 3.47Å
478	K	69.9	Low	64.7	Low	121 Å²	121	122.1 Å²	122.1	53%	0.526	61%	0.612	S	S	.	*	H	α-helix	trans	-68.4	-41	170	-75.8	169.2	-174.1	167.9	0	112.4	V474 E475 L476 E480 G482	V474-K478 HydrophobicContact CG1-CD 4.36Å; V474-K478 WeakPolarHBondContact O-CB 3.31Å; V474-K478 VanDerWaalsContact O-CG 3.23Å; V474-K478 WeakPolarHBondContact O-CG 3.49Å; V474-K478 PolarHBondContact O-N 2.96Å; E475-K478 PolarHBondContact O-N 2.94Å; E475-K478 IonicContact OE1-NZ 2.68Å; L476-K478 VanDerWaalsContact C-N 3.29Å; L476-K478 PolarHBondContact O-N 3.42Å; K478-E480 VanDerWaalsContact C-N 3.26Å; K478-E480 PolarHBondContact O-N 3.07Å; K478-G482 PolarHBondContact O-N 2.95Å
479	Q	63	Low	63.3	Low	117 Å²	117	122.7 Å²	122.7	55%	0.547	62%	0.623	S	S	.	*	H	α-helix	trans	-66.6	-30.5	177.5	-171.7	178.1	97.8	0	0	112	E475 L476 K483	E475-Q479 WeakPolarHBondContact O-CB 3.35Å; E475-Q479 PolarHBondContact O-N 3.42Å; L476-Q479 CarbonylContact O-C 3.57Å; L476-Q479 WeakPolarHBondContact O-CA 3.42Å; L476-Q479 WeakPolarHBondContact O-CB 3.39Å; L476-Q479 PolarHBondContact O-N 3.19Å; Q479-K483 WeakPolarHBondContact O-CD 3.44Å; Q479-K483 WeakPolarHBondContact O-CG 3.28Å
480	E	56	Low	61.8	Low	133 Å²	133	127.8 Å²	127.8	62%	0.621	64%	0.637	S	S	*	*	H	α-helix	trans	-74.2	-53	174.6	-170.2	171.4	-129.1	0	0	111.4	L476 K478 G482 K483	L476-E480 WeakPolarHBondContact O-CB 3.21Å; L476-E480 PolarHBondContact O-N 3.47Å; K478-E480 VanDerWaalsContact C-N 3.26Å; K478-E480 PolarHBondContact O-N 3.07Å; E480-G482 PolarHBondContact O-N 3.38Å; E480-K483 PolarHBondContact O-N 3.39Å; E480-K483 VanDerWaalsContact O-N 3.09Å
481	Q	51.5	Low	60.2	Low	148 Å²	148	128.9 Å²	128.9	69%	0.692	65%	0.646	S	S	*	*	H	α-helix	trans	-59.5	-32.3	175.4	-72.6	-176.4	14.6	0	0	112.9	L477 K483 N484	L477-Q481 WeakPolarHBondContact O-CB 3.45Å; L477-Q481 WeakPolarHBondContact O-CG 3.32Å; L477-Q481 PolarHBondContact O-N 3.47Å; Q481-K483 PolarHBondContact O-N 2.92Å; Q481-N484 PolarHBondContact O-ND2 2.85Å
482	G	47.8	Very low	58.7	Low	67 Å²	67	128.5 Å²	128.5	69%	0.691	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-4	177	0	0	0	0	0	116.1	K478 E480	K478-G482 PolarHBondContact O-N 2.95Å; E480-G482 PolarHBondContact O-N 3.38Å
483	K	44.3	Very low	57.4	Low	149 Å²	149	127.1 Å²	127.1	65%	0.648	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	32.8	-173.8	-74.6	178.6	-179.6	172.1	0	115	Q479 E480 Q481 Q485	Q479-K483 WeakPolarHBondContact O-CD 3.44Å; Q479-K483 WeakPolarHBondContact O-CG 3.28Å; E480-K483 PolarHBondContact O-N 3.39Å; E480-K483 VanDerWaalsContact O-N 3.09Å; Q481-K483 PolarHBondContact O-N 2.92Å; K483-Q485 PolarHBondContact O-N 3.14Å; K483-Q485 VanDerWaalsContact O-N 3.12Å
484	N	50.7	Low	56.6	Low	140 Å²	140	125.5 Å²	125.5	75%	0.749	65%	0.649	S	S	*	*			trans	-78.6	88.2	174.1	-85.5	-74.3	0	0	0	113.4	Q481	Q481-N484 PolarHBondContact O-ND2 2.85Å
485	Q	38.6	Very low	55.8	Low	185 Å²	185	127.6 Å²	127.6	86%	0.864	65%	0.654	S	S	*	*	S	Bend	trans	-171.9	160.5	143.2	-105.3	-175.4	28.8	0	0	112.2	K483	K483-Q485 PolarHBondContact O-N 3.14Å; K483-Q485 VanDerWaalsContact O-N 3.12Å
486	P	55	Low	55.2	Low	117 Å²	117	126.7 Å²	126.7	76%	0.76	66%	0.659	S	S	*	*			trans	-94.2	134.6	-146.5	34.3	-37.9	0	0	0	116.8
487	V	35.2	Very low	55.4	Low	142 Å²	142	126.7 Å²	126.7	86%	0.861	66%	0.656	S	S	*	*			trans	-136.1	137.1	154.1	-178.4	0	0	0	0	108.3
488	R	52.4	Low	55.6	Low	247 Å²	247	128.7 Å²	128.7	93%	0.932	66%	0.663	S	S	*	*			trans	-87.1	134.9	177.1	-68.2	168.5	164.9	165.4	-7.6	111
489	S	54.8	Low	55.7	Low	93 Å²	93	128.4 Å²	128.4	65%	0.65	67%	0.666	S	S	*	*			trans	-164.4	118.1	152.7	50	0	0	0	0	113.5	E491	S489-E491 VanDerWaalsContact C-N 3.33Å; S489-E491 PolarHBondContact O-N 3.36Å
490	E	50.6	Low	56.4	Low	163 Å²	163	125.6 Å²	125.6	76%	0.762	66%	0.66	S	S	*	*	S	Bend	trans	62.9	-39.9	148.8	-54.7	-171.9	179.2	0	0	120.8	T493 T494	E490-T493 VanDerWaalsContact C-OG1 3.31Å; E490-T493 WeakPolarHBondContact CA-OG1 3.45Å; E490-T493 PolarHBondContact O-N 2.88Å; E490-T493 PolarHBondContact O-OG1 3.17Å; E490-T494 PolarHBondContact O-N 3.17Å
491	E	50.8	Low	57.6	Low	150 Å²	150	125.6 Å²	125.6	70%	0.701	66%	0.658	S	S	*	*	H	α-helix	trans	-73	-36	-173.5	-66.5	-177.4	134.7	0	0	113.9	S489 T493 T494 H495	S489-E491 VanDerWaalsContact C-N 3.33Å; S489-E491 PolarHBondContact O-N 3.36Å; E491-T493 PolarHBondContact O-N 2.9Å; E491-T494 PolarHBondContact O-N 2.71Å; E491-T494 PolarHBondContact O-OG1 2.93Å; E491-H495 PolarHBondContact O-N 3.01Å
492	D	53	Low	58.9	Low	149 Å²	149	124.2 Å²	124.2	80%	0.797	66%	0.655	S	S	*	*	H	α-helix	trans	-56.3	-38	170.8	-95.6	-31.4	0	0	0	111.7	S496	D492-S496 WeakPolarHBondContact O-CB 3.4Å; D492-S496 PolarHBondContact O-N 3.43Å
493	T	54	Low	60.3	Low	81 Å²	81	125.4 Å²	125.4	50%	0.497	64%	0.642	S	S	.	*	H	α-helix	trans	-70.6	-36.2	-179.3	15.7	0	0	0	0	112.7	E490 E491 Q497	E490-T493 VanDerWaalsContact C-OG1 3.31Å; E490-T493 WeakPolarHBondContact CA-OG1 3.45Å; E490-T493 PolarHBondContact O-N 2.88Å; E490-T493 PolarHBondContact O-OG1 3.17Å; E491-T493 PolarHBondContact O-N 2.9Å; T493-Q497 WeakPolarHBondContact O-CB 3.44Å; T493-Q497 VanDerWaalsContact O-CG 3.23Å; T493-Q497 WeakPolarHBondContact O-CG 3.38Å; T493-Q497 PolarHBondContact O-N 3.18Å; T493-Q497 VanDerWaalsContact O-N 3.08Å
494	T	64.6	Low	62.1	Low	71 Å²	71	124.6 Å²	124.6	44%	0.436	64%	0.641	S	S	.	*	H	α-helix	trans	-75.1	-42.2	177.3	54.5	0	0	0	0	111.3	E490 E491 Q497 Q498	E490-T494 PolarHBondContact O-N 3.17Å; E491-T494 PolarHBondContact O-N 2.71Å; E491-T494 PolarHBondContact O-OG1 2.93Å; T494-Q497 PolarHBondContact O-N 3.18Å; T494-Q498 WeakPolarHBondContact O-CB 3.37Å; T494-Q498 WeakPolarHBondContact O-CG 3.49Å; T494-Q498 PolarHBondContact O-N 3.4Å
495	H	61.1	Low	63.5	Low	115 Å²	115	120.9 Å²	120.9	53%	0.532	63%	0.629	S	S	.	*	H	α-helix	trans	-62.3	-43.7	173.5	-93.3	-81.7	0	0	0	112.6	E491 Q497 Q498 L499	E491-H495 PolarHBondContact O-N 3.01Å; H495-Q497 PolarHBondContact O-N 3.19Å; H495-Q498 PolarHBondContact O-N 2.92Å; H495-L499 WeakPolarHBondContact O-CD1 3.28Å; H495-L499 PolarHBondContact O-N 3.23Å
496	S	68.8	Low	65.5	Low	81 Å²	81	116.7 Å²	116.7	57%	0.566	61%	0.613	S	S	*	*	H	α-helix	trans	-63.4	-40.7	176.8	-174.4	0	0	0	0	112.2	D492 L499 S500	D492-S496 WeakPolarHBondContact O-CB 3.4Å; D492-S496 PolarHBondContact O-N 3.43Å; S496-L499 PolarHBondContact O-N 3.02Å; S496-S500 PolarHBondContact O-N 3.24Å; S496-S500 PolarHBondContact O-OG 3.05Å
497	Q	73.9	Confident	66.9	Low	112 Å²	112	117 Å²	117	52%	0.523	60%	0.604	S	S	.	*	H	α-helix	trans	-63.1	-47.1	172.9	-76.1	174.9	17.8	0	0	111.8	T493 T494 H495 L499 S500 F501	T493-Q497 WeakPolarHBondContact O-CB 3.44Å; T493-Q497 VanDerWaalsContact O-CG 3.23Å; T493-Q497 WeakPolarHBondContact O-CG 3.38Å; T493-Q497 PolarHBondContact O-N 3.18Å; T493-Q497 VanDerWaalsContact O-N 3.08Å; T494-Q497 PolarHBondContact O-N 3.18Å; H495-Q497 PolarHBondContact O-N 3.19Å; Q497-L499 PolarHBondContact O-N 3.44Å; Q497-S500 PolarHBondContact O-N 3.48Å; Q497-S500 VanDerWaalsContact O-N 3.14Å; Q497-S500 PolarHBondContact O-OG 3.25Å; Q497-F501 WeakPolarHBondContact O-CD2 3.2Å; Q497-F501 PolarHBondContact O-N 3.22Å
498	Q	72.4	Confident	69.4	Low	121 Å²	121	112.2 Å²	112.2	57%	0.565	58%	0.583	S	S	*	*	H	α-helix	trans	-59.2	-43.8	177	-74.1	177.8	4.6	0	0	112.5	T494 H495 S500 F501 L502	T494-Q498 WeakPolarHBondContact O-CB 3.37Å; T494-Q498 WeakPolarHBondContact O-CG 3.49Å; T494-Q498 PolarHBondContact O-N 3.4Å; H495-Q498 PolarHBondContact O-N 2.92Å; Q498-S500 PolarHBondContact O-N 2.88Å; Q498-F501 PolarHBondContact O-N 2.96Å; Q498-L502 WeakPolarHBondContact O-CB 3.47Å; Q498-L502 PolarHBondContact O-N 2.89Å
499	L	71.9	Confident	70.7	Confident	115 Å²	115	105.7 Å²	105.7	60%	0.602	56%	0.564	S	S	*	*	H	α-helix	trans	-59.8	-44.6	173.5	-99.2	85.9	0	0	0	111.7	H495 S496 Q497 F501 L502 Q503	H495-L499 WeakPolarHBondContact O-CD1 3.28Å; H495-L499 PolarHBondContact O-N 3.23Å; S496-L499 PolarHBondContact O-N 3.02Å; Q497-L499 PolarHBondContact O-N 3.44Å; L499-F501 PolarHBondContact O-N 3.2Å; L499-L502 PolarHBondContact O-N 3.27Å; L499-Q503 VanDerWaalsContact O-CB 3.27Å; L499-Q503 WeakPolarHBondContact O-CB 3.46Å; L499-Q503 PolarHBondContact O-N 3.43Å
500	S	77.5	Confident	72.1	Confident	58 Å²	58	105.6 Å²	105.6	41%	0.406	55%	0.554	S	S	.	*	H	α-helix	trans	-65.8	-37.4	-179.8	70.1	0	0	0	0	112.9	S496 Q497 Q498 Q504	S496-S500 PolarHBondContact O-N 3.24Å; S496-S500 PolarHBondContact O-OG 3.05Å; Q497-S500 PolarHBondContact O-N 3.48Å; Q497-S500 VanDerWaalsContact O-N 3.14Å; Q497-S500 PolarHBondContact O-OG 3.25Å; Q498-S500 PolarHBondContact O-N 2.88Å; S500-Q504 VanDerWaalsContact O-CB 3.27Å; S500-Q504 WeakPolarHBondContact O-CB 3.41Å; S500-Q504 PolarHBondContact O-N 3.16Å
501	F	81.6	Confident	73.8	Confident	134 Å²	134	105.7 Å²	105.7	59%	0.588	55%	0.552	S	S	*	*	H	α-helix	trans	-64.7	-42.9	171.6	-75.7	-59	0	0	0	112.2	Q497 Q498 L499 Q504 A505	Q497-F501 WeakPolarHBondContact O-CD2 3.2Å; Q497-F501 PolarHBondContact O-N 3.22Å; Q498-F501 PolarHBondContact O-N 2.96Å; L499-F501 PolarHBondContact O-N 3.2Å; F501-Q504 PolarHBondContact O-N 2.87Å; F501-A505 WeakPolarHBondContact O-CB 3.25Å; F501-A505 PolarHBondContact O-N 2.77Å
502	L	77.3	Confident	75.4	Confident	118 Å²	118	104.5 Å²	104.5	62%	0.618	55%	0.546	S	S	*	.	H	α-helix	trans	-65.9	-40.4	178.3	-162.2	74.3	0	0	0	111.5	Q498 L499 A505 L506	Q498-L502 WeakPolarHBondContact O-CB 3.47Å; Q498-L502 PolarHBondContact O-N 2.89Å; L499-L502 PolarHBondContact O-N 3.27Å; L502-A505 PolarHBondContact O-N 3.09Å; L502-L506 WeakPolarHBondContact O-CB 3.01Å; L502-L506 PolarHBondContact O-N 2.81Å
503	Q	77.1	Confident	76.9	Confident	93 Å²	93	102.3 Å²	102.3	44%	0.435	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-39.2	175.5	-168.1	174.3	36.2	0	0	111.8	L499 L506 Q507	L499-Q503 VanDerWaalsContact O-CB 3.27Å; L499-Q503 WeakPolarHBondContact O-CB 3.46Å; L499-Q503 PolarHBondContact O-N 3.43Å; Q503-L506 PolarHBondContact O-N 3.38Å; Q503-Q507 PolarHBondContact O-N 2.88Å
504	Q	82.6	Confident	78.5	Confident	131 Å²	131	103.4 Å²	103.4	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-40	174.2	-170.8	176.3	32.3	0	0	111.9	S500 F501 Q507 G508	S500-Q504 VanDerWaalsContact O-CB 3.27Å; S500-Q504 WeakPolarHBondContact O-CB 3.41Å; S500-Q504 PolarHBondContact O-N 3.16Å; F501-Q504 PolarHBondContact O-N 2.87Å; Q504-Q507 PolarHBondContact O-N 3.44Å; Q504-G508 PolarHBondContact O-N 2.95Å
505	A	79.8	Confident	79.6	Confident	62 Å²	62	105.8 Å²	105.8	51%	0.512	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-43.3	174.5	0	0	0	0	0	111.8	F501 L502 G508 M509	F501-A505 WeakPolarHBondContact O-CB 3.25Å; F501-A505 PolarHBondContact O-N 2.77Å; L502-A505 PolarHBondContact O-N 3.09Å; A505-G508 PolarHBondContact O-N 3.4Å; A505-M509 PolarHBondContact O-N 3.38Å
506	L	81	Confident	80.7	Confident	97 Å²	97	105.3 Å²	105.3	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-45.9	174.8	-84.3	161.5	0	0	0	112.3	L502 Q503 G508 M509 Q510	L502-L506 WeakPolarHBondContact O-CB 3.01Å; L502-L506 PolarHBondContact O-N 2.81Å; Q503-L506 PolarHBondContact O-N 3.38Å; L506-G508 VanDerWaalsContact C-N 3.33Å; L506-G508 PolarHBondContact O-N 3.32Å; L506-M509 HydrophobicContact CD2-CE 4.23Å; L506-M509 PolarHBondContact O-N 2.74Å; L506-Q510 WeakPolarHBondContact O-CB 3.37Å; L506-Q510 PolarHBondContact O-N 3.47Å
507	Q	85.2	Confident	81.6	Confident	124 Å²	124	109.6 Å²	109.6	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-62.6	-38.8	173.9	-76.1	-172.8	-7.5	0	0	112.4	Q503 Q504 Q510 K511	Q503-Q507 PolarHBondContact O-N 2.88Å; Q504-Q507 PolarHBondContact O-N 3.44Å; Q507-Q510 PolarHBondContact O-N 3.28Å; Q507-K511 WeakPolarHBondContact O-CB 3.41Å; Q507-K511 PolarHBondContact O-N 2.85Å
