A0A5K4FBW4_SCHMA Loading...

Splicing factor Cactin

AlphaFold DB , UniProt , Accession A0A5K4FBW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 764 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41	Very low	42.4	Very low	237 Å²	237	142.1 Å²	142.1	100%	1.167	77%	0.765	S	S	*	*				0	147.4	0	-59.3	142.3	174.6	0	0	107.7
2	S	37.8	Very low	42.2	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	77%	0.77	S	S	*	*			cis	-171.5	113.4	-26.4	-87.2	0	0	0	0	108.7
3	H	44.8	Very low	42.2	Very low	167 Å²	167	154.5 Å²	154.5	77%	0.773	78%	0.782	S	S	*	*			trans	64.8	166.6	152.6	-61.7	-52.6	0	0	0	118.3
4	K	45.2	Very low	41.9	Very low	170 Å²	170	156.1 Å²	156.1	74%	0.739	78%	0.781	S	S	*	*			cis	-148.5	144	3.4	-124.2	150.2	174.8	-165.5	0	106.8
5	I	45.2	Very low	41.8	Very low	129 Å²	129	156.7 Å²	156.7	66%	0.662	78%	0.78	S	S	*	*				59.6	142.2	87.6	-65.2	-173.1	0	0	0	113.5
6	K	44.6	Very low	41.7	Very low	165 Å²	165	155.4 Å²	155.4	72%	0.717	78%	0.777	S	S	*	*			cis	-179.9	150.6	-13.7	-96.5	-174.1	-173.5	-174.1	0	107.3
7	S	43.1	Very low	41.3	Very low	105 Å²	105	157.7 Å²	157.7	73%	0.734	78%	0.781	S	S	*	*			trans	170.7	130.4	142.6	44.2	0	0	0	0	108.5
8	E	41.5	Very low	41.3	Very low	166 Å²	166	156.2 Å²	156.2	78%	0.776	78%	0.781	S	S	*	*				76.2	138	62.6	-70	176.5	-164.9	0	0	112.4
9	V	41.2	Very low	41	Very low	124 Å²	124	154.8 Å²	154.8	75%	0.752	78%	0.782	S	S	*	*			cis	-160.4	164.5	10.9	92	0	0	0	0	113.5
10	S	41.2	Very low	41.1	Very low	110 Å²	110	153.3 Å²	153.3	77%	0.769	78%	0.78	S	S	*	*			trans	66.6	159	159.9	-80.6	0	0	0	0	120.8
11	S	41.1	Very low	40.8	Very low	97 Å²	97	153.1 Å²	153.1	68%	0.678	78%	0.782	S	S	*	*			cis	-161.8	137.3	-16.1	172.5	0	0	0	0	112.6
12	Y	39.5	Very low	40.7	Very low	210 Å²	210	151 Å²	151	82%	0.824	77%	0.768	S	S	*	*			trans	29.7	121.8	153.7	-75.2	-101.8	0	0	0	122.9
13	Y	43	Very low	40.5	Very low	236 Å²	236	157.7 Å²	157.7	93%	0.925	78%	0.779	S	S	*	*				-146.3	148.5	114.2	-116.8	-84.4	0	0	0	110.1
14	K	37	Very low	40	Very low	176 Å²	176	160.9 Å²	160.9	77%	0.765	79%	0.785	S	S	*	*			trans	-163.7	177.5	-177.5	-138.8	174.9	-175.5	177	0	111.3
15	H	40.7	Very low	39.5	Very low	166 Å²	166	157.7 Å²	157.7	77%	0.769	78%	0.784	S	S	*	*			trans	80.6	139.6	-170.9	-61.3	-90	0	0	0	113.8
16	D	39.8	Very low	38.9	Very low	136 Å²	136	157.1 Å²	157.1	73%	0.727	79%	0.791	S	S	*	*			cis	-149.6	168.7	-11.8	-128.7	-30.6	0	0	0	114.1
17	K	34.7	Very low	38.5	Very low	194 Å²	194	154.5 Å²	154.5	84%	0.843	79%	0.794	S	S	*	*			trans	-112	122.4	172.9	-74.9	-172.9	177.4	-177	0	111.6
18	V	42	Very low	38.1	Very low	131 Å²	131	155.5 Å²	155.5	79%	0.794	80%	0.795	S	S	*	*			trans	-117.6	123	168.4	-179.5	0	0	0	0	109.7	V20	V18-V20 HydrophobicContact CG1-CG2 4.2Å
19	T	35.7	Very low	38	Very low	129 Å²	129	154.5 Å²	154.5	79%	0.791	80%	0.795	S	S	*	*			trans	-114.9	121.2	176.2	53.8	0	0	0	0	110.2
20	V	42	Very low	37.7	Very low	124 Å²	124	153 Å²	153	75%	0.752	79%	0.79	S	S	*	*			trans	-120	118.8	174.6	178.9	0	0	0	0	109.7	V18	V18-V20 HydrophobicContact CG1-CG2 4.2Å
21	N	35.5	Very low	37.5	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	79%	0.794	S	S	*	*			trans	-71.9	144.7	168.2	-64.1	-73.2	0	0	0	109.9
22	H	39.2	Very low	37.5	Very low	191 Å²	191	159.1 Å²	159.1	88%	0.884	81%	0.807	S	S	*	*			trans	-147.2	158.1	146.3	-105.9	76.3	0	0	0	110.5
23	R	32.7	Very low	37.3	Very low	234 Å²	234	151.6 Å²	151.6	88%	0.883	79%	0.793	S	S	*	*			trans	-128.2	147.4	-174.4	-90.5	-179	166.3	179.3	-3.2	111.6
24	R	34.4	Very low	37.2	Very low	234 Å²	234	149.7 Å²	149.7	88%	0.883	79%	0.79	S	S	*	*			trans	78.6	146.3	149	-88.5	-176.4	165.5	-166.3	-4.6	120.5
25	S	34.8	Very low	37.3	Very low	103 Å²	103	148.5 Å²	148.5	72%	0.72	79%	0.789	S	S	*	*			trans	94.7	86.9	150.6	-49.6	0	0	0	0	120.8
26	S	32.6	Very low	37.2	Very low	117 Å²	117	144.8 Å²	144.8	82%	0.818	78%	0.782	S	S	*	*				48.8	111.1	121.7	61.5	0	0	0	0	123.3
27	S	36	Very low	37	Very low	110 Å²	110	147.5 Å²	147.5	77%	0.769	78%	0.783	S	S	*	*				-168	115.5	127.1	-163.3	0	0	0	0	107
28	V	34.6	Very low	37.3	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	78%	0.781	S	S	*	*				57.8	85.8	83.1	-172.7	0	0	0	0	114
29	D	40.2	Very low	36.9	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	77%	0.773	S	S	*	*			trans	167.2	167.6	137	-98.1	-33.2	0	0	0	108.5
30	S	35.5	Very low	37	Very low	93 Å²	93	148.8 Å²	148.8	65%	0.65	78%	0.782	S	S	*	*			cis	-170.6	156.5	-44.9	-95.4	0	0	0	0	107.7
31	N	35.4	Very low	36.5	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	78%	0.783	S	S	*	*			trans	64.9	92.2	177	-64.5	-22.6	0	0	0	119.4
32	D	41.1	Very low	36.7	Very low	175 Å²	175	146.6 Å²	146.6	94%	0.936	78%	0.784	S	S	*	*				-169.6	162.9	118.1	-118.3	-20.3	0	0	0	110.4
33	G	36.8	Very low	36.5	Very low	53 Å²	53	144.4 Å²	144.4	55%	0.546	78%	0.779	S	S	.	*			cis	-169.8	12.1	0.6	0	0	0	0	0	117.2
34	K	40.5	Very low	36.5	Very low	196 Å²	196	142.4 Å²	142.4	85%	0.852	78%	0.779	S	S	*	*			trans	69.5	162.6	-176.9	-57.3	171	-178.3	166.4	0	113.7
35	M	38.2	Very low	36.7	Very low	151 Å²	151	141.1 Å²	141.1	74%	0.744	78%	0.78	S	S	*	*			cis	-161.1	171.5	-15.4	-110	165.9	90.1	0	0	107.6
36	S	39.4	Very low	36.6	Very low	88 Å²	88	144.9 Å²	144.9	62%	0.615	79%	0.786	S	S	*	*			cis	-164.8	147	1.5	34.1	0	0	0	0	113.2
37	Y	36.5	Very low	36.8	Very low	192 Å²	192	144.4 Å²	144.4	75%	0.753	78%	0.783	S	S	*	*			trans	23.9	135.6	143.6	-63.9	-85.6	0	0	0	124.1
38	V	40.3	Very low	36.7	Very low	132 Å²	132	148.1 Å²	148.1	80%	0.8	79%	0.785	S	S	*	*				-176.8	98.1	98.1	156.2	0	0	0	0	107.5
39	S	33.2	Very low	36.8	Very low	91 Å²	91	149.3 Å²	149.3	64%	0.636	79%	0.792	S	S	*	*				63	110.1	81.7	-59.8	0	0	0	0	114.8
40	R	37.6	Very low	36.6	Very low	259 Å²	259	153.5 Å²	153.5	98%	0.977	80%	0.797	S	S	*	*			trans	-133.8	107.5	168	-140.1	178.9	-174.2	177.6	1.7	109.8
41	S	32.3	Very low	37.2	Very low	109 Å²	109	153.2 Å²	153.2	76%	0.762	79%	0.793	S	S	*	*			trans	-128	148.9	173.7	61.3	0	0	0	0	110.1
42	S	38.4	Very low	37.1	Very low	120 Å²	120	153.9 Å²	153.9	84%	0.839	79%	0.791	S	S	*	*			trans	-149.4	109.2	167.1	55.2	0	0	0	0	109.6
43	N	35.6	Very low	36.9	Very low	145 Å²	145	149.8 Å²	149.8	78%	0.775	78%	0.776	S	S	*	*			trans	-73.9	152.5	-169.3	-78	-42.9	0	0	0	114.2
44	H	33.7	Very low	36.8	Very low	191 Å²	191	152.3 Å²	152.3	88%	0.884	79%	0.785	S	S	*	*			trans	-60.4	140	152.1	-79.6	26.2	0	0	0	110.6
45	K	38	Very low	36.8	Very low	207 Å²	207	149.6 Å²	149.6	90%	0.9	78%	0.779	S	S	*	*			trans	-142.5	146.4	152.1	-78.8	-158.7	173.7	-175.7	0	111.6
46	H	32.8	Very low	36.9	Very low	182 Å²	182	151.5 Å²	151.5	84%	0.843	78%	0.783	S	S	*	*			trans	-95.9	140.1	-175.9	-106.8	-41	0	0	0	112.7
47	S	35.8	Very low	37	Very low	108 Å²	108	151.2 Å²	151.2	76%	0.755	78%	0.781	S	S	*	*			trans	-175.9	123	139.3	44.1	0	0	0	0	107.5
48	K	34	Very low	37	Very low	188 Å²	188	147.6 Å²	147.6	82%	0.817	78%	0.779	S	S	*	*				64.5	86.9	54.9	-76.3	-167	174.4	179.7	0	114.8
49	T	38.1	Very low	37	Very low	151 Å²	151	146.8 Å²	146.8	93%	0.926	77%	0.774	S	S	*	*			trans	-161.2	169.3	142.5	16.7	0	0	0	0	110.8
50	R	34.6	Very low	37.4	Very low	234 Å²	234	150.6 Å²	150.6	88%	0.883	78%	0.782	S	S	*	*			trans	-159.6	177.6	-167.7	-121.1	-165.8	165.9	-160.2	-1.8	106.9
51	P	48.2	Very low	37.6	Very low	87 Å²	87	143 Å²	143	57%	0.565	77%	0.768	S	S	*	*			cis	-129.2	-150.8	-37.3	29.7	-6.1	0	0	0	111
52	H	34.8	Very low	38.1	Very low	173 Å²	173	144.4 Å²	144.4	80%	0.801	76%	0.763	S	S	*	*			trans	72.9	154.7	168.1	-62.2	-71.4	0	0	0	118.2
53	S	36.1	Very low	38.3	Very low	89 Å²	89	145.2 Å²	145.2	62%	0.622	75%	0.753	S	S	*	*			cis	-169.8	160.9	-29.3	57.1	0	0	0	0	111.6
54	S	35.6	Very low	38.7	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	74%	0.742	S	S	*	*			trans	72.2	161.6	154.4	93.3	0	0	0	0	117.3
55	I	40.4	Very low	38.9	Very low	138 Å²	138	144.4 Å²	144.4	71%	0.708	74%	0.74	S	S	*	*			cis	-165	162.2	-16.9	-119.6	173.6	0	0	0	110.2
56	K	39.5	Very low	38.8	Very low	191 Å²	191	138.5 Å²	138.5	83%	0.83	73%	0.725	S	S	*	*			trans	66.9	153.9	167.5	-81.8	158.1	-174.8	179.9	0	118.9
57	S	41.2	Very low	39.1	Very low	83 Å²	83	136.9 Å²	136.9	58%	0.58	72%	0.717	S	S	*	*			cis	-173.2	165	-28.6	53.2	0	0	0	0	112.8
58	T	37.8	Very low	39.2	Very low	116 Å²	116	139.5 Å²	139.5	71%	0.712	72%	0.717	S	S	*	*			trans	66	138.9	142.6	48.6	0	0	0	0	120.1
59	T	39.8	Very low	39.3	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	71%	0.71	S	S	*	*			cis	-168.3	174.8	-3.4	11.2	0	0	0	0	112.2
60	H	40.8	Very low	39.2	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.796	70%	0.699	S	S	*	*			trans	72.6	151.6	162	-74.6	-74.7	0	0	0	119.2
61	S	42.3	Very low	39.3	Very low	99 Å²	99	130 Å²	130	69%	0.692	69%	0.694	S	S	*	*			cis	176.4	146.1	-38.1	47.6	0	0	0	0	109.2
62	E	42.6	Very low	38.6	Very low	138 Å²	138	134.3 Å²	134.3	65%	0.645	70%	0.704	S	S	*	*			cis	-134.3	-94.1	-16.2	-169.9	-148	123	0	0	110.4	K64	E62-K64 WeakPolarHBondContact OE1-CE 3.1Å; E62-K64 WeakPolarHBondContact OE1-CG 3.43Å; E62-K64 IonicContact OE1-NZ 3.84Å; E62-K64 PolarHBondContact OE1-NZ 2.79Å; E62-K64 IonicContact OE2-NZ 3.24Å; E62-K64 PolarHBondContact OE2-NZ 3.49Å
63	H	43.8	Very low	38.7	Very low	137 Å²	137	135 Å²	135	63%	0.634	70%	0.704	S	S	*	*			cis	-151.3	83.9	-20.6	-171.4	-90.4	0	0	0	113.6
64	K	42.3	Very low	38.7	Very low	124 Å²	124	141.8 Å²	141.8	54%	0.539	72%	0.716	S	S	.	*			trans	63.9	161.4	156.7	-48.2	-168.3	178.5	61.7	0	118.1	E62	E62-K64 WeakPolarHBondContact OE1-CE 3.1Å; E62-K64 WeakPolarHBondContact OE1-CG 3.43Å; E62-K64 IonicContact OE1-NZ 3.84Å; E62-K64 PolarHBondContact OE1-NZ 2.79Å; E62-K64 IonicContact OE2-NZ 3.24Å; E62-K64 PolarHBondContact OE2-NZ 3.49Å
65	K	39.6	Very low	38.8	Very low	196 Å²	196	144.7 Å²	144.7	85%	0.852	72%	0.716	S	S	*	*			cis	-152	165.1	6.3	-140.8	159.4	-172.9	179.6	0	111.5
66	S	35.5	Very low	38.7	Very low	83 Å²	83	145.7 Å²	145.7	58%	0.58	72%	0.715	S	S	*	*			trans	-107.9	166.2	-174.3	40.9	0	0	0	0	114.8
67	H	39.3	Very low	38.7	Very low	147 Å²	147	143.6 Å²	143.6	68%	0.681	71%	0.708	S	S	*	*				153.5	146.8	121.5	-77.1	-66.9	0	0	0	116
68	H	37.9	Very low	38.8	Very low	163 Å²	163	149.7 Å²	149.7	76%	0.755	72%	0.718	S	S	*	*			trans	16.1	160.3	142.3	-49.5	-42.7	0	0	0	123.2
69	S	35.6	Very low	39.1	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	72%	0.722	S	S	*	*			cis	-176.4	136.5	-24.3	58.1	0	0	0	0	113
70	S	35.4	Very low	39.2	Very low	98 Å²	98	153.1 Å²	153.1	69%	0.685	72%	0.719	S	S	*	*			trans	69.6	150	148.4	89	0	0	0	0	123
71	K	36.1	Very low	39.1	Very low	181 Å²	181	150.5 Å²	150.5	79%	0.787	72%	0.72	S	S	*	*			trans	72.6	111.5	149.5	-73.2	170.2	-178.7	167.1	0	122.7
72	K	35.2	Very low	39	Very low	177 Å²	177	151.3 Å²	151.3	77%	0.77	73%	0.726	S	S	*	*				72.2	110.7	127.9	-71.4	-177	175.5	177.2	0	122.2
73	K	35.2	Very low	38.5	Very low	187 Å²	187	152.6 Å²	152.6	81%	0.813	74%	0.737	S	S	*	*				70.6	148.8	127.9	-70.4	-171.2	173.2	-175.3	0	120.5
74	R	37	Very low	38.1	Very low	231 Å²	231	152 Å²	152	87%	0.872	75%	0.748	S	S	*	*			trans	74.3	147.2	162.3	-74.8	-179.7	167.9	-166.3	-2.7	116.3
75	K	38	Very low	37.6	Very low	167 Å²	167	151 Å²	151	73%	0.726	76%	0.757	S	S	*	*			cis	-172	154.7	-26.3	-143	-177.6	-175.1	-175.9	0	109
76	K	38.7	Very low	37.2	Very low	159 Å²	159	146.2 Å²	146.2	69%	0.691	75%	0.749	S	S	*	*			trans	70.9	154.5	161.4	-59.6	-172.5	159.3	-170.1	0	116.3
77	H	39.5	Very low	37	Very low	148 Å²	148	147.3 Å²	147.3	69%	0.685	76%	0.756	S	S	*	*			cis	-170.9	172.7	-18.8	-97.6	-38.2	0	0	0	110
78	R	43.4	Very low	36.5	Very low	211 Å²	211	145.1 Å²	145.1	80%	0.796	76%	0.757	S	S	*	*			trans	80.4	137.9	162.9	-58.1	-167.3	170.4	156.1	-3.5	114.3
79	R	42.6	Very low	36.1	Very low	210 Å²	210	142.1 Å²	142.1	79%	0.792	76%	0.755	S	S	*	*			cis	-153.5	159.6	3.9	-107.9	151	176.5	170.6	-5.3	107.1
80	S	43.3	Very low	35.8	Very low	92 Å²	92	142.3 Å²	142.3	64%	0.643	76%	0.756	S	S	*	*			cis	-175	146.1	-10.4	38.8	0	0	0	0	111.9
81	S	37.6	Very low	35.5	Very low	117 Å²	117	143 Å²	143	82%	0.818	76%	0.761	S	S	*	*			trans	57.5	149	152.7	46.3	0	0	0	0	120.2
82	S	40	Very low	35.3	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	76%	0.759	S	S	*	*			cis	-144.8	161.1	6.6	38.4	0	0	0	0	112.5
83	N	32.6	Very low	35.3	Very low	165 Å²	165	136 Å²	136	88%	0.882	76%	0.757	S	S	*	*			trans	-83.8	151.4	170	-62.6	-16.3	0	0	0	111.3
84	S	36.1	Very low	35.2	Very low	124 Å²	124	131.9 Å²	131.9	87%	0.867	75%	0.751	S	S	*	*			trans	-156.2	170.8	130.8	59.9	0	0	0	0	110.1
85	S	32.1	Very low	35.3	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	74%	0.74	S	S	*	*			trans	-117.7	-170.8	-169.2	56.8	0	0	0	0	112.6
86	S	31.1	Very low	35.2	Very low	96 Å²	96	125 Å²	125	67%	0.671	74%	0.739	S	S	*	*			trans	69.2	103.6	156	40.4	0	0	0	0	119.2
87	S	30.5	Very low	35.1	Very low	106 Å²	106	128.4 Å²	128.4	74%	0.741	75%	0.748	S	S	*	*				65.2	142.4	126.2	59.8	0	0	0	0	123.3
88	S	29.6	Very low	35	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	75%	0.75	S	S	*	*			trans	75.4	130.5	144.1	47.6	0	0	0	0	121.9
89	S	29.2	Very low	34.6	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	75%	0.748	S	S	*	*			trans	70.9	116.7	139.1	57.5	0	0	0	0	122.4
90	S	28.5	Very low	34.2	Very low	100 Å²	100	119.8 Å²	119.8	70%	0.699	75%	0.746	S	S	*	*				70.8	135.2	128.2	61.1	0	0	0	0	123
91	S	28.8	Very low	33.8	Very low	112 Å²	112	118.9 Å²	118.9	78%	0.783	75%	0.751	S	S	*	*			trans	64.1	149.2	150.8	40.4	0	0	0	0	118.8
92	S	32.9	Very low	33.6	Very low	106 Å²	106	119 Å²	119	74%	0.741	75%	0.747	S	S	*	*			cis	-167.2	-168.6	-14.1	47.7	0	0	0	0	109.1
93	S	33.9	Very low	33.4	Very low	105 Å²	105	120.4 Å²	120.4	73%	0.734	75%	0.751	S	S	*	*			trans	73.3	118.1	-178.3	-62	0	0	0	0	114.4
94	C	34.4	Very low	33.4	Very low	101 Å²	101	121.7 Å²	121.7	68%	0.682	75%	0.749	S	S	*	*				86.4	141	53.1	89.1	0	0	0	0	112.4
95	D	38.5	Very low	33.2	Very low	122 Å²	122	125.5 Å²	125.5	65%	0.652	75%	0.75	S	S	*	*			cis	-144.5	148.7	21.7	-96.3	-55.3	0	0	0	116.9
96	N	36.8	Very low	33.4	Very low	130 Å²	130	129 Å²	129	70%	0.695	76%	0.755	S	S	*	*			trans	43.5	119.7	141.4	-53.3	-39.6	0	0	0	124.1
97	R	36.5	Very low	33.5	Very low	232 Å²	232	130.2 Å²	130.2	88%	0.875	76%	0.758	S	S	*	*				173.9	106.8	97.5	-88.1	178	-170.8	-162.7	-0	109.3
98	S	36.7	Very low	33.8	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	77%	0.765	S	S	*	*				55.8	130.8	94	67.6	0	0	0	0	114.2
99	D	35.8	Very low	34.1	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	77%	0.765	S	S	*	*			cis	-152	123.4	12.4	-151	41.1	0	0	0	108.3
100	N	32.6	Very low	34.5	Very low	140 Å²	140	130.6 Å²	130.6	75%	0.749	77%	0.766	S	S	*	*				81.1	140.3	95.6	-163.9	11.2	0	0	0	115.1