508	G	86.7	Confident	82.3	Confident	41 Å²	41	109.2 Å²	109.2	42%	0.423	55%	0.545	S	S	.	.	H	α-helix	trans	-60.4	-48.4	174.3	0	0	0	0	0	112.3	Q504 A505 L506 K511 Q512	Q504-G508 PolarHBondContact O-N 2.95Å; A505-G508 PolarHBondContact O-N 3.4Å; L506-G508 VanDerWaalsContact C-N 3.33Å; L506-G508 PolarHBondContact O-N 3.32Å; G508-K511 PolarHBondContact O-N 2.96Å; G508-Q512 PolarHBondContact O-N 3.42Å
509	M	79.7	Confident	83	Confident	110 Å²	110	107.9 Å²	107.9	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-42	177.5	-171.7	173.7	70.3	0	0	112.1	A505 L506 K511 Q512 L513	A505-M509 PolarHBondContact O-N 3.38Å; L506-M509 HydrophobicContact CD2-CE 4.23Å; L506-M509 PolarHBondContact O-N 2.74Å; M509-K511 VanDerWaalsContact C-N 3.31Å; M509-K511 PolarHBondContact O-N 3.17Å; M509-Q512 WeakPolarHBondContact O-CB 3.44Å; M509-Q512 PolarHBondContact O-N 3.18Å; M509-L513 HydrophobicContact CG-CD1 4.28Å; M509-L513 WeakPolarHBondContact O-CG 3.28Å; M509-L513 PolarHBondContact O-N 2.91Å
510	Q	84.1	Confident	83.6	Confident	92 Å²	92	107.6 Å²	107.6	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-59.6	-42.8	175.2	-170.2	179.1	16	0	0	111.2	L506 Q507 L513 L514	L506-Q510 WeakPolarHBondContact O-CB 3.37Å; L506-Q510 PolarHBondContact O-N 3.47Å; Q507-Q510 PolarHBondContact O-N 3.28Å; Q510-L513 PolarHBondContact O-N 2.86Å; Q510-L514 HydrophobicContact CG-CD1 4.24Å; Q510-L514 VanDerWaalsContact O-CD1 3.31Å; Q510-L514 WeakPolarHBondContact O-CD1 3.08Å; Q510-L514 PolarHBondContact O-N 3.33Å
511	K	87	Confident	84.2	Confident	164 Å²	164	111.8 Å²	111.8	71%	0.713	55%	0.549	S	S	*	.	H	α-helix	trans	-66.3	-36.8	176.1	-170.8	173.3	-177.6	175.9	0	112.8	Q507 G508 M509 K515	Q507-K511 WeakPolarHBondContact O-CB 3.41Å; Q507-K511 PolarHBondContact O-N 2.85Å; G508-K511 PolarHBondContact O-N 2.96Å; M509-K511 VanDerWaalsContact C-N 3.31Å; M509-K511 PolarHBondContact O-N 3.17Å; K511-K515 PolarHBondContact O-N 3.06Å; K511-K515 VanDerWaalsContact O-N 3.12Å
512	Q	84.3	Confident	84.6	Confident	125 Å²	125	111.1 Å²	111.1	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-43.7	172.4	-169	80.8	-3.5	0	0	111.1	G508 M509 K515 M516	G508-Q512 PolarHBondContact O-N 3.42Å; M509-Q512 WeakPolarHBondContact O-CB 3.44Å; M509-Q512 PolarHBondContact O-N 3.18Å; Q512-K515 PolarHBondContact O-N 3.2Å; Q512-M516 WeakPolarHBondContact O-CG 3.11Å; Q512-M516 PolarHBondContact O-N 3.43Å
513	L	84.3	Confident	85	Confident	104 Å²	104	113.8 Å²	113.8	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-40.1	179.6	-70.5	168.9	0	0	0	112.8	M509 Q510 M516 R517	M509-L513 HydrophobicContact CG-CD1 4.28Å; M509-L513 WeakPolarHBondContact O-CG 3.28Å; M509-L513 PolarHBondContact O-N 2.91Å; Q510-L513 PolarHBondContact O-N 2.86Å; L513-M516 PolarHBondContact O-N 2.88Å; L513-R517 PolarHBondContact O-N 3.17Å
514	L	87.1	Confident	85.4	Confident	104 Å²	104	115.7 Å²	115.7	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-60.1	-47.8	171.8	-94.9	71.3	0	0	0	111	Q510 M516 R517 D518	Q510-L514 HydrophobicContact CG-CD1 4.24Å; Q510-L514 VanDerWaalsContact O-CD1 3.31Å; Q510-L514 WeakPolarHBondContact O-CD1 3.08Å; Q510-L514 PolarHBondContact O-N 3.33Å; L514-M516 VanDerWaalsContact C-N 3.33Å; L514-M516 PolarHBondContact O-N 3.32Å; L514-R517 WeakPolarHBondContact O-CB 3.43Å; L514-R517 PolarHBondContact O-N 3.05Å; L514-D518 PolarHBondContact O-N 2.98Å
515	K	89.2	Confident	85.8	Confident	121 Å²	121	112.4 Å²	112.4	53%	0.526	55%	0.553	S	S	.	*	H	α-helix	trans	-60	-41.5	178.3	-174.8	172.5	-179.3	-71.8	0	112.5	K511 Q512 R517 D518 E519	K511-K515 PolarHBondContact O-N 3.06Å; K511-K515 VanDerWaalsContact O-N 3.12Å; Q512-K515 PolarHBondContact O-N 3.2Å; K515-R517 VanDerWaalsContact C-N 3.33Å; K515-R517 PolarHBondContact O-N 3.05Å; K515-D518 PolarHBondContact O-N 3.35Å; K515-E519 IonicContact NZ-OE1 3.53Å; K515-E519 PolarHBondContact NZ-OE1 3.13Å; K515-E519 WeakPolarHBondContact O-CB 3.49Å; K515-E519 WeakPolarHBondContact O-CG 3.3Å; K515-E519 PolarHBondContact O-N 3.04Å
516	M	82.6	Confident	86.3	Confident	105 Å²	105	114.1 Å²	114.1	52%	0.517	55%	0.551	S	S	.	*	H	α-helix	trans	-62.3	-38.2	174	-68.5	-101.9	-68.7	0	0	112.3	Q512 L513 L514 E519 L520	Q512-M516 WeakPolarHBondContact O-CG 3.11Å; Q512-M516 PolarHBondContact O-N 3.43Å; L513-M516 PolarHBondContact O-N 2.88Å; L514-M516 VanDerWaalsContact C-N 3.33Å; L514-M516 PolarHBondContact O-N 3.32Å; M516-E519 PolarHBondContact O-N 3.34Å; M516-L520 WeakPolarHBondContact O-CG 3.29Å; M516-L520 PolarHBondContact O-N 3.4Å
517	R	87.8	Confident	86.6	Confident	170 Å²	170	114.7 Å²	114.7	64%	0.642	55%	0.554	S	S	*	*	H	α-helix	trans	-66.4	-41.9	177	-171.5	-177	-173.1	178.7	4.2	111.9	L513 L514 K515 L520 K521	L513-R517 PolarHBondContact O-N 3.17Å; L514-R517 WeakPolarHBondContact O-CB 3.43Å; L514-R517 PolarHBondContact O-N 3.05Å; K515-R517 VanDerWaalsContact C-N 3.33Å; K515-R517 PolarHBondContact O-N 3.05Å; R517-L520 PolarHBondContact O-N 3.09Å; R517-K521 WeakPolarHBondContact O-CB 3.49Å; R517-K521 PolarHBondContact O-N 2.61Å
518	D	88.8	Confident	86.8	Confident	105 Å²	105	115 Å²	115	56%	0.561	56%	0.555	S	S	*	*	H	α-helix	trans	-67.5	-40	176.4	-68.4	-31.6	0	0	0	111.7	L514 K515 K521 Q522	L514-D518 PolarHBondContact O-N 2.98Å; K515-D518 PolarHBondContact O-N 3.35Å; D518-K521 PolarHBondContact O-N 3.03Å; D518-Q522 PolarHBondContact O-N 2.97Å
519	E	87.8	Confident	87.1	Confident	92 Å²	92	118.9 Å²	118.9	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-39.1	174.4	-76.3	174.3	-167.3	0	0	112.9	K515 M516 Q522 R523	K515-E519 IonicContact NZ-OE1 3.53Å; K515-E519 PolarHBondContact NZ-OE1 3.13Å; K515-E519 WeakPolarHBondContact O-CB 3.49Å; K515-E519 WeakPolarHBondContact O-CG 3.3Å; K515-E519 PolarHBondContact O-N 3.04Å; M516-E519 PolarHBondContact O-N 3.34Å; E519-Q522 PolarHBondContact O-N 3.15Å; E519-R523 VanDerWaalsContact O-CG 3.26Å; E519-R523 WeakPolarHBondContact O-CG 3.45Å; E519-R523 PolarHBondContact O-N 2.75Å
520	L	83.6	Confident	87.4	Confident	110 Å²	110	116.9 Å²	116.9	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-46.2	172.2	-76.2	170.4	0	0	0	111.5	M516 R517 Q522 R523 E524	M516-L520 WeakPolarHBondContact O-CG 3.29Å; M516-L520 PolarHBondContact O-N 3.4Å; R517-L520 PolarHBondContact O-N 3.09Å; L520-Q522 VanDerWaalsContact C-N 3.29Å; L520-Q522 PolarHBondContact O-N 2.69Å; L520-R523 WeakPolarHBondContact O-CA 3.36Å; L520-R523 WeakPolarHBondContact O-CB 3.32Å; L520-R523 PolarHBondContact O-N 3.35Å; L520-E524 WeakPolarHBondContact O-CG 3.32Å; L520-E524 PolarHBondContact O-N 3.18Å
521	K	90.1	Very high	87.6	Confident	146 Å²	146	116.7 Å²	116.7	64%	0.635	56%	0.559	S	S	*	*	H	α-helix	trans	-63.4	-34	178.5	-169.6	178.1	-179.1	-177.2	0	112.7	R517 D518 A525	R517-K521 WeakPolarHBondContact O-CB 3.49Å; R517-K521 PolarHBondContact O-N 2.61Å; D518-K521 PolarHBondContact O-N 3.03Å; K521-A525 PolarHBondContact O-N 2.84Å
522	Q	91.4	Very high	87.8	Confident	119 Å²	119	115.1 Å²	115.1	56%	0.556	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-43.8	171.1	-177	177.6	-29.2	0	0	111.3	D518 E519 L520 E524 A525 E526	D518-Q522 PolarHBondContact O-N 2.97Å; E519-Q522 PolarHBondContact O-N 3.15Å; L520-Q522 VanDerWaalsContact C-N 3.29Å; L520-Q522 PolarHBondContact O-N 2.69Å; Q522-E524 VanDerWaalsContact C-N 3.31Å; Q522-E524 PolarHBondContact O-N 3.42Å; Q522-A525 PolarHBondContact O-N 3.31Å; Q522-E526 HydrophobicContact CG-CG 4.43Å; Q522-E526 WeakPolarHBondContact CG-OE1 3.48Å; Q522-E526 PolarHBondContact NE2-OE1 3Å; Q522-E526 WeakPolarHBondContact O-CG 3.49Å; Q522-E526 PolarHBondContact O-N 3.5Å
523	R	85.4	Confident	88	Confident	175 Å²	175	113 Å²	113	66%	0.66	55%	0.547	S	S	*	.	H	α-helix	trans	-61.4	-36.9	176.5	-73.4	-80.6	-178	69.3	4.1	113	E519 L520 E526 L527	E519-R523 VanDerWaalsContact O-CG 3.26Å; E519-R523 WeakPolarHBondContact O-CG 3.45Å; E519-R523 PolarHBondContact O-N 2.75Å; L520-R523 WeakPolarHBondContact O-CA 3.36Å; L520-R523 WeakPolarHBondContact O-CB 3.32Å; L520-R523 PolarHBondContact O-N 3.35Å; R523-E526 PolarHBondContact O-N 3.1Å; R523-L527 WeakPolarHBondContact O-CB 3.48Å; R523-L527 PolarHBondContact O-N 2.72Å
524	E	84.8	Confident	88.3	Confident	132 Å²	132	115 Å²	115	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-62.6	-47.1	173.6	-71.3	172.2	153.8	0	0	111.1	L520 Q522 E526 L527 E528	L520-E524 WeakPolarHBondContact O-CG 3.32Å; L520-E524 PolarHBondContact O-N 3.18Å; Q522-E524 VanDerWaalsContact C-N 3.31Å; Q522-E524 PolarHBondContact O-N 3.42Å; E524-E526 PolarHBondContact O-N 2.88Å; E524-L527 PolarHBondContact O-N 3.35Å; E524-E528 PolarHBondContact O-N 2.94Å
525	A	90.8	Very high	88.4	Confident	63 Å²	63	116.7 Å²	116.7	52%	0.521	56%	0.556	S	S	.	*	H	α-helix	trans	-66	-35.7	176.9	0	0	0	0	0	113.4	K521 Q522 L527 K529	K521-A525 PolarHBondContact O-N 2.84Å; Q522-A525 PolarHBondContact O-N 3.31Å; A525-L527 VanDerWaalsContact C-N 3.34Å; A525-K529 PolarHBondContact O-N 2.92Å; A525-K529 VanDerWaalsContact O-N 3.15Å
526	E	90.9	Very high	88.5	Confident	98 Å²	98	116.5 Å²	116.5	46%	0.458	56%	0.557	S	S	.	*	H	α-helix	trans	-65.4	-36.5	172.5	-73.9	171.6	-176.5	0	0	111.9	Q522 R523 E524 S530	Q522-E526 HydrophobicContact CG-CG 4.43Å; Q522-E526 WeakPolarHBondContact CG-OE1 3.48Å; Q522-E526 PolarHBondContact NE2-OE1 3Å; Q522-E526 WeakPolarHBondContact O-CG 3.49Å; Q522-E526 PolarHBondContact O-N 3.5Å; R523-E526 PolarHBondContact O-N 3.1Å; E524-E526 PolarHBondContact O-N 2.88Å; E526-S530 WeakPolarHBondContact O-CB 3.43Å; E526-S530 PolarHBondContact O-N 3.29Å
527	L	87.5	Confident	88.8	Confident	109 Å²	109	116.5 Å²	116.5	57%	0.571	56%	0.558	S	S	*	*	H	α-helix	trans	-71.4	-43.9	176.5	-178.5	63	0	0	0	112.3	R523 E524 A525 K529 S530 L531	R523-L527 WeakPolarHBondContact O-CB 3.48Å; R523-L527 PolarHBondContact O-N 2.72Å; E524-L527 PolarHBondContact O-N 3.35Å; A525-L527 VanDerWaalsContact C-N 3.34Å; L527-K529 PolarHBondContact O-N 3.06Å; L527-S530 WeakPolarHBondContact O-CB 3.49Å; L527-S530 PolarHBondContact O-N 2.82Å; L527-S530 VanDerWaalsContact O-N 3.15Å; L527-L531 WeakPolarHBondContact O-CG 3.39Å; L527-L531 PolarHBondContact O-N 2.71Å
528	E	89.2	Confident	88.8	Confident	129 Å²	129	115.9 Å²	115.9	60%	0.603	56%	0.561	S	S	*	*	H	α-helix	trans	-54.9	-52.1	174.7	-166.7	88.7	-100.1	0	0	110.2	E524 S530 L531 E532	E524-E528 PolarHBondContact O-N 2.94Å; E528-S530 VanDerWaalsContact C-N 3.31Å; E528-S530 PolarHBondContact O-N 2.64Å; E528-L531 WeakPolarHBondContact O-CB 3.37Å; E528-L531 PolarHBondContact O-N 2.92Å; E528-E532 PolarHBondContact O-N 2.98Å
529	K	92.6	Very high	88.8	Confident	123 Å²	123	113.9 Å²	113.9	54%	0.535	56%	0.555	S	S	.	*	H	α-helix	trans	-59.6	-40.2	175.7	-173.3	-173.4	172.1	-171.3	0	112.5	A525 L527 L531 E532 D533	A525-K529 PolarHBondContact O-N 2.92Å; A525-K529 VanDerWaalsContact O-N 3.15Å; L527-K529 PolarHBondContact O-N 3.06Å; K529-L531 PolarHBondContact O-N 3.49Å; K529-E532 WeakPolarHBondContact O-CB 3.36Å; K529-E532 PolarHBondContact O-N 3.2Å; K529-D533 PolarHBondContact O-N 2.9Å
530	S	85.6	Confident	88.8	Confident	68 Å²	68	114 Å²	114	48%	0.476	56%	0.555	S	S	.	*	H	α-helix	trans	-63.2	-31	176.9	-169.2	0	0	0	0	112.6	E526 L527 E528 K534	E526-S530 WeakPolarHBondContact O-CB 3.43Å; E526-S530 PolarHBondContact O-N 3.29Å; L527-S530 WeakPolarHBondContact O-CB 3.49Å; L527-S530 PolarHBondContact O-N 2.82Å; L527-S530 VanDerWaalsContact O-N 3.15Å; E528-S530 VanDerWaalsContact C-N 3.31Å; E528-S530 PolarHBondContact O-N 2.64Å; S530-K534 WeakPolarHBondContact O-CB 3.33Å; S530-K534 PolarHBondContact O-N 3.48Å; S530-K534 VanDerWaalsContact O-N 3.09Å
531	L	88.7	Confident	89	Confident	89 Å²	89	113 Å²	113	47%	0.466	55%	0.553	S	S	.	*	H	α-helix	trans	-72	-40.4	172.2	-67.7	167.5	0	0	0	111.9	L527 E528 K529 K534 Q535	L527-L531 WeakPolarHBondContact O-CG 3.39Å; L527-L531 PolarHBondContact O-N 2.71Å; E528-L531 WeakPolarHBondContact O-CB 3.37Å; E528-L531 PolarHBondContact O-N 2.92Å; K529-L531 PolarHBondContact O-N 3.49Å; L531-K534 PolarHBondContact O-N 3.15Å; L531-Q535 WeakPolarHBondContact O-CB 3.49Å; L531-Q535 PolarHBondContact O-N 3.2Å