101	G	35.6	Very low	35	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	77%	0.774	S	S	*	*			trans	151.3	95.5	-170.4	0	0	0	0	0	112.4
102	T	33.1	Very low	36	Very low	120 Å²	120	131.8 Å²	131.8	74%	0.736	76%	0.764	S	S	*	*			trans	-87.2	142.7	-166.7	48.9	0	0	0	0	114.6
103	T	36.2	Very low	36.7	Very low	145 Å²	145	130.2 Å²	130.2	89%	0.89	75%	0.752	S	S	*	*				-178.7	132.1	127.8	24.2	0	0	0	0	111.1
104	K	32.9	Very low	37.8	Very low	192 Å²	192	133.9 Å²	133.9	84%	0.835	75%	0.754	S	S	*	*			trans	-96.5	140.8	177.8	-81.9	178.5	177.9	170.3	0	111.7	H106	K104-H106 PolarHBondContact O-N 3.5Å
105	K	30.8	Very low	38.8	Very low	205 Å²	205	136.2 Å²	136.2	89%	0.891	76%	0.755	S	S	*	*			trans	-70.3	118.6	171.5	-65.1	169.1	-177.5	168.8	0	109.9
106	H	37.1	Very low	39.5	Very low	177 Å²	177	132.9 Å²	132.9	82%	0.819	74%	0.737	S	S	*	*			trans	-95.4	105	164.6	-79.6	-95.2	0	0	0	109.8	K104	K104-H106 PolarHBondContact O-N 3.5Å
107	T	33.3	Very low	40.4	Very low	121 Å²	121	133.8 Å²	133.8	74%	0.742	74%	0.741	S	S	*	*			trans	-80.9	115.4	165.5	49.9	0	0	0	0	108.8	S109	T107-S109 VanDerWaalsContact C-N 3.26Å; T107-S109 PolarHBondContact O-N 3.44Å
108	S	36.3	Very low	41.6	Very low	126 Å²	126	127.5 Å²	127.5	88%	0.881	73%	0.733	S	S	*	*			trans	-70.7	77.3	177.7	52.7	0	0	0	0	111.6
109	S	35.7	Very low	42.7	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	71%	0.712	S	S	*	*			trans	-69.9	135.5	172.8	55.6	0	0	0	0	111	T107	T107-S109 VanDerWaalsContact C-N 3.26Å; T107-S109 PolarHBondContact O-N 3.44Å
110	A	37.8	Very low	44.4	Very low	89 Å²	89	120.9 Å²	120.9	74%	0.736	69%	0.693	S	S	*	*			trans	-16.1	129.5	174.3	0	0	0	0	0	116.8	V112	A110-V112 PolarHBondContact O-N 2.92Å
111	T	39.3	Very low	46.3	Very low	140 Å²	140	120.5 Å²	120.5	86%	0.859	69%	0.69	S	S	*	*			trans	-40.7	107.9	175.2	47.3	0	0	0	0	112.8
112	V	50	Low	48.2	Very low	96 Å²	96	123 Å²	123	58%	0.582	68%	0.682	S	S	*	*			trans	-69.5	128.3	167.8	-173.9	0	0	0	0	107.4	A110 K114 L116	A110-V112 PolarHBondContact O-N 2.92Å; V112-K114 PolarHBondContact O-N 2.94Å; V112-L116 HydrophobicContact CG1-CB 3.99Å; V112-L116 HydrophobicContact CG1-CD1 4.05Å
113	P	46.6	Very low	50.2	Low	74 Å²	74	121.1 Å²	121.1	48%	0.481	67%	0.665	S	S	.	*			trans	-55.5	134.7	175.4	-26.1	35	0	0	0	111	E115 L116	P113-E115 PolarHBondContact O-N 2.92Å; P113-E115 VanDerWaalsContact O-N 3.1Å; P113-L116 PolarHBondContact O-N 2.8Å
114	K	57.3	Low	51.9	Low	182 Å²	182	117.6 Å²	117.6	79%	0.791	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-58.6	-26.9	-176.9	-72.6	-178.8	172.1	-180	0	112.9	V112 L116 L117	V112-K114 PolarHBondContact O-N 2.94Å; K114-L116 PolarHBondContact O-N 3.3Å; K114-L117 WeakPolarHBondContact O-CB 3.27Å; K114-L117 PolarHBondContact O-N 3.28Å
115	E	55.7	Low	54	Low	149 Å²	149	114 Å²	114	70%	0.696	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-57.8	-25.4	174.5	-59.6	168.5	157.1	0	0	113.7	P113 L117 S118 L119	P113-E115 PolarHBondContact O-N 2.92Å; P113-E115 VanDerWaalsContact O-N 3.1Å; E115-L117 VanDerWaalsContact C-N 3.25Å; E115-L117 PolarHBondContact O-N 2.95Å; E115-S118 PolarHBondContact O-OG 3.31Å; E115-S118 VanDerWaalsContact O-OG 3.09Å; E115-L119 WeakPolarHBondContact O-CD1 3.41Å; E115-L119 WeakPolarHBondContact O-CG 3.5Å
116	L	53.1	Low	56.4	Low	53 Å²	53	110 Å²	110	28%	0.277	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-78.9	-3.2	175.8	-92.9	167.2	0	0	0	114.1	V112 P113 K114 I124	V112-L116 HydrophobicContact CG1-CB 3.99Å; V112-L116 HydrophobicContact CG1-CD1 4.05Å; P113-L116 PolarHBondContact O-N 2.8Å; K114-L116 PolarHBondContact O-N 3.3Å; L116-I124 HydrophobicContact CD2-CG1 4.16Å
117	L	56.5	Low	58.5	Low	148 Å²	148	104.5 Å²	104.5	78%	0.775	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-98.7	-11.8	176.8	-63.5	170.1	0	0	0	113.3	K114 E115	K114-L117 WeakPolarHBondContact O-CB 3.27Å; K114-L117 PolarHBondContact O-N 3.28Å; E115-L117 VanDerWaalsContact C-N 3.25Å; E115-L117 PolarHBondContact O-N 2.95Å
118	S	61.1	Low	60.5	Low	101 Å²	101	102.4 Å²	102.4	71%	0.706	58%	0.575	S	S	*	*	S	Bend	trans	-103.1	1	-179.5	50.6	0	0	0	0	114.1	E115	E115-S118 PolarHBondContact O-OG 3.31Å; E115-S118 VanDerWaalsContact O-OG 3.09Å
119	L	60.3	Low	62.7	Low	57 Å²	57	101.5 Å²	101.5	30%	0.298	56%	0.557	S	S	.	*	S	Bend	trans	-101.5	148	-175.5	-71	168	0	0	0	111.3	E115 E123 I124 I127	E115-L119 WeakPolarHBondContact O-CD1 3.41Å; E115-L119 WeakPolarHBondContact O-CG 3.5Å; L119-E123 HydrophobicContact CB-CB 4.02Å; L119-E123 HydrophobicContact CD2-CB 4.21Å; L119-I124 HydrophobicContact CB-CG1 4.35Å; L119-I127 HydrophobicContact CD1-CD1 3.53Å
120	S	71.7	Confident	64.9	Low	51 Å²	51	101.2 Å²	101.2	36%	0.357	55%	0.545	S	S	.	.			trans	-62.4	158.4	177.8	65.6	0	0	0	0	112.2	E122 E123 I124	S120-E122 PolarHBondContact O-N 3.35Å; S120-E123 VanDerWaalsContact CB-OE2 3.23Å; S120-E123 WeakPolarHBondContact CB-OE2 3.43Å; S120-E123 PolarHBondContact N-OE2 2.94Å; S120-E123 PolarHBondContact O-N 3.32Å; S120-E123 WeakPolarHBondContact OG-CB 3.35Å; S120-E123 VanDerWaalsContact OG-CD 3.32Å; S120-E123 VanDerWaalsContact OG-CG 3.29Å; S120-E123 WeakPolarHBondContact OG-CG 3.28Å; S120-E123 PolarHBondContact OG-N 3.07Å; S120-E123 VanDerWaalsContact OG-N 3.1Å; S120-E123 PolarHBondContact OG-OE2 3.32Å; S120-I124 WeakPolarHBondContact O-CG1 3.5Å; S120-I124 PolarHBondContact O-N 3.13Å
121	L	71	Confident	66.8	Low	131 Å²	131	104.5 Å²	104.5	69%	0.686	54%	0.538	S	S	*	.	H	α-helix	trans	-58.5	-30.4	175.7	-132.5	167.8	0	0	0	111.4	Q125	L121-Q125 VanDerWaalsContact O-CG 3.3Å; L121-Q125 WeakPolarHBondContact O-CG 3.42Å; L121-Q125 PolarHBondContact O-N 3.43Å
122	E	76.2	Confident	68.8	Low	127 Å²	127	106.8 Å²	106.8	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-70.6	-40.8	172.3	-62.2	-171.1	-176.5	0	0	113.2	S120 Q125 K126	S120-E122 PolarHBondContact O-N 3.35Å; E122-Q125 CarbonylContact O-C 3.44Å; E122-Q125 WeakPolarHBondContact O-CB 3.41Å; E122-Q125 PolarHBondContact O-N 2.95Å; E122-K126 WeakPolarHBondContact O-CG 3.43Å; E122-K126 PolarHBondContact O-N 2.89Å; E122-K126 IonicContact OE2-NZ 2.76Å
123	E	74.6	Confident	70.3	Confident	80 Å²	80	107.9 Å²	107.9	37%	0.374	53%	0.529	S	S	.	.	H	α-helix	trans	-69.5	-36.4	177.1	-74.8	161.3	122.7	0	0	111.8	L119 S120 Q125 K126 I127	L119-E123 HydrophobicContact CB-CB 4.02Å; L119-E123 HydrophobicContact CD2-CB 4.21Å; S120-E123 VanDerWaalsContact CB-OE2 3.23Å; S120-E123 WeakPolarHBondContact CB-OE2 3.43Å; S120-E123 PolarHBondContact N-OE2 2.94Å; S120-E123 PolarHBondContact O-N 3.32Å; S120-E123 WeakPolarHBondContact OG-CB 3.35Å; S120-E123 VanDerWaalsContact OG-CD 3.32Å; S120-E123 VanDerWaalsContact OG-CG 3.29Å; S120-E123 WeakPolarHBondContact OG-CG 3.28Å; S120-E123 PolarHBondContact OG-N 3.07Å; S120-E123 VanDerWaalsContact OG-N 3.1Å; S120-E123 PolarHBondContact OG-OE2 3.32Å; E123-Q125 VanDerWaalsContact C-N 3.25Å; E123-Q125 PolarHBondContact O-N 3.35Å; E123-K126 PolarHBondContact O-N 3.39Å; E123-I127 VanDerWaalsContact O-CB 3.31Å; E123-I127 WeakPolarHBondContact O-CB 3.26Å; E123-I127 VanDerWaalsContact O-CG1 3.26Å; E123-I127 WeakPolarHBondContact O-CG1 3.43Å; E123-I127 PolarHBondContact O-N 2.88Å
124	I	72.9	Confident	71.9	Confident	70 Å²	70	110 Å²	110	36%	0.359	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-38.5	170.9	-64.9	169.3	0	0	0	110.3	L116 L119 S120 S128	L116-I124 HydrophobicContact CD2-CG1 4.16Å; L119-I124 HydrophobicContact CB-CG1 4.35Å; S120-I124 WeakPolarHBondContact O-CG1 3.5Å; S120-I124 PolarHBondContact O-N 3.13Å; I124-S128 WeakPolarHBondContact O-CB 3.41Å; I124-S128 PolarHBondContact O-N 3.01Å; I124-S128 VanDerWaalsContact O-N 3.09Å
125	Q	77.1	Confident	73	Confident	118 Å²	118	107 Å²	107	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-67.7	-51.1	172.6	-71.4	176	36.6	0	0	111.8	L121 E122 E123 I127 S128 E129	L121-Q125 VanDerWaalsContact O-CG 3.3Å; L121-Q125 WeakPolarHBondContact O-CG 3.42Å; L121-Q125 PolarHBondContact O-N 3.43Å; E122-Q125 CarbonylContact O-C 3.44Å; E122-Q125 WeakPolarHBondContact O-CB 3.41Å; E122-Q125 PolarHBondContact O-N 2.95Å; E123-Q125 VanDerWaalsContact C-N 3.25Å; E123-Q125 PolarHBondContact O-N 3.35Å; Q125-I127 VanDerWaalsContact C-N 3.33Å; Q125-I127 PolarHBondContact O-N 3.04Å; Q125-S128 CarbonylContact O-C 3.58Å; Q125-S128 WeakPolarHBondContact O-CA 3.4Å; Q125-S128 VanDerWaalsContact O-CB 3.31Å; Q125-S128 WeakPolarHBondContact O-CB 3.45Å; Q125-S128 PolarHBondContact O-N 2.86Å; Q125-E129 WeakPolarHBondContact O-CG 3.34Å; Q125-E129 PolarHBondContact O-N 2.91Å
126	K	81.9	Confident	74.3	Confident	119 Å²	119	101.9 Å²	101.9	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-55	-44	176.7	-72.2	168.3	-175	160.7	0	112	E122 E123 S128 E129 E130	E122-K126 WeakPolarHBondContact O-CG 3.43Å; E122-K126 PolarHBondContact O-N 2.89Å; E122-K126 IonicContact OE2-NZ 2.76Å; E123-K126 PolarHBondContact O-N 3.39Å; K126-S128 VanDerWaalsContact C-N 3.35Å; K126-S128 PolarHBondContact O-N 3.39Å; K126-E129 PolarHBondContact O-N 2.84Å; K126-E130 WeakPolarHBondContact O-CB 3.35Å; K126-E130 PolarHBondContact O-N 2.96Å
127	I	79.9	Confident	75.6	Confident	62 Å²	62	104.3 Å²	104.3	32%	0.318	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-36.7	176.2	-71.6	167.7	0	0	0	111.7	L119 E123 Q125 R131	L119-I127 HydrophobicContact CD1-CD1 3.53Å; E123-I127 VanDerWaalsContact O-CB 3.31Å; E123-I127 WeakPolarHBondContact O-CB 3.26Å; E123-I127 VanDerWaalsContact O-CG1 3.26Å; E123-I127 WeakPolarHBondContact O-CG1 3.43Å; E123-I127 PolarHBondContact O-N 2.88Å; Q125-I127 VanDerWaalsContact C-N 3.33Å; Q125-I127 PolarHBondContact O-N 3.04Å; I127-R131 VanDerWaalsContact O-CB 3.31Å; I127-R131 WeakPolarHBondContact O-CB 3.28Å; I127-R131 PolarHBondContact O-N 3.01Å
128	S	76.3	Confident	76.3	Confident	77 Å²	77	103 Å²	103	54%	0.538	51%	0.505	S	S	.	.	H	α-helix	trans	-66.6	-42.8	174.3	-167.8	0	0	0	0	111.6	I124 Q125 K126 R131 R132	I124-S128 WeakPolarHBondContact O-CB 3.41Å; I124-S128 PolarHBondContact O-N 3.01Å; I124-S128 VanDerWaalsContact O-N 3.09Å; Q125-S128 CarbonylContact O-C 3.58Å; Q125-S128 WeakPolarHBondContact O-CA 3.4Å; Q125-S128 VanDerWaalsContact O-CB 3.31Å; Q125-S128 WeakPolarHBondContact O-CB 3.45Å; Q125-S128 PolarHBondContact O-N 2.86Å; K126-S128 VanDerWaalsContact C-N 3.35Å; K126-S128 PolarHBondContact O-N 3.39Å; S128-R131 WeakPolarHBondContact O-CB 3.47Å; S128-R131 PolarHBondContact O-N 2.92Å; S128-R132 WeakPolarHBondContact O-CB 3.18Å; S128-R132 PolarHBondContact O-N 3.16Å
129	E	81.6	Confident	77.3	Confident	108 Å²	108	103.7 Å²	103.7	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-69.9	-43.4	176.8	-64.9	-147.7	134.4	0	0	112.5	Q125 K126 R131 R132 Q133	Q125-E129 WeakPolarHBondContact O-CG 3.34Å; Q125-E129 PolarHBondContact O-N 2.91Å; K126-E129 PolarHBondContact O-N 2.84Å; E129-R131 VanDerWaalsContact C-N 3.31Å; E129-R131 PolarHBondContact O-N 3.17Å; E129-R132 CarbonylContact O-C 3.48Å; E129-R132 WeakPolarHBondContact O-CA 3.45Å; E129-R132 VanDerWaalsContact O-CB 3.25Å; E129-R132 WeakPolarHBondContact O-CB 3.42Å; E129-R132 PolarHBondContact O-N 2.83Å; E129-Q133 WeakPolarHBondContact O-CG 3.43Å; E129-Q133 PolarHBondContact O-N 3.22Å
130	E	83.2	Confident	78.1	Confident	93 Å²	93	107.5 Å²	107.5	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-56.2	-45.9	168.9	-84.6	-162.5	-168.1	0	0	111.1	K126 R132 Q133 K134	K126-E130 WeakPolarHBondContact O-CB 3.35Å; K126-E130 PolarHBondContact O-N 2.96Å; E130-R132 PolarHBondContact O-N 2.86Å; E130-Q133 PolarHBondContact O-N 3.3Å; E130-K134 HydrophobicContact CB-CD 4.46Å; E130-K134 WeakPolarHBondContact O-CB 3.39Å; E130-K134 VanDerWaalsContact O-CG 3.28Å; E130-K134 WeakPolarHBondContact O-CG 3.37Å; E130-K134 PolarHBondContact O-N 2.95Å; E130-K134 IonicContact OE2-NZ 3.82Å; E130-K134 PolarHBondContact OE2-NZ 2.9Å
131	R	77.4	Confident	78.4	Confident	159 Å²	159	111.7 Å²	111.7	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-59.7	-31.3	173.8	-97.9	178.4	156.3	-173.2	-1.3	111.7	I127 S128 E129 K135	I127-R131 VanDerWaalsContact O-CB 3.31Å; I127-R131 WeakPolarHBondContact O-CB 3.28Å; I127-R131 PolarHBondContact O-N 3.01Å; S128-R131 WeakPolarHBondContact O-CB 3.47Å; S128-R131 PolarHBondContact O-N 2.92Å; E129-R131 VanDerWaalsContact C-N 3.31Å; E129-R131 PolarHBondContact O-N 3.17Å; R131-K135 WeakPolarHBondContact O-CB 3.33Å; R131-K135 WeakPolarHBondContact O-CD 3.47Å; R131-K135 WeakPolarHBondContact O-CG 3.45Å; R131-K135 PolarHBondContact O-N 3.19Å
132	R	81	Confident	78.6	Confident	188 Å²	188	106.4 Å²	106.4	71%	0.709	50%	0.504	S	S	*	.	H	α-helix	trans	-75.6	-42.5	177	-166.9	178.7	-177.5	177.6	-0	111.7	S128 E129 E130 K135 A136	S128-R132 WeakPolarHBondContact O-CB 3.18Å; S128-R132 PolarHBondContact O-N 3.16Å; E129-R132 CarbonylContact O-C 3.48Å; E129-R132 WeakPolarHBondContact O-CA 3.45Å; E129-R132 VanDerWaalsContact O-CB 3.25Å; E129-R132 WeakPolarHBondContact O-CB 3.42Å; E129-R132 PolarHBondContact O-N 2.83Å; E130-R132 PolarHBondContact O-N 2.86Å; R132-K135 CarbonylContact O-C 3.55Å; R132-K135 PolarHBondContact O-N 3.46Å; R132-A136 WeakPolarHBondContact O-CB 3.45Å; R132-A136 PolarHBondContact O-N 3.39Å
133	Q	81.7	Confident	78.8	Confident	118 Å²	118	103.8 Å²	103.8	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-68.4	-48.6	176.6	-68	178.1	15.5	0	0	111.8	E129 E130 K135 A136 L137	E129-Q133 WeakPolarHBondContact O-CG 3.43Å; E129-Q133 PolarHBondContact O-N 3.22Å; E130-Q133 PolarHBondContact O-N 3.3Å; Q133-K135 VanDerWaalsContact C-N 3.3Å; Q133-K135 PolarHBondContact O-N 3.25Å; Q133-A136 CarbonylContact O-C 3.5Å; Q133-A136 WeakPolarHBondContact O-CA 3.28Å; Q133-A136 WeakPolarHBondContact O-CB 3.46Å; Q133-A136 PolarHBondContact O-N 2.77Å; Q133-L137 PolarHBondContact O-N 3.47Å
134	K	80.4	Confident	79	Confident	119 Å²	119	105.5 Å²	105.5	52%	0.517	52%	0.515	S	S	.	.	H	α-helix	trans	-57.5	-42.3	172.9	-69.8	167.3	176.4	170.6	0	110.7	E130 A136 M138	E130-K134 HydrophobicContact CB-CD 4.46Å; E130-K134 WeakPolarHBondContact O-CB 3.39Å; E130-K134 VanDerWaalsContact O-CG 3.28Å; E130-K134 WeakPolarHBondContact O-CG 3.37Å; E130-K134 PolarHBondContact O-N 2.95Å; E130-K134 IonicContact OE2-NZ 3.82Å; E130-K134 PolarHBondContact OE2-NZ 2.9Å; K134-A136 PolarHBondContact O-N 3.31Å; K134-M138 VanDerWaalsContact O-CB 3.28Å; K134-M138 WeakPolarHBondContact O-CB 3.49Å; K134-M138 VanDerWaalsContact O-CG 3.23Å; K134-M138 WeakPolarHBondContact O-CG 3.47Å; K134-M138 PolarHBondContact O-N 3.11Å
135	K	79.9	Confident	79.1	Confident	120 Å²	120	109.2 Å²	109.2	52%	0.522	53%	0.531	S	S	.	.	H	α-helix	trans	-72.9	-0.7	170.4	-70.2	170.9	-168.6	169.9	0	114.9	R131 R132 Q133 K139	R131-K135 WeakPolarHBondContact O-CB 3.33Å; R131-K135 WeakPolarHBondContact O-CD 3.47Å; R131-K135 WeakPolarHBondContact O-CG 3.45Å; R131-K135 PolarHBondContact O-N 3.19Å; R132-K135 CarbonylContact O-C 3.55Å; R132-K135 PolarHBondContact O-N 3.46Å; Q133-K135 VanDerWaalsContact C-N 3.3Å; Q133-K135 PolarHBondContact O-N 3.25Å; K135-K139 VanDerWaalsContact O-CD 3.26Å; K135-K139 WeakPolarHBondContact O-CD 3.26Å; K135-K139 WeakPolarHBondContact O-CE 3.27Å; K135-K139 VanDerWaalsContact O-CG 3.28Å; K135-K139 WeakPolarHBondContact O-CG 3.46Å; K135-K139 PolarHBondContact O-NZ 2.84Å
136	A	82.5	Confident	79.1	Confident	41 Å²	41	108 Å²	108	34%	0.339	53%	0.526	S	S	.	.	H	α-helix	trans	-102.1	-45.8	171.4	0	0	0	0	0	110.4	R132 Q133 K134 M138 K139 I140	R132-A136 WeakPolarHBondContact O-CB 3.45Å; R132-A136 PolarHBondContact O-N 3.39Å; Q133-A136 CarbonylContact O-C 3.5Å; Q133-A136 WeakPolarHBondContact O-CA 3.28Å; Q133-A136 WeakPolarHBondContact O-CB 3.46Å; Q133-A136 PolarHBondContact O-N 2.77Å; K134-A136 PolarHBondContact O-N 3.31Å; A136-M138 VanDerWaalsContact C-N 3.35Å; A136-M138 PolarHBondContact O-N 3.31Å; A136-K139 WeakPolarHBondContact O-CA 3.35Å; A136-K139 WeakPolarHBondContact O-CB 3.42Å; A136-K139 PolarHBondContact O-N 2.97Å; A136-I140 WeakPolarHBondContact O-CG1 3.3Å; A136-I140 PolarHBondContact O-N 2.84Å; A136-I140 VanDerWaalsContact O-N 3.16Å
137	L	80.5	Confident	78.9	Confident	103 Å²	103	106.7 Å²	106.7	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-56.3	-47.2	171.3	-65.7	171.5	0	0	0	111.2	Q133 K139 I140 L141	Q133-L137 PolarHBondContact O-N 3.47Å; L137-K139 PolarHBondContact O-N 3.49Å; L137-I140 PolarHBondContact O-N 3.14Å; L137-L141 PolarHBondContact O-N 3.33Å
138	M	72	Confident	78.7	Confident	121 Å²	121	112.4 Å²	112.4	60%	0.596	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	0.3	171.7	-69.1	-65.1	-63.1	0	0	115	K134 A136	K134-M138 VanDerWaalsContact O-CB 3.28Å; K134-M138 WeakPolarHBondContact O-CB 3.49Å; K134-M138 VanDerWaalsContact O-CG 3.23Å; K134-M138 WeakPolarHBondContact O-CG 3.47Å; K134-M138 PolarHBondContact O-N 3.11Å; A136-M138 VanDerWaalsContact C-N 3.35Å; A136-M138 PolarHBondContact O-N 3.31Å
139	K	80.9	Confident	78.9	Confident	116 Å²	116	111.4 Å²	111.4	50%	0.504	53%	0.533	S	S	.	.	H	α-helix	trans	-110.7	-12.5	170	-65.1	179	-172.9	125.1	0	113.2	K135 A136 L137	K135-K139 VanDerWaalsContact O-CD 3.26Å; K135-K139 WeakPolarHBondContact O-CD 3.26Å; K135-K139 WeakPolarHBondContact O-CE 3.27Å; K135-K139 VanDerWaalsContact O-CG 3.28Å; K135-K139 WeakPolarHBondContact O-CG 3.46Å; K135-K139 PolarHBondContact O-NZ 2.84Å; A136-K139 WeakPolarHBondContact O-CA 3.35Å; A136-K139 WeakPolarHBondContact O-CB 3.42Å; A136-K139 PolarHBondContact O-N 2.97Å; L137-K139 PolarHBondContact O-N 3.49Å
140	I	77.6	Confident	78.9	Confident	137 Å²	137	110.8 Å²	110.8	70%	0.703	53%	0.526	S	S	*	.	H	α-helix	trans	-94	-41.6	178.4	-66.6	163.1	0	0	0	109.1	A136 L137 E142	A136-I140 WeakPolarHBondContact O-CG1 3.3Å; A136-I140 PolarHBondContact O-N 2.84Å; A136-I140 VanDerWaalsContact O-N 3.16Å; L137-I140 PolarHBondContact O-N 3.14Å; I140-E142 VanDerWaalsContact C-N 3.29Å
141	L	78.1	Confident	78.6	Confident	139 Å²	139	114.7 Å²	114.7	73%	0.728	54%	0.537	S	S	*	.	S	Bend	trans	-78.2	-9.3	171.9	-70.2	165.5	0	0	0	113.9	L137 T143	L137-L141 PolarHBondContact O-N 3.33Å; L141-T143 PolarHBondContact O-N 2.87Å
142	E	74.6	Confident	78.7	Confident	20 Å²	20	112.3 Å²	112.3	9%	0.093	54%	0.536	C	S	.	.			trans	-64.5	116.7	-175	-165.8	-178.3	-143.3	0	0	111.7	I140 E146 K147 R150	I140-E142 VanDerWaalsContact C-N 3.29Å; E142-E146 HydrophobicContact CG-CB 4.12Å; E142-E146 HydrophobicContact CG-CG 4.01Å; E142-K147 VanDerWaalsContact CD-CA 3.48Å; E142-K147 HydrophobicContact CG-CB 3.91Å; E142-K147 WeakPolarHBondContact OE2-CG 3.37Å; E142-R150 VanDerWaalsContact CD-NH2 3.29Å; E142-R150 WeakPolarHBondContact OE1-CD 3.39Å; E142-R150 IonicContact OE1-CZ 2.83Å; E142-R150 IonicContact OE1-NE 3.23Å; E142-R150 PolarHBondContact OE1-NE 3.23Å; E142-R150 IonicContact OE1-NH1 2.7Å; E142-R150 PolarHBondContact OE1-NH1 3.05Å; E142-R150 IonicContact OE1-NH2 2.66Å; E142-R150 PolarHBondContact OE1-NH2 3.3Å; E142-R150 IonicContact OE2-CZ 2.8Å; E142-R150 IonicContact OE2-NH1 2.74Å; E142-R150 PolarHBondContact OE2-NH1 3.05Å; E142-R150 IonicContact OE2-NH2 3.25Å; E142-R150 PolarHBondContact OE2-NH2 3.48Å
143	T	80.9	Confident	78.8	Confident	71 Å²	71	106 Å²	106	44%	0.436	52%	0.524	S	S	.	.			trans	-60.2	153.1	178.8	64.8	0	0	0	0	111	L141 E145 E146 K147	L141-T143 PolarHBondContact O-N 2.87Å; T143-E145 PolarHBondContact O-N 3.29Å; T143-E145 VanDerWaalsContact O-N 3.11Å; T143-E146 PolarHBondContact N-OE2 2.96Å; T143-E146 PolarHBondContact O-N 3.24Å; T143-E146 WeakPolarHBondContact OG1-CB 3.36Å; T143-E146 PolarHBondContact OG1-N 3.2Å; T143-E146 VanDerWaalsContact OG1-N 3.16Å; T143-K147 WeakPolarHBondContact O-CB 3.17Å; T143-K147 PolarHBondContact O-N 3.14Å
144	P	79.7	Confident	78.9	Confident	117 Å²	117	107.3 Å²	107.3	76%	0.76	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.2	180	23.1	-34.1	0	0	0	113.2	R148	P144-R148 PolarHBondContact O-N 2.89Å
145	E	74.6	Confident	79	Confident	148 Å²	148	107.8 Å²	107.8	69%	0.692	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-48.7	176.1	-177.7	155.3	-132.1	0	0	112.6	T143 K147 R148 A149	T143-E145 PolarHBondContact O-N 3.29Å; T143-E145 VanDerWaalsContact O-N 3.11Å; E145-K147 VanDerWaalsContact C-N 3.27Å; E145-K147 PolarHBondContact O-N 2.69Å; E145-R148 CarbonylContact O-C 3.51Å; E145-R148 VanDerWaalsContact O-CA 3.3Å; E145-R148 WeakPolarHBondContact O-CA 3.46Å; E145-R148 WeakPolarHBondContact O-CB 3.5Å; E145-R148 PolarHBondContact O-N 3.26Å; E145-A149 PolarHBondContact O-N 2.88Å
146	E	76.9	Confident	78.8	Confident	93 Å²	93	106.8 Å²	106.8	44%	0.435	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-38	174.7	-174.1	176.8	-154.7	0	0	111.8	E142 T143 R148 A149 R150	E142-E146 HydrophobicContact CG-CB 4.12Å; E142-E146 HydrophobicContact CG-CG 4.01Å; T143-E146 PolarHBondContact N-OE2 2.96Å; T143-E146 PolarHBondContact O-N 3.24Å; T143-E146 WeakPolarHBondContact OG1-CB 3.36Å; T143-E146 PolarHBondContact OG1-N 3.2Å; T143-E146 VanDerWaalsContact OG1-N 3.16Å; E146-R148 PolarHBondContact O-N 2.94Å; E146-A149 PolarHBondContact O-N 3.24Å; E146-A149 VanDerWaalsContact O-N 3.17Å; E146-R150 WeakPolarHBondContact O-CB 3.41Å; E146-R150 PolarHBondContact O-N 2.81Å
147	K	78	Confident	78.6	Confident	90 Å²	90	107.5 Å²	107.5	39%	0.391	53%	0.533	S	S	.	.	H	α-helix	trans	-61.1	-28.7	171.1	-170.2	166.5	-171.6	165.3	0	112.9	E142 T143 E145 R151	E142-K147 VanDerWaalsContact CD-CA 3.48Å; E142-K147 HydrophobicContact CG-CB 3.91Å; E142-K147 WeakPolarHBondContact OE2-CG 3.37Å; T143-K147 WeakPolarHBondContact O-CB 3.17Å; T143-K147 PolarHBondContact O-N 3.14Å; E145-K147 VanDerWaalsContact C-N 3.27Å; E145-K147 PolarHBondContact O-N 2.69Å; K147-R151 WeakPolarHBondContact O-CD 3.43Å; K147-R151 VanDerWaalsContact O-CG 3.25Å; K147-R151 WeakPolarHBondContact O-CG 3.35Å; K147-R151 PolarHBondContact O-N 3.44Å
148	R	75.1	Confident	78.5	Confident	183 Å²	183	109 Å²	109	69%	0.691	54%	0.535	S	S	*	.	H	α-helix	trans	-78.1	-46.6	172.3	-156.4	-176.9	-168.9	-177.3	4	110.5	P144 E145 E146 R151 L152	P144-R148 PolarHBondContact O-N 2.89Å; E145-R148 CarbonylContact O-C 3.51Å; E145-R148 VanDerWaalsContact O-CA 3.3Å; E145-R148 WeakPolarHBondContact O-CA 3.46Å; E145-R148 WeakPolarHBondContact O-CB 3.5Å; E145-R148 PolarHBondContact O-N 3.26Å; E146-R148 PolarHBondContact O-N 2.94Å; R148-R151 WeakPolarHBondContact O-CA 3.24Å; R148-R151 WeakPolarHBondContact O-CB 2.9Å; R148-R151 PolarHBondContact O-N 3.42Å; R148-R151 VanDerWaalsContact O-N 3.1Å; R148-L152 PolarHBondContact O-N 2.84Å
149	A	80.4	Confident	78.4	Confident	55 Å²	55	105.3 Å²	105.3	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-58.1	-49.2	176.6	0	0	0	0	0	112.1	E145 E146 R151 L152 A153	E145-A149 PolarHBondContact O-N 2.88Å; E146-A149 PolarHBondContact O-N 3.24Å; E146-A149 VanDerWaalsContact O-N 3.17Å; A149-R151 VanDerWaalsContact C-N 3.27Å; A149-R151 PolarHBondContact O-N 3.33Å; A149-L152 WeakPolarHBondContact O-CB 3.4Å; A149-L152 PolarHBondContact O-N 3.08Å; A149-L152 VanDerWaalsContact O-N 3.09Å; A149-A153 PolarHBondContact O-N 3.3Å
150	R	81.2	Confident	77.8	Confident	95 Å²	95	105 Å²	105	36%	0.358	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-31.1	175.3	-168.5	-158.4	62.1	-141.8	-32.6	112.6	E142 E146 K154	E142-R150 VanDerWaalsContact CD-NH2 3.29Å; E142-R150 WeakPolarHBondContact OE1-CD 3.39Å; E142-R150 IonicContact OE1-CZ 2.83Å; E142-R150 IonicContact OE1-NE 3.23Å; E142-R150 PolarHBondContact OE1-NE 3.23Å; E142-R150 IonicContact OE1-NH1 2.7Å; E142-R150 PolarHBondContact OE1-NH1 3.05Å; E142-R150 IonicContact OE1-NH2 2.66Å; E142-R150 PolarHBondContact OE1-NH2 3.3Å; E142-R150 IonicContact OE2-CZ 2.8Å; E142-R150 IonicContact OE2-NH1 2.74Å; E142-R150 PolarHBondContact OE2-NH1 3.05Å; E142-R150 IonicContact OE2-NH2 3.25Å; E142-R150 PolarHBondContact OE2-NH2 3.48Å; E146-R150 WeakPolarHBondContact O-CB 3.41Å; E146-R150 PolarHBondContact O-N 2.81Å; R150-K154 WeakPolarHBondContact O-CB 3.17Å; R150-K154 PolarHBondContact O-N 3.12Å
151	R	78.2	Confident	77.5	Confident	175 Å²	175	105.5 Å²	105.5	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-70	-40.1	173	-81.8	174.4	173.3	-167.8	-1.7	111.6	K147 R148 A149 K155	K147-R151 WeakPolarHBondContact O-CD 3.43Å; K147-R151 VanDerWaalsContact O-CG 3.25Å; K147-R151 WeakPolarHBondContact O-CG 3.35Å; K147-R151 PolarHBondContact O-N 3.44Å; R148-R151 WeakPolarHBondContact O-CA 3.24Å; R148-R151 WeakPolarHBondContact O-CB 2.9Å; R148-R151 PolarHBondContact O-N 3.42Å; R148-R151 VanDerWaalsContact O-N 3.1Å; A149-R151 VanDerWaalsContact C-N 3.27Å; A149-R151 PolarHBondContact O-N 3.33Å; R151-K155 PolarHBondContact O-N 3.43Å
152	L	79.4	Confident	76.9	Confident	109 Å²	109	105 Å²	105	57%	0.571	49%	0.494	S	S	*	.	H	α-helix	trans	-64.3	-52.7	173.8	-75.6	165.5	0	0	0	111.3	R148 A149 K154 K155 E156	R148-L152 PolarHBondContact O-N 2.84Å; A149-L152 WeakPolarHBondContact O-CB 3.4Å; A149-L152 PolarHBondContact O-N 3.08Å; A149-L152 VanDerWaalsContact O-N 3.09Å; L152-K154 VanDerWaalsContact C-N 3.28Å; L152-K154 PolarHBondContact O-N 3.05Å; L152-K155 CarbonylContact O-C 3.58Å; L152-K155 WeakPolarHBondContact O-CA 3.24Å; L152-K155 VanDerWaalsContact O-CB 3.31Å; L152-K155 WeakPolarHBondContact O-CB 3.33Å; L152-K155 PolarHBondContact O-N 2.86Å; L152-E156 PolarHBondContact O-N 2.93Å
153	A	81.8	Confident	76.4	Confident	56 Å²	56	107.1 Å²	107.1	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-38.6	176.7	0	0	0	0	0	112.5	A149 K155 E156 A157	A149-A153 PolarHBondContact O-N 3.3Å; A153-K155 VanDerWaalsContact C-N 3.32Å; A153-K155 PolarHBondContact O-N 2.79Å; A153-E156 PolarHBondContact O-N 2.68Å; A153-A157 VanDerWaalsContact O-CB 3.25Å; A153-A157 WeakPolarHBondContact O-CB 3.26Å; A153-A157 PolarHBondContact O-N 3.31Å
154	K	85	Confident	75.7	Confident	146 Å²	146	108.9 Å²	108.9	64%	0.635	50%	0.504	S	S	*	.	H	α-helix	trans	-71.3	-22.8	174.2	-172.7	168.3	-178.3	174.3	0	113.6	R150 L152 K158	R150-K154 WeakPolarHBondContact O-CB 3.17Å; R150-K154 PolarHBondContact O-N 3.12Å; L152-K154 VanDerWaalsContact C-N 3.28Å; L152-K154 PolarHBondContact O-N 3.05Å; K154-K158 WeakPolarHBondContact O-CG 3.49Å
155	K	81.2	Confident	75	Confident	129 Å²	129	111.3 Å²	111.3	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-76.6	-51.8	169.6	-167.2	-161.3	175	-155.3	0	109.8	R151 L152 A153 A157 K158 E159	R151-K155 PolarHBondContact O-N 3.43Å; L152-K155 CarbonylContact O-C 3.58Å; L152-K155 WeakPolarHBondContact O-CA 3.24Å; L152-K155 VanDerWaalsContact O-CB 3.31Å; L152-K155 WeakPolarHBondContact O-CB 3.33Å; L152-K155 PolarHBondContact O-N 2.86Å; A153-K155 VanDerWaalsContact C-N 3.32Å; A153-K155 PolarHBondContact O-N 2.79Å; K155-A157 PolarHBondContact O-N 3.48Å; K155-K158 CarbonylContact O-C 3.54Å; K155-K158 WeakPolarHBondContact O-CA 3.42Å; K155-K158 WeakPolarHBondContact O-CB 3.22Å; K155-K158 PolarHBondContact O-N 3.05Å; K155-E159 WeakPolarHBondContact CE-OE2 3.37Å; K155-E159 IonicContact NZ-OE2 3.84Å; K155-E159 PolarHBondContact O-N 2.88Å
156	E	77	Confident	74.2	Confident	98 Å²	98	108.1 Å²	108.1	46%	0.458	49%	0.485	S	S	.	.	H	α-helix	trans	-58.7	-44.6	-179.9	-164.9	-149.3	136.5	0	0	112.3	L152 A153 K158 E159 R160	L152-E156 PolarHBondContact O-N 2.93Å; A153-E156 PolarHBondContact O-N 2.68Å; E156-K158 VanDerWaalsContact C-N 3.3Å; E156-K158 PolarHBondContact O-N 3.1Å; E156-E159 CarbonylContact O-C 3.54Å; E156-E159 WeakPolarHBondContact O-CA 3.23Å; E156-E159 WeakPolarHBondContact O-CB 3.25Å; E156-E159 PolarHBondContact O-N 3.45Å; E156-R160 PolarHBondContact O-N 2.82Å; E156-R160 IonicContact OE1-CZ 3.44Å; E156-R160 IonicContact OE1-NH1 2.75Å; E156-R160 PolarHBondContact OE1-NH1 3.4Å; E156-R160 IonicContact OE1-NH2 2.65Å
157	A	78.3	Confident	73.4	Confident	57 Å²	57	105.7 Å²	105.7	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-35.6	175.8	0	0	0	0	0	112.5	A153 K155 W161	A153-A157 VanDerWaalsContact O-CB 3.25Å; A153-A157 WeakPolarHBondContact O-CB 3.26Å; A153-A157 PolarHBondContact O-N 3.31Å; K155-A157 PolarHBondContact O-N 3.48Å; A157-W161 VanDerWaalsContact O-CB 3.22Å; A157-W161 WeakPolarHBondContact O-CB 3.4Å; A157-W161 PolarHBondContact O-N 2.97Å
158	K	76.6	Confident	72.3	Confident	133 Å²	133	104.1 Å²	104.1	58%	0.578	48%	0.476	S	S	*	.	H	α-helix	trans	-69.7	-33.5	170.3	-80.6	-174.5	168.2	-162.4	0	112.3	K154 K155 E156 R162	K154-K158 WeakPolarHBondContact O-CG 3.49Å; K155-K158 CarbonylContact O-C 3.54Å; K155-K158 WeakPolarHBondContact O-CA 3.42Å; K155-K158 WeakPolarHBondContact O-CB 3.22Å; K155-K158 PolarHBondContact O-N 3.05Å; E156-K158 VanDerWaalsContact C-N 3.3Å; E156-K158 PolarHBondContact O-N 3.1Å; K158-R162 VanDerWaalsContact O-CB 3.3Å; K158-R162 WeakPolarHBondContact O-CB 3.5Å; K158-R162 PolarHBondContact O-N 2.99Å
159	E	70.3	Confident	71.2	Confident	44 Å²	44	99.8 Å²	99.8	21%	0.206	47%	0.466	C	S	.	.	H	α-helix	trans	-66	-48.7	175.9	-125.6	86.1	-92.7	0	0	111	K155 E156 R162 R163	K155-E159 WeakPolarHBondContact CE-OE2 3.37Å; K155-E159 IonicContact NZ-OE2 3.84Å; K155-E159 PolarHBondContact O-N 2.88Å; E156-E159 CarbonylContact O-C 3.54Å; E156-E159 WeakPolarHBondContact O-CA 3.23Å; E156-E159 WeakPolarHBondContact O-CB 3.25Å; E156-E159 PolarHBondContact O-N 3.45Å; E159-R162 WeakPolarHBondContact O-CB 3.47Å; E159-R162 PolarHBondContact O-N 3.15Å; E159-R162 IonicContact OE1-CZ 2.73Å; E159-R162 IonicContact OE1-NH1 2.83Å; E159-R162 PolarHBondContact OE1-NH1 2.83Å; E159-R162 IonicContact OE1-NH2 3.17Å; E159-R162 PolarHBondContact OE1-NH2 3.1Å; E159-R163 PolarHBondContact O-N 3.24Å