532	E	91.3	Very high	88.8	Confident	130 Å²	130	111.1 Å²	111.1	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-60.9	-51.8	173	-64.9	-173.9	140.4	0	0	111.9	E528 K529 K534 Q535 Q536	E528-E532 PolarHBondContact O-N 2.98Å; K529-E532 WeakPolarHBondContact O-CB 3.36Å; K529-E532 PolarHBondContact O-N 3.2Å; E532-K534 VanDerWaalsContact C-N 3.28Å; E532-K534 PolarHBondContact O-N 3.49Å; E532-Q535 PolarHBondContact O-N 3.45Å; E532-Q536 PolarHBondContact O-N 3.05Å
533	D	89.8	Confident	88.7	Confident	82 Å²	82	110.8 Å²	110.8	44%	0.439	55%	0.549	S	S	.	.	H	α-helix	trans	-56.8	-42.3	177.4	-76.4	-28.6	0	0	0	110.8	K529 Q536 L537	K529-D533 PolarHBondContact O-N 2.9Å; D533-Q536 PolarHBondContact O-N 2.84Å; D533-L537 WeakPolarHBondContact O-CB 3.26Å; D533-L537 PolarHBondContact O-N 2.97Å
534	K	88.9	Confident	88.7	Confident	144 Å²	144	108.4 Å²	108.4	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-65.2	-38.1	175.8	-179.9	-179.9	-179.1	179.7	0	112.6	S530 L531 E532 K538	S530-K534 WeakPolarHBondContact O-CB 3.33Å; S530-K534 PolarHBondContact O-N 3.48Å; S530-K534 VanDerWaalsContact O-N 3.09Å; L531-K534 PolarHBondContact O-N 3.15Å; E532-K534 VanDerWaalsContact C-N 3.28Å; E532-K534 PolarHBondContact O-N 3.49Å; K534-K538 WeakPolarHBondContact O-CB 3.38Å; K534-K538 PolarHBondContact O-N 3.03Å
535	Q	89.5	Confident	88.7	Confident	140 Å²	140	109.1 Å²	109.1	65%	0.654	55%	0.55	S	S	*	.	H	α-helix	trans	-71.3	-38.4	176.2	-179.3	165.4	-29.7	0	0	111.6	L531 E532 S539	L531-Q535 WeakPolarHBondContact O-CB 3.49Å; L531-Q535 PolarHBondContact O-N 3.2Å; E532-Q535 PolarHBondContact O-N 3.45Å; Q535-S539 PolarHBondContact O-N 2.98Å; Q535-S539 VanDerWaalsContact O-N 3.07Å; Q535-S539 PolarHBondContact O-OG 3.32Å
536	Q	91.6	Very high	88.4	Confident	117 Å²	117	109.6 Å²	109.6	55%	0.547	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-46.8	172.7	-164	-175.3	27.2	0	0	111.1	E532 D533 K538 S539 Q540	E532-Q536 PolarHBondContact O-N 3.05Å; D533-Q536 PolarHBondContact O-N 2.84Å; Q536-K538 PolarHBondContact O-N 3.44Å; Q536-S539 WeakPolarHBondContact O-CB 3.44Å; Q536-S539 PolarHBondContact O-N 3.14Å; Q536-S539 VanDerWaalsContact O-N 3.11Å; Q536-Q540 WeakPolarHBondContact O-CG 3.34Å; Q536-Q540 PolarHBondContact O-N 3.06Å
537	L	89.4	Confident	88	Confident	105 Å²	105	106.4 Å²	106.4	55%	0.55	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-42.4	177.5	-173.4	65.4	0	0	0	112	D533 S539 Q540 V541	D533-L537 WeakPolarHBondContact O-CB 3.26Å; D533-L537 PolarHBondContact O-N 2.97Å; L537-S539 PolarHBondContact O-N 3.07Å; L537-Q540 PolarHBondContact O-N 3.32Å; L537-V541 WeakPolarHBondContact O-CG2 3.26Å; L537-V541 PolarHBondContact O-N 2.92Å
538	K	87.2	Confident	87.5	Confident	158 Å²	158	106.4 Å²	106.4	69%	0.687	53%	0.534	S	S	*	.	H	α-helix	trans	-57.4	-39.1	173.2	-174.4	-177.5	178.8	-173	0	111.8	K534 Q536 V541 Q542	K534-K538 WeakPolarHBondContact O-CB 3.38Å; K534-K538 PolarHBondContact O-N 3.03Å; Q536-K538 PolarHBondContact O-N 3.44Å; K538-V541 PolarHBondContact O-N 3.37Å; K538-Q542 PolarHBondContact O-N 3.32Å
539	S	89.3	Confident	86.8	Confident	62 Å²	62	105.8 Å²	105.8	43%	0.434	53%	0.532	S	S	.	.	H	α-helix	trans	-70.3	-39	178.4	-53.3	0	0	0	0	112	Q535 Q536 L537 Q542 N543	Q535-S539 PolarHBondContact O-N 2.98Å; Q535-S539 VanDerWaalsContact O-N 3.07Å; Q535-S539 PolarHBondContact O-OG 3.32Å; Q536-S539 WeakPolarHBondContact O-CB 3.44Å; Q536-S539 PolarHBondContact O-N 3.14Å; Q536-S539 VanDerWaalsContact O-N 3.11Å; L537-S539 PolarHBondContact O-N 3.07Å; S539-Q542 PolarHBondContact O-N 2.83Å; S539-N543 PolarHBondContact O-N 3.22Å; S539-N543 PolarHBondContact O-ND2 3.41Å
540	Q	87.6	Confident	86	Confident	96 Å²	96	106.7 Å²	106.7	45%	0.449	54%	0.535	S	S	.	.	H	α-helix	trans	-63.3	-44.6	172	-67.6	179	23.8	0	0	111.9	Q536 L537 Q542 N543 L544	Q536-Q540 WeakPolarHBondContact O-CG 3.34Å; Q536-Q540 PolarHBondContact O-N 3.06Å; L537-Q540 PolarHBondContact O-N 3.32Å; Q540-Q542 VanDerWaalsContact C-N 3.3Å; Q540-Q542 PolarHBondContact O-N 3.19Å; Q540-N543 PolarHBondContact O-N 2.91Å; Q540-L544 WeakPolarHBondContact O-CB 3.38Å; Q540-L544 WeakPolarHBondContact O-CG 3.5Å; Q540-L544 PolarHBondContact O-N 3.07Å
541	V	88.3	Confident	85.3	Confident	88 Å²	88	109.2 Å²	109.2	53%	0.533	54%	0.543	S	S	.	.	H	α-helix	trans	-61	-38.7	176.2	170.2	0	0	0	0	111.4	L537 K538 K545	L537-V541 WeakPolarHBondContact O-CG2 3.26Å; L537-V541 PolarHBondContact O-N 2.92Å; K538-V541 PolarHBondContact O-N 3.37Å; V541-K545 WeakPolarHBondContact O-CB 3.46Å; V541-K545 PolarHBondContact O-N 3.02Å
542	Q	86.2	Confident	84.2	Confident	107 Å²	107	110.7 Å²	110.7	50%	0.5	55%	0.547	S	S	.	.	H	α-helix	trans	-66.4	-47.5	174.3	-179.8	165.8	-20.6	0	0	112.1	K538 S539 Q540 L544 K545 E546	K538-Q542 PolarHBondContact O-N 3.32Å; S539-Q542 PolarHBondContact O-N 2.83Å; Q540-Q542 VanDerWaalsContact C-N 3.3Å; Q540-Q542 PolarHBondContact O-N 3.19Å; Q542-L544 VanDerWaalsContact C-N 3.29Å; Q542-L544 PolarHBondContact O-N 3.23Å; Q542-K545 WeakPolarHBondContact O-CB 3.29Å; Q542-K545 PolarHBondContact O-N 3.36Å; Q542-K545 VanDerWaalsContact O-N 3.09Å; Q542-E546 HydrophobicContact CG-CG 4.48Å; Q542-E546 VanDerWaalsContact CG-OE1 3.28Å; Q542-E546 WeakPolarHBondContact CG-OE1 3.46Å; Q542-E546 PolarHBondContact NE2-OE1 3.18Å; Q542-E546 WeakPolarHBondContact O-CG 3.26Å; Q542-E546 PolarHBondContact O-N 2.78Å
543	N	89.3	Confident	82.7	Confident	111 Å²	111	108.2 Å²	108.2	59%	0.594	55%	0.545	S	S	*	.	H	α-helix	trans	-57.8	-41	175.7	-74.8	-28.4	0	0	0	112.4	S539 Q540 E546 G547	S539-N543 PolarHBondContact O-N 3.22Å; S539-N543 PolarHBondContact O-ND2 3.41Å; Q540-N543 PolarHBondContact O-N 2.91Å; N543-E546 PolarHBondContact O-N 3.16Å; N543-G547 PolarHBondContact O-N 3.09Å
544	L	85.3	Confident	81	Confident	125 Å²	125	108.2 Å²	108.2	65%	0.654	55%	0.548	S	S	*	.	H	α-helix	trans	-65	-41	174.8	-73.1	170.1	0	0	0	111.9	Q540 Q542 G547 L548	Q540-L544 WeakPolarHBondContact O-CB 3.38Å; Q540-L544 WeakPolarHBondContact O-CG 3.5Å; Q540-L544 PolarHBondContact O-N 3.07Å; Q542-L544 VanDerWaalsContact C-N 3.29Å; Q542-L544 PolarHBondContact O-N 3.23Å; L544-G547 PolarHBondContact O-N 3.13Å; L544-L548 WeakPolarHBondContact O-CB 3.49Å; L544-L548 PolarHBondContact O-N 3.35Å
545	K	83.6	Confident	79.1	Confident	147 Å²	147	107 Å²	107	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-62.9	-44.3	176	-174.3	179.1	179.2	-177.8	0	111.8	V541 Q542 L548 Q549	V541-K545 WeakPolarHBondContact O-CB 3.46Å; V541-K545 PolarHBondContact O-N 3.02Å; Q542-K545 WeakPolarHBondContact O-CB 3.29Å; Q542-K545 PolarHBondContact O-N 3.36Å; Q542-K545 VanDerWaalsContact O-N 3.09Å; K545-L548 PolarHBondContact O-N 3.47Å; K545-Q549 WeakPolarHBondContact O-CB 3.37Å; K545-Q549 PolarHBondContact O-N 3.01Å
546	E	84.3	Confident	76.9	Confident	74 Å²	74	106 Å²	106	35%	0.346	55%	0.547	S	S	.	.	H	α-helix	trans	-66.9	-35.6	176.1	-69.4	177.6	-153.7	0	0	112.1	Q542 N543 K550	Q542-E546 HydrophobicContact CG-CG 4.48Å; Q542-E546 VanDerWaalsContact CG-OE1 3.28Å; Q542-E546 WeakPolarHBondContact CG-OE1 3.46Å; Q542-E546 PolarHBondContact NE2-OE1 3.18Å; Q542-E546 WeakPolarHBondContact O-CG 3.26Å; Q542-E546 PolarHBondContact O-N 2.78Å; N543-E546 PolarHBondContact O-N 3.16Å; E546-K550 WeakPolarHBondContact O-CG 3.19Å; E546-K550 PolarHBondContact O-N 2.97Å
547	G	83.7	Confident	74.6	Confident	31 Å²	31	108.4 Å²	108.4	32%	0.32	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-44.2	171.1	0	0	0	0	0	113	N543 L544 Q549 K550 L551	N543-G547 PolarHBondContact O-N 3.09Å; L544-G547 PolarHBondContact O-N 3.13Å; G547-Q549 VanDerWaalsContact C-N 3.33Å; G547-Q549 PolarHBondContact O-N 3.31Å; G547-K550 PolarHBondContact O-N 3.49Å; G547-L551 PolarHBondContact O-N 2.99Å
548	L	76.2	Confident	72.3	Confident	108 Å²	108	110.7 Å²	110.7	57%	0.565	57%	0.569	S	S	*	*	H	α-helix	trans	-63.3	-40.5	176.1	-147.5	86.2	0	0	0	111.5	L544 K545 L551 Q552	L544-L548 WeakPolarHBondContact O-CB 3.49Å; L544-L548 PolarHBondContact O-N 3.35Å; K545-L548 PolarHBondContact O-N 3.47Å; L548-L551 PolarHBondContact O-N 3.5Å; L548-Q552 WeakPolarHBondContact O-CG 3.37Å; L548-Q552 PolarHBondContact O-N 3.39Å
549	Q	74.3	Confident	70	Confident	117 Å²	117	109.7 Å²	109.7	55%	0.547	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-40.5	178.6	-161.5	167.6	17.9	0	0	111.5	K545 G547 Q552 S553	K545-Q549 WeakPolarHBondContact O-CB 3.37Å; K545-Q549 PolarHBondContact O-N 3.01Å; G547-Q549 VanDerWaalsContact C-N 3.33Å; G547-Q549 PolarHBondContact O-N 3.31Å; Q549-Q552 PolarHBondContact O-N 3.46Å; Q549-S553 PolarHBondContact O-N 3.48Å; Q549-S553 PolarHBondContact O-OG 3.02Å; Q549-S553 VanDerWaalsContact O-OG 3.1Å
550	K	76.6	Confident	67.3	Low	141 Å²	141	115.7 Å²	115.7	61%	0.613	59%	0.591	S	S	*	*	H	α-helix	trans	-61	-42.6	170.9	-74.6	166.4	-177.9	165.5	0	112.2	E546 G547 Q552 S553 T554	E546-K550 WeakPolarHBondContact O-CG 3.19Å; E546-K550 PolarHBondContact O-N 2.97Å; G547-K550 PolarHBondContact O-N 3.49Å; K550-Q552 PolarHBondContact O-N 2.98Å; K550-S553 WeakPolarHBondContact O-CB 3.34Å; K550-S553 PolarHBondContact O-N 3.06Å; K550-T554 PolarHBondContact O-N 3.38Å; K550-T554 PolarHBondContact O-OG1 2.97Å; K550-T554 VanDerWaalsContact O-OG1 3.06Å
551	L	70.8	Confident	64.6	Low	121 Å²	121	119 Å²	119	63%	0.634	61%	0.609	S	S	*	*	H	α-helix	trans	-62.4	-40	175.1	-79.8	164.2	0	0	0	112.4	G547 L548 T554 H555	G547-L551 PolarHBondContact O-N 2.99Å; L548-L551 PolarHBondContact O-N 3.5Å; L551-T554 PolarHBondContact O-N 3.42Å; L551-H555 WeakPolarHBondContact O-CB 3.38Å; L551-H555 PolarHBondContact O-N 2.59Å
552	Q	65.3	Low	61.9	Low	120 Å²	120	119.7 Å²	119.7	56%	0.561	62%	0.617	S	S	*	*	H	α-helix	trans	-64	-42.5	174.4	-73.4	174.7	-23	0	0	112	L548 Q549 K550 T554 H555 T556	L548-Q552 WeakPolarHBondContact O-CG 3.37Å; L548-Q552 PolarHBondContact O-N 3.39Å; Q549-Q552 PolarHBondContact O-N 3.46Å; K550-Q552 PolarHBondContact O-N 2.98Å; Q552-T554 PolarHBondContact O-N 2.91Å; Q552-H555 PolarHBondContact O-N 2.96Å; Q552-T556 PolarHBondContact O-N 3.16Å; Q552-T556 VanDerWaalsContact O-N 3.14Å; Q552-T556 PolarHBondContact O-OG1 3.12Å
553	S	59.1	Low	59.2	Low	78 Å²	78	122 Å²	122	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-58.7	-45.8	173.1	-56.4	0	0	0	0	112.2	Q549 K550 T556	Q549-S553 PolarHBondContact O-N 3.48Å; Q549-S553 PolarHBondContact O-OG 3.02Å; Q549-S553 VanDerWaalsContact O-OG 3.1Å; K550-S553 WeakPolarHBondContact O-CB 3.34Å; K550-S553 PolarHBondContact O-N 3.06Å; S553-T556 PolarHBondContact O-N 3.17Å
554	T	54.9	Low	57.2	Low	82 Å²	82	122.3 Å²	122.3	50%	0.503	64%	0.641	S	S	.	*	H	α-helix	trans	-65	-42.6	178.3	-54.5	0	0	0	0	112.1	K550 L551 Q552 T556 M557	K550-T554 PolarHBondContact O-N 3.38Å; K550-T554 PolarHBondContact O-OG1 2.97Å; K550-T554 VanDerWaalsContact O-OG1 3.06Å; L551-T554 PolarHBondContact O-N 3.42Å; Q552-T554 PolarHBondContact O-N 2.91Å; T554-T556 PolarHBondContact O-N 3.37Å; T554-M557 PolarHBondContact O-N 3Å; T554-M557 VanDerWaalsContact O-N 3.08Å
555	H	49.2	Very low	54.4	Low	120 Å²	120	119.9 Å²	119.9	56%	0.556	65%	0.646	S	S	*	*	H	α-helix	trans	-63.7	-32.1	179.9	-164.7	-9.3	0	0	0	112.3	L551 Q552 M557 Q558	L551-H555 WeakPolarHBondContact O-CB 3.38Å; L551-H555 PolarHBondContact O-N 2.59Å; Q552-H555 PolarHBondContact O-N 2.96Å; H555-M557 PolarHBondContact O-N 3.41Å; H555-Q558 PolarHBondContact O-N 2.93Å
556	T	42.4	Very low	51.7	Low	117 Å²	117	120.7 Å²	120.7	72%	0.718	66%	0.658	S	S	*	*	H	α-helix	trans	-63.9	-21.2	176.8	-53.9	0	0	0	0	112.4	Q552 S553 T554	Q552-T556 PolarHBondContact O-N 3.16Å; Q552-T556 VanDerWaalsContact O-N 3.14Å; Q552-T556 PolarHBondContact O-OG1 3.12Å; S553-T556 PolarHBondContact O-N 3.17Å; T554-T556 PolarHBondContact O-N 3.37Å
557	M	44.8	Very low	49	Very low	169 Å²	169	120.7 Å²	120.7	83%	0.833	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	9.1	179.7	-54.4	-143.8	83.6	0	0	114.4	T554 H555	T554-M557 PolarHBondContact O-N 3Å; T554-M557 VanDerWaalsContact O-N 3.08Å; H555-M557 PolarHBondContact O-N 3.41Å