160	R	69.7	Low	70.3	Confident	109 Å²	109	106.7 Å²	106.7	41%	0.411	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-50	176.4	178.2	-178.7	-86.4	106.7	-4	111	E156 R162 R163 E164	E156-R160 PolarHBondContact O-N 2.82Å; E156-R160 IonicContact OE1-CZ 3.44Å; E156-R160 IonicContact OE1-NH1 2.75Å; E156-R160 PolarHBondContact OE1-NH1 3.4Å; E156-R160 IonicContact OE1-NH2 2.65Å; R160-R162 PolarHBondContact O-N 3.32Å; R160-R163 PolarHBondContact O-N 3.12Å; R160-E164 WeakPolarHBondContact CD-OE1 3.42Å; R160-E164 HydrophobicContact CG-CG 4.42Å; R160-E164 WeakPolarHBondContact CG-OE1 3.03Å; R160-E164 WeakPolarHBondContact O-CG 3.34Å; R160-E164 PolarHBondContact O-N 3.08Å
161	W	69.4	Low	69.1	Low	148 Å²	148	110.2 Å²	110.2	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-60.7	-30.8	176.1	-176.5	87.8	0	0	0	113.3	A157 R165	A157-W161 VanDerWaalsContact O-CB 3.22Å; A157-W161 WeakPolarHBondContact O-CB 3.4Å; A157-W161 PolarHBondContact O-N 2.97Å; W161-R165 VanDerWaalsContact CH2-NH2 3.31Å; W161-R165 WeakPolarHBondContact O-CB 3.43Å; W161-R165 PolarHBondContact O-N 3.46Å
162	R	67.1	Low	68.1	Low	128 Å²	128	108 Å²	108	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-70.6	-42.7	172.2	-163.3	-167.9	-49.9	117.4	9	111.4	K158 E159 R160 R165 M166	K158-R162 VanDerWaalsContact O-CB 3.3Å; K158-R162 WeakPolarHBondContact O-CB 3.5Å; K158-R162 PolarHBondContact O-N 2.99Å; E159-R162 WeakPolarHBondContact O-CB 3.47Å; E159-R162 PolarHBondContact O-N 3.15Å; E159-R162 IonicContact OE1-CZ 2.73Å; E159-R162 IonicContact OE1-NH1 2.83Å; E159-R162 PolarHBondContact OE1-NH1 2.83Å; E159-R162 IonicContact OE1-NH2 3.17Å; E159-R162 PolarHBondContact OE1-NH2 3.1Å; R160-R162 PolarHBondContact O-N 3.32Å; R162-R165 PolarHBondContact O-N 3.42Å; R162-M166 WeakPolarHBondContact O-CG 3.49Å; R162-M166 PolarHBondContact O-N 3.01Å
163	R	64.1	Low	67	Low	66 Å²	66	105.3 Å²	105.3	25%	0.249	49%	0.485	C	S	.	.	H	α-helix	trans	-64.6	-48.7	176.9	-83	178.1	-90.8	142.4	-8.3	112.4	E159 R160 R165 M166 L173	E159-R163 PolarHBondContact O-N 3.24Å; R160-R163 PolarHBondContact O-N 3.12Å; R163-R165 VanDerWaalsContact C-N 3.29Å; R163-R165 PolarHBondContact O-N 2.81Å; R163-M166 PolarHBondContact O-N 3.03Å; R163-L173 PolarHBondContact NH1-O 2.9Å
164	E	64.9	Low	65.9	Low	108 Å²	108	105.6 Å²	105.6	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-57.9	-41.4	175.6	-70.3	165.4	179.1	0	0	111.7	R160 M166 G167	R160-E164 WeakPolarHBondContact CD-OE1 3.42Å; R160-E164 HydrophobicContact CG-CG 4.42Å; R160-E164 WeakPolarHBondContact CG-OE1 3.03Å; R160-E164 WeakPolarHBondContact O-CG 3.34Å; R160-E164 PolarHBondContact O-N 3.08Å; E164-M166 VanDerWaalsContact C-N 3.26Å; E164-M166 PolarHBondContact O-N 3.33Å; E164-G167 PolarHBondContact O-N 3.26Å
165	R	66.4	Low	64.9	Low	167 Å²	167	102.8 Å²	102.8	63%	0.63	48%	0.48	S	S	*	.	H	α-helix	trans	-63.1	-28.8	175.2	175.2	173.7	-70.8	-131.7	-11.3	113.7	W161 R162 R163 G167	W161-R165 VanDerWaalsContact CH2-NH2 3.31Å; W161-R165 WeakPolarHBondContact O-CB 3.43Å; W161-R165 PolarHBondContact O-N 3.46Å; R162-R165 PolarHBondContact O-N 3.42Å; R163-R165 VanDerWaalsContact C-N 3.29Å; R163-R165 PolarHBondContact O-N 2.81Å; R165-G167 VanDerWaalsContact C-N 3.27Å; R165-G167 PolarHBondContact O-N 2.8Å
166	M	57.2	Low	63.8	Low	82 Å²	82	99.4 Å²	99.4	40%	0.404	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2.3	178.6	-65.9	-74.6	-81.3	0	0	113.1	R162 R163 E164 S188	R162-M166 WeakPolarHBondContact O-CG 3.49Å; R162-M166 PolarHBondContact O-N 3.01Å; R163-M166 PolarHBondContact O-N 3.03Å; E164-M166 VanDerWaalsContact C-N 3.26Å; E164-M166 PolarHBondContact O-N 3.33Å; M166-S188 VanDerWaalsContact CE-O 3.31Å; M166-S188 WeakPolarHBondContact CE-O 3.46Å
167	G	59.2	Low	63.4	Low	41 Å²	41	97.5 Å²	97.5	42%	0.423	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	20	172.7	0	0	0	0	0	115	E164 R165 D169	E164-G167 PolarHBondContact O-N 3.26Å; R165-G167 VanDerWaalsContact C-N 3.27Å; R165-G167 PolarHBondContact O-N 2.8Å; G167-D169 PolarHBondContact O-N 3.32Å
168	W	56.3	Low	62.8	Low	58 Å²	58	104.1 Å²	104.1	22%	0.22	48%	0.484	C	S	.	.			trans	-72.5	114.1	176.9	-72.6	25.7	0	0	0	110	Y175 L187	W168-Y175 WeakPolarHBondContact CZ3-O 3.16Å; W168-L187 HydrophobicContact CH2-CD2 3.78Å; W168-L187 HydrophobicContact CH2-CG 3.82Å; W168-L187 HydrophobicContact CZ2-CG 4.15Å
169	D	52	Low	62.2	Low	92 Å²	92	103.2 Å²	103.2	49%	0.492	49%	0.485	S	S	.	.			trans	-65.2	161.9	176.2	-104.6	-41.1	0	0	0	111.7	G167 E171 Y172 L173 K222	G167-D169 PolarHBondContact O-N 3.32Å; D169-E171 PolarHBondContact O-N 3.17Å; D169-Y172 PolarHBondContact O-N 2.81Å; D169-L173 PolarHBondContact O-N 3.21Å; D169-K222 IonicContact OD1-NZ 3.76Å; D169-K222 PolarHBondContact OD1-NZ 3.41Å; D169-K222 IonicContact OD2-NZ 2.89Å; D169-K222 PolarHBondContact OD2-NZ 2.85Å
170	K	61.5	Low	62.1	Low	199 Å²	199	102 Å²	102	87%	0.865	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-24.5	-167.6	-155.5	178.4	-175	-175.6	0	114.9
171	E	56.3	Low	62.1	Low	169 Å²	169	101 Å²	101	79%	0.79	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-33.8	179.2	-171.6	168.7	-136.6	0	0	113.3	D169 L173	D169-E171 PolarHBondContact O-N 3.17Å; E171-L173 VanDerWaalsContact C-N 3.31Å
172	Y	55.8	Low	61.7	Low	129 Å²	129	101.5 Å²	101.5	51%	0.506	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-84.9	-5.7	178.2	-74.7	-95	0	0	0	113.2	D169 G174 Y175	D169-Y172 PolarHBondContact O-N 2.81Å; Y172-G174 PolarHBondContact O-N 3.36Å; Y172-Y175 HydrophobicContact CD1-CD2 4.03Å; Y172-Y175 HydrophobicContact CD1-CE2 4.02Å; Y172-Y175 HydrophobicContact CE1-CE2 4.5Å; Y172-Y175 PolarHBondContact O-N 3.13Å
173	L	57.2	Low	61.6	Low	53 Å²	53	97.9 Å²	97.9	28%	0.277	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-66.1	-13.5	-169.1	-151.6	73.5	0	0	0	114.7	R163 D169 E171	R163-L173 PolarHBondContact NH1-O 2.9Å; D169-L173 PolarHBondContact O-N 3.21Å; E171-L173 VanDerWaalsContact C-N 3.31Å
174	G	58.4	Low	61.8	Low	62 Å²	62	98.5 Å²	98.5	64%	0.639	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-85.1	-25.3	178.9	0	0	0	0	0	115.5	Y172	Y172-G174 PolarHBondContact O-N 3.36Å
175	Y	63.5	Low	62.1	Low	87 Å²	87	100.8 Å²	100.8	34%	0.341	52%	0.515	S	S	.	.			trans	-73.7	150.4	-176.4	-58.5	-61.6	0	0	0	112.5	W168 Y172 P181	W168-Y175 WeakPolarHBondContact CZ3-O 3.16Å; Y172-Y175 HydrophobicContact CD1-CD2 4.03Å; Y172-Y175 HydrophobicContact CD1-CE2 4.02Å; Y172-Y175 HydrophobicContact CE1-CE2 4.5Å; Y172-Y175 PolarHBondContact O-N 3.13Å; Y175-P181 HydrophobicContact CD1-CG 4.16Å; Y175-P181 VanDerWaalsContact CE1-CD 3.49Å; Y175-P181 HydrophobicContact CE1-CG 3.63Å
176	T	58.8	Low	62.1	Low	58 Å²	58	100 Å²	100	36%	0.356	51%	0.512	S	S	.	.			trans	-134	170.3	174.6	78	0	0	0	0	110.6	E178 D179	T176-E178 PolarHBondContact O-N 3.2Å; T176-E178 PolarHBondContact OG1-N 2.88Å; T176-D179 PolarHBondContact N-O 3.17Å; T176-D179 CarbonylContact O-C 3.54Å; T176-D179 PolarHBondContact O-N 3.2Å; T176-D179 VanDerWaalsContact O-O 3.09Å; T176-D179 WeakPolarHBondContact OG1-CB 3.43Å; T176-D179 PolarHBondContact OG1-N 3.22Å
177	N	68.5	Low	62.6	Low	58 Å²	58	98.5 Å²	98.5	31%	0.31	51%	0.506	S	S	.	.	S	Bend	trans	-66.7	-17.6	173	-74.9	49.6	0	0	0	113.1	H185 S188	N177-H185 PolarHBondContact ND2-O 3Å; N177-S188 VanDerWaalsContact CG-OG 3.29Å; N177-S188 PolarHBondContact ND2-OG 3.32Å; N177-S188 VanDerWaalsContact OD1-CB 3.25Å; N177-S188 WeakPolarHBondContact OD1-CB 3.43Å; N177-S188 PolarHBondContact OD1-N 2.93Å; N177-S188 PolarHBondContact OD1-OG 3.26Å
178	E	65.1	Low	62.6	Low	196 Å²	196	99.4 Å²	99.4	92%	0.916	51%	0.505	S	S	*	.	S	Bend	trans	-98.3	-21.2	179.8	-66.9	167.7	-166.4	0	0	111.5	T176	T176-E178 PolarHBondContact O-N 3.2Å; T176-E178 PolarHBondContact OG1-N 2.88Å
179	D	65.3	Low	63.2	Low	113 Å²	113	102.2 Å²	102.2	60%	0.604	52%	0.521	S	S	*	.	S	Bend	trans	-131	83.4	-178	-165.8	6.9	0	0	0	109.3	T176	T176-D179 PolarHBondContact N-O 3.17Å; T176-D179 CarbonylContact O-C 3.54Å; T176-D179 PolarHBondContact O-N 3.2Å; T176-D179 VanDerWaalsContact O-O 3.09Å; T176-D179 WeakPolarHBondContact OG1-CB 3.43Å; T176-D179 PolarHBondContact OG1-N 3.22Å
180	N	67.7	Low	63.7	Low	19 Å²	19	100.3 Å²	100.3	10%	0.102	52%	0.515	C	S	.	.			trans	-133.2	115.4	-174.8	176.5	7.1	0	0	0	110.1	F182 G183 D184 L187	N180-F182 PolarHBondContact O-N 2.81Å; N180-F182 VanDerWaalsContact O-N 3.1Å; N180-F182 WeakPolarHBondContact OD1-CB 3.39Å; N180-F182 WeakPolarHBondContact OD1-CD2 3.47Å; N180-F182 PolarHBondContact OD1-N 3.19Å; N180-G183 PolarHBondContact O-N 3.42Å; N180-D184 PolarHBondContact ND2-N 3.17Å; N180-D184 VanDerWaalsContact ND2-N 3.16Å; N180-D184 PolarHBondContact ND2-O 2.99Å; N180-L187 HydrophobicContact CB-CD2 4.17Å
181	P	69.3	Low	64.2	Low	87 Å²	87	99 Å²	99	57%	0.565	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.8	-179.3	28.6	-36.6	0	0	0	113.8	Y175	Y175-P181 HydrophobicContact CD1-CG 4.16Å; Y175-P181 VanDerWaalsContact CE1-CD 3.49Å; Y175-P181 HydrophobicContact CE1-CG 3.63Å
182	F	62.1	Low	64.7	Low	160 Å²	160	94.4 Å²	94.4	70%	0.702	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-0.8	177.1	-53	-70.1	0	0	0	113.7	N180 D184	N180-F182 PolarHBondContact O-N 2.81Å; N180-F182 VanDerWaalsContact O-N 3.1Å; N180-F182 WeakPolarHBondContact OD1-CB 3.39Å; N180-F182 WeakPolarHBondContact OD1-CD2 3.47Å; N180-F182 PolarHBondContact OD1-N 3.19Å; F182-D184 PolarHBondContact O-N 2.83Å
183	G	63.8	Low	65.7	Low	51 Å²	51	95.1 Å²	95.1	53%	0.526	50%	0.495	S	S	.	.			trans	72.6	0.7	175.4	0	0	0	0	0	116.6	N180 H185	N180-G183 PolarHBondContact O-N 3.42Å; G183-H185 PolarHBondContact O-CE1 3.43Å; G183-H185 PolarHBondContact O-N 2.71Å; G183-H185 PolarHBondContact O-ND1 2.96Å
184	D	69.3	Low	66.5	Low	79 Å²	79	100 Å²	100	42%	0.422	51%	0.514	S	S	.	.			trans	-79.7	116.8	178.8	-175.6	1.9	0	0	0	112	N180 F182 R186	N180-D184 PolarHBondContact ND2-N 3.17Å; N180-D184 VanDerWaalsContact ND2-N 3.16Å; N180-D184 PolarHBondContact ND2-O 2.99Å; F182-D184 PolarHBondContact O-N 2.83Å; D184-R186 PolarHBondContact O-N 3.49Å; D184-R186 VanDerWaalsContact O-N 3.16Å; D184-R186 WeakPolarHBondContact OD1-CB 3.26Å; D184-R186 PolarHBondContact OD1-N 3.27Å
185	H	70.1	Confident	67.5	Low	156 Å²	156	106 Å²	106	72%	0.722	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.8	177.5	-38.6	-44.6	0	0	0	113.9	N177 G183	N177-H185 PolarHBondContact ND2-O 3Å; G183-H185 PolarHBondContact O-CE1 3.43Å; G183-H185 PolarHBondContact O-N 2.71Å; G183-H185 PolarHBondContact O-ND1 2.96Å
186	R	67.5	Low	68.2	Low	150 Å²	150	106.2 Å²	106.2	57%	0.566	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	21.4	-172.7	-59.9	177.2	-176.1	-85.4	-4.5	113.8	D184 S188 E189	D184-R186 PolarHBondContact O-N 3.49Å; D184-R186 VanDerWaalsContact O-N 3.16Å; D184-R186 WeakPolarHBondContact OD1-CB 3.26Å; D184-R186 PolarHBondContact OD1-N 3.27Å; R186-S188 PolarHBondContact O-N 3.48Å; R186-E189 HydrophobicContact CB-CB 4.25Å; R186-E189 HydrophobicContact CB-CG 4.26Å; R186-E189 WeakPolarHBondContact CD-OE2 3.18Å; R186-E189 IonicContact CZ-OE2 3.21Å; R186-E189 IonicContact NE-OE2 3.32Å; R186-E189 IonicContact NH1-OE1 3.05Å; R186-E189 IonicContact NH1-OE2 3.06Å; R186-E189 PolarHBondContact NH1-OE2 3.08Å; R186-E189 PolarHBondContact O-N 3.24Å
187	L	66.2	Low	69	Low	52 Å²	52	105.2 Å²	105.2	27%	0.272	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-29.5	-175.3	-166.7	66.3	0	0	0	114.9	W168 N180	W168-L187 HydrophobicContact CH2-CD2 3.78Å; W168-L187 HydrophobicContact CH2-CG 3.82Å; W168-L187 HydrophobicContact CZ2-CG 4.15Å; N180-L187 HydrophobicContact CB-CD2 4.17Å
188	S	60.8	Low	69.6	Low	60 Å²	60	108.5 Å²	108.5	42%	0.42	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-0.9	175	58.5	0	0	0	0	116.7	M166 N177 R186	M166-S188 VanDerWaalsContact CE-O 3.31Å; M166-S188 WeakPolarHBondContact CE-O 3.46Å; N177-S188 VanDerWaalsContact CG-OG 3.29Å; N177-S188 PolarHBondContact ND2-OG 3.32Å; N177-S188 VanDerWaalsContact OD1-CB 3.25Å; N177-S188 WeakPolarHBondContact OD1-CB 3.43Å; N177-S188 PolarHBondContact OD1-N 2.93Å; N177-S188 PolarHBondContact OD1-OG 3.26Å; R186-S188 PolarHBondContact O-N 3.48Å
189	E	67.1	Low	70.4	Confident	116 Å²	116	108.6 Å²	108.6	54%	0.542	52%	0.518	S	S	.	.	S	Bend	trans	-87.5	126	171	-61.7	-169.3	155.9	0	0	110.1	R186 F191	R186-E189 HydrophobicContact CB-CB 4.25Å; R186-E189 HydrophobicContact CB-CG 4.26Å; R186-E189 WeakPolarHBondContact CD-OE2 3.18Å; R186-E189 IonicContact CZ-OE2 3.21Å; R186-E189 IonicContact NE-OE2 3.32Å; R186-E189 IonicContact NH1-OE1 3.05Å; R186-E189 IonicContact NH1-OE2 3.06Å; R186-E189 PolarHBondContact NH1-OE2 3.08Å; R186-E189 PolarHBondContact O-N 3.24Å; E189-F191 PolarHBondContact O-N 3.37Å; E189-F191 VanDerWaalsContact O-N 3.15Å
190	S	64.1	Low	70.8	Confident	53 Å²	53	108.8 Å²	108.8	37%	0.371	52%	0.515	S	S	.	.			trans	-72	109.9	178.3	29.5	0	0	0	0	111.8	V192	S190-V192 PolarHBondContact O-N 2.77Å
191	F	70.9	Confident	71.3	Confident	171 Å²	171	109.6 Å²	109.6	75%	0.75	53%	0.528	S	S	*	.			trans	-61.7	115.7	176.9	176.9	-102.7	0	0	0	111.9	E189 W193	E189-F191 PolarHBondContact O-N 3.37Å; E189-F191 VanDerWaalsContact O-N 3.15Å; F191-W193 HydrophobicContact CD1-CB 4.46Å; F191-W193 HydrophobicContact CE1-CB 3.79Å; F191-W193 HydrophobicContact CE1-CG 4.32Å; F191-W193 HydrophobicContact CZ-CB 4.46Å
192	V	68.3	Low	71.5	Confident	73 Å²	73	107.8 Å²	107.8	44%	0.442	51%	0.513	S	S	.	.			trans	-97.7	107.1	175.7	-178.3	0	0	0	0	109.6	S190 K194 L197	S190-V192 PolarHBondContact O-N 2.77Å; V192-K194 VanDerWaalsContact C-N 3.28Å; V192-K194 PolarHBondContact O-N 3.24Å; V192-L197 HydrophobicContact CG1-CD1 4.15Å; V192-L197 HydrophobicContact CG1-CD2 4.05Å
193	W	75.5	Confident	71.9	Confident	143 Å²	143	103.8 Å²	103.8	54%	0.542	51%	0.505	S	S	.	.			trans	-73.5	80.5	174.3	-170.7	5.3	0	0	0	110.6	F191 R195 K196 L197	F191-W193 HydrophobicContact CD1-CB 4.46Å; F191-W193 HydrophobicContact CE1-CB 3.79Å; F191-W193 HydrophobicContact CE1-CG 4.32Å; F191-W193 HydrophobicContact CZ-CB 4.46Å; W193-R195 VanDerWaalsContact C-N 3.29Å; W193-R195 PolarHBondContact O-N 3.39Å; W193-K196 HydrophobicContact CB-CB 4.06Å; W193-K196 HydrophobicContact CD2-CB 3.57Å; W193-K196 HydrophobicContact CD2-CD 4.08Å; W193-K196 HydrophobicContact CD2-CG 4.47Å; W193-K196 HydrophobicContact CE3-CB 3.86Å; W193-K196 HydrophobicContact CE3-CD 3.44Å; W193-K196 VanDerWaalsContact CE3-CD 3.44Å; W193-K196 HydrophobicContact CE3-CG 4.28Å; W193-K196 HydrophobicContact CG-CB 3.67Å; W193-K196 HydrophobicContact CZ3-CD 3.77Å; W193-K196 WeakPolarHBondContact O-CA 3.33Å; W193-K196 WeakPolarHBondContact O-CB 3.5Å; W193-K196 PolarHBondContact O-N 3.14Å; W193-L197 PolarHBondContact O-N 2.64Å; W193-L197 VanDerWaalsContact O-N 3.13Å
194	K	74.9	Confident	72.2	Confident	157 Å²	157	108.8 Å²	108.8	68%	0.683	51%	0.514	S	S	*	.	H	α-helix	trans	-46.8	-47.9	-176.1	-61.9	-175.8	179.7	-177.1	0	113.4	V192 K196 L197 E198	V192-K194 VanDerWaalsContact C-N 3.28Å; V192-K194 PolarHBondContact O-N 3.24Å; K194-K196 PolarHBondContact O-N 3.48Å; K194-K196 VanDerWaalsContact O-N 3.16Å; K194-L197 WeakPolarHBondContact O-CA 3.49Å; K194-L197 WeakPolarHBondContact O-CB 3.17Å; K194-L197 PolarHBondContact O-N 3.31Å; K194-E198 WeakPolarHBondContact O-CG 3.34Å; K194-E198 PolarHBondContact O-N 2.88Å
195	R	79	Confident	72.4	Confident	186 Å²	186	107.9 Å²	107.9	70%	0.702	51%	0.51	S	S	*	.	H	α-helix	trans	-64.2	-18.7	179.6	-153.3	173.9	-173.7	-178.1	1.2	114.5	W193 E198 R199	W193-R195 VanDerWaalsContact C-N 3.29Å; W193-R195 PolarHBondContact O-N 3.39Å; R195-E198 WeakPolarHBondContact CA-OE2 3.37Å; R195-R199 WeakPolarHBondContact O-CB 3.34Å; R195-R199 PolarHBondContact O-N 3.38Å
196	K	77.4	Confident	72.7	Confident	92 Å²	92	103 Å²	103	40%	0.4	49%	0.492	S	S	.	.	H	α-helix	trans	-87.5	-37.2	170.2	178.2	172.7	176.3	175.7	0	111.8	W193 K194 E198 R199 Q200	W193-K196 HydrophobicContact CB-CB 4.06Å; W193-K196 HydrophobicContact CD2-CB 3.57Å; W193-K196 HydrophobicContact CD2-CD 4.08Å; W193-K196 HydrophobicContact CD2-CG 4.47Å; W193-K196 HydrophobicContact CE3-CB 3.86Å; W193-K196 HydrophobicContact CE3-CD 3.44Å; W193-K196 VanDerWaalsContact CE3-CD 3.44Å; W193-K196 HydrophobicContact CE3-CG 4.28Å; W193-K196 HydrophobicContact CG-CB 3.67Å; W193-K196 HydrophobicContact CZ3-CD 3.77Å; W193-K196 WeakPolarHBondContact O-CA 3.33Å; W193-K196 WeakPolarHBondContact O-CB 3.5Å; W193-K196 PolarHBondContact O-N 3.14Å; K194-K196 PolarHBondContact O-N 3.48Å; K194-K196 VanDerWaalsContact O-N 3.16Å; K196-E198 VanDerWaalsContact C-N 3.33Å; K196-R199 PolarHBondContact O-N 3.22Å; K196-Q200 HydrophobicContact CG-CG 4.29Å; K196-Q200 WeakPolarHBondContact O-CB 3.47Å; K196-Q200 WeakPolarHBondContact O-CG 3.35Å; K196-Q200 PolarHBondContact O-N 3.44Å
197	L	77.1	Confident	73	Confident	38 Å²	38	103.1 Å²	103.1	20%	0.199	50%	0.497	C	S	.	.	H	α-helix	trans	-57.5	-47	170.2	-103.3	68.8	0	0	0	111.4	V192 W193 K194 Q200 G201 L202 L210	V192-L197 HydrophobicContact CG1-CD1 4.15Å; V192-L197 HydrophobicContact CG1-CD2 4.05Å; W193-L197 PolarHBondContact O-N 2.64Å; W193-L197 VanDerWaalsContact O-N 3.13Å; K194-L197 WeakPolarHBondContact O-CA 3.49Å; K194-L197 WeakPolarHBondContact O-CB 3.17Å; K194-L197 PolarHBondContact O-N 3.31Å; L197-Q200 PolarHBondContact O-N 3.08Å; L197-G201 PolarHBondContact O-N 3.35Å; L197-L202 HydrophobicContact CG-CB 4.36Å; L197-L202 PolarHBondContact O-N 2.95Å; L197-L210 HydrophobicContact CD1-CD2 4.32Å; L197-L210 HydrophobicContact CD2-CD1 3.69Å; L197-L210 HydrophobicContact CD2-CD2 3.94Å; L197-L210 HydrophobicContact CD2-CG 4.49Å; L197-L210 HydrophobicContact CG-CD2 4.05Å
198	E	80.1	Confident	73.5	Confident	126 Å²	126	107.9 Å²	107.9	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-59.4	-51.4	175.5	-68.6	165.9	152.4	0	0	111	K194 R195 K196 Q200 G201	K194-E198 WeakPolarHBondContact O-CG 3.34Å; K194-E198 PolarHBondContact O-N 2.88Å; R195-E198 WeakPolarHBondContact CA-OE2 3.37Å; K196-E198 VanDerWaalsContact C-N 3.33Å; E198-Q200 VanDerWaalsContact C-N 3.28Å; E198-Q200 PolarHBondContact O-N 3.18Å; E198-G201 PolarHBondContact O-N 2.64Å; E198-G201 VanDerWaalsContact O-N 3.09Å
199	R	82.4	Confident	74.3	Confident	199 Å²	199	108.6 Å²	108.6	75%	0.751	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-30.3	179.7	-174	-178.2	-67.5	173.7	-5	113.9	R195 K196	R195-R199 WeakPolarHBondContact O-CB 3.34Å; R195-R199 PolarHBondContact O-N 3.38Å; K196-R199 PolarHBondContact O-N 3.22Å
200	Q	74	Confident	74.8	Confident	116 Å²	116	104.8 Å²	104.8	54%	0.542	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	2	177.6	-65.9	-165	-92.7	0	0	113.5	K196 L197 E198 L202	K196-Q200 HydrophobicContact CG-CG 4.29Å; K196-Q200 WeakPolarHBondContact O-CB 3.47Å; K196-Q200 WeakPolarHBondContact O-CG 3.35Å; K196-Q200 PolarHBondContact O-N 3.44Å; L197-Q200 PolarHBondContact O-N 3.08Å; E198-Q200 VanDerWaalsContact C-N 3.28Å; E198-Q200 PolarHBondContact O-N 3.18Å; Q200-L202 HydrophobicContact CB-CD1 3.94Å; Q200-L202 HydrophobicContact CB-CG 4.03Å; Q200-L202 PolarHBondContact O-N 2.86Å
201	G	76.8	Confident	75.3	Confident	37 Å²	37	106.5 Å²	106.5	38%	0.381	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	23.9	-176.4	0	0	0	0	0	113.7	L197 E198 H204	L197-G201 PolarHBondContact O-N 3.35Å; E198-G201 PolarHBondContact O-N 2.64Å; E198-G201 VanDerWaalsContact O-N 3.09Å; G201-H204 PolarHBondContact O-CE1 3.05Å; G201-H204 PolarHBondContact O-NE2 2.95Å
202	L	73.6	Confident	75.8	Confident	48 Å²	48	103.1 Å²	103.1	25%	0.251	50%	0.496	S	S	.	.			trans	-103	14.4	-177.9	-60.9	173.3	0	0	0	112.7	L197 Q200 H204 L205 L210	L197-L202 HydrophobicContact CG-CB 4.36Å; L197-L202 PolarHBondContact O-N 2.95Å; Q200-L202 HydrophobicContact CB-CD1 3.94Å; Q200-L202 HydrophobicContact CB-CG 4.03Å; Q200-L202 PolarHBondContact O-N 2.86Å; L202-H204 PolarHBondContact O-N 2.88Å; L202-L205 HydrophobicContact CB-CD1 4.24Å; L202-L205 HydrophobicContact CD2-CD1 3.71Å; L202-L210 HydrophobicContact CB-CD2 4.23Å
203	S	71.2	Confident	76.3	Confident	77 Å²	77	103.4 Å²	103.4	54%	0.538	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.2	-175.7	54.8	0	0	0	0	114.8
204	H	70.5	Confident	76.2	Confident	155 Å²	155	101.8 Å²	101.8	72%	0.718	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-1.1	-171.6	43.2	-88.1	0	0	0	114.2	G201 L202	G201-H204 PolarHBondContact O-CE1 3.05Å; G201-H204 PolarHBondContact O-NE2 2.95Å; L202-H204 PolarHBondContact O-N 2.88Å
205	L	72	Confident	76.4	Confident	61 Å²	61	100.2 Å²	100.2	32%	0.319	49%	0.486	S	S	.	.	S	Bend	trans	-78	154.6	169.9	-73.7	94.3	0	0	0	111.1	L202 D209 L210 L213	L202-L205 HydrophobicContact CB-CD1 4.24Å; L202-L205 HydrophobicContact CD2-CD1 3.71Å; L205-D209 HydrophobicContact CB-CB 4.12Å; L205-D209 HydrophobicContact CD2-CB 3.97Å; L205-L210 HydrophobicContact CB-CG 4.34Å; L205-L213 HydrophobicContact CD2-CD1 4.04Å
206	S	78.1	Confident	76.5	Confident	52 Å²	52	97 Å²	97	36%	0.364	48%	0.477	S	S	.	.			trans	-69.8	161.1	-179.4	82.6	0	0	0	0	111.9	E208 D209 L210	S206-E208 PolarHBondContact O-N 3.29Å; S206-E208 VanDerWaalsContact O-N 3.13Å; S206-E208 PolarHBondContact OG-N 3.05Å; S206-D209 WeakPolarHBondContact CB-OD2 3.3Å; S206-D209 PolarHBondContact N-OD2 3.43Å; S206-D209 PolarHBondContact O-N 2.9Å; S206-D209 PolarHBondContact OG-N 3.04Å; S206-D209 VanDerWaalsContact OG-N 3.16Å; S206-D209 PolarHBondContact OG-OD2 3.06Å; S206-L210 WeakPolarHBondContact O-CD1 3.41Å; S206-L210 VanDerWaalsContact O-CG 3.29Å; S206-L210 WeakPolarHBondContact O-CG 3.48Å; S206-L210 PolarHBondContact O-N 3.1Å
207	K	74.1	Confident	76.6	Confident	154 Å²	154	99.5 Å²	99.5	67%	0.67	49%	0.488	S	S	*	.	H	α-helix	trans	-58.3	-25.2	173.6	-173.1	174.6	178.5	-179.7	0	112.5	Q211	K207-Q211 VanDerWaalsContact O-CG 3.32Å; K207-Q211 WeakPolarHBondContact O-CG 3.17Å; K207-Q211 PolarHBondContact O-N 3.32Å
208	E	75.4	Confident	76.2	Confident	151 Å²	151	102.2 Å²	102.2	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-81.3	-44	179.1	-55.6	-166.5	155.1	0	0	110.9	S206 L210 Q211 V212	S206-E208 PolarHBondContact O-N 3.29Å; S206-E208 VanDerWaalsContact O-N 3.13Å; S206-E208 PolarHBondContact OG-N 3.05Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 2.88Å; E208-Q211 WeakPolarHBondContact O-CB 3.31Å; E208-Q211 PolarHBondContact O-N 3Å; E208-Q211 VanDerWaalsContact O-N 3.09Å; E208-V212 WeakPolarHBondContact O-CG2 3.48Å; E208-V212 PolarHBondContact O-N 3.15Å
209	D	78.4	Confident	76	Confident	75 Å²	75	101.7 Å²	101.7	40%	0.401	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-41.8	175.2	-54.6	-53.8	0	0	0	111.9	L205 S206 Q211 V212 L213	L205-D209 HydrophobicContact CB-CB 4.12Å; L205-D209 HydrophobicContact CD2-CB 3.97Å; S206-D209 WeakPolarHBondContact CB-OD2 3.3Å; S206-D209 PolarHBondContact N-OD2 3.43Å; S206-D209 PolarHBondContact O-N 2.9Å; S206-D209 PolarHBondContact OG-N 3.04Å; S206-D209 VanDerWaalsContact OG-N 3.16Å; S206-D209 PolarHBondContact OG-OD2 3.06Å; D209-Q211 VanDerWaalsContact C-N 3.28Å; D209-Q211 PolarHBondContact O-N 2.82Å; D209-V212 PolarHBondContact O-N 3.49Å; D209-V212 VanDerWaalsContact O-N 3.16Å; D209-L213 PolarHBondContact O-N 2.91Å
210	L	77.1	Confident	75.9	Confident	36 Å²	36	96.3 Å²	96.3	19%	0.188	48%	0.482	C	S	.	.	H	α-helix	trans	-61	-37.3	175.5	-71.1	164.3	0	0	0	111.9	L197 L202 L205 S206 E208 Q214	L197-L210 HydrophobicContact CD1-CD2 4.32Å; L197-L210 HydrophobicContact CD2-CD1 3.69Å; L197-L210 HydrophobicContact CD2-CD2 3.94Å; L197-L210 HydrophobicContact CD2-CG 4.49Å; L197-L210 HydrophobicContact CG-CD2 4.05Å; L202-L210 HydrophobicContact CB-CD2 4.23Å; L205-L210 HydrophobicContact CB-CG 4.34Å; S206-L210 WeakPolarHBondContact O-CD1 3.41Å; S206-L210 VanDerWaalsContact O-CG 3.29Å; S206-L210 WeakPolarHBondContact O-CG 3.48Å; S206-L210 PolarHBondContact O-N 3.1Å; E208-L210 VanDerWaalsContact C-N 3.32Å; E208-L210 PolarHBondContact O-N 2.88Å; L210-Q214 VanDerWaalsContact O-CB 3.25Å; L210-Q214 WeakPolarHBondContact O-CB 3.38Å; L210-Q214 PolarHBondContact O-N 3.13Å
211	Q	75.6	Confident	75.9	Confident	90 Å²	90	94.6 Å²	94.6	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-71.5	-36.3	174.1	-73.9	177.8	9.1	0	0	112.2	K207 E208 D209 K215	K207-Q211 VanDerWaalsContact O-CG 3.32Å; K207-Q211 WeakPolarHBondContact O-CG 3.17Å; K207-Q211 PolarHBondContact O-N 3.32Å; E208-Q211 WeakPolarHBondContact O-CB 3.31Å; E208-Q211 PolarHBondContact O-N 3Å; E208-Q211 VanDerWaalsContact O-N 3.09Å; D209-Q211 VanDerWaalsContact C-N 3.28Å; D209-Q211 PolarHBondContact O-N 2.82Å; Q211-K215 WeakPolarHBondContact O-CB 3.47Å; Q211-K215 PolarHBondContact O-N 2.9Å
212	V	80.7	Confident	75.9	Confident	100 Å²	100	97 Å²	97	61%	0.606	48%	0.476	S	S	*	.	H	α-helix	trans	-64.5	-46.3	173.9	173.1	0	0	0	0	110.9	E208 D209 K215 K216	E208-V212 WeakPolarHBondContact O-CG2 3.48Å; E208-V212 PolarHBondContact O-N 3.15Å; D209-V212 PolarHBondContact O-N 3.49Å; D209-V212 VanDerWaalsContact O-N 3.16Å; V212-K215 PolarHBondContact O-N 2.95Å; V212-K216 WeakPolarHBondContact O-CB 3.4Å; V212-K216 PolarHBondContact O-N 3.21Å
213	L	77.9	Confident	76.1	Confident	78 Å²	78	101 Å²	101	41%	0.408	50%	0.495	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.3	-77	169.5	0	0	0	112.1	L205 D209 K215 K216 K217	L205-L213 HydrophobicContact CD2-CD1 4.04Å; D209-L213 PolarHBondContact O-N 2.91Å; L213-K215 VanDerWaalsContact C-N 3.32Å; L213-K215 PolarHBondContact O-N 3.47Å; L213-K216 PolarHBondContact O-N 3.34Å; L213-K217 WeakPolarHBondContact O-CB 3.44Å; L213-K217 PolarHBondContact O-N 3.42Å
214	Q	75.1	Confident	76.3	Confident	109 Å²	109	102.9 Å²	102.9	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-40.3	177.5	-174.8	173.9	3.9	0	0	111.5	L210 M218	L210-Q214 VanDerWaalsContact O-CB 3.25Å; L210-Q214 WeakPolarHBondContact O-CB 3.38Å; L210-Q214 PolarHBondContact O-N 3.13Å; Q214-M218 WeakPolarHBondContact O-CB 3.45Å; Q214-M218 PolarHBondContact O-N 2.92Å
215	K	78.3	Confident	76.4	Confident	124 Å²	124	100.6 Å²	100.6	54%	0.539	49%	0.488	S	S	.	.	H	α-helix	trans	-65.8	-44.9	175.1	-177.3	175.2	178.8	175	0	112.1	Q211 V212 L213 K217 M218 Q219	Q211-K215 WeakPolarHBondContact O-CB 3.47Å; Q211-K215 PolarHBondContact O-N 2.9Å; V212-K215 PolarHBondContact O-N 2.95Å; L213-K215 VanDerWaalsContact C-N 3.32Å; L213-K215 PolarHBondContact O-N 3.47Å; K215-K217 VanDerWaalsContact C-N 3.33Å; K215-K217 PolarHBondContact O-N 3.12Å; K215-M218 WeakPolarHBondContact O-CB 3.34Å; K215-M218 PolarHBondContact O-N 3.4Å; K215-Q219 WeakPolarHBondContact O-CG 3.46Å; K215-Q219 PolarHBondContact O-N 2.92Å
216	K	81.2	Confident	76.7	Confident	119 Å²	119	101.9 Å²	101.9	52%	0.517	49%	0.492	S	S	.	.	H	α-helix	trans	-57.8	-48.3	176.5	-165.7	-171	-175.6	-114	0	110.4	V212 L213 M218 Q219 E220	V212-K216 WeakPolarHBondContact O-CB 3.4Å; V212-K216 PolarHBondContact O-N 3.21Å; L213-K216 PolarHBondContact O-N 3.34Å; K216-M218 VanDerWaalsContact C-N 3.31Å; K216-M218 PolarHBondContact O-N 3.29Å; K216-Q219 PolarHBondContact O-N 2.89Å; K216-Q219 VanDerWaalsContact O-N 3.11Å; K216-E220 WeakPolarHBondContact CD-OE1 3.35Å; K216-E220 VanDerWaalsContact CE-OE1 3.23Å; K216-E220 WeakPolarHBondContact CE-OE1 3.36Å; K216-E220 WeakPolarHBondContact CG-OE1 3.42Å; K216-E220 IonicContact NZ-OE1 3.64Å; K216-E220 PolarHBondContact NZ-OE1 3.16Å; K216-E220 WeakPolarHBondContact O-CG 3.46Å; K216-E220 PolarHBondContact O-N 3.17Å
217	K	79.1	Confident	77.1	Confident	145 Å²	145	101.4 Å²	101.4	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-63.1	-33.9	178.3	-164.6	173.1	-175.3	71.4	0	113.4	L213 K215 E220 N221	L213-K217 WeakPolarHBondContact O-CB 3.44Å; L213-K217 PolarHBondContact O-N 3.42Å; K215-K217 VanDerWaalsContact C-N 3.33Å; K215-K217 PolarHBondContact O-N 3.12Å; K217-E220 WeakPolarHBondContact CA-OE2 3.31Å; K217-N221 WeakPolarHBondContact O-CB 3.01Å; K217-N221 PolarHBondContact O-N 2.82Å
218	M	69.7	Low	77.2	Confident	95 Å²	95	98 Å²	98	47%	0.468	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-39.3	173.5	-168.3	-162.8	-55.7	0	0	111.9	Q214 K215 K216 K222	Q214-M218 WeakPolarHBondContact O-CB 3.45Å; Q214-M218 PolarHBondContact O-N 2.92Å; K215-M218 WeakPolarHBondContact O-CB 3.34Å; K215-M218 PolarHBondContact O-N 3.4Å; K216-M218 VanDerWaalsContact C-N 3.31Å; K216-M218 PolarHBondContact O-N 3.29Å; M218-K222 WeakPolarHBondContact O-CB 3.15Å; M218-K222 PolarHBondContact O-N 2.9Å
219	Q	75.3	Confident	77.5	Confident	115 Å²	115	99.4 Å²	99.4	54%	0.537	48%	0.482	S	S	.	.	H	α-helix	trans	-69.3	-42.8	175.1	-67.4	-179.3	-86.4	0	0	111.7	K215 K216 K222 M223	K215-Q219 WeakPolarHBondContact O-CG 3.46Å; K215-Q219 PolarHBondContact O-N 2.92Å; K216-Q219 PolarHBondContact O-N 2.89Å; K216-Q219 VanDerWaalsContact O-N 3.11Å; Q219-K222 PolarHBondContact O-N 2.74Å; Q219-M223 WeakPolarHBondContact O-CG 3.39Å; Q219-M223 PolarHBondContact O-N 3.1Å