558	Q	40.7	Very low	46.3	Very low	152 Å²	152	123.2 Å²	123.2	71%	0.71	70%	0.703	S	S	*	*	S	Bend	trans	-125.9	20.5	-179	-77.1	-169	-29.1	0	0	114.5	H555	H555-Q558 PolarHBondContact O-N 2.93Å
559	L	37.5	Very low	44.2	Very low	137 Å²	137	126.4 Å²	126.4	72%	0.717	71%	0.713	S	S	*	*			trans	-103.1	15.9	179.9	-106.9	161.5	0	0	0	115.4
560	E	33.8	Very low	42.1	Very low	188 Å²	188	126.9 Å²	126.9	88%	0.879	72%	0.719	S	S	*	*	S	Bend	trans	-113.7	89.5	156.5	-72.1	-162	146.3	0	0	110.1
561	M	31.5	Very low	40	Very low	165 Å²	165	127.6 Å²	127.6	81%	0.813	73%	0.729	S	S	*	*	S	Bend	trans	171.1	128.5	142.1	-95.9	-70.5	-76.4	0	0	113.3
562	S	30.4	Very low	38	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	73%	0.73	S	S	*	*			trans	47.6	116.1	152.2	60.4	0	0	0	0	122.2
563	N	29.7	Very low	36.4	Very low	157 Å²	157	125.5 Å²	125.5	84%	0.84	74%	0.738	S	S	*	*			trans	-104.4	170.3	142	-158.5	24.7	0	0	0	106.6
564	P	46.8	Very low	35	Very low	116 Å²	116	127.4 Å²	127.4	75%	0.753	74%	0.742	S	S	*	*			cis	-131.5	178.3	-6	43	-27.1	0	0	0	115.5
565	G	26.2	Very low	33.9	Very low	74 Å²	74	132 Å²	132	76%	0.763	75%	0.754	S	S	*	*			trans	170.4	86.8	163.3	0	0	0	0	0	121.1
566	N	28.1	Very low	32.7	Very low	165 Å²	165	131.8 Å²	131.8	88%	0.882	76%	0.762	S	S	*	*			trans	43	111.2	135	-172.8	70.8	0	0	0	123.5
567	G	27.5	Very low	32.2	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	77%	0.766	S	S	*	*				86.5	131.2	121.8	0	0	0	0	0	121.2
568	G	27.4	Very low	31.3	Very low	83 Å²	83	132 Å²	132	86%	0.856	76%	0.762	S	S	*	*			trans	163	109.9	165.6	0	0	0	0	0	117.6
569	K	31.2	Very low	30.7	Very low	175 Å²	175	128.4 Å²	128.4	76%	0.761	76%	0.758	S	S	*	*			trans	-71.2	171.4	161.2	-80.9	-177.4	133.8	-78.6	0	112.2
570	D	31.2	Very low	30.2	Very low	127 Å²	127	127.3 Å²	127.3	68%	0.679	76%	0.757	S	S	*	*			cis	-142.9	-166.1	-27.4	-62.3	-55.7	0	0	0	104.1
571	D	30.6	Very low	29.9	Very low	156 Å²	156	125.6 Å²	125.6	83%	0.834	75%	0.753	S	S	*	*			cis	-157.6	161.1	-3.7	-175.8	34.3	0	0	0	109.9
572	G	29.5	Very low	29.6	Very low	62 Å²	62	122.8 Å²	122.8	64%	0.639	75%	0.75	S	S	*	*			trans	81.6	157.2	147.2	0	0	0	0	0	120.3
573	N	31	Very low	29.4	Very low	136 Å²	136	122.3 Å²	122.3	73%	0.727	75%	0.752	S	S	*	*			cis	-169.3	127.4	-13.5	179.4	16.9	0	0	0	111.6
574	N	30.1	Very low	29.2	Very low	118 Å²	118	121.2 Å²	121.2	63%	0.631	75%	0.751	S	S	*	*				165	140.8	124.7	-99.1	-80.8	0	0	0	115.7
575	K	31.4	Very low	28.2	Very low	177 Å²	177	121.4 Å²	121.4	77%	0.77	75%	0.749	S	S	*	*			trans	61	109.6	153.2	-65	170.6	-175.7	178.2	0	116.4
576	T	25.7	Very low	28.1	Very low	117 Å²	117	122.7 Å²	122.7	72%	0.718	75%	0.747	S	S	*	*			cis	68.4	92.4	24.9	-34.1	0	0	0	0	114.7
577	V	31.7	Very low	27.9	Very low	133 Å²	133	119.6 Å²	119.6	81%	0.806	74%	0.737	S	S	*	*				-139.3	125.8	103.4	-148.4	0	0	0	0	104.5
578	E	25.7	Very low	27.9	Very low	157 Å²	157	121 Å²	121	73%	0.734	74%	0.735	S	S	*	*				55.2	143.2	65.2	-101.2	-165.9	140.9	0	0	114.1
579	A	27.7	Very low	27.9	Very low	76 Å²	76	125.2 Å²	125.2	63%	0.628	73%	0.733	S	S	*	*			cis	-147.8	144.2	6.7	0	0	0	0	0	109.5
580	T	27	Very low	27.6	Very low	114 Å²	114	126.5 Å²	126.5	70%	0.699	74%	0.741	S	S	*	*				69	130.1	91.2	-57.8	0	0	0	0	113.3
581	L	26.9	Very low	27.4	Very low	152 Å²	152	129.7 Å²	129.7	80%	0.796	75%	0.749	S	S	*	*			cis	161	169	-12.9	-108.5	162.6	0	0	0	106.6
582	S	25.4	Very low	27.1	Very low	106 Å²	106	134.1 Å²	134.1	74%	0.741	75%	0.754	S	S	*	*			trans	104.3	128	160.6	-45.1	0	0	0	0	115.7
583	A	26.6	Very low	26.9	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	76%	0.757	S	S	*	*			cis	75.1	153.3	38.6	0	0	0	0	0	112.8
584	V	25.8	Very low	27.4	Very low	134 Å²	134	133.6 Å²	133.6	81%	0.812	76%	0.759	S	S	*	*			cis	-130.2	-167.9	8.7	-69.8	0	0	0	0	109.5
585	V	25.8	Very low	27.3	Very low	119 Å²	119	134.9 Å²	134.9	72%	0.721	77%	0.772	S	S	*	*			cis	-157.3	139.4	3.8	96.5	0	0	0	0	106.2
586	S	24.4	Very low	27.4	Very low	102 Å²	102	135.3 Å²	135.3	71%	0.713	78%	0.776	S	S	*	*				47.4	151.7	95.9	-73.2	0	0	0	0	117.6
587	C	23.5	Very low	27.8	Very low	100 Å²	100	139.1 Å²	139.1	68%	0.676	78%	0.783	S	S	*	*			cis	-151.5	173.3	-2.4	-121	0	0	0	0	108.2
588	S	28.1	Very low	27.9	Very low	102 Å²	102	140 Å²	140	71%	0.713	78%	0.783	S	S	*	*			cis	-161.4	145.8	49.5	-63.2	0	0	0	0	114
589	Q	27.6	Very low	28.2	Very low	173 Å²	173	136.2 Å²	136.2	81%	0.808	77%	0.774	S	S	*	*			trans	28.9	144	130.6	-63.5	174	-2.1	0	0	120.1
590	E	23.7	Very low	29.4	Very low	202 Å²	202	139.6 Å²	139.6	94%	0.944	79%	0.787	S	S	*	*			cis	-114.4	-169.4	39.3	-70.3	-157.8	100.3	0	0	117.4
591	K	26.4	Very low	31	Very low	194 Å²	194	136.3 Å²	136.3	84%	0.843	77%	0.769	S	S	*	*			trans	-146.4	131.2	-153.9	173.3	-171.9	178.9	-176.7	0	112.7
592	R	24.2	Very low	33.2	Very low	248 Å²	248	132.5 Å²	132.5	94%	0.936	75%	0.753	S	S	*	*			trans	-147.8	153.2	151.9	-149.2	158.9	-69.6	-147.6	2.9	110.6
593	G	25.8	Very low	36	Very low	68 Å²	68	129.9 Å²	129.9	70%	0.701	73%	0.73	S	S	*	*			trans	-90.6	174.1	-158.1	0	0	0	0	0	116.9
594	P	41.5	Very low	38.7	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	72%	0.72	S	S	*	*			trans	-99.2	158.1	-168.1	38.5	-35.7	0	0	0	114.6
595	T	29.4	Very low	41.6	Very low	145 Å²	145	127.4 Å²	127.4	89%	0.89	70%	0.699	S	S	*	*			trans	-169.2	92.1	141.8	10.7	0	0	0	0	108.8
596	E	31.8	Very low	44.4	Very low	186 Å²	186	129.4 Å²	129.4	87%	0.869	70%	0.701	S	S	*	*			trans	-73.8	136.5	167.5	-66.9	-177.8	139.8	0	0	109.4
597	K	34.6	Very low	47.4	Very low	196 Å²	196	128.3 Å²	128.3	85%	0.852	68%	0.681	S	S	*	*			trans	-114.4	116.9	163.4	-78.6	-171.7	174.8	-177.3	0	107.3	S599	K597-S599 PolarHBondContact O-N 3.2Å
598	N	33.1	Very low	50.6	Low	153 Å²	153	124.5 Å²	124.5	82%	0.818	65%	0.653	S	S	*	*			trans	-55.4	108.3	-173.8	-58.8	-1.9	0	0	0	111.6
599	S	33.6	Very low	53.5	Low	77 Å²	77	121.9 Å²	121.9	54%	0.538	64%	0.638	S	S	.	*			trans	-81.9	116.5	166.1	52.3	0	0	0	0	109	K597 S601	K597-S599 PolarHBondContact O-N 3.2Å; S599-S601 PolarHBondContact O-N 3.28Å
600	T	52.8	Low	56.5	Low	147 Å²	147	118.9 Å²	118.9	90%	0.902	63%	0.627	S	S	*	*			trans	-77.7	54.9	175.2	54.9	0	0	0	0	111.4
601	S	60.5	Low	59.7	Low	45 Å²	45	109.7 Å²	109.7	32%	0.315	58%	0.584	S	S	.	*			trans	-97.5	132.7	173.6	49.4	0	0	0	0	109.1	S599 I603 H604	S599-S601 PolarHBondContact O-N 3.28Å; S601-I603 VanDerWaalsContact CB-O 3.3Å; S601-I603 WeakPolarHBondContact CB-O 3.27Å; S601-I603 PolarHBondContact O-N 3.18Å; S601-I603 PolarHBondContact OG-O 2.86Å; S601-H604 PolarHBondContact O-CD2 3.35Å; S601-H604 PolarHBondContact O-NE2 2.96Å
602	P	73.2	Confident	62.9	Low	71 Å²	71	101.3 Å²	101.3	46%	0.461	55%	0.549	S	S	.	.	S	Bend	trans	-68.7	-1.3	-179	29	-35.6	0	0	0	113.7	R653 L654	P602-R653 PolarHBondContact O-NE 2.88Å; P602-R653 VanDerWaalsContact O-NE 3.09Å; P602-R653 PolarHBondContact O-NH2 2.89Å; P602-L654 HydrophobicContact CB-CD2 3.82Å; P602-L654 HydrophobicContact CG-CD2 3.93Å
603	I	83.8	Confident	66.2	Low	52 Å²	52	91.2 Å²	91.2	27%	0.267	52%	0.523	S	S	.	.			trans	-122.4	129.3	167.4	-60.1	178.9	0	0	0	106.7	S601 S605 E608 A609 V612 L654	S601-I603 VanDerWaalsContact CB-O 3.3Å; S601-I603 WeakPolarHBondContact CB-O 3.27Å; S601-I603 PolarHBondContact O-N 3.18Å; S601-I603 PolarHBondContact OG-O 2.86Å; I603-S605 WeakPolarHBondContact CG2-O 3.31Å; I603-E608 HydrophobicContact CG2-CB 3.82Å; I603-A609 HydrophobicContact CG2-CB 4.13Å; I603-V612 HydrophobicContact CD1-CG2 4.2Å; I603-L654 HydrophobicContact CD1-CD1 4.38Å; I603-L654 HydrophobicContact CG1-CD1 4.25Å; I603-L654 HydrophobicContact CG1-CD2 4.3Å
604	H	82.8	Confident	69.3	Low	121 Å²	121	90.7 Å²	90.7	56%	0.56	50%	0.503	S	S	*	.			trans	-113.4	-9.3	-175.1	-55.5	110.1	0	0	0	113.2	S601 E608 R653	S601-H604 PolarHBondContact O-CD2 3.35Å; S601-H604 PolarHBondContact O-NE2 2.96Å; H604-E608 PolarHBondContact N-OE2 3.5Å; H604-E608 IonicContact ND1-OE2 2.98Å; H604-R653 PolarHBondContact ND1-NH2 3.46Å; H604-R653 VanDerWaalsContact ND1-NH2 3.13Å
605	S	86.8	Confident	71.8	Confident	54 Å²	54	85 Å²	85	38%	0.378	47%	0.466	S	S	.	.	S	Bend	trans	-146.5	159.5	176.4	72.7	0	0	0	0	113.7	I603 R607 E608 A609	I603-S605 WeakPolarHBondContact CG2-O 3.31Å; S605-R607 VanDerWaalsContact C-N 3.27Å; S605-R607 PolarHBondContact O-N 3.01Å; S605-E608 PolarHBondContact N-OE2 3.34Å; S605-E608 PolarHBondContact O-N 2.98Å; S605-E608 WeakPolarHBondContact OG-CG 3.36Å; S605-E608 PolarHBondContact OG-N 3.46Å; S605-A609 PolarHBondContact O-N 2.93Å; S605-A609 VanDerWaalsContact O-N 3.12Å
606	E	85.6	Confident	74.9	Confident	161 Å²	161	79.1 Å²	79.1	75%	0.752	43%	0.431	S	S	*	.	H	α-helix	trans	-60.4	-35.7	172.2	-174	175.5	-165	0	0	112.2	E608 A609 L610	E606-E608 PolarHBondContact O-N 2.88Å; E606-A609 WeakPolarHBondContact O-CB 3.35Å; E606-A609 PolarHBondContact O-N 3.26Å; E606-L610 HydrophobicContact CG-CD1 4.4Å; E606-L610 WeakPolarHBondContact O-CG 3.34Å; E606-L610 PolarHBondContact O-N 2.92Å
607	R	86.8	Confident	77.7	Confident	80 Å²	80	74.6 Å²	74.6	30%	0.302	42%	0.416	S	S	.	.	H	α-helix	trans	-60.1	-44.6	174.2	-174.8	-179.7	-174.7	-118.5	7.7	111.4	S605 A609 L610 L611 D639 K641 E646	S605-R607 VanDerWaalsContact C-N 3.27Å; S605-R607 PolarHBondContact O-N 3.01Å; R607-A609 VanDerWaalsContact C-N 3.35Å; R607-L610 PolarHBondContact O-N 3.04Å; R607-L611 HydrophobicContact CG-CD1 4.17Å; R607-L611 WeakPolarHBondContact O-CB 3.4Å; R607-L611 VanDerWaalsContact O-CG 3.29Å; R607-L611 WeakPolarHBondContact O-CG 3.41Å; R607-L611 PolarHBondContact O-N 3.42Å; R607-D639 IonicContact CZ-OD2 3.84Å; R607-D639 IonicContact NE-OD2 2.7Å; R607-D639 IonicContact NH2-OD2 2.68Å; R607-D639 PolarHBondContact NH2-OD2 3.37Å; R607-K641 PolarHBondContact NH2-O 2.86Å; R607-E646 IonicContact CZ-OE1 2.69Å; R607-E646 IonicContact CZ-OE2 3.93Å; R607-E646 IonicContact NH1-OE1 2.61Å; R607-E646 PolarHBondContact NH1-OE1 2.96Å; R607-E646 IonicContact NH1-OE2 2.86Å; R607-E646 PolarHBondContact NH1-OE2 3.43Å
608	E	90.3	Very high	80.6	Confident	20 Å²	20	65.9 Å²	65.9	9%	0.093	38%	0.378	C	S	.	.	H	α-helix	trans	-64	-39.3	176	-72.6	-178.3	148.8	0	0	111.9	I603 H604 S605 E606 L611 V612 L650 R653	I603-E608 HydrophobicContact CG2-CB 3.82Å; H604-E608 PolarHBondContact N-OE2 3.5Å; H604-E608 IonicContact ND1-OE2 2.98Å; S605-E608 PolarHBondContact N-OE2 3.34Å; S605-E608 PolarHBondContact O-N 2.98Å; S605-E608 WeakPolarHBondContact OG-CG 3.36Å; S605-E608 PolarHBondContact OG-N 3.46Å; E606-E608 PolarHBondContact O-N 2.88Å; E608-L611 PolarHBondContact O-N 3.32Å; E608-V612 VanDerWaalsContact O-CG2 3.27Å; E608-V612 WeakPolarHBondContact O-CG2 3.45Å; E608-V612 PolarHBondContact O-N 2.89Å; E608-L650 HydrophobicContact CB-CD1 3.88Å; E608-L650 HydrophobicContact CB-CD2 4.09Å; E608-L650 HydrophobicContact CG-CD1 3.99Å; E608-L650 HydrophobicContact CG-CD2 4.15Å; E608-R653 IonicContact OE1-CZ 3.75Å; E608-R653 VanDerWaalsContact OE1-CZ 3.25Å; E608-R653 IonicContact OE1-NH1 2.71Å; E608-R653 PolarHBondContact OE1-NH1 2.89Å; E608-R653 IonicContact OE1-NH2 3.64Å; E608-R653 PolarHBondContact OE1-NH2 3.17Å; E608-R653 IonicContact OE2-CZ 3.64Å; E608-R653 IonicContact OE2-NH1 3.78Å; E608-R653 IonicContact OE2-NH2 2.72Å; E608-R653 PolarHBondContact OE2-NH2 3.32Å
609	A	90.4	Very high	83.4	Confident	47 Å²	47	58.8 Å²	58.8	39%	0.388	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-42.7	175.6	0	0	0	0	0	112.4	I603 S605 E606 R607 V612 G613	I603-A609 HydrophobicContact CG2-CB 4.13Å; S605-A609 PolarHBondContact O-N 2.93Å; S605-A609 VanDerWaalsContact O-N 3.12Å; E606-A609 WeakPolarHBondContact O-CB 3.35Å; E606-A609 PolarHBondContact O-N 3.26Å; R607-A609 VanDerWaalsContact C-N 3.35Å; A609-V612 PolarHBondContact O-N 3.03Å; A609-G613 PolarHBondContact O-N 3.13Å