220	E	80.2	Confident	77.7	Confident	86 Å²	86	104.3 Å²	104.3	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-56.8	-50	173.7	-72.4	163.8	171	0	0	110.9	K216 K217 K222 M223 E224	K216-E220 WeakPolarHBondContact CD-OE1 3.35Å; K216-E220 VanDerWaalsContact CE-OE1 3.23Å; K216-E220 WeakPolarHBondContact CE-OE1 3.36Å; K216-E220 WeakPolarHBondContact CG-OE1 3.42Å; K216-E220 IonicContact NZ-OE1 3.64Å; K216-E220 PolarHBondContact NZ-OE1 3.16Å; K216-E220 WeakPolarHBondContact O-CG 3.46Å; K216-E220 PolarHBondContact O-N 3.17Å; K217-E220 WeakPolarHBondContact CA-OE2 3.31Å; E220-K222 PolarHBondContact O-N 3.23Å; E220-M223 PolarHBondContact O-N 2.86Å; E220-E224 WeakPolarHBondContact O-CB 3.23Å; E220-E224 PolarHBondContact O-N 3.38Å
221	N	73.9	Confident	77.7	Confident	80 Å²	80	111.1 Å²	111.1	43%	0.428	52%	0.518	S	S	.	.	H	α-helix	trans	-69.4	-28.7	179.6	-172.4	-120	0	0	0	113.4	K217 E224 L225	K217-N221 WeakPolarHBondContact O-CB 3.01Å; K217-N221 PolarHBondContact O-N 2.82Å; N221-E224 PolarHBondContact ND2-OE2 3.2Å; N221-L225 WeakPolarHBondContact O-CB 3.42Å; N221-L225 VanDerWaalsContact O-CG 3.27Å; N221-L225 WeakPolarHBondContact O-CG 3.46Å; N221-L225 PolarHBondContact O-N 3.05Å
222	K	76.6	Confident	77.6	Confident	88 Å²	88	113.9 Å²	113.9	38%	0.383	53%	0.525	S	S	.	.	H	α-helix	trans	-68.8	-43.5	171.6	-172.4	160	-174.2	161.6	0	111.9	D169 M218 Q219 E220 E224 L225 E226	D169-K222 IonicContact OD1-NZ 3.76Å; D169-K222 PolarHBondContact OD1-NZ 3.41Å; D169-K222 IonicContact OD2-NZ 2.89Å; D169-K222 PolarHBondContact OD2-NZ 2.85Å; M218-K222 WeakPolarHBondContact O-CB 3.15Å; M218-K222 PolarHBondContact O-N 2.9Å; Q219-K222 PolarHBondContact O-N 2.74Å; E220-K222 PolarHBondContact O-N 3.23Å; K222-E224 VanDerWaalsContact C-N 3.32Å; K222-E224 PolarHBondContact O-N 2.86Å; K222-L225 PolarHBondContact O-N 3.41Å; K222-E226 WeakPolarHBondContact O-CG 3.38Å; K222-E226 PolarHBondContact O-N 3.07Å
223	M	77.5	Confident	77.6	Confident	132 Å²	132	113 Å²	113	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-39.5	173.2	-68.7	-65.2	-61.2	0	0	111.9	Q219 E220 E226 A227	Q219-M223 WeakPolarHBondContact O-CG 3.39Å; Q219-M223 PolarHBondContact O-N 3.1Å; E220-M223 PolarHBondContact O-N 2.86Å; M223-E226 PolarHBondContact O-N 2.66Å; M223-A227 WeakPolarHBondContact O-CB 3.45Å; M223-A227 PolarHBondContact O-N 3.44Å
224	E	76.6	Confident	77.9	Confident	116 Å²	116	113.3 Å²	113.3	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-62.6	-46.8	174.9	-177.5	179	-142.3	0	0	111.7	E220 N221 K222 A227 V228	E220-E224 WeakPolarHBondContact O-CB 3.23Å; E220-E224 PolarHBondContact O-N 3.38Å; N221-E224 PolarHBondContact ND2-OE2 3.2Å; K222-E224 VanDerWaalsContact C-N 3.32Å; K222-E224 PolarHBondContact O-N 2.86Å; E224-A227 PolarHBondContact O-N 2.96Å; E224-V228 WeakPolarHBondContact O-CB 3.46Å; E224-V228 VanDerWaalsContact O-CG2 3.31Å; E224-V228 WeakPolarHBondContact O-CG2 3.49Å; E224-V228 PolarHBondContact O-N 2.93Å
225	L	72.5	Confident	77.9	Confident	106 Å²	106	114.8 Å²	114.8	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-62.4	-41.1	174.8	-76.9	165.6	0	0	0	112.5	N221 K222 V228 R229	N221-L225 WeakPolarHBondContact O-CB 3.42Å; N221-L225 VanDerWaalsContact O-CG 3.27Å; N221-L225 WeakPolarHBondContact O-CG 3.46Å; N221-L225 PolarHBondContact O-N 3.05Å; K222-L225 PolarHBondContact O-N 3.41Å; L225-V228 PolarHBondContact O-N 3.48Å; L225-R229 WeakPolarHBondContact O-CB 3.01Å; L225-R229 PolarHBondContact O-N 2.86Å
226	E	77.5	Confident	77.9	Confident	88 Å²	88	112.8 Å²	112.8	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-38.7	175	-73.9	-179.7	-151.8	0	0	111.9	K222 M223 R229 R230	K222-E226 WeakPolarHBondContact O-CG 3.38Å; K222-E226 PolarHBondContact O-N 3.07Å; M223-E226 PolarHBondContact O-N 2.66Å; E226-R229 PolarHBondContact O-N 3.14Å; E226-R230 WeakPolarHBondContact O-CG 3.38Å; E226-R230 PolarHBondContact O-N 2.98Å
227	A	85.8	Confident	78	Confident	43 Å²	43	113.1 Å²	113.1	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-67.6	-40.8	174.3	0	0	0	0	0	112.5	M223 E224 R229 R230 R231	M223-A227 WeakPolarHBondContact O-CB 3.45Å; M223-A227 PolarHBondContact O-N 3.44Å; E224-A227 PolarHBondContact O-N 2.96Å; A227-R229 VanDerWaalsContact C-N 3.32Å; A227-R229 PolarHBondContact O-N 3.11Å; A227-R230 PolarHBondContact O-N 3.35Å; A227-R231 WeakPolarHBondContact O-CB 3.36Å; A227-R231 WeakPolarHBondContact O-CG 3.41Å; A227-R231 PolarHBondContact O-N 3.33Å
228	V	77.2	Confident	78	Confident	81 Å²	81	111.4 Å²	111.4	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-38.1	172.8	167.4	0	0	0	0	111	E224 L225 R231 R232	E224-V228 WeakPolarHBondContact O-CB 3.46Å; E224-V228 VanDerWaalsContact O-CG2 3.31Å; E224-V228 WeakPolarHBondContact O-CG2 3.49Å; E224-V228 PolarHBondContact O-N 2.93Å; L225-V228 PolarHBondContact O-N 3.48Å; V228-R231 PolarHBondContact O-N 3.14Å; V228-R232 PolarHBondContact O-N 3.11Å
229	R	80.7	Confident	78.4	Confident	182 Å²	182	113.5 Å²	113.5	69%	0.687	50%	0.504	S	S	*	.	H	α-helix	trans	-66.4	-42.8	174.1	-170	175.3	-176.7	170.8	2.4	112	L225 E226 A227 R232 I233	L225-R229 WeakPolarHBondContact O-CB 3.01Å; L225-R229 PolarHBondContact O-N 2.86Å; E226-R229 PolarHBondContact O-N 3.14Å; A227-R229 VanDerWaalsContact C-N 3.32Å; A227-R229 PolarHBondContact O-N 3.11Å; R229-R232 WeakPolarHBondContact O-CB 3.27Å; R229-R232 PolarHBondContact O-N 2.98Å; R229-R232 VanDerWaalsContact O-N 3.16Å; R229-I233 HydrophobicContact CG-CD1 4.12Å; R229-I233 WeakPolarHBondContact O-CG1 3.49Å; R229-I233 PolarHBondContact O-N 3.38Å
230	R	82.2	Confident	78.9	Confident	178 Å²	178	112.5 Å²	112.5	67%	0.672	50%	0.499	S	S	*	.	H	α-helix	trans	-61	-47.4	173	-70.6	-178.3	-167.8	-167.4	4.9	111.7	E226 A227 R232 I233 E234	E226-R230 WeakPolarHBondContact O-CG 3.38Å; E226-R230 PolarHBondContact O-N 2.98Å; A227-R230 PolarHBondContact O-N 3.35Å; R230-R232 PolarHBondContact O-N 3.31Å; R230-R232 VanDerWaalsContact O-N 3.13Å; R230-I233 PolarHBondContact O-N 3.14Å; R230-I233 VanDerWaalsContact O-N 3.12Å; R230-E234 PolarHBondContact O-N 2.96Å
231	R	77.4	Confident	79.1	Confident	179 Å²	179	113 Å²	113	68%	0.675	50%	0.502	S	S	*	.	H	α-helix	trans	-64.7	-11.1	174	-72.9	178.9	177.9	165.4	-1.9	114.8	A227 V228 R235	A227-R231 WeakPolarHBondContact O-CB 3.36Å; A227-R231 WeakPolarHBondContact O-CG 3.41Å; A227-R231 PolarHBondContact O-N 3.33Å; V228-R231 PolarHBondContact O-N 3.14Å; R231-R235 PolarHBondContact O-NE 3.41Å; R231-R235 PolarHBondContact O-NH2 2.92Å
232	R	74.2	Confident	79.1	Confident	148 Å²	148	115 Å²	115	56%	0.558	51%	0.508	S	S	*	.	H	α-helix	trans	-85.9	-50.9	168.2	177.1	-176.9	-70.3	-107.9	4.2	109.9	V228 R229 R230 E234 R235 E236	V228-R232 PolarHBondContact O-N 3.11Å; R229-R232 WeakPolarHBondContact O-CB 3.27Å; R229-R232 PolarHBondContact O-N 2.98Å; R229-R232 VanDerWaalsContact O-N 3.16Å; R230-R232 PolarHBondContact O-N 3.31Å; R230-R232 VanDerWaalsContact O-N 3.13Å; R232-E234 PolarHBondContact O-N 3.39Å; R232-R235 PolarHBondContact O-N 2.79Å; R232-E236 WeakPolarHBondContact CD-OE1 3.5Å; R232-E236 WeakPolarHBondContact CG-OE1 3.46Å; R232-E236 WeakPolarHBondContact O-CG 3.39Å; R232-E236 PolarHBondContact O-N 2.89Å
233	I	81.2	Confident	79.2	Confident	82 Å²	82	117.5 Å²	117.5	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-41.9	-179.8	-66	166.2	0	0	0	111.6	R229 R230 E236 R237	R229-I233 HydrophobicContact CG-CD1 4.12Å; R229-I233 WeakPolarHBondContact O-CG1 3.49Å; R229-I233 PolarHBondContact O-N 3.38Å; R230-I233 PolarHBondContact O-N 3.14Å; R230-I233 VanDerWaalsContact O-N 3.12Å; I233-E236 WeakPolarHBondContact O-CB 3.49Å; I233-E236 PolarHBondContact O-N 3.4Å; I233-E236 VanDerWaalsContact O-N 3.13Å; I233-R237 PolarHBondContact O-N 2.84Å
234	E	83.3	Confident	79.7	Confident	84 Å²	84	116.4 Å²	116.4	39%	0.393	51%	0.513	S	S	.	.	H	α-helix	trans	-65.4	-45.2	179	-142.4	66.5	-116.8	0	0	111.1	R230 R232 E236 R237 E238	R230-E234 PolarHBondContact O-N 2.96Å; R232-E234 PolarHBondContact O-N 3.39Å; E234-E236 PolarHBondContact O-N 3.35Å; E234-R237 CarbonylContact O-C 3.56Å; E234-R237 WeakPolarHBondContact O-CB 3.37Å; E234-R237 PolarHBondContact O-N 3.43Å; E234-R237 VanDerWaalsContact O-N 3.12Å; E234-R237 WeakPolarHBondContact OE1-CD 3.4Å; E234-R237 IonicContact OE1-CZ 3.13Å; E234-R237 IonicContact OE1-NH1 2.72Å; E234-R237 PolarHBondContact OE1-NH1 3.48Å; E234-R237 IonicContact OE2-NH1 3.13Å; E234-E238 VanDerWaalsContact O-CG 3.31Å; E234-E238 WeakPolarHBondContact O-CG 3.36Å; E234-E238 PolarHBondContact O-N 3.22Å
235	R	75.5	Confident	80.1	Confident	139 Å²	139	116.4 Å²	116.4	53%	0.525	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-21.1	172.6	-76.7	-175.8	-60.6	142.7	6	113.9	R231 R232 E238 R239	R231-R235 PolarHBondContact O-NE 3.41Å; R231-R235 PolarHBondContact O-NH2 2.92Å; R232-R235 PolarHBondContact O-N 2.79Å; R235-E238 VanDerWaalsContact CA-OE2 3.31Å; R235-E238 WeakPolarHBondContact CA-OE2 3.28Å; R235-E238 VanDerWaalsContact CG-OE2 3.28Å; R235-E238 WeakPolarHBondContact CG-OE2 3.39Å; R235-R239 PolarHBondContact O-N 3.21Å; R235-R239 PolarHBondContact O-NH1 3.41Å; R235-R239 PolarHBondContact O-NH2 3.28Å
236	E	77.7	Confident	80.5	Confident	83 Å²	83	116.7 Å²	116.7	39%	0.388	51%	0.512	S	S	.	.	H	α-helix	trans	-75.8	-42.9	171.9	-77.5	158.9	-177.4	0	0	109.7	R232 I233 E234 R239 E240	R232-E236 WeakPolarHBondContact CD-OE1 3.5Å; R232-E236 WeakPolarHBondContact CG-OE1 3.46Å; R232-E236 WeakPolarHBondContact O-CG 3.39Å; R232-E236 PolarHBondContact O-N 2.89Å; I233-E236 WeakPolarHBondContact O-CB 3.49Å; I233-E236 PolarHBondContact O-N 3.4Å; I233-E236 VanDerWaalsContact O-N 3.13Å; E234-E236 PolarHBondContact O-N 3.35Å; E236-R239 VanDerWaalsContact CG-NH2 3.31Å; E236-E240 WeakPolarHBondContact O-CB 2.94Å; E236-E240 PolarHBondContact O-N 2.61Å
237	R	83.5	Confident	80.9	Confident	126 Å²	126	117.2 Å²	117.2	48%	0.475	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-48.4	170.2	167.3	-179	-71.2	137.2	-6.6	113.1	I233 E234 R239 E240 Q241	I233-R237 PolarHBondContact O-N 2.84Å; E234-R237 CarbonylContact O-C 3.56Å; E234-R237 WeakPolarHBondContact O-CB 3.37Å; E234-R237 PolarHBondContact O-N 3.43Å; E234-R237 VanDerWaalsContact O-N 3.12Å; E234-R237 WeakPolarHBondContact OE1-CD 3.4Å; E234-R237 IonicContact OE1-CZ 3.13Å; E234-R237 IonicContact OE1-NH1 2.72Å; E234-R237 PolarHBondContact OE1-NH1 3.48Å; E234-R237 IonicContact OE2-NH1 3.13Å; R237-R239 VanDerWaalsContact C-N 3.26Å; R237-R239 PolarHBondContact O-N 3.35Å; R237-E240 CarbonylContact O-C 3.48Å; R237-E240 WeakPolarHBondContact O-CB 3.44Å; R237-E240 PolarHBondContact O-N 2.93Å; R237-Q241 HydrophobicContact CG-CG 4.19Å; R237-Q241 WeakPolarHBondContact O-CG 3.33Å; R237-Q241 PolarHBondContact O-N 2.71Å
238	E	79.1	Confident	80.7	Confident	108 Å²	108	120.8 Å²	120.8	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-57.7	-41.4	-178.5	-72.6	164.7	161.7	0	0	110.8	E234 R235 H242	E234-E238 VanDerWaalsContact O-CG 3.31Å; E234-E238 WeakPolarHBondContact O-CG 3.36Å; E234-E238 PolarHBondContact O-N 3.22Å; R235-E238 VanDerWaalsContact CA-OE2 3.31Å; R235-E238 WeakPolarHBondContact CA-OE2 3.28Å; R235-E238 VanDerWaalsContact CG-OE2 3.28Å; R235-E238 WeakPolarHBondContact CG-OE2 3.39Å; E238-H242 WeakPolarHBondContact O-CB 3.28Å; E238-H242 PolarHBondContact O-N 2.71Å
239	R	79.1	Confident	81	Confident	139 Å²	139	122 Å²	122	53%	0.525	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-44	171.9	-75.3	-165.4	-54.6	-67.5	-11.1	112.4	R235 E236 R237 Q241 H242 E243	R235-R239 PolarHBondContact O-N 3.21Å; R235-R239 PolarHBondContact O-NH1 3.41Å; R235-R239 PolarHBondContact O-NH2 3.28Å; E236-R239 VanDerWaalsContact CG-NH2 3.31Å; R237-R239 VanDerWaalsContact C-N 3.26Å; R237-R239 PolarHBondContact O-N 3.35Å; R239-Q241 VanDerWaalsContact C-N 3.26Å; R239-Q241 PolarHBondContact O-N 2.68Å; R239-H242 PolarHBondContact O-N 2.77Å; R239-E243 WeakPolarHBondContact O-CB 3.41Å; R239-E243 PolarHBondContact O-N 3.49Å
240	E	85.8	Confident	81.3	Confident	95 Å²	95	117.7 Å²	117.7	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-32.2	178.1	-168.2	-169.3	166.4	0	0	112.5	E236 R237 K244	E236-E240 WeakPolarHBondContact O-CB 2.94Å; E236-E240 PolarHBondContact O-N 2.61Å; R237-E240 CarbonylContact O-C 3.48Å; R237-E240 WeakPolarHBondContact O-CB 3.44Å; R237-E240 PolarHBondContact O-N 2.93Å; E240-K244 HydrophobicContact CG-CD 4.43Å; E240-K244 WeakPolarHBondContact O-CB 3.47Å; E240-K244 WeakPolarHBondContact O-CD 3.34Å; E240-K244 VanDerWaalsContact O-CG 3.24Å; E240-K244 WeakPolarHBondContact O-CG 3.26Å; E240-K244 PolarHBondContact O-N 3.14Å; E240-K244 IonicContact OE1-NZ 2.66Å; E240-K244 PolarHBondContact OE1-NZ 3.5Å
241	Q	84.6	Confident	81.5	Confident	97 Å²	97	115 Å²	115	45%	0.453	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-53.3	173.5	-71.2	-178.2	-97	0	0	111	R237 R239 E243 K244 E245	R237-Q241 HydrophobicContact CG-CG 4.19Å; R237-Q241 WeakPolarHBondContact O-CG 3.33Å; R237-Q241 PolarHBondContact O-N 2.71Å; R239-Q241 VanDerWaalsContact C-N 3.26Å; R239-Q241 PolarHBondContact O-N 2.68Å; Q241-E243 VanDerWaalsContact C-N 3.27Å; Q241-E243 PolarHBondContact O-N 2.88Å; Q241-K244 PolarHBondContact O-N 3.29Å; Q241-K244 VanDerWaalsContact O-N 3.1Å; Q241-E245 WeakPolarHBondContact O-CB 3.47Å; Q241-E245 WeakPolarHBondContact O-CG 3.46Å; Q241-E245 PolarHBondContact O-N 3.38Å
242	H	74	Confident	81.9	Confident	120 Å²	120	110.3 Å²	110.3	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-60.3	-35.2	177.6	-173.5	-51.2	0	0	0	112.5	E238 R239 M246	E238-H242 WeakPolarHBondContact O-CB 3.28Å; E238-H242 PolarHBondContact O-N 2.71Å; R239-H242 PolarHBondContact O-N 2.77Å; H242-M246 WeakPolarHBondContact ND1-CG 3.45Å; H242-M246 WeakPolarHBondContact O-CB 3.43Å; H242-M246 VanDerWaalsContact O-CG 3.23Å; H242-M246 WeakPolarHBondContact O-CG 3.28Å; H242-M246 PolarHBondContact O-N 3.23Å
243	E	78.5	Confident	82.6	Confident	141 Å²	141	108.8 Å²	108.8	66%	0.659	49%	0.491	S	S	*	.	H	α-helix	trans	-65.6	-42	175.5	-174.4	169	-155.5	0	0	111.1	R239 Q241 E247	R239-E243 WeakPolarHBondContact O-CB 3.41Å; R239-E243 PolarHBondContact O-N 3.49Å; Q241-E243 VanDerWaalsContact C-N 3.27Å; Q241-E243 PolarHBondContact O-N 2.88Å; E243-E247 VanDerWaalsContact O-CB 3.29Å; E243-E247 WeakPolarHBondContact O-CB 3.28Å; E243-E247 PolarHBondContact O-N 2.92Å