610	L	90	Very high	86.1	Confident	109 Å²	109	60.5 Å²	60.5	57%	0.571	34%	0.34	S	S	*	.	H	α-helix	trans	-64.8	-43.1	175.4	-69.1	169.5	0	0	0	111.8	E606 R607 G613 I614	E606-L610 HydrophobicContact CG-CD1 4.4Å; E606-L610 WeakPolarHBondContact O-CG 3.34Å; E606-L610 PolarHBondContact O-N 2.92Å; R607-L610 PolarHBondContact O-N 3.04Å; L610-G613 PolarHBondContact O-N 3.29Å; L610-I614 WeakPolarHBondContact O-CG1 3.27Å; L610-I614 PolarHBondContact O-N 3.1Å
611	L	91.6	Very high	88	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.047	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-44.6	174.6	-72.4	170.8	0	0	0	111.7	R607 E608 G613 I614 I615 L635 I642 L650	R607-L611 HydrophobicContact CG-CD1 4.17Å; R607-L611 WeakPolarHBondContact O-CB 3.4Å; R607-L611 VanDerWaalsContact O-CG 3.29Å; R607-L611 WeakPolarHBondContact O-CG 3.41Å; R607-L611 PolarHBondContact O-N 3.42Å; E608-L611 PolarHBondContact O-N 3.32Å; L611-G613 VanDerWaalsContact C-N 3.31Å; L611-G613 PolarHBondContact O-N 2.95Å; L611-I614 PolarHBondContact O-N 3.4Å; L611-I615 HydrophobicContact CB-CD1 4.42Å; L611-I615 WeakPolarHBondContact O-CB 3.22Å; L611-I615 WeakPolarHBondContact O-CD1 3.5Å; L611-I615 WeakPolarHBondContact O-CG1 3.43Å; L611-I615 PolarHBondContact O-N 3.37Å; L611-L635 HydrophobicContact CD2-CD1 4.47Å; L611-L635 HydrophobicContact CD2-CD2 4.14Å; L611-I642 HydrophobicContact CD2-CD1 3.58Å; L611-I642 HydrophobicContact CD2-CG1 4.38Å; L611-L650 HydrophobicContact CB-CD2 3.88Å; L611-L650 HydrophobicContact CD1-CD2 4.25Å
612	V	93	Very high	89.3	Confident	18 Å²	18	58.5 Å²	58.5	11%	0.109	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-42.8	175	167.7	0	0	0	0	111.2	I603 E608 A609 S616 L650 L654 F658	I603-V612 HydrophobicContact CD1-CG2 4.2Å; E608-V612 VanDerWaalsContact O-CG2 3.27Å; E608-V612 WeakPolarHBondContact O-CG2 3.45Å; E608-V612 PolarHBondContact O-N 2.89Å; A609-V612 PolarHBondContact O-N 3.03Å; V612-S616 VanDerWaalsContact O-CB 3.28Å; V612-S616 WeakPolarHBondContact O-CB 3.25Å; V612-S616 PolarHBondContact O-N 3.48Å; V612-S616 PolarHBondContact O-OG 3.35Å; V612-L650 HydrophobicContact CG2-CD1 4.07Å; V612-L650 HydrophobicContact CG2-CD2 4.12Å; V612-L650 HydrophobicContact CG2-CG 4.09Å; V612-L654 HydrophobicContact CB-CD1 4.46Å; V612-L654 HydrophobicContact CG1-CD1 4.24Å; V612-L654 HydrophobicContact CG2-CD1 3.33Å; V612-F658 HydrophobicContact CG1-CE2 4.05Å; V612-F658 HydrophobicContact CG1-CZ 4.2Å; V612-F658 HydrophobicContact CG2-CE2 4.38Å
613	G	92.1	Very high	89.8	Confident	37 Å²	37	60.3 Å²	60.3	38%	0.381	33%	0.333	S	S	.	.	H	α-helix	trans	-60.1	-49.5	175.7	0	0	0	0	0	112.9	A609 L610 L611 S616 T617	A609-G613 PolarHBondContact O-N 3.13Å; L610-G613 PolarHBondContact O-N 3.29Å; L611-G613 VanDerWaalsContact C-N 3.31Å; L611-G613 PolarHBondContact O-N 2.95Å; G613-S616 PolarHBondContact O-N 2.98Å; G613-T617 PolarHBondContact O-N 2.84Å; G613-T617 VanDerWaalsContact O-N 3.12Å; G613-T617 PolarHBondContact O-OG1 3.37Å
614	I	92.4	Very high	89.9	Confident	57 Å²	57	65.6 Å²	65.6	29%	0.292	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-41.9	-179.1	-64.8	164.1	0	0	0	111.7	L610 L611 S616 T617 F618 Y634 L635 L638	L610-I614 WeakPolarHBondContact O-CG1 3.27Å; L610-I614 PolarHBondContact O-N 3.1Å; L611-I614 PolarHBondContact O-N 3.4Å; I614-S616 VanDerWaalsContact C-N 3.32Å; I614-T617 PolarHBondContact O-N 3.26Å; I614-T617 PolarHBondContact O-OG1 2.96Å; I614-T617 VanDerWaalsContact O-OG1 3.05Å; I614-F618 WeakPolarHBondContact O-CB 3.46Å; I614-F618 PolarHBondContact O-N 2.88Å; I614-Y634 HydrophobicContact CG2-CE1 3.87Å; I614-L635 HydrophobicContact CB-CD2 4.39Å; I614-L635 HydrophobicContact CG2-CD2 3.68Å; I614-L638 HydrophobicContact CD1-CD1 4.46Å; I614-L638 HydrophobicContact CG2-CD1 3.9Å
615	I	94.3	Very high	90.2	Very high	1 Å²	1	60 Å²	60	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-71.1	-31.8	178.8	-58.2	159.6	0	0	0	110.7	L611 L619 I631 L635 V647 L651 F658	L611-I615 HydrophobicContact CB-CD1 4.42Å; L611-I615 WeakPolarHBondContact O-CB 3.22Å; L611-I615 WeakPolarHBondContact O-CD1 3.5Å; L611-I615 WeakPolarHBondContact O-CG1 3.43Å; L611-I615 PolarHBondContact O-N 3.37Å; I615-L619 HydrophobicContact CG2-CD1 3.73Å; I615-L619 HydrophobicContact CG2-CG 3.98Å; I615-L619 WeakPolarHBondContact O-CB 3.22Å; I615-L619 WeakPolarHBondContact O-CG 3.22Å; I615-L619 PolarHBondContact O-N 3.39Å; I615-I631 HydrophobicContact CD1-CG2 4.47Å; I615-I631 HydrophobicContact CG1-CG2 4.11Å; I615-I631 HydrophobicContact CG2-CG2 4.1Å; I615-L635 HydrophobicContact CD1-CD1 3.96Å; I615-L635 HydrophobicContact CG1-CD1 3.91Å; I615-L635 HydrophobicContact CG1-CD2 4.15Å; I615-L635 HydrophobicContact CG1-CG 4.42Å; I615-V647 HydrophobicContact CD1-CG1 3.81Å; I615-L651 HydrophobicContact CD1-CD2 4.17Å; I615-L651 HydrophobicContact CG2-CD2 3.89Å; I615-F658 HydrophobicContact CB-CE1 4.34Å; I615-F658 HydrophobicContact CB-CZ 4.29Å; I615-F658 HydrophobicContact CG2-CE1 3.92Å; I615-F658 HydrophobicContact CG2-CZ 4.29Å
616	S	93.5	Very high	90.5	Very high	20 Å²	20	57.5 Å²	57.5	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-46.9	173.6	-59.8	0	0	0	0	111.9	V612 G613 I614 H620 F658 F675	V612-S616 VanDerWaalsContact O-CB 3.28Å; V612-S616 WeakPolarHBondContact O-CB 3.25Å; V612-S616 PolarHBondContact O-N 3.48Å; V612-S616 PolarHBondContact O-OG 3.35Å; G613-S616 PolarHBondContact O-N 2.98Å; I614-S616 VanDerWaalsContact C-N 3.32Å; S616-H620 VanDerWaalsContact O-CB 3.24Å; S616-H620 WeakPolarHBondContact O-CB 3.33Å; S616-H620 PolarHBondContact O-N 2.9Å; S616-F658 WeakPolarHBondContact OG-CZ 3.21Å; S616-F675 WeakPolarHBondContact OG-CE2 3.39Å
617	T	91.6	Very high	90.9	Very high	92 Å²	92	50.5 Å²	50.5	56%	0.564	28%	0.281	S	S	*	.	H	α-helix	trans	-69.3	-35.4	178.9	54.7	0	0	0	0	112.5	G613 I614	G613-T617 PolarHBondContact O-N 2.84Å; G613-T617 VanDerWaalsContact O-N 3.12Å; G613-T617 PolarHBondContact O-OG1 3.37Å; I614-T617 PolarHBondContact O-N 3.26Å; I614-T617 PolarHBondContact O-OG1 2.96Å; I614-T617 VanDerWaalsContact O-OG1 3.05Å
618	F	93.9	Very high	91.2	Very high	12 Å²	12	47.4 Å²	47.4	5%	0.053	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-56.3	172.1	178.1	-100.7	0	0	0	111.9	I614 H620 V621 H622 A626 Y630 I631 Y634	I614-F618 WeakPolarHBondContact O-CB 3.46Å; I614-F618 PolarHBondContact O-N 2.88Å; F618-H620 VanDerWaalsContact C-N 3.28Å; F618-H620 PolarHBondContact O-N 3.02Å; F618-V621 WeakPolarHBondContact O-CG2 3.46Å; F618-V621 PolarHBondContact O-N 3.03Å; F618-H622 AromaticContact CD1-CD2 3.94Å; F618-H622 AromaticContact CD2-NE2 3.8Å; F618-H622 AromaticContact CE1-CD2 3.68Å; F618-H622 AromaticContact CE1-NE2 3.98Å; F618-H622 AromaticContact CE2-CD2 3.76Å; F618-H622 AromaticContact CE2-NE2 3.27Å; F618-H622 VanDerWaalsContact CE2-NE2 3.27Å; F618-H622 WeakPolarHBondContact CE2-NE2 3.45Å; F618-H622 AromaticContact CZ-CD2 3.59Å; F618-H622 AromaticContact CZ-NE2 3.37Å; F618-H622 WeakPolarHBondContact CZ-NE2 3.42Å; F618-H622 PolarHBondContact O-CD2 3.48Å; F618-A626 HydrophobicContact CE1-CB 3.85Å; F618-A626 HydrophobicContact CZ-CB 4.5Å; F618-Y630 HydrophobicContact CZ-CD1 4.05Å; F618-Y630 AromaticContact CZ-CE1 3.85Å; F618-Y630 HydrophobicContact CZ-CE1 3.85Å; F618-Y630 HydrophobicContact CZ-CE2 4.4Å; F618-Y630 HydrophobicContact CZ-CG 4.4Å; F618-I631 HydrophobicContact CD1-CG1 4.22Å; F618-I631 HydrophobicContact CE1-CB 4.44Å; F618-I631 HydrophobicContact CE1-CG1 3.79Å; F618-Y634 HydrophobicContact CB-CD1 4.26Å; F618-Y634 HydrophobicContact CB-CE1 4.09Å; F618-Y634 AromaticContact CD2-CD1 3.53Å; F618-Y634 HydrophobicContact CD2-CD1 3.53Å; F618-Y634 AromaticContact CD2-CD2 3.78Å; F618-Y634 HydrophobicContact CD2-CD2 3.78Å; F618-Y634 AromaticContact CD2-CE1 3.82Å; F618-Y634 HydrophobicContact CD2-CE1 3.82Å; F618-Y634 HydrophobicContact CD2-CE2 4.05Å; F618-Y634 AromaticContact CD2-CG 3.51Å; F618-Y634 HydrophobicContact CD2-CG 3.51Å; F618-Y634 HydrophobicContact CE2-CD1 4.02Å; F618-Y634 AromaticContact CE2-CD2 3.77Å; F618-Y634 HydrophobicContact CE2-CD2 3.77Å; F618-Y634 HydrophobicContact CE2-CE2 4.43Å; F618-Y634 AromaticContact CE2-CG 3.53Å; F618-Y634 HydrophobicContact CE2-CG 3.53Å; F618-Y634 AromaticContact CG-CD1 3.95Å; F618-Y634 HydrophobicContact CG-CD1 3.95Å; F618-Y634 HydrophobicContact CG-CE1 4.21Å; F618-Y634 HydrophobicContact CG-CG 4.32Å; F618-Y634 HydrophobicContact CZ-CG 4.36Å
619	L	92.9	Very high	91.2	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-68.4	-25.3	-177.1	-71.1	-178.2	0	0	0	113.3	I615 V621 H622 A626 I631 F658 W673 F675	I615-L619 HydrophobicContact CG2-CD1 3.73Å; I615-L619 HydrophobicContact CG2-CG 3.98Å; I615-L619 WeakPolarHBondContact O-CB 3.22Å; I615-L619 WeakPolarHBondContact O-CG 3.22Å; I615-L619 PolarHBondContact O-N 3.39Å; L619-V621 VanDerWaalsContact C-N 3.25Å; L619-V621 PolarHBondContact O-N 2.96Å; L619-H622 PolarHBondContact O-N 3.38Å; L619-H622 VanDerWaalsContact O-N 3.13Å; L619-A626 HydrophobicContact CD2-CB 3.76Å; L619-I631 HydrophobicContact CD1-CD1 4.32Å; L619-I631 HydrophobicContact CD2-CD1 4.09Å; L619-I631 HydrophobicContact CD2-CG1 4.24Å; L619-F658 HydrophobicContact CD1-CD1 3.8Å; L619-F658 HydrophobicContact CD1-CE1 4.11Å; L619-W673 HydrophobicContact CD1-CB 4Å; L619-W673 WeakPolarHBondContact CD2-O 3.43Å; L619-F675 HydrophobicContact CB-CB 3.75Å
620	H	89.8	Confident	91.3	Very high	114 Å²	114	55.5 Å²	55.5	53%	0.528	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-29.7	175.5	-175.6	27.1	0	0	0	113.1	S616 F618 F675 F678	S616-H620 VanDerWaalsContact O-CB 3.24Å; S616-H620 WeakPolarHBondContact O-CB 3.33Å; S616-H620 PolarHBondContact O-N 2.9Å; F618-H620 VanDerWaalsContact C-N 3.28Å; F618-H620 PolarHBondContact O-N 3.02Å; H620-F675 HydrophobicContact CB-CD1 4.39Å; H620-F678 AromaticContact CE1-CE2 3.78Å; H620-F678 AromaticContact NE2-CE2 3.86Å
621	V	92.2	Very high	91.5	Very high	104 Å²	104	50.4 Å²	50.4	63%	0.63	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	3.1	175.8	-60	0	0	0	0	113.8	F618 L619 P623	F618-V621 WeakPolarHBondContact O-CG2 3.46Å; F618-V621 PolarHBondContact O-N 3.03Å; L619-V621 VanDerWaalsContact C-N 3.25Å; L619-V621 PolarHBondContact O-N 2.96Å; V621-P623 WeakPolarHBondContact O-CD 3.27Å
622	H	89.3	Confident	91.5	Very high	45 Å²	45	50.1 Å²	50.1	21%	0.208	27%	0.268	C	S	.	.			trans	-113.7	86.9	177.1	-71.6	-58.4	0	0	0	110.8	F618 L619 F624 G625 Y630	F618-H622 AromaticContact CD1-CD2 3.94Å; F618-H622 AromaticContact CD2-NE2 3.8Å; F618-H622 AromaticContact CE1-CD2 3.68Å; F618-H622 AromaticContact CE1-NE2 3.98Å; F618-H622 AromaticContact CE2-CD2 3.76Å; F618-H622 AromaticContact CE2-NE2 3.27Å; F618-H622 VanDerWaalsContact CE2-NE2 3.27Å; F618-H622 WeakPolarHBondContact CE2-NE2 3.45Å; F618-H622 AromaticContact CZ-CD2 3.59Å; F618-H622 AromaticContact CZ-NE2 3.37Å; F618-H622 WeakPolarHBondContact CZ-NE2 3.42Å; F618-H622 PolarHBondContact O-CD2 3.48Å; L619-H622 PolarHBondContact O-N 3.38Å; L619-H622 VanDerWaalsContact O-N 3.13Å; H622-F624 PolarHBondContact O-N 3.34Å; H622-F624 VanDerWaalsContact O-N 3.1Å; H622-G625 PolarHBondContact O-N 2.87Å; H622-Y630 AromaticContact CE1-CE1 3.92Å; H622-Y630 AromaticContact NE2-CE1 3.99Å
623	P	82.4	Confident	91.4	Very high	109 Å²	109	51.7 Å²	51.7	71%	0.708	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.7	-172.6	27.5	-36.4	0	0	0	114.8	V621	V621-P623 WeakPolarHBondContact O-CD 3.27Å
624	F	86.3	Confident	91.4	Very high	164 Å²	164	53.7 Å²	53.7	72%	0.719	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	15.3	173.9	-52.1	-66.8	0	0	0	112.5	H622 R672	H622-F624 PolarHBondContact O-N 3.34Å; H622-F624 VanDerWaalsContact O-N 3.1Å; F624-R672 WeakPolarHBondContact O-CD 3.35Å; F624-R672 PolarHBondContact O-NH1 3.28Å
625	G	89.7	Confident	91.2	Very high	4 Å²	4	51 Å²	51	4%	0.041	26%	0.263	C	S	.	.			trans	67	-176.6	-178.6	0	0	0	0	0	114.7	H622 R672 W673 N674	H622-G625 PolarHBondContact O-N 2.87Å; G625-R672 PolarHBondContact O-NH1 3.01Å; G625-R672 VanDerWaalsContact O-NH1 3.15Å; G625-W673 WeakPolarHBondContact CA-O 3.44Å; G625-N674 WeakPolarHBondContact CA-OD1 3.42Å; G625-N674 PolarHBondContact N-OD1 2.95Å
626	A	93.2	Very high	91	Very high	1 Å²	1	55 Å²	55	1%	0.008	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-139.5	145.5	177	0	0	0	0	0	111.6	F618 L619 Y630 I631 R672 W673	F618-A626 HydrophobicContact CE1-CB 3.85Å; F618-A626 HydrophobicContact CZ-CB 4.5Å; L619-A626 HydrophobicContact CD2-CB 3.76Å; A626-Y630 HydrophobicContact CB-CD1 3.66Å; A626-Y630 HydrophobicContact CB-CE1 4.4Å; A626-Y630 HydrophobicContact CB-CG 4.47Å; A626-I631 HydrophobicContact CB-CD1 4.26Å; A626-I631 HydrophobicContact CB-CG1 3.79Å; A626-R672 WeakPolarHBondContact O-CA 3.42Å; A626-W673 PolarHBondContact N-O 3.34Å; A626-W673 VanDerWaalsContact N-O 3.11Å; A626-W673 PolarHBondContact O-N 2.92Å
627	S	93.2	Very high	90.7	Very high	13 Å²	13	62.6 Å²	62.6	9%	0.091	31%	0.307	C	S	.	.			trans	-67.8	157.3	168.5	32.7	0	0	0	0	111.7	E629 Y630 I631 E670 K671	S627-E629 PolarHBondContact O-N 2.82Å; S627-Y630 PolarHBondContact O-N 3.39Å; S627-Y630 VanDerWaalsContact O-N 3.1Å; S627-I631 WeakPolarHBondContact O-CG1 3.34Å; S627-I631 PolarHBondContact O-N 3.48Å; S627-E670 WeakPolarHBondContact CB-OE1 3.38Å; S627-E670 PolarHBondContact OG-OE1 2.82Å; S627-K671 WeakPolarHBondContact CA-O 3.36Å
628	I	93.1	Very high	90.3	Very high	16 Å²	16	63.3 Å²	63.3	8%	0.082	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-33.7	-176.1	-173.8	64.2	0	0	0	111.4	C632 V647 E648 L651	I628-C632 WeakPolarHBondContact O-CB 3.49Å; I628-C632 PolarHBondContact O-N 3.01Å; I628-C632 PolarHBondContact O-SG 3.44Å; I628-V647 HydrophobicContact CD1-CB 3.97Å; I628-V647 HydrophobicContact CD1-CG1 3.67Å; I628-E648 HydrophobicContact CD1-CB 4.05Å; I628-E648 HydrophobicContact CG1-CB 4.15Å; I628-L651 HydrophobicContact CD1-CD1 4.28Å
629	E	90.8	Very high	89.7	Confident	131 Å²	131	65.1 Å²	65.1	61%	0.612	32%	0.317	S	S	*	.	H	α-helix	trans	-61.2	-43.8	173.6	-64.1	71.7	-159.7	0	0	111.7	S627 C632 S633	S627-E629 PolarHBondContact O-N 2.82Å; E629-C632 PolarHBondContact O-N 2.77Å; E629-S633 WeakPolarHBondContact O-CB 3.24Å; E629-S633 PolarHBondContact O-N 2.91Å
630	Y	92.8	Very high	89	Confident	106 Å²	106	70.9 Å²	70.9	42%	0.416	35%	0.353	S	S	.	.	H	α-helix	trans	-71.3	-42.1	-179.9	-177.2	-145.5	0	0	0	111.8	F618 H622 A626 S627 C632 S633 Y634	F618-Y630 HydrophobicContact CZ-CD1 4.05Å; F618-Y630 AromaticContact CZ-CE1 3.85Å; F618-Y630 HydrophobicContact CZ-CE1 3.85Å; F618-Y630 HydrophobicContact CZ-CE2 4.4Å; F618-Y630 HydrophobicContact CZ-CG 4.4Å; H622-Y630 AromaticContact CE1-CE1 3.92Å; H622-Y630 AromaticContact NE2-CE1 3.99Å; A626-Y630 HydrophobicContact CB-CD1 3.66Å; A626-Y630 HydrophobicContact CB-CE1 4.4Å; A626-Y630 HydrophobicContact CB-CG 4.47Å; S627-Y630 PolarHBondContact O-N 3.39Å; S627-Y630 VanDerWaalsContact O-N 3.1Å; Y630-C632 VanDerWaalsContact C-N 3.31Å; Y630-C632 PolarHBondContact O-N 3.47Å; Y630-S633 PolarHBondContact O-N 2.85Å; Y630-Y634 PolarHBondContact O-N 3.2Å
631	I	93.1	Very high	88.7	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-57.5	-46	172.1	-63.7	164.7	0	0	0	110	I615 F618 L619 A626 S627 Y634 L635 V647 L651 W673	I615-I631 HydrophobicContact CD1-CG2 4.47Å; I615-I631 HydrophobicContact CG1-CG2 4.11Å; I615-I631 HydrophobicContact CG2-CG2 4.1Å; F618-I631 HydrophobicContact CD1-CG1 4.22Å; F618-I631 HydrophobicContact CE1-CB 4.44Å; F618-I631 HydrophobicContact CE1-CG1 3.79Å; L619-I631 HydrophobicContact CD1-CD1 4.32Å; L619-I631 HydrophobicContact CD2-CD1 4.09Å; L619-I631 HydrophobicContact CD2-CG1 4.24Å; A626-I631 HydrophobicContact CB-CD1 4.26Å; A626-I631 HydrophobicContact CB-CG1 3.79Å; S627-I631 WeakPolarHBondContact O-CG1 3.34Å; S627-I631 PolarHBondContact O-N 3.48Å; I631-Y634 PolarHBondContact O-N 3.48Å; I631-L635 HydrophobicContact CG2-CD1 3.83Å; I631-L635 HydrophobicContact CG2-CG 4.35Å; I631-L635 WeakPolarHBondContact O-CB 3.34Å; I631-L635 VanDerWaalsContact O-CG 3.28Å; I631-L635 WeakPolarHBondContact O-CG 3.34Å; I631-L635 PolarHBondContact O-N 3.14Å; I631-V647 HydrophobicContact CG2-CG1 4.15Å; I631-L651 HydrophobicContact CD1-CD1 4.24Å; I631-W673 HydrophobicContact CD1-CB 3.88Å; I631-W673 HydrophobicContact CD1-CG 4.25Å
632	C	91.3	Very high	88.3	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.02	33%	0.332	C	S	.	.	H	α-helix	trans	-67.4	-37.5	178.1	-66.8	0	0	0	0	112.6	I628 E629 Y630 Y634 L635 Q636 P644	I628-C632 WeakPolarHBondContact O-CB 3.49Å; I628-C632 PolarHBondContact O-N 3.01Å; I628-C632 PolarHBondContact O-SG 3.44Å; E629-C632 PolarHBondContact O-N 2.77Å; Y630-C632 VanDerWaalsContact C-N 3.31Å; Y630-C632 PolarHBondContact O-N 3.47Å; C632-Y634 VanDerWaalsContact C-N 3.29Å; C632-Y634 PolarHBondContact O-N 2.9Å; C632-L635 PolarHBondContact O-N 2.91Å; C632-Q636 VanDerWaalsContact O-CB 3.28Å; C632-Q636 WeakPolarHBondContact O-CB 3.49Å; C632-Q636 WeakPolarHBondContact O-CG 3.39Å; C632-Q636 PolarHBondContact O-N 3.08Å; C632-P644 HydrophobicContact CB-CG 4.24Å; C632-P644 VanDerWaalsContact SG-CA 3.55Å
633	S	91.1	Very high	88.2	Confident	52 Å²	52	70.5 Å²	70.5	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-31.6	174.6	-175.8	0	0	0	0	113.1	E629 Y630 R637	E629-S633 WeakPolarHBondContact O-CB 3.24Å; E629-S633 PolarHBondContact O-N 2.91Å; Y630-S633 PolarHBondContact O-N 2.85Å; S633-R637 WeakPolarHBondContact O-CG 3.23Å; S633-R637 PolarHBondContact O-NE 3.48Å
634	Y	91.7	Very high	88.4	Confident	78 Å²	78	68.1 Å²	68.1	31%	0.306	33%	0.33	S	S	.	.	H	α-helix	trans	-71.3	-53	170.1	175.9	-102.1	0	0	0	111	I614 F618 Y630 I631 C632 Q636 R637 L638	I614-Y634 HydrophobicContact CG2-CE1 3.87Å; F618-Y634 HydrophobicContact CB-CD1 4.26Å; F618-Y634 HydrophobicContact CB-CE1 4.09Å; F618-Y634 AromaticContact CD2-CD1 3.53Å; F618-Y634 HydrophobicContact CD2-CD1 3.53Å; F618-Y634 AromaticContact CD2-CD2 3.78Å; F618-Y634 HydrophobicContact CD2-CD2 3.78Å; F618-Y634 AromaticContact CD2-CE1 3.82Å; F618-Y634 HydrophobicContact CD2-CE1 3.82Å; F618-Y634 HydrophobicContact CD2-CE2 4.05Å; F618-Y634 AromaticContact CD2-CG 3.51Å; F618-Y634 HydrophobicContact CD2-CG 3.51Å; F618-Y634 HydrophobicContact CE2-CD1 4.02Å; F618-Y634 AromaticContact CE2-CD2 3.77Å; F618-Y634 HydrophobicContact CE2-CD2 3.77Å; F618-Y634 HydrophobicContact CE2-CE2 4.43Å; F618-Y634 AromaticContact CE2-CG 3.53Å; F618-Y634 HydrophobicContact CE2-CG 3.53Å; F618-Y634 AromaticContact CG-CD1 3.95Å; F618-Y634 HydrophobicContact CG-CD1 3.95Å; F618-Y634 HydrophobicContact CG-CE1 4.21Å; F618-Y634 HydrophobicContact CG-CG 4.32Å; F618-Y634 HydrophobicContact CZ-CG 4.36Å; Y630-Y634 PolarHBondContact O-N 3.2Å; I631-Y634 PolarHBondContact O-N 3.48Å; C632-Y634 VanDerWaalsContact C-N 3.29Å; C632-Y634 PolarHBondContact O-N 2.9Å; Y634-Q636 VanDerWaalsContact C-N 3.35Å; Y634-Q636 PolarHBondContact O-N 3.3Å; Y634-R637 WeakPolarHBondContact O-CB 3.4Å; Y634-R637 PolarHBondContact O-N 3.03Å; Y634-R637 VanDerWaalsContact O-N 3.16Å; Y634-L638 HydrophobicContact CE1-CD1 4.2Å
635	L	90	Very high	88.5	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-37.2	-177.6	-74.7	175.5	0	0	0	113.9	L611 I614 I615 I631 C632 R637 L638 D639 I642 V647	L611-L635 HydrophobicContact CD2-CD1 4.47Å; L611-L635 HydrophobicContact CD2-CD2 4.14Å; I614-L635 HydrophobicContact CB-CD2 4.39Å; I614-L635 HydrophobicContact CG2-CD2 3.68Å; I615-L635 HydrophobicContact CD1-CD1 3.96Å; I615-L635 HydrophobicContact CG1-CD1 3.91Å; I615-L635 HydrophobicContact CG1-CD2 4.15Å; I615-L635 HydrophobicContact CG1-CG 4.42Å; I631-L635 HydrophobicContact CG2-CD1 3.83Å; I631-L635 HydrophobicContact CG2-CG 4.35Å; I631-L635 WeakPolarHBondContact O-CB 3.34Å; I631-L635 VanDerWaalsContact O-CG 3.28Å; I631-L635 WeakPolarHBondContact O-CG 3.34Å; I631-L635 PolarHBondContact O-N 3.14Å; C632-L635 PolarHBondContact O-N 2.91Å; L635-R637 PolarHBondContact O-N 3.49Å; L635-R637 VanDerWaalsContact O-N 3.14Å; L635-L638 WeakPolarHBondContact O-CA 3.48Å; L635-L638 WeakPolarHBondContact O-CB 3.21Å; L635-L638 PolarHBondContact O-N 3.15Å; L635-D639 PolarHBondContact O-N 3.37Å; L635-I642 HydrophobicContact CB-CD1 3.72Å; L635-I642 HydrophobicContact CB-CG2 4.03Å; L635-I642 HydrophobicContact CD1-CD1 4.48Å; L635-I642 HydrophobicContact CD1-CG2 4.06Å; L635-I642 HydrophobicContact CD2-CD1 4.36Å; L635-I642 HydrophobicContact CG-CD1 4.42Å; L635-V647 HydrophobicContact CD1-CG1 4.21Å; L635-V647 HydrophobicContact CD1-CG2 3.92Å
636	Q	90.2	Very high	88.5	Confident	84 Å²	84	67.7 Å²	67.7	39%	0.393	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.5	179.6	-75.9	171.4	-5.2	0	0	113.8	C632 Y634 L638 D639 I642	C632-Q636 VanDerWaalsContact O-CB 3.28Å; C632-Q636 WeakPolarHBondContact O-CB 3.49Å; C632-Q636 WeakPolarHBondContact O-CG 3.39Å; C632-Q636 PolarHBondContact O-N 3.08Å; Y634-Q636 VanDerWaalsContact C-N 3.35Å; Y634-Q636 PolarHBondContact O-N 3.3Å; Q636-L638 VanDerWaalsContact C-N 3.29Å; Q636-D639 WeakPolarHBondContact CA-O 3.41Å; Q636-I642 HydrophobicContact CG-CB 4.33Å; Q636-I642 PolarHBondContact NE2-O 2.88Å
637	R	86.3	Confident	88.3	Confident	180 Å²	180	67.6 Å²	67.6	68%	0.679	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.4	169.5	-54.9	169.5	-160.3	-163.1	-0.1	112.4	S633 Y634 L635	S633-R637 WeakPolarHBondContact O-CG 3.23Å; S633-R637 PolarHBondContact O-NE 3.48Å; Y634-R637 WeakPolarHBondContact O-CB 3.4Å; Y634-R637 PolarHBondContact O-N 3.03Å; Y634-R637 VanDerWaalsContact O-N 3.16Å; L635-R637 PolarHBondContact O-N 3.49Å; L635-R637 VanDerWaalsContact O-N 3.14Å
638	L	83.1	Confident	88.3	Confident	108 Å²	108	69.9 Å²	69.9	57%	0.565	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-43.2	-178.3	-55.2	175.6	0	0	0	111.6	I614 Y634 L635 Q636	I614-L638 HydrophobicContact CD1-CD1 4.46Å; I614-L638 HydrophobicContact CG2-CD1 3.9Å; Y634-L638 HydrophobicContact CE1-CD1 4.2Å; L635-L638 WeakPolarHBondContact O-CA 3.48Å; L635-L638 WeakPolarHBondContact O-CB 3.21Å; L635-L638 PolarHBondContact O-N 3.15Å; Q636-L638 VanDerWaalsContact C-N 3.29Å
639	D	81.5	Confident	88.1	Confident	49 Å²	49	71.4 Å²	71.4	26%	0.262	36%	0.364	S	S	.	.			trans	-138.9	115.9	171.4	172	19.8	0	0	0	110.5	R607 L635 Q636 K641 I642	R607-D639 IonicContact CZ-OD2 3.84Å; R607-D639 IonicContact NE-OD2 2.7Å; R607-D639 IonicContact NH2-OD2 2.68Å; R607-D639 PolarHBondContact NH2-OD2 3.37Å; L635-D639 PolarHBondContact O-N 3.37Å; Q636-D639 WeakPolarHBondContact CA-O 3.41Å; D639-K641 PolarHBondContact O-N 3.14Å; D639-K641 VanDerWaalsContact O-N 3.12Å; D639-K641 WeakPolarHBondContact OD1-CB 3.1Å; D639-K641 PolarHBondContact OD1-N 3.1Å; D639-I642 HydrophobicContact CB-CD1 3.8Å; D639-I642 HydrophobicContact CB-CG1 4.01Å; D639-I642 WeakPolarHBondContact O-CG1 3.48Å; D639-I642 PolarHBondContact O-N 3.43Å
640	T	78.8	Confident	88.2	Confident	126 Å²	126	65.2 Å²	65.2	77%	0.773	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-2.9	-178.9	54.1	0	0	0	0	114
641	K	82.3	Confident	88.1	Confident	156 Å²	156	60.2 Å²	60.2	68%	0.678	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	14.9	176.8	-56.6	176.7	-178.6	174.6	0	113.8	R607 D639 N643	R607-K641 PolarHBondContact NH2-O 2.86Å; D639-K641 PolarHBondContact O-N 3.14Å; D639-K641 VanDerWaalsContact O-N 3.12Å; D639-K641 WeakPolarHBondContact OD1-CB 3.1Å; D639-K641 PolarHBondContact OD1-N 3.1Å; K641-N643 PolarHBondContact O-ND2 3.16Å
642	I	85	Confident	88	Confident	6 Å²	6	63.5 Å²	63.5	3%	0.031	34%	0.338	C	S	.	.			trans	-85.3	119.1	-177.1	-70.8	176.4	0	0	0	111.3	L611 L635 Q636 D639 V647	L611-I642 HydrophobicContact CD2-CD1 3.58Å; L611-I642 HydrophobicContact CD2-CG1 4.38Å; L635-I642 HydrophobicContact CB-CD1 3.72Å; L635-I642 HydrophobicContact CB-CG2 4.03Å; L635-I642 HydrophobicContact CD1-CD1 4.48Å; L635-I642 HydrophobicContact CD1-CG2 4.06Å; L635-I642 HydrophobicContact CD2-CD1 4.36Å; L635-I642 HydrophobicContact CG-CD1 4.42Å; Q636-I642 HydrophobicContact CG-CB 4.33Å; Q636-I642 PolarHBondContact NE2-O 2.88Å; D639-I642 HydrophobicContact CB-CD1 3.8Å; D639-I642 HydrophobicContact CB-CG1 4.01Å; D639-I642 WeakPolarHBondContact O-CG1 3.48Å; D639-I642 PolarHBondContact O-N 3.43Å; I642-V647 HydrophobicContact CG2-CG2 3.58Å