244	K	87.8	Confident	82.9	Confident	110 Å²	110	109.1 Å²	109.1	48%	0.478	49%	0.49	S	S	.	.	H	α-helix	trans	-72.3	-35.4	175.7	-73.5	168.2	-176.4	171.3	0	113.7	E240 Q241 E247 M248	E240-K244 HydrophobicContact CG-CD 4.43Å; E240-K244 WeakPolarHBondContact O-CB 3.47Å; E240-K244 WeakPolarHBondContact O-CD 3.34Å; E240-K244 VanDerWaalsContact O-CG 3.24Å; E240-K244 WeakPolarHBondContact O-CG 3.26Å; E240-K244 PolarHBondContact O-N 3.14Å; E240-K244 IonicContact OE1-NZ 2.66Å; E240-K244 PolarHBondContact OE1-NZ 3.5Å; Q241-K244 PolarHBondContact O-N 3.29Å; Q241-K244 VanDerWaalsContact O-N 3.1Å; K244-E247 PolarHBondContact O-N 2.95Å; K244-M248 VanDerWaalsContact O-CB 3.27Å; K244-M248 WeakPolarHBondContact O-CB 3.48Å; K244-M248 PolarHBondContact O-N 3.49Å
245	E	83.5	Confident	83.4	Confident	115 Å²	115	107 Å²	107	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-66.4	-43.4	174.6	-74	162	-161.2	0	0	110.3	Q241 M248 M249	Q241-E245 WeakPolarHBondContact O-CB 3.47Å; Q241-E245 WeakPolarHBondContact O-CG 3.46Å; Q241-E245 PolarHBondContact O-N 3.38Å; E245-M248 PolarHBondContact O-N 3.05Å; E245-M249 WeakPolarHBondContact O-CB 3.32Å; E245-M249 VanDerWaalsContact O-CG 3.27Å; E245-M249 WeakPolarHBondContact O-CG 3.11Å; E245-M249 PolarHBondContact O-N 2.9Å
246	M	81.2	Confident	84	Confident	112 Å²	112	106.2 Å²	106.2	55%	0.552	49%	0.489	S	S	*	.	H	α-helix	trans	-64.8	-40.2	172.1	-72.7	-62.7	-56.8	0	0	112.8	H242 M248 Q250	H242-M246 WeakPolarHBondContact ND1-CG 3.45Å; H242-M246 WeakPolarHBondContact O-CB 3.43Å; H242-M246 VanDerWaalsContact O-CG 3.23Å; H242-M246 WeakPolarHBondContact O-CG 3.28Å; H242-M246 PolarHBondContact O-N 3.23Å; M246-M248 VanDerWaalsContact C-N 3.35Å; M246-Q250 VanDerWaalsContact O-CB 3.25Å; M246-Q250 WeakPolarHBondContact O-CB 3.34Å; M246-Q250 PolarHBondContact O-N 3.36Å
247	E	87.2	Confident	84.4	Confident	100 Å²	100	109.4 Å²	109.4	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-69	-31.9	176.8	-163.7	-153.6	-156.8	0	0	112.3	E243 K244 R251	E243-E247 VanDerWaalsContact O-CB 3.29Å; E243-E247 WeakPolarHBondContact O-CB 3.28Å; E243-E247 PolarHBondContact O-N 2.92Å; K244-E247 PolarHBondContact O-N 2.95Å; E247-R251 VanDerWaalsContact CD-CZ 3.41Å; E247-R251 WeakPolarHBondContact O-CG 3.43Å; E247-R251 PolarHBondContact O-N 3.28Å; E247-R251 VanDerWaalsContact O-N 3.13Å; E247-R251 PolarHBondContact O-NH1 2.74Å; E247-R251 IonicContact OE1-CZ 3.94Å; E247-R251 IonicContact OE1-NH2 2.82Å; E247-R251 PolarHBondContact OE1-NH2 3.15Å; E247-R251 IonicContact OE2-CZ 2.76Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 2.61Å; E247-R251 PolarHBondContact OE2-NH1 3.3Å; E247-R251 IonicContact OE2-NH2 3.9Å; E247-R251 PolarHBondContact OE2-NH2 2.87Å
248	M	82.1	Confident	84.8	Confident	118 Å²	118	111 Å²	111	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-67.9	-55.1	172	-174.6	169.7	-69.8	0	0	110.3	K244 E245 M246 Q250 R251 D252	K244-M248 VanDerWaalsContact O-CB 3.27Å; K244-M248 WeakPolarHBondContact O-CB 3.48Å; K244-M248 PolarHBondContact O-N 3.49Å; E245-M248 PolarHBondContact O-N 3.05Å; M246-M248 VanDerWaalsContact C-N 3.35Å; M248-Q250 PolarHBondContact O-N 3.45Å; M248-Q250 VanDerWaalsContact O-N 3.14Å; M248-R251 PolarHBondContact O-N 3.42Å; M248-D252 WeakPolarHBondContact CG-OD2 3.12Å; M248-D252 VanDerWaalsContact O-CG 3.31Å; M248-D252 PolarHBondContact O-N 3.15Å
249	M	82.9	Confident	85.2	Confident	106 Å²	106	112.8 Å²	112.8	52%	0.522	51%	0.508	S	S	.	.	H	α-helix	trans	-55.4	-32.8	175.3	-71.9	-65.1	-58.7	0	0	113.1	E245 K253	E245-M249 WeakPolarHBondContact O-CB 3.32Å; E245-M249 VanDerWaalsContact O-CG 3.27Å; E245-M249 WeakPolarHBondContact O-CG 3.11Å; E245-M249 PolarHBondContact O-N 2.9Å; M249-K253 WeakPolarHBondContact O-CB 3.27Å; M249-K253 WeakPolarHBondContact O-CG 3.36Å; M249-K253 PolarHBondContact O-N 3.49Å; M249-K253 VanDerWaalsContact O-N 3.11Å
250	Q	87	Confident	85.6	Confident	92 Å²	92	108.6 Å²	108.6	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-71.4	-45.1	175.7	-176.7	59.7	28.9	0	0	111.9	M246 M248 D252 K253 E254	M246-Q250 VanDerWaalsContact O-CB 3.25Å; M246-Q250 WeakPolarHBondContact O-CB 3.34Å; M246-Q250 PolarHBondContact O-N 3.36Å; M248-Q250 PolarHBondContact O-N 3.45Å; M248-Q250 VanDerWaalsContact O-N 3.14Å; Q250-D252 VanDerWaalsContact C-N 3.33Å; Q250-D252 PolarHBondContact O-N 3.04Å; Q250-K253 PolarHBondContact O-N 3.05Å; Q250-E254 WeakPolarHBondContact CG-OE1 3.18Å; Q250-E254 PolarHBondContact NE2-OE1 2.82Å; Q250-E254 WeakPolarHBondContact O-CB 3.3Å; Q250-E254 VanDerWaalsContact O-CG 3.31Å; Q250-E254 WeakPolarHBondContact O-CG 3.49Å; Q250-E254 PolarHBondContact O-N 3.07Å
251	R	85.4	Confident	85.8	Confident	121 Å²	121	109.6 Å²	109.6	46%	0.457	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-38.1	174.4	-72.1	-171.7	-157.3	88.8	-11.1	112.6	E247 M248 E254 A255	E247-R251 VanDerWaalsContact CD-CZ 3.41Å; E247-R251 WeakPolarHBondContact O-CG 3.43Å; E247-R251 PolarHBondContact O-N 3.28Å; E247-R251 VanDerWaalsContact O-N 3.13Å; E247-R251 PolarHBondContact O-NH1 2.74Å; E247-R251 IonicContact OE1-CZ 3.94Å; E247-R251 IonicContact OE1-NH2 2.82Å; E247-R251 PolarHBondContact OE1-NH2 3.15Å; E247-R251 IonicContact OE2-CZ 2.76Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 2.61Å; E247-R251 PolarHBondContact OE2-NH1 3.3Å; E247-R251 IonicContact OE2-NH2 3.9Å; E247-R251 PolarHBondContact OE2-NH2 2.87Å; M248-R251 PolarHBondContact O-N 3.42Å; R251-E254 PolarHBondContact O-N 2.75Å; R251-A255 WeakPolarHBondContact O-CB 3.34Å; R251-A255 PolarHBondContact O-N 2.95Å
252	D	86.9	Confident	85.8	Confident	81 Å²	81	110.4 Å²	110.4	43%	0.433	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-44.3	-179.9	-65.5	-30.9	0	0	0	110.2	M248 Q250 E254 A255 E256	M248-D252 WeakPolarHBondContact CG-OD2 3.12Å; M248-D252 VanDerWaalsContact O-CG 3.31Å; M248-D252 PolarHBondContact O-N 3.15Å; Q250-D252 VanDerWaalsContact C-N 3.33Å; Q250-D252 PolarHBondContact O-N 3.04Å; D252-E254 PolarHBondContact O-N 2.89Å; D252-A255 PolarHBondContact O-N 2.85Å; D252-E256 WeakPolarHBondContact O-CG 3.41Å; D252-E256 PolarHBondContact O-N 3.42Å
253	K	89.1	Confident	86.5	Confident	116 Å²	116	110.2 Å²	110.2	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-60.5	-42	170.6	-75.8	174	177.9	-172.1	0	113.4	M249 Q250 A255 E256 Y257	M249-K253 WeakPolarHBondContact O-CB 3.27Å; M249-K253 WeakPolarHBondContact O-CG 3.36Å; M249-K253 PolarHBondContact O-N 3.49Å; M249-K253 VanDerWaalsContact O-N 3.11Å; Q250-K253 PolarHBondContact O-N 3.05Å; K253-A255 VanDerWaalsContact C-N 3.34Å; K253-E256 PolarHBondContact O-N 3.3Å; K253-Y257 WeakPolarHBondContact O-CB 3.49Å; K253-Y257 PolarHBondContact O-N 3.23Å
254	E	87.7	Confident	86.9	Confident	89 Å²	89	109.3 Å²	109.3	42%	0.416	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-41.9	175.7	-76.8	168.3	-167.2	0	0	110.7	Q250 R251 D252 Y257 Y258	Q250-E254 WeakPolarHBondContact CG-OE1 3.18Å; Q250-E254 PolarHBondContact NE2-OE1 2.82Å; Q250-E254 WeakPolarHBondContact O-CB 3.3Å; Q250-E254 VanDerWaalsContact O-CG 3.31Å; Q250-E254 WeakPolarHBondContact O-CG 3.49Å; Q250-E254 PolarHBondContact O-N 3.07Å; R251-E254 PolarHBondContact O-N 2.75Å; D252-E254 PolarHBondContact O-N 2.89Å; E254-Y257 PolarHBondContact O-N 3.15Å; E254-Y258 WeakPolarHBondContact O-CD2 3.28Å; E254-Y258 PolarHBondContact O-N 3.46Å
255	A	92.6	Very high	87	Confident	39 Å²	39	108 Å²	108	32%	0.322	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-37.2	176.1	0	0	0	0	0	113.1	R251 D252 K253 R259	R251-A255 WeakPolarHBondContact O-CB 3.34Å; R251-A255 PolarHBondContact O-N 2.95Å; D252-A255 PolarHBondContact O-N 2.85Å; K253-A255 VanDerWaalsContact C-N 3.34Å; A255-R259 VanDerWaalsContact O-CG 3.3Å; A255-R259 WeakPolarHBondContact O-CG 3.47Å; A255-R259 PolarHBondContact O-N 3.49Å
256	E	88.5	Confident	87.1	Confident	122 Å²	122	104.8 Å²	104.8	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-64.1	-44.7	171.6	-73.8	172.6	169.5	0	0	111.3	D252 K253 R259 S260	D252-E256 WeakPolarHBondContact O-CG 3.41Å; D252-E256 PolarHBondContact O-N 3.42Å; K253-E256 PolarHBondContact O-N 3.3Å; E256-R259 PolarHBondContact O-N 2.9Å; E256-S260 PolarHBondContact O-N 3.37Å; E256-S260 PolarHBondContact O-OG 3.27Å
257	Y	86.9	Confident	87.2	Confident	150 Å²	150	102.1 Å²	102.1	59%	0.588	47%	0.473	S	S	*	.	H	α-helix	trans	-59	-50.5	174.8	-177.7	-92.2	0	0	0	111.3	K253 E254 R259 S260 W261	K253-Y257 WeakPolarHBondContact O-CB 3.49Å; K253-Y257 PolarHBondContact O-N 3.23Å; E254-Y257 PolarHBondContact O-N 3.15Å; Y257-R259 PolarHBondContact O-N 2.95Å; Y257-S260 PolarHBondContact O-N 3.05Å; Y257-S260 VanDerWaalsContact O-N 3.15Å; Y257-S260 PolarHBondContact O-OG 2.88Å; Y257-W261 WeakPolarHBondContact O-CB 3.49Å; Y257-W261 PolarHBondContact O-N 3.48Å
258	Y	90	Very high	87.3	Confident	159 Å²	159	103 Å²	103	62%	0.624	48%	0.476	S	S	*	.	H	α-helix	trans	-59.2	-42.9	177.1	-80.9	-65	0	0	0	112.7	E254 S260 W261 E262	E254-Y258 WeakPolarHBondContact O-CD2 3.28Å; E254-Y258 PolarHBondContact O-N 3.46Å; Y258-S260 VanDerWaalsContact C-N 3.32Å; Y258-S260 PolarHBondContact O-N 3.12Å; Y258-W261 PolarHBondContact O-N 3.39Å; Y258-E262 VanDerWaalsContact O-CB 3.3Å; Y258-E262 WeakPolarHBondContact O-CB 3.48Å; Y258-E262 PolarHBondContact O-N 3.44Å
259	R	88.1	Confident	87.4	Confident	147 Å²	147	102 Å²	102	56%	0.555	47%	0.469	S	S	*	.	H	α-helix	trans	-64.5	-34.6	175.5	-74.2	174.9	-169.1	155.8	6.3	113.3	A255 E256 Y257 Q263	A255-R259 VanDerWaalsContact O-CG 3.3Å; A255-R259 WeakPolarHBondContact O-CG 3.47Å; A255-R259 PolarHBondContact O-N 3.49Å; E256-R259 PolarHBondContact O-N 2.9Å; Y257-R259 PolarHBondContact O-N 2.95Å; R259-Q263 WeakPolarHBondContact O-CG 3.33Å; R259-Q263 PolarHBondContact O-N 2.65Å; R259-Q263 PolarHBondContact O-NE2 3Å
260	S	88.4	Confident	87.5	Confident	50 Å²	50	98.3 Å²	98.3	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-72.9	-35.3	177.4	73.5	0	0	0	0	111.4	E256 Y257 Y258 Q264	E256-S260 PolarHBondContact O-N 3.37Å; E256-S260 PolarHBondContact O-OG 3.27Å; Y257-S260 PolarHBondContact O-N 3.05Å; Y257-S260 VanDerWaalsContact O-N 3.15Å; Y257-S260 PolarHBondContact O-OG 2.88Å; Y258-S260 VanDerWaalsContact C-N 3.32Å; Y258-S260 PolarHBondContact O-N 3.12Å; S260-Q264 WeakPolarHBondContact O-CG 3.35Å; S260-Q264 PolarHBondContact O-N 3.22Å; S260-Q264 VanDerWaalsContact O-N 3.11Å
261	W	88.9	Confident	87.4	Confident	116 Å²	116	100.1 Å²	100.1	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-70.3	-42.2	174.5	-169.5	80.1	0	0	0	112.3	Y257 Y258 Q263 Q264 E265	Y257-W261 WeakPolarHBondContact O-CB 3.49Å; Y257-W261 PolarHBondContact O-N 3.48Å; Y258-W261 PolarHBondContact O-N 3.39Å; W261-Q263 PolarHBondContact O-N 2.97Å; W261-Q264 CarbonylContact O-C 3.47Å; W261-Q264 WeakPolarHBondContact O-CA 3.39Å; W261-Q264 WeakPolarHBondContact O-CB 3.42Å; W261-Q264 PolarHBondContact O-N 3.19Å; W261-Q264 VanDerWaalsContact O-N 3.08Å; W261-E265 WeakPolarHBondContact CH2-OE1 3.4Å; W261-E265 WeakPolarHBondContact CH2-OE2 3.33Å; W261-E265 WeakPolarHBondContact CZ3-OE2 3.39Å; W261-E265 PolarHBondContact O-N 3.2Å
262	E	85.8	Confident	87.5	Confident	115 Å²	115	98 Å²	98	54%	0.537	46%	0.455	S	S	.	.	H	α-helix	trans	-55.6	-46.3	172.1	-178.4	176.9	-133.8	0	0	111.3	Y258 Q264 E265 D266	Y258-E262 VanDerWaalsContact O-CB 3.3Å; Y258-E262 WeakPolarHBondContact O-CB 3.48Å; Y258-E262 PolarHBondContact O-N 3.44Å; E262-Q264 VanDerWaalsContact C-N 3.33Å; E262-Q264 PolarHBondContact O-N 3.27Å; E262-E265 PolarHBondContact O-N 2.94Å; E262-D266 WeakPolarHBondContact O-CB 3.42Å; E262-D266 PolarHBondContact O-N 2.9Å
263	Q	88	Confident	87.5	Confident	115 Å²	115	94.7 Å²	94.7	54%	0.537	44%	0.439	S	S	.	.	H	α-helix	trans	-67.4	-29.2	175.2	-74.5	167.8	73.3	0	0	113.9	R259 W261 S267	R259-Q263 WeakPolarHBondContact O-CG 3.33Å; R259-Q263 PolarHBondContact O-N 2.65Å; R259-Q263 PolarHBondContact O-NE2 3Å; W261-Q263 PolarHBondContact O-N 2.97Å; Q263-S267 WeakPolarHBondContact O-CB 3.48Å; Q263-S267 PolarHBondContact O-N 2.94Å; Q263-S267 VanDerWaalsContact O-N 3.14Å; Q263-S267 PolarHBondContact O-OG 3.45Å
264	Q	87.8	Confident	87.3	Confident	122 Å²	122	92.1 Å²	92.1	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-72.3	-42.3	172.5	-74.7	171.5	7.9	0	0	111	S260 W261 E262 S267 F268	S260-Q264 WeakPolarHBondContact O-CG 3.35Å; S260-Q264 PolarHBondContact O-N 3.22Å; S260-Q264 VanDerWaalsContact O-N 3.11Å; W261-Q264 CarbonylContact O-C 3.47Å; W261-Q264 WeakPolarHBondContact O-CA 3.39Å; W261-Q264 WeakPolarHBondContact O-CB 3.42Å; W261-Q264 PolarHBondContact O-N 3.19Å; W261-Q264 VanDerWaalsContact O-N 3.08Å; E262-Q264 VanDerWaalsContact C-N 3.33Å; E262-Q264 PolarHBondContact O-N 3.27Å; Q264-S267 PolarHBondContact O-N 3.14Å; Q264-S267 PolarHBondContact O-OG 2.88Å; Q264-F268 WeakPolarHBondContact O-CB 3.26Å; Q264-F268 PolarHBondContact O-N 3.4Å
265	E	88.4	Confident	87.2	Confident	84 Å²	84	91.9 Å²	91.9	39%	0.393	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-45.1	175.3	-173.6	163	-120.5	0	0	111.4	W261 E262 S267 F268 H269	W261-E265 WeakPolarHBondContact CH2-OE1 3.4Å; W261-E265 WeakPolarHBondContact CH2-OE2 3.33Å; W261-E265 WeakPolarHBondContact CZ3-OE2 3.39Å; W261-E265 PolarHBondContact O-N 3.2Å; E262-E265 PolarHBondContact O-N 2.94Å; E265-S267 PolarHBondContact O-N 3.27Å; E265-F268 PolarHBondContact O-N 3.35Å; E265-H269 WeakPolarHBondContact CG-NE2 3.39Å; E265-H269 WeakPolarHBondContact O-CB 3.38Å; E265-H269 PolarHBondContact O-CD2 2.89Å; E265-H269 VanDerWaalsContact O-CD2 3.3Å; E265-H269 PolarHBondContact O-N 3.39Å
266	D	85.6	Confident	87	Confident	47 Å²	47	96.9 Å²	96.9	25%	0.251	44%	0.44	S	S	.	.	H	α-helix	trans	-47.9	-56.9	168.1	-89.3	1.5	0	0	0	111.7	E262 F268 H269 L270 L343 K345	E262-D266 WeakPolarHBondContact O-CB 3.42Å; E262-D266 PolarHBondContact O-N 2.9Å; D266-F268 VanDerWaalsContact C-N 3.33Å; D266-F268 PolarHBondContact O-N 2.83Å; D266-H269 PolarHBondContact O-N 3.29Å; D266-L270 PolarHBondContact O-N 3.42Å; D266-L343 HydrophobicContact CB-CD2 3.64Å; D266-L343 VanDerWaalsContact CG-CD2 3.43Å; D266-L343 VanDerWaalsContact OD1-CD2 3.31Å; D266-L343 WeakPolarHBondContact OD1-CD2 3.5Å; D266-K345 IonicContact OD2-NZ 2.71Å; D266-K345 PolarHBondContact OD2-NZ 2.89Å
267	S	84.4	Confident	86.9	Confident	56 Å²	56	91.4 Å²	91.4	39%	0.392	42%	0.415	S	S	.	.	H	α-helix	trans	-67	-35.1	-175.8	69	0	0	0	0	112.3	Q263 Q264 E265 L270 Q271	Q263-S267 WeakPolarHBondContact O-CB 3.48Å; Q263-S267 PolarHBondContact O-N 2.94Å; Q263-S267 VanDerWaalsContact O-N 3.14Å; Q263-S267 PolarHBondContact O-OG 3.45Å; Q264-S267 PolarHBondContact O-N 3.14Å; Q264-S267 PolarHBondContact O-OG 2.88Å; E265-S267 PolarHBondContact O-N 3.27Å; S267-L270 PolarHBondContact O-N 3.3Å; S267-Q271 WeakPolarHBondContact O-CB 3.39Å; S267-Q271 WeakPolarHBondContact O-CG 3Å; S267-Q271 PolarHBondContact O-N 2.93Å