643	N	86.1	Confident	88	Confident	93 Å²	93	67.1 Å²	67.1	50%	0.497	35%	0.351	S	S	.	.			trans	-98.1	129.9	-177.9	-56.3	-72.8	0	0	0	110.5	K641 S645 E646 V647	K641-N643 PolarHBondContact O-ND2 3.16Å; N643-S645 VanDerWaalsContact C-N 3.32Å; N643-S645 PolarHBondContact O-N 2.83Å; N643-E646 HydrophobicContact CB-CB 4.1Å; N643-E646 WeakPolarHBondContact O-CB 3.2Å; N643-E646 PolarHBondContact O-N 2.68Å; N643-V647 PolarHBondContact O-N 2.92Å
644	P	87.9	Confident	88	Confident	59 Å²	59	65.5 Å²	65.5	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-56.5	-40	-178.3	-28.3	35.6	0	0	0	114.9	C632 E646 V647 E648	C632-P644 HydrophobicContact CB-CG 4.24Å; C632-P644 VanDerWaalsContact SG-CA 3.55Å; P644-E646 VanDerWaalsContact C-N 3.31Å; P644-E646 PolarHBondContact O-N 3.35Å; P644-V647 PolarHBondContact O-N 2.89Å; P644-E648 PolarHBondContact O-N 3.1Å
645	S	87.1	Confident	87.7	Confident	95 Å²	95	66.3 Å²	66.3	66%	0.664	35%	0.353	S	S	*	.	H	α-helix	trans	-68.5	-26.2	178.5	-46.1	0	0	0	0	113.8	N643 A649	N643-S645 VanDerWaalsContact C-N 3.32Å; N643-S645 PolarHBondContact O-N 2.83Å; S645-A649 VanDerWaalsContact O-CB 3.26Å; S645-A649 WeakPolarHBondContact O-CB 3.49Å; S645-A649 PolarHBondContact O-N 2.94Å
646	E	89.7	Confident	87.3	Confident	63 Å²	63	70.8 Å²	70.8	29%	0.294	38%	0.383	S	S	.	.	H	α-helix	trans	-71	-43.6	173.1	-174.5	-176.2	-170.8	0	0	110	R607 N643 P644 L650	R607-E646 IonicContact CZ-OE1 2.69Å; R607-E646 IonicContact CZ-OE2 3.93Å; R607-E646 IonicContact NH1-OE1 2.61Å; R607-E646 PolarHBondContact NH1-OE1 2.96Å; R607-E646 IonicContact NH1-OE2 2.86Å; R607-E646 PolarHBondContact NH1-OE2 3.43Å; N643-E646 HydrophobicContact CB-CB 4.1Å; N643-E646 WeakPolarHBondContact O-CB 3.2Å; N643-E646 PolarHBondContact O-N 2.68Å; P644-E646 VanDerWaalsContact C-N 3.31Å; P644-E646 PolarHBondContact O-N 3.35Å; E646-L650 WeakPolarHBondContact O-CB 3.24Å; E646-L650 PolarHBondContact O-N 2.84Å
647	V	90.4	Very high	87.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-66.5	-46.6	177.2	-178.8	0	0	0	0	111.1	I615 I628 I631 L635 I642 N643 P644 A649 L650 L651	I615-V647 HydrophobicContact CD1-CG1 3.81Å; I628-V647 HydrophobicContact CD1-CB 3.97Å; I628-V647 HydrophobicContact CD1-CG1 3.67Å; I631-V647 HydrophobicContact CG2-CG1 4.15Å; L635-V647 HydrophobicContact CD1-CG1 4.21Å; L635-V647 HydrophobicContact CD1-CG2 3.92Å; I642-V647 HydrophobicContact CG2-CG2 3.58Å; N643-V647 PolarHBondContact O-N 2.92Å; P644-V647 PolarHBondContact O-N 2.89Å; V647-A649 VanDerWaalsContact C-N 3.32Å; V647-A649 PolarHBondContact O-N 3.37Å; V647-L650 PolarHBondContact O-N 3.2Å; V647-L651 HydrophobicContact CG1-CD1 3.97Å; V647-L651 HydrophobicContact CG1-CG 4.3Å; V647-L651 VanDerWaalsContact O-CG 3.32Å; V647-L651 WeakPolarHBondContact O-CG 3.32Å; V647-L651 PolarHBondContact O-N 2.89Å
648	E	91.9	Very high	87.5	Confident	60 Å²	60	60 Å²	60	28%	0.28	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-39.4	179.2	-161.5	179.7	-163.9	0	0	111.7	I628 P644 S652 Q660 K671 W673	I628-E648 HydrophobicContact CD1-CB 4.05Å; I628-E648 HydrophobicContact CG1-CB 4.15Å; P644-E648 PolarHBondContact O-N 3.1Å; E648-S652 VanDerWaalsContact O-CB 3.26Å; E648-S652 WeakPolarHBondContact O-CB 3.49Å; E648-S652 PolarHBondContact O-N 3.37Å; E648-S652 PolarHBondContact O-OG 2.96Å; E648-Q660 PolarHBondContact OE1-NE2 3.25Å; E648-K671 IonicContact OE1-NZ 2.88Å; E648-W673 HydrophobicContact CG-CZ2 3.86Å
649	A	89.6	Confident	87.8	Confident	49 Å²	49	60.2 Å²	60.2	41%	0.405	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-38.2	175.1	0	0	0	0	0	112.8	S645 V647 R653	S645-A649 VanDerWaalsContact O-CB 3.26Å; S645-A649 WeakPolarHBondContact O-CB 3.49Å; S645-A649 PolarHBondContact O-N 2.94Å; V647-A649 VanDerWaalsContact C-N 3.32Å; V647-A649 PolarHBondContact O-N 3.37Å; A649-R653 WeakPolarHBondContact O-CD 3.39Å; A649-R653 WeakPolarHBondContact O-CG 3.44Å; A649-R653 PolarHBondContact O-N 3.49Å; A649-R653 VanDerWaalsContact O-N 3.16Å
650	L	91.8	Very high	88.3	Confident	1 Å²	1	61 Å²	61	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-67.4	-43.6	176.7	178.7	58.5	0	0	0	112.1	E608 L611 V612 E646 V647 R653 L654	E608-L650 HydrophobicContact CB-CD1 3.88Å; E608-L650 HydrophobicContact CB-CD2 4.09Å; E608-L650 HydrophobicContact CG-CD1 3.99Å; E608-L650 HydrophobicContact CG-CD2 4.15Å; L611-L650 HydrophobicContact CB-CD2 3.88Å; L611-L650 HydrophobicContact CD1-CD2 4.25Å; V612-L650 HydrophobicContact CG2-CD1 4.07Å; V612-L650 HydrophobicContact CG2-CD2 4.12Å; V612-L650 HydrophobicContact CG2-CG 4.09Å; E646-L650 WeakPolarHBondContact O-CB 3.24Å; E646-L650 PolarHBondContact O-N 2.84Å; V647-L650 PolarHBondContact O-N 3.2Å; L650-R653 PolarHBondContact O-N 3.37Å; L650-L654 HydrophobicContact CD1-CD1 4.21Å
651	L	92	Very high	88.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.5	-42.2	175.6	-62.4	175.3	0	0	0	111.2	I615 I628 I631 V647 R653 L654 F658 W673	I615-L651 HydrophobicContact CD1-CD2 4.17Å; I615-L651 HydrophobicContact CG2-CD2 3.89Å; I628-L651 HydrophobicContact CD1-CD1 4.28Å; I631-L651 HydrophobicContact CD1-CD1 4.24Å; V647-L651 HydrophobicContact CG1-CD1 3.97Å; V647-L651 HydrophobicContact CG1-CG 4.3Å; V647-L651 VanDerWaalsContact O-CG 3.32Å; V647-L651 WeakPolarHBondContact O-CG 3.32Å; V647-L651 PolarHBondContact O-N 2.89Å; L651-R653 PolarHBondContact O-N 2.9Å; L651-L654 PolarHBondContact O-N 3.03Å; L651-F658 HydrophobicContact CB-CB 4.48Å; L651-F658 HydrophobicContact CD2-CB 4.14Å; L651-F658 HydrophobicContact CD2-CD1 3.84Å; L651-F658 HydrophobicContact CD2-CD2 3.38Å; L651-F658 HydrophobicContact CD2-CE1 4Å; L651-F658 HydrophobicContact CD2-CE2 3.56Å; L651-F658 HydrophobicContact CD2-CG 3.52Å; L651-F658 HydrophobicContact CD2-CZ 3.86Å; L651-W673 HydrophobicContact CB-CD2 4.01Å; L651-W673 HydrophobicContact CB-CE3 3.79Å; L651-W673 HydrophobicContact CB-CH2 3.7Å; L651-W673 HydrophobicContact CB-CZ2 3.92Å; L651-W673 HydrophobicContact CB-CZ3 3.63Å; L651-W673 HydrophobicContact CD1-CB 4.41Å; L651-W673 HydrophobicContact CD1-CD2 3.8Å; L651-W673 HydrophobicContact CD1-CE3 4.29Å; L651-W673 HydrophobicContact CD1-CG 3.85Å
652	S	90.4	Very high	88.9	Confident	71 Å²	71	56.2 Å²	56.2	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-25.4	176.3	-59.2	0	0	0	0	113.8	E648 L654 W673	E648-S652 VanDerWaalsContact O-CB 3.26Å; E648-S652 WeakPolarHBondContact O-CB 3.49Å; E648-S652 PolarHBondContact O-N 3.37Å; E648-S652 PolarHBondContact O-OG 2.96Å; S652-L654 VanDerWaalsContact C-N 3.3Å; S652-W673 WeakPolarHBondContact OG-CH2 3.33Å
653	R	92.2	Very high	88.5	Confident	79 Å²	79	58.6 Å²	58.6	30%	0.298	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-9	175.4	-83.5	160	44.6	-164.7	-10.3	114	P602 H604 E608 A649 L650 L651 P655	P602-R653 PolarHBondContact O-NE 2.88Å; P602-R653 VanDerWaalsContact O-NE 3.09Å; P602-R653 PolarHBondContact O-NH2 2.89Å; H604-R653 PolarHBondContact ND1-NH2 3.46Å; H604-R653 VanDerWaalsContact ND1-NH2 3.13Å; E608-R653 IonicContact OE1-CZ 3.75Å; E608-R653 VanDerWaalsContact OE1-CZ 3.25Å; E608-R653 IonicContact OE1-NH1 2.71Å; E608-R653 PolarHBondContact OE1-NH1 2.89Å; E608-R653 IonicContact OE1-NH2 3.64Å; E608-R653 PolarHBondContact OE1-NH2 3.17Å; E608-R653 IonicContact OE2-CZ 3.64Å; E608-R653 IonicContact OE2-NH1 3.78Å; E608-R653 IonicContact OE2-NH2 2.72Å; E608-R653 PolarHBondContact OE2-NH2 3.32Å; A649-R653 WeakPolarHBondContact O-CD 3.39Å; A649-R653 WeakPolarHBondContact O-CG 3.44Å; A649-R653 PolarHBondContact O-N 3.49Å; A649-R653 VanDerWaalsContact O-N 3.16Å; L650-R653 PolarHBondContact O-N 3.37Å; L651-R653 PolarHBondContact O-N 2.9Å; R653-P655 WeakPolarHBondContact O-CD 3.28Å
654	L	89.4	Confident	88	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	32%	0.324	C	S	.	.			trans	-127.1	56.1	-171.9	-65.9	169.8	0	0	0	112.5	P602 I603 V612 L650 L651 S652 C656 T657 F658	P602-L654 HydrophobicContact CB-CD2 3.82Å; P602-L654 HydrophobicContact CG-CD2 3.93Å; I603-L654 HydrophobicContact CD1-CD1 4.38Å; I603-L654 HydrophobicContact CG1-CD1 4.25Å; I603-L654 HydrophobicContact CG1-CD2 4.3Å; V612-L654 HydrophobicContact CB-CD1 4.46Å; V612-L654 HydrophobicContact CG1-CD1 4.24Å; V612-L654 HydrophobicContact CG2-CD1 3.33Å; L650-L654 HydrophobicContact CD1-CD1 4.21Å; L651-L654 PolarHBondContact O-N 3.03Å; S652-L654 VanDerWaalsContact C-N 3.3Å; L654-C656 PolarHBondContact O-N 3.23Å; L654-C656 VanDerWaalsContact O-N 3.08Å; L654-T657 PolarHBondContact O-N 3.35Å; L654-F658 HydrophobicContact CB-CD2 4.02Å; L654-F658 HydrophobicContact CB-CE2 4.49Å; L654-F658 HydrophobicContact CD1-CE2 4.26Å; L654-F658 PolarHBondContact O-N 2.96Å
655	P	85.7	Confident	86.6	Confident	94 Å²	94	59.4 Å²	59.4	61%	0.61	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.9	-172.5	28.5	-37.5	0	0	0	115	R653 F658	R653-P655 WeakPolarHBondContact O-CD 3.28Å; P655-F658 WeakPolarHBondContact CA-O 3.26Å
656	C	83.1	Confident	85.7	Confident	95 Å²	95	58 Å²	58	64%	0.642	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-15.8	173.4	-55.7	0	0	0	0	113.1	L654	L654-C656 PolarHBondContact O-N 3.23Å; L654-C656 VanDerWaalsContact O-N 3.08Å
657	T	87.6	Confident	84.1	Confident	36 Å²	36	60.5 Å²	60.5	22%	0.221	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-38.5	-178	-49.3	0	0	0	0	111.1	L654 F675 C676 G677	L654-T657 PolarHBondContact O-N 3.35Å; T657-F675 HydrophobicContact CG2-CD2 4.13Å; T657-F675 HydrophobicContact CG2-CE2 3.63Å; T657-F675 WeakPolarHBondContact O-CD2 3.36Å; T657-C676 PolarHBondContact O-N 2.83Å; T657-G677 PolarHBondContact O-N 3.09Å
658	F	92.1	Very high	82.6	Confident	1 Å²	1	64.3 Å²	64.3	0%	0.004	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.8	-178.6	-51.6	-75.9	0	0	0	111.3	V612 I615 S616 L619 L651 L654 P655 W673 N674 F675	V612-F658 HydrophobicContact CG1-CE2 4.05Å; V612-F658 HydrophobicContact CG1-CZ 4.2Å; V612-F658 HydrophobicContact CG2-CE2 4.38Å; I615-F658 HydrophobicContact CB-CE1 4.34Å; I615-F658 HydrophobicContact CB-CZ 4.29Å; I615-F658 HydrophobicContact CG2-CE1 3.92Å; I615-F658 HydrophobicContact CG2-CZ 4.29Å; S616-F658 WeakPolarHBondContact OG-CZ 3.21Å; L619-F658 HydrophobicContact CD1-CD1 3.8Å; L619-F658 HydrophobicContact CD1-CE1 4.11Å; L651-F658 HydrophobicContact CB-CB 4.48Å; L651-F658 HydrophobicContact CD2-CB 4.14Å; L651-F658 HydrophobicContact CD2-CD1 3.84Å; L651-F658 HydrophobicContact CD2-CD2 3.38Å; L651-F658 HydrophobicContact CD2-CE1 4Å; L651-F658 HydrophobicContact CD2-CE2 3.56Å; L651-F658 HydrophobicContact CD2-CG 3.52Å; L651-F658 HydrophobicContact CD2-CZ 3.86Å; L654-F658 HydrophobicContact CB-CD2 4.02Å; L654-F658 HydrophobicContact CB-CE2 4.49Å; L654-F658 HydrophobicContact CD1-CE2 4.26Å; L654-F658 PolarHBondContact O-N 2.96Å; P655-F658 WeakPolarHBondContact CA-O 3.26Å; F658-W673 HydrophobicContact CB-CE3 4.03Å; F658-W673 HydrophobicContact CB-CZ3 4.32Å; F658-N674 CarbonylContact C-O 3.5Å; F658-N674 VanDerWaalsContact CA-O 3.31Å; F658-N674 WeakPolarHBondContact CA-O 3.46Å; F658-F675 HydrophobicContact CD1-CD2 4.1Å; F658-F675 AromaticContact CE1-CD2 3.82Å; F658-F675 HydrophobicContact CE1-CD2 3.82Å
659	R	90.3	Very high	81.9	Confident	114 Å²	114	66 Å²	66	43%	0.43	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.9	-179.2	-170.7	-170.5	-65.9	-122.4	11.2	109.1	E661 W673 N674 C676 E679	R659-E661 WeakPolarHBondContact CD-OE1 3.47Å; R659-E661 HydrophobicContact CG-CG 4.05Å; R659-W673 WeakPolarHBondContact O-CA 3.23Å; R659-N674 PolarHBondContact N-O 2.66Å; R659-N674 PolarHBondContact O-N 3.48Å; R659-C676 HydrophobicContact CB-CB 4.49Å; R659-E679 IonicContact CZ-OE2 2.75Å; R659-E679 IonicContact NE-OE2 3.35Å; R659-E679 IonicContact NH2-OE2 3.99Å; R659-E679 PolarHBondContact NH2-OE2 3.27Å
660	Q	91.3	Very high	81.6	Confident	66 Å²	66	66.9 Å²	66.9	31%	0.308	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127	168.2	-174.6	170.2	101.3	0	0	108.9	E648 R672 W673	E648-Q660 PolarHBondContact OE1-NE2 3.25Å; Q660-R672 CarbonylContact C-O 3.59Å; Q660-R672 WeakPolarHBondContact CA-O 3.38Å; Q660-W673 HydrophobicContact CB-CD2 4.07Å; Q660-W673 HydrophobicContact CB-CE3 3.92Å; Q660-W673 HydrophobicContact CB-CH2 3.91Å; Q660-W673 HydrophobicContact CB-CZ2 4.05Å; Q660-W673 HydrophobicContact CB-CZ3 3.85Å; Q660-W673 HydrophobicContact CG-CZ2 4.45Å; Q660-W673 VanDerWaalsContact NE2-CE2 3.29Å
661	E	88.3	Confident	81.5	Confident	76 Å²	76	72 Å²	72	36%	0.355	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	158.2	176	-64.5	-174.3	158.1	0	0	109.6	R659 R672 N674	R659-E661 WeakPolarHBondContact CD-OE1 3.47Å; R659-E661 HydrophobicContact CG-CG 4.05Å; E661-R672 PolarHBondContact N-O 2.81Å; E661-R672 PolarHBondContact O-N 3.02Å; E661-N674 PolarHBondContact OE2-ND2 2.9Å
662	L	85.3	Confident	81.5	Confident	105 Å²	105	75 Å²	75	55%	0.55	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.3	175.7	-67.6	93.9	0	0	0	108.7	L669 E670 K671	L662-L669 HydrophobicContact CB-CD1 4.31Å; L662-L669 HydrophobicContact CB-CG 4.3Å; L662-L669 HydrophobicContact CD2-CD2 3.74Å; L662-L669 HydrophobicContact CD2-CG 4.11Å; L662-E670 WeakPolarHBondContact CA-O 3.3Å; L662-K671 HydrophobicContact CD2-CG 4.45Å; L662-K671 HydrophobicContact CG-CG 4.44Å
663	T	77	Confident	81.7	Confident	55 Å²	55	72 Å²	72	34%	0.337	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.5	-174.4	52.2	0	0	0	0	109.8	E670 R672	T663-E670 PolarHBondContact N-O 2.82Å; T663-E670 PolarHBondContact O-N 3.47Å; T663-E670 PolarHBondContact OG1-O 2.88Å; T663-R672 WeakPolarHBondContact OG1-CD 3.39Å
664	G	74.2	Confident	81.7	Confident	42 Å²	42	69.7 Å²	69.7	43%	0.433	41%	0.413	S	S	.	.	S	Bend	trans	129.5	-179.1	-177.7	0	0	0	0	0	112.5
665	V	60.1	Low	81.8	Confident	127 Å²	127	71.2 Å²	71.2	77%	0.77	42%	0.418	S	S	*	.	S	Bend	trans	-140.2	128	-179.7	-177.8	0	0	0	0	109.7	A667 S668	V665-A667 PolarHBondContact O-N 3.32Å; V665-S668 PolarHBondContact N-OG 3.47Å; V665-S668 VanDerWaalsContact N-OG 3.13Å; V665-S668 PolarHBondContact O-N 3.33Å; V665-S668 PolarHBondContact O-OG 2.86Å; V665-S668 VanDerWaalsContact O-OG 3.05Å
666	G	66.7	Low	81.9	Confident	65 Å²	65	67.1 Å²	67.1	67%	0.67	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	63.9	-115.9	-179.5	0	0	0	0	0	112.1	S668	G666-S668 VanDerWaalsContact C-N 3.3Å; G666-S668 PolarHBondContact O-N 3.31Å
667	A	57.3	Low	81.8	Confident	117 Å²	117	63.4 Å²	63.4	97%	0.967	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-74.6	-13.2	-175.1	0	0	0	0	0	114.6	V665	V665-A667 PolarHBondContact O-N 3.32Å
668	S	59.3	Low	81.1	Confident	80 Å²	80	67.2 Å²	67.2	56%	0.559	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-96.2	19.4	-178.3	61	0	0	0	0	114.4	V665 G666 E670	V665-S668 PolarHBondContact N-OG 3.47Å; V665-S668 VanDerWaalsContact N-OG 3.13Å; V665-S668 PolarHBondContact O-N 3.33Å; V665-S668 PolarHBondContact O-OG 2.86Å; V665-S668 VanDerWaalsContact O-OG 3.05Å; G666-S668 VanDerWaalsContact C-N 3.3Å; G666-S668 PolarHBondContact O-N 3.31Å; S668-E670 PolarHBondContact O-N 2.84Å
669	L	76.8	Confident	80	Confident	94 Å²	94	72 Å²	72	49%	0.492	41%	0.406	S	S	.	.			trans	-75.2	88.6	-172.5	-159.8	77.9	0	0	0	112.5	L662	L662-L669 HydrophobicContact CB-CD1 4.31Å; L662-L669 HydrophobicContact CB-CG 4.3Å; L662-L669 HydrophobicContact CD2-CD2 3.74Å; L662-L669 HydrophobicContact CD2-CG 4.11Å
670	E	82.7	Confident	78.3	Confident	68 Å²	68	68 Å²	68	32%	0.318	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.7	176.5	-168.5	178.3	-155.5	0	0	111.2	S627 L662 T663 S668 R672	S627-E670 WeakPolarHBondContact CB-OE1 3.38Å; S627-E670 PolarHBondContact OG-OE1 2.82Å; L662-E670 WeakPolarHBondContact CA-O 3.3Å; T663-E670 PolarHBondContact N-O 2.82Å; T663-E670 PolarHBondContact O-N 3.47Å; T663-E670 PolarHBondContact OG1-O 2.88Å; S668-E670 PolarHBondContact O-N 2.84Å; E670-R672 HydrophobicContact CG-CG 4.15Å; E670-R672 IonicContact OE2-CZ 2.98Å; E670-R672 IonicContact OE2-NE 2.68Å; E670-R672 PolarHBondContact OE2-NE 3.48Å; E670-R672 IonicContact OE2-NH2 3.88Å; E670-R672 PolarHBondContact OE2-NH2 3.02Å
671	K	89.3	Confident	76.5	Confident	108 Å²	108	70.6 Å²	70.6	47%	0.47	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.5	166.2	-72	-178.6	173	-168.9	0	109.7	S627 E648 L662	S627-K671 WeakPolarHBondContact CA-O 3.36Å; E648-K671 IonicContact OE1-NZ 2.88Å; L662-K671 HydrophobicContact CD2-CG 4.45Å; L662-K671 HydrophobicContact CG-CG 4.44Å
672	R	92.9	Very high	74.5	Confident	64 Å²	64	75.7 Å²	75.7	24%	0.242	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	147	177.8	-65.6	-166.6	165	-142.1	-10.3	112.1	F624 G625 A626 Q660 E661 T663 E670	F624-R672 WeakPolarHBondContact O-CD 3.35Å; F624-R672 PolarHBondContact O-NH1 3.28Å; G625-R672 PolarHBondContact O-NH1 3.01Å; G625-R672 VanDerWaalsContact O-NH1 3.15Å; A626-R672 WeakPolarHBondContact O-CA 3.42Å; Q660-R672 CarbonylContact C-O 3.59Å; Q660-R672 WeakPolarHBondContact CA-O 3.38Å; E661-R672 PolarHBondContact N-O 2.81Å; E661-R672 PolarHBondContact O-N 3.02Å; T663-R672 WeakPolarHBondContact OG1-CD 3.39Å; E670-R672 HydrophobicContact CG-CG 4.15Å; E670-R672 IonicContact OE2-CZ 2.98Å; E670-R672 IonicContact OE2-NE 2.68Å; E670-R672 PolarHBondContact OE2-NE 3.48Å; E670-R672 IonicContact OE2-NH2 3.88Å; E670-R672 PolarHBondContact OE2-NH2 3.02Å
673	W	94.3	Very high	72.6	Confident	9 Å²	9	75.5 Å²	75.5	3%	0.034	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130	171.1	-69.3	95.2	0	0	0	110.1	L619 G625 A626 I631 E648 L651 S652 F658 R659 Q660	L619-W673 HydrophobicContact CD1-CB 4Å; L619-W673 WeakPolarHBondContact CD2-O 3.43Å; G625-W673 WeakPolarHBondContact CA-O 3.44Å; A626-W673 PolarHBondContact N-O 3.34Å; A626-W673 VanDerWaalsContact N-O 3.11Å; A626-W673 PolarHBondContact O-N 2.92Å; I631-W673 HydrophobicContact CD1-CB 3.88Å; I631-W673 HydrophobicContact CD1-CG 4.25Å; E648-W673 HydrophobicContact CG-CZ2 3.86Å; L651-W673 HydrophobicContact CB-CD2 4.01Å; L651-W673 HydrophobicContact CB-CE3 3.79Å; L651-W673 HydrophobicContact CB-CH2 3.7Å; L651-W673 HydrophobicContact CB-CZ2 3.92Å; L651-W673 HydrophobicContact CB-CZ3 3.63Å; L651-W673 HydrophobicContact CD1-CB 4.41Å; L651-W673 HydrophobicContact CD1-CD2 3.8Å; L651-W673 HydrophobicContact CD1-CE3 4.29Å; L651-W673 HydrophobicContact CD1-CG 3.85Å; S652-W673 WeakPolarHBondContact OG-CH2 3.33Å; F658-W673 HydrophobicContact CB-CE3 4.03Å; F658-W673 HydrophobicContact CB-CZ3 4.32Å; R659-W673 WeakPolarHBondContact O-CA 3.23Å; Q660-W673 HydrophobicContact CB-CD2 4.07Å; Q660-W673 HydrophobicContact CB-CE3 3.92Å; Q660-W673 HydrophobicContact CB-CH2 3.91Å; Q660-W673 HydrophobicContact CB-CZ2 4.05Å; Q660-W673 HydrophobicContact CB-CZ3 3.85Å; Q660-W673 HydrophobicContact CG-CZ2 4.45Å; Q660-W673 VanDerWaalsContact NE2-CE2 3.29Å
674	N	92.3	Very high	70.8	Confident	30 Å²	30	81.4 Å²	81.4	16%	0.16	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	146.4	176.3	-81.7	-36.8	0	0	0	110.3	G625 F658 R659 E661	G625-N674 WeakPolarHBondContact CA-OD1 3.42Å; G625-N674 PolarHBondContact N-OD1 2.95Å; F658-N674 CarbonylContact C-O 3.5Å; F658-N674 VanDerWaalsContact CA-O 3.31Å; F658-N674 WeakPolarHBondContact CA-O 3.46Å; R659-N674 PolarHBondContact N-O 2.66Å; R659-N674 PolarHBondContact O-N 3.48Å; E661-N674 PolarHBondContact OE2-ND2 2.9Å
675	F	92.4	Very high	70.6	Confident	49 Å²	49	83.4 Å²	83.4	22%	0.215	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.5	172.2	178.3	-100.6	0	0	0	110.6	S616 L619 H620 T657 F658 F678	S616-F675 WeakPolarHBondContact OG-CE2 3.39Å; L619-F675 HydrophobicContact CB-CB 3.75Å; H620-F675 HydrophobicContact CB-CD1 4.39Å; T657-F675 HydrophobicContact CG2-CD2 4.13Å; T657-F675 HydrophobicContact CG2-CE2 3.63Å; T657-F675 WeakPolarHBondContact O-CD2 3.36Å; F658-F675 HydrophobicContact CD1-CD2 4.1Å; F658-F675 AromaticContact CE1-CD2 3.82Å; F658-F675 HydrophobicContact CE1-CD2 3.82Å; F675-F678 HydrophobicContact CD1-CD2 4.34Å; F675-F678 HydrophobicContact CD1-CE2 4.41Å; F675-F678 AromaticContact CE1-CD2 3.73Å; F675-F678 HydrophobicContact CE1-CD2 3.73Å; F675-F678 AromaticContact CE1-CE2 3.68Å; F675-F678 HydrophobicContact CE1-CE2 3.68Å; F675-F678 HydrophobicContact CE1-CG 4.36Å; F675-F678 HydrophobicContact CE1-CZ 4.26Å
676	C	87.1	Confident	71.1	Confident	9 Å²	9	81.1 Å²	81.1	6%	0.061	47%	0.467	C	S	.	.			trans	-114.9	9	-177.2	58.9	0	0	0	0	113.8	T657 R659 F678 E679	T657-C676 PolarHBondContact O-N 2.83Å; R659-C676 HydrophobicContact CB-CB 4.49Å; C676-F678 PolarHBondContact O-N 3.21Å; C676-E679 HydrophobicContact CB-CG 4.27Å; C676-E679 VanDerWaalsContact CB-OE2 3.3Å; C676-E679 WeakPolarHBondContact CB-OE2 3.44Å; C676-E679 VanDerWaalsContact O-CB 3.32Å; C676-E679 WeakPolarHBondContact O-CB 3.5Å; C676-E679 PolarHBondContact O-N 3.46Å
677	G	79.8	Confident	71.4	Confident	16 Å²	16	82 Å²	82	17%	0.165	46%	0.456	C	S	.	.	H	α-helix	trans	-55.2	-27.7	-175.2	0	0	0	0	0	115.5	T657	T657-G677 PolarHBondContact O-N 3.09Å
678	F	74.3	Confident	72.2	Confident	116 Å²	116	79.9 Å²	79.9	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-79.2	-15.5	174.8	-61.4	-55.1	0	0	0	114.5	H620 F675 C676 I681	H620-F678 AromaticContact CE1-CE2 3.78Å; H620-F678 AromaticContact NE2-CE2 3.86Å; F675-F678 HydrophobicContact CD1-CD2 4.34Å; F675-F678 HydrophobicContact CD1-CE2 4.41Å; F675-F678 AromaticContact CE1-CD2 3.73Å; F675-F678 HydrophobicContact CE1-CD2 3.73Å; F675-F678 AromaticContact CE1-CE2 3.68Å; F675-F678 HydrophobicContact CE1-CE2 3.68Å; F675-F678 HydrophobicContact CE1-CG 4.36Å; F675-F678 HydrophobicContact CE1-CZ 4.26Å; C676-F678 PolarHBondContact O-N 3.21Å; F678-I681 HydrophobicContact CD1-CD1 4.35Å
679	E	68.3	Low	73	Confident	102 Å²	102	79.9 Å²	79.9	48%	0.477	42%	0.417	S	S	.	.	H	α-helix	trans	-78.4	-40.1	175.8	-54	-170.2	127.7	0	0	111.2	R659 C676 I681 K682	R659-E679 IonicContact CZ-OE2 2.75Å; R659-E679 IonicContact NE-OE2 3.35Å; R659-E679 IonicContact NH2-OE2 3.99Å; R659-E679 PolarHBondContact NH2-OE2 3.27Å; C676-E679 HydrophobicContact CB-CG 4.27Å; C676-E679 VanDerWaalsContact CB-OE2 3.3Å; C676-E679 WeakPolarHBondContact CB-OE2 3.44Å; C676-E679 VanDerWaalsContact O-CB 3.32Å; C676-E679 WeakPolarHBondContact O-CB 3.5Å; C676-E679 PolarHBondContact O-N 3.46Å; E679-I681 VanDerWaalsContact C-N 3.27Å; E679-I681 PolarHBondContact O-N 3.24Å; E679-K682 PolarHBondContact O-N 2.93Å
680	G	54.6	Low	72.8	Confident	31 Å²	31	79 Å²	79	32%	0.32	41%	0.412	S	S	.	.	H	α-helix	trans	-57.5	-39.2	177.1	0	0	0	0	0	112.8	K682 S683	G680-K682 PolarHBondContact O-N 3.25Å; G680-K682 VanDerWaalsContact O-N 3.14Å; G680-S683 PolarHBondContact O-N 3.12Å
681	I	54.6	Low	72.1	Confident	119 Å²	119	79.8 Å²	79.8	61%	0.61	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.7	178.5	-58	170	0	0	0	112.5	F678 E679	F678-I681 HydrophobicContact CD1-CD1 4.35Å; E679-I681 VanDerWaalsContact C-N 3.27Å; E679-I681 PolarHBondContact O-N 3.24Å
682	K	45.7	Very low	70.7	Confident	183 Å²	183	77.6 Å²	77.6	80%	0.796	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.9	176.6	-63	178.3	-177.7	174	0	113.7	E679 G680	E679-K682 PolarHBondContact O-N 2.93Å; G680-K682 PolarHBondContact O-N 3.25Å; G680-K682 VanDerWaalsContact O-N 3.14Å
683	S	44.1	Very low	68.9	Low	102 Å²	102	78.8 Å²	78.8	71%	0.713	43%	0.43	S	S	*	.			trans	-120	12.9	-173.2	-55.8	0	0	0	0	113.7	G680	G680-S683 PolarHBondContact O-N 3.12Å
684	T	39.3	Very low	66.6	Low	179 Å²	179	85.1 Å²	85.1	100%	1.098	47%	0.466	S	S	*	.			trans	-136.2	0	174.6	56.5	0	0	0	0	109.9

Retrieved 684 of 684 residues in 154.9 ms (Link to these results)

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