268	F	88.1	Confident	86.9	Confident	119 Å²	119	90.4 Å²	90.4	52%	0.522	41%	0.41	S	S	.	.	H	α-helix	trans	-68	-39.1	174.4	179.7	-102.3	0	0	0	111.8	Q264 E265 D266 Q271 Q272	Q264-F268 WeakPolarHBondContact O-CB 3.26Å; Q264-F268 PolarHBondContact O-N 3.4Å; E265-F268 PolarHBondContact O-N 3.35Å; D266-F268 VanDerWaalsContact C-N 3.33Å; D266-F268 PolarHBondContact O-N 2.83Å; F268-Q271 PolarHBondContact O-N 3.25Å; F268-Q272 WeakPolarHBondContact O-CB 3.17Å; F268-Q272 PolarHBondContact O-N 2.94Å
269	H	85.6	Confident	86.7	Confident	96 Å²	96	86.8 Å²	86.8	44%	0.444	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-42.4	173.2	-75.5	-38.4	0	0	0	112.1	E265 D266 Q272 A273 L343	E265-H269 WeakPolarHBondContact CG-NE2 3.39Å; E265-H269 WeakPolarHBondContact O-CB 3.38Å; E265-H269 PolarHBondContact O-CD2 2.89Å; E265-H269 VanDerWaalsContact O-CD2 3.3Å; E265-H269 PolarHBondContact O-N 3.39Å; D266-H269 PolarHBondContact O-N 3.29Å; H269-Q272 PolarHBondContact O-N 3.09Å; H269-A273 WeakPolarHBondContact O-CB 3.41Å; H269-A273 PolarHBondContact O-N 3.33Å; H269-L343 HydrophobicContact CB-CD1 4.06Å
270	L	84.1	Confident	86.7	Confident	28 Å²	28	82.6 Å²	82.6	15%	0.147	39%	0.385	C	S	.	.	H	α-helix	trans	-64.6	-44.7	175	-176.8	61.9	0	0	0	112.2	D266 S267 A273 K274 Y340 L343	D266-L270 PolarHBondContact O-N 3.42Å; S267-L270 PolarHBondContact O-N 3.3Å; L270-A273 WeakPolarHBondContact O-CB 3.14Å; L270-A273 PolarHBondContact O-N 3.07Å; L270-K274 PolarHBondContact O-N 3.23Å; L270-Y340 HydrophobicContact CD1-CD1 4.07Å; L270-Y340 HydrophobicContact CD1-CE1 4.15Å; L270-L343 HydrophobicContact CB-CB 4.36Å; L270-L343 HydrophobicContact CB-CD1 4.33Å; L270-L343 HydrophobicContact CD1-CB 4.49Å
271	Q	84.8	Confident	86.6	Confident	131 Å²	131	82.4 Å²	82.4	61%	0.612	38%	0.38	S	S	*	.	H	α-helix	trans	-63.1	-44.2	175.1	-74.5	178	1.3	0	0	112	S267 F268 A273 K274 L275	S267-Q271 WeakPolarHBondContact O-CB 3.39Å; S267-Q271 WeakPolarHBondContact O-CG 3Å; S267-Q271 PolarHBondContact O-N 2.93Å; F268-Q271 PolarHBondContact O-N 3.25Å; Q271-A273 VanDerWaalsContact C-N 3.27Å; Q271-A273 PolarHBondContact O-N 3.4Å; Q271-K274 PolarHBondContact O-N 2.86Å; Q271-L275 WeakPolarHBondContact O-CB 3.43Å; Q271-L275 PolarHBondContact O-N 3.11Å
272	Q	87.3	Confident	86.6	Confident	76 Å²	76	81 Å²	81	36%	0.355	39%	0.393	S	S	.	.	H	α-helix	trans	-65.6	-30.4	177.2	-178.5	67.5	-29.8	0	0	111.7	F268 H269 R276	F268-Q272 WeakPolarHBondContact O-CB 3.17Å; F268-Q272 PolarHBondContact O-N 2.94Å; H269-Q272 PolarHBondContact O-N 3.09Å; Q272-R276 VanDerWaalsContact O-CB 3.27Å; Q272-R276 WeakPolarHBondContact O-CB 3.3Å; Q272-R276 WeakPolarHBondContact O-CD 3.26Å; Q272-R276 WeakPolarHBondContact O-CG 3.39Å; Q272-R276 PolarHBondContact O-N 2.93Å
273	A	87.2	Confident	86.7	Confident	12 Å²	12	79.8 Å²	79.8	10%	0.099	39%	0.39	C	S	.	.	H	α-helix	trans	-68.9	-49.4	170.1	0	0	0	0	0	112.2	H269 L270 Q271 L275 R276 S277 V339	H269-A273 WeakPolarHBondContact O-CB 3.41Å; H269-A273 PolarHBondContact O-N 3.33Å; L270-A273 WeakPolarHBondContact O-CB 3.14Å; L270-A273 PolarHBondContact O-N 3.07Å; Q271-A273 VanDerWaalsContact C-N 3.27Å; Q271-A273 PolarHBondContact O-N 3.4Å; A273-L275 VanDerWaalsContact C-N 3.27Å; A273-L275 PolarHBondContact O-N 3.45Å; A273-R276 PolarHBondContact O-N 2.87Å; A273-S277 PolarHBondContact O-N 3.33Å; A273-S277 PolarHBondContact O-OG 2.81Å; A273-V339 HydrophobicContact CB-CG1 3.34Å
274	K	85.3	Confident	86.6	Confident	61 Å²	61	77.6 Å²	77.6	27%	0.265	40%	0.398	S	S	.	.	H	α-helix	trans	-59.3	-35.1	174.9	-72.4	-171.7	177.1	-177	0	112.1	L270 Q271 S277 R278 E300	L270-K274 PolarHBondContact O-N 3.23Å; Q271-K274 PolarHBondContact O-N 2.86Å; K274-S277 PolarHBondContact O-OG 3.46Å; K274-R278 WeakPolarHBondContact O-CB 3.21Å; K274-R278 PolarHBondContact O-N 3.34Å; K274-R278 VanDerWaalsContact O-N 3.14Å; K274-E300 IonicContact NZ-OE1 2.69Å; K274-E300 IonicContact NZ-OE2 2.72Å; K274-E300 PolarHBondContact NZ-OE2 2.86Å
275	L	86.2	Confident	86.6	Confident	85 Å²	85	79.4 Å²	79.4	45%	0.445	40%	0.4	S	S	.	.	H	α-helix	trans	-71.6	-43.7	174	-177.8	59.4	0	0	0	112.3	Q271 A273 S277 R278 I279	Q271-L275 WeakPolarHBondContact O-CB 3.43Å; Q271-L275 PolarHBondContact O-N 3.11Å; A273-L275 VanDerWaalsContact C-N 3.27Å; A273-L275 PolarHBondContact O-N 3.45Å; L275-S277 VanDerWaalsContact C-N 3.32Å; L275-S277 PolarHBondContact O-N 2.76Å; L275-R278 PolarHBondContact O-N 2.94Å; L275-I279 HydrophobicContact CD1-CD1 4.02Å; L275-I279 HydrophobicContact CD1-CG1 4.33Å; L275-I279 HydrophobicContact CG-CD1 3.97Å; L275-I279 WeakPolarHBondContact O-CG1 3.17Å; L275-I279 PolarHBondContact O-N 3.27Å
276	R	87.9	Confident	86.4	Confident	144 Å²	144	77.3 Å²	77.3	54%	0.543	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-32.5	176.9	-76.6	168	66.5	-163.2	-0	112.7	Q272 A273 R280	Q272-R276 VanDerWaalsContact O-CB 3.27Å; Q272-R276 WeakPolarHBondContact O-CB 3.3Å; Q272-R276 WeakPolarHBondContact O-CD 3.26Å; Q272-R276 WeakPolarHBondContact O-CG 3.39Å; Q272-R276 PolarHBondContact O-N 2.93Å; A273-R276 PolarHBondContact O-N 2.87Å; R276-R280 WeakPolarHBondContact O-CB 3.42Å; R276-R280 VanDerWaalsContact O-CG 3.3Å; R276-R280 WeakPolarHBondContact O-CG 3.39Å; R276-R280 PolarHBondContact O-N 3.08Å; R276-R280 VanDerWaalsContact O-N 3.14Å; R276-R280 PolarHBondContact O-NE 2.75Å
277	S	86.4	Confident	86.4	Confident	7 Å²	7	77.9 Å²	77.9	5%	0.049	40%	0.397	C	S	.	.	H	α-helix	trans	-71	-48.5	173	61.5	0	0	0	0	111.6	A273 K274 L275 I279 R280 I281 D290	A273-S277 PolarHBondContact O-N 3.33Å; A273-S277 PolarHBondContact O-OG 2.81Å; K274-S277 PolarHBondContact O-OG 3.46Å; L275-S277 VanDerWaalsContact C-N 3.32Å; L275-S277 PolarHBondContact O-N 2.76Å; S277-I279 VanDerWaalsContact C-N 3.32Å; S277-I279 PolarHBondContact O-N 2.9Å; S277-R280 PolarHBondContact O-N 3.4Å; S277-R280 VanDerWaalsContact O-N 3.11Å; S277-I281 VanDerWaalsContact O-CG1 3.31Å; S277-I281 WeakPolarHBondContact O-CG1 3.39Å; S277-I281 PolarHBondContact O-N 3.1Å; S277-D290 WeakPolarHBondContact CA-OD1 3.32Å; S277-D290 WeakPolarHBondContact CB-OD1 3.49Å
278	R	87.2	Confident	86.4	Confident	128 Å²	128	76.4 Å²	76.4	48%	0.483	39%	0.386	S	S	.	.	H	α-helix	trans	-52.5	-45.7	174.9	-178	168.6	-74.1	161.7	-2.3	112.6	K274 L275 I281 A282 E301	K274-R278 WeakPolarHBondContact O-CB 3.21Å; K274-R278 PolarHBondContact O-N 3.34Å; K274-R278 VanDerWaalsContact O-N 3.14Å; L275-R278 PolarHBondContact O-N 2.94Å; R278-I281 PolarHBondContact O-N 3.45Å; R278-A282 PolarHBondContact O-N 3.28Å; R278-A282 VanDerWaalsContact O-N 3.08Å; R278-E301 IonicContact CZ-OE1 2.65Å; R278-E301 IonicContact NH1-OE1 2.59Å; R278-E301 VanDerWaalsContact NH2-CD 3.32Å; R278-E301 IonicContact NH2-OE1 2.66Å; R278-E301 PolarHBondContact NH2-OE1 2.61Å; R278-E301 IonicContact NH2-OE2 3.66Å; R278-E301 PolarHBondContact NH2-OE2 2.87Å
279	I	85.9	Confident	86.4	Confident	84 Å²	84	70.9 Å²	70.9	43%	0.431	36%	0.362	S	S	.	.	H	α-helix	trans	-66.2	-44.9	176.4	-66.2	166.8	0	0	0	111.7	L275 S277 I281 A282 D283	L275-I279 HydrophobicContact CD1-CD1 4.02Å; L275-I279 HydrophobicContact CD1-CG1 4.33Å; L275-I279 HydrophobicContact CG-CD1 3.97Å; L275-I279 WeakPolarHBondContact O-CG1 3.17Å; L275-I279 PolarHBondContact O-N 3.27Å; S277-I279 VanDerWaalsContact C-N 3.32Å; S277-I279 PolarHBondContact O-N 2.9Å; I279-I281 VanDerWaalsContact C-N 3.28Å; I279-I281 PolarHBondContact O-N 3.26Å; I279-A282 PolarHBondContact O-N 3.13Å; I279-D283 WeakPolarHBondContact O-CB 3.24Å; I279-D283 PolarHBondContact O-N 2.98Å
280	R	88.3	Confident	86.4	Confident	58 Å²	58	66.3 Å²	66.3	22%	0.219	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-33.1	178.6	-78.7	-176.8	-69.9	-172.3	6.8	112.9	R276 S277 G284 R285 A286 D290	R276-R280 WeakPolarHBondContact O-CB 3.42Å; R276-R280 VanDerWaalsContact O-CG 3.3Å; R276-R280 WeakPolarHBondContact O-CG 3.39Å; R276-R280 PolarHBondContact O-N 3.08Å; R276-R280 VanDerWaalsContact O-N 3.14Å; R276-R280 PolarHBondContact O-NE 2.75Å; S277-R280 PolarHBondContact O-N 3.4Å; S277-R280 VanDerWaalsContact O-N 3.11Å; R280-G284 PolarHBondContact O-N 2.73Å; R280-R285 CarbonylContact O-C 3.59Å; R280-R285 VanDerWaalsContact O-C 3.22Å; R280-R285 WeakPolarHBondContact O-CA 3.43Å; R280-R285 PolarHBondContact O-N 3.33Å; R280-A286 PolarHBondContact O-N 3.27Å; R280-A286 VanDerWaalsContact O-N 3.14Å; R280-D290 WeakPolarHBondContact CB-OD2 3.41Å; R280-D290 WeakPolarHBondContact CD-OD2 3.45Å; R280-D290 IonicContact CZ-OD1 3.81Å; R280-D290 IonicContact CZ-OD2 3.89Å; R280-D290 VanDerWaalsContact CZ-OD2 3.31Å; R280-D290 IonicContact NE-OD1 3.44Å; R280-D290 PolarHBondContact NE-OD1 2.95Å; R280-D290 IonicContact NE-OD2 3.65Å; R280-D290 PolarHBondContact NE-OD2 3.38Å; R280-D290 IonicContact NH2-OD1 2.69Å; R280-D290 PolarHBondContact NH2-OD1 3.48Å; R280-D290 IonicContact NH2-OD2 3.24Å
281	I	86.4	Confident	86.5	Confident	46 Å²	46	66.8 Å²	66.8	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-48.6	173.4	-65.8	161.3	0	0	0	110.8	S277 R278 I279 D283 G284 A286 D290 K294	S277-I281 VanDerWaalsContact O-CG1 3.31Å; S277-I281 WeakPolarHBondContact O-CG1 3.39Å; S277-I281 PolarHBondContact O-N 3.1Å; R278-I281 PolarHBondContact O-N 3.45Å; I279-I281 VanDerWaalsContact C-N 3.28Å; I279-I281 PolarHBondContact O-N 3.26Å; I281-D283 VanDerWaalsContact C-N 3.29Å; I281-D283 PolarHBondContact O-N 3.25Å; I281-G284 PolarHBondContact O-N 3.47Å; I281-A286 HydrophobicContact CG1-CB 3.95Å; I281-D290 HydrophobicContact CD1-CB 4.19Å; I281-D290 HydrophobicContact CG1-CB 4.03Å; I281-K294 HydrophobicContact CD1-CB 3.83Å; I281-K294 HydrophobicContact CD1-CD 4.48Å
282	A	87.2	Confident	86.6	Confident	87 Å²	87	60.6 Å²	60.6	72%	0.719	31%	0.314	S	S	*	.	H	α-helix	trans	-60.2	-38.2	178.6	0	0	0	0	0	112.7	R278 I279 G284	R278-A282 PolarHBondContact O-N 3.28Å; R278-A282 VanDerWaalsContact O-N 3.08Å; I279-A282 PolarHBondContact O-N 3.13Å; A282-G284 PolarHBondContact O-N 2.88Å
283	D	88.3	Confident	86.5	Confident	89 Å²	89	57.3 Å²	57.3	48%	0.476	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-6.6	174.9	-86.5	11.7	0	0	0	114.3	I279 I281 R285	I279-D283 WeakPolarHBondContact O-CB 3.24Å; I279-D283 PolarHBondContact O-N 2.98Å; I281-D283 VanDerWaalsContact C-N 3.29Å; I281-D283 PolarHBondContact O-N 3.25Å; D283-R285 VanDerWaalsContact C-N 3.28Å; D283-R285 HydrophobicContact CB-CB 4.48Å; D283-R285 HydrophobicContact CB-CG 4.43Å; D283-R285 PolarHBondContact O-N 2.73Å; D283-R285 IonicContact OD2-CZ 3.28Å; D283-R285 IonicContact OD2-NE 3.8Å; D283-R285 IonicContact OD2-NH2 3.03Å; D283-R285 PolarHBondContact OD2-NH2 2.92Å
284	G	85.3	Confident	86.3	Confident	69 Å²	69	58.8 Å²	58.8	71%	0.711	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	21.2	-173.7	0	0	0	0	0	114.2	R280 I281 A282	R280-G284 PolarHBondContact O-N 2.73Å; I281-G284 PolarHBondContact O-N 3.47Å; A282-G284 PolarHBondContact O-N 2.88Å
285	R	88	Confident	86.2	Confident	161 Å²	161	56.1 Å²	56.1	61%	0.608	29%	0.293	S	S	*	.			trans	-125.2	38	-174.1	-59.5	-178.3	-57.7	108.3	-3	112	R280 D283	R280-R285 CarbonylContact O-C 3.59Å; R280-R285 VanDerWaalsContact O-C 3.22Å; R280-R285 WeakPolarHBondContact O-CA 3.43Å; R280-R285 PolarHBondContact O-N 3.33Å; D283-R285 VanDerWaalsContact C-N 3.28Å; D283-R285 HydrophobicContact CB-CB 4.48Å; D283-R285 HydrophobicContact CB-CG 4.43Å; D283-R285 PolarHBondContact O-N 2.73Å; D283-R285 IonicContact OD2-CZ 3.28Å; D283-R285 IonicContact OD2-NE 3.8Å; D283-R285 IonicContact OD2-NH2 3.03Å; D283-R285 PolarHBondContact OD2-NH2 2.92Å
286	A	85.1	Confident	85.9	Confident	39 Å²	39	52.2 Å²	52.2	32%	0.322	27%	0.272	S	S	.	.			trans	-63.7	130.7	-179.2	0	0	0	0	0	112.1	R280 I281 D290 L291	R280-A286 PolarHBondContact O-N 3.27Å; R280-A286 VanDerWaalsContact O-N 3.14Å; I281-A286 HydrophobicContact CG1-CB 3.95Å; A286-D290 HydrophobicContact CB-CB 4.13Å; A286-L291 HydrophobicContact CB-CD2 3.86Å; A286-L291 HydrophobicContact CB-CG 4.07Å
287	K	85.4	Confident	85.3	Confident	60 Å²	60	46 Å²	46	26%	0.261	25%	0.252	S	S	.	.			trans	-67.8	160.2	158.6	-90.8	-154.4	175.5	-164.2	0	109.5	I289 D290 L291 D331 D335	K287-I289 HydrophobicContact CB-CG2 4.13Å; K287-I289 HydrophobicContact CD-CG2 4.38Å; K287-I289 PolarHBondContact O-N 2.79Å; K287-D290 WeakPolarHBondContact CB-OD2 3.22Å; K287-D290 PolarHBondContact N-OD2 2.95Å; K287-D290 WeakPolarHBondContact O-CB 3.43Å; K287-D290 PolarHBondContact O-N 2.93Å; K287-L291 PolarHBondContact O-N 3.05Å; K287-D331 IonicContact NZ-OD2 2.64Å; K287-D331 PolarHBondContact NZ-OD2 3.26Å; K287-D335 IonicContact NZ-OD2 3.91Å; K287-D335 PolarHBondContact NZ-OD2 3.41Å
288	P	84.7	Confident	84.4	Confident	24 Å²	24	47.2 Å²	47.2	16%	0.156	26%	0.258	C	S	.	.	H	α-helix	trans	-53.1	-39.2	171	-27	36	0	0	0	113.3	D290 L291 L292 L324 L332	P288-D290 VanDerWaalsContact C-N 3.3Å; P288-D290 PolarHBondContact O-N 3.24Å; P288-L291 PolarHBondContact O-N 3.42Å; P288-L292 WeakPolarHBondContact O-CG 3.44Å; P288-L292 PolarHBondContact O-N 3.15Å; P288-L324 HydrophobicContact CB-CD1 3.83Å; P288-L324 HydrophobicContact CB-CD2 4.46Å; P288-L324 HydrophobicContact CG-CD1 3.72Å; P288-L324 HydrophobicContact CG-CD2 3.58Å; P288-L324 HydrophobicContact CG-CG 4.33Å; P288-L332 HydrophobicContact CB-CD2 4.43Å
289	I	86.9	Confident	83.4	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-67	-27.9	177.1	-158.8	169.2	0	0	0	113.3	K287 L291 L292 A293 L332 D335 I336 Y340 W352	K287-I289 HydrophobicContact CB-CG2 4.13Å; K287-I289 HydrophobicContact CD-CG2 4.38Å; K287-I289 PolarHBondContact O-N 2.79Å; I289-L291 VanDerWaalsContact C-N 3.34Å; I289-L292 PolarHBondContact O-N 3.25Å; I289-A293 VanDerWaalsContact O-CB 3.23Å; I289-A293 WeakPolarHBondContact O-CB 3.13Å; I289-A293 PolarHBondContact O-N 3.3Å; I289-L332 HydrophobicContact CB-CD1 3.59Å; I289-L332 HydrophobicContact CD1-CD1 4.29Å; I289-L332 HydrophobicContact CG1-CD1 3.96Å; I289-D335 HydrophobicContact CD1-CB 3.55Å; I289-D335 HydrophobicContact CG2-CB 4.47Å; I289-I336 HydrophobicContact CD1-CB 4.49Å; I289-I336 HydrophobicContact CD1-CG1 3.7Å; I289-I336 HydrophobicContact CG1-CG1 4.29Å; I289-Y340 HydrophobicContact CD1-CD2 3.8Å; I289-Y340 HydrophobicContact CD1-CE2 3.55Å; I289-Y340 HydrophobicContact CG1-CE2 3.99Å; I289-W352 HydrophobicContact CG1-CH2 4.26Å; I289-W352 HydrophobicContact CG1-CZ3 4.44Å
290	D	87.1	Confident	82.2	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-40.8	178.1	-61.5	-38.5	0	0	0	110.4	S277 R280 I281 A286 K287 P288 A293 K294	S277-D290 WeakPolarHBondContact CA-OD1 3.32Å; S277-D290 WeakPolarHBondContact CB-OD1 3.49Å; R280-D290 WeakPolarHBondContact CB-OD2 3.41Å; R280-D290 WeakPolarHBondContact CD-OD2 3.45Å; R280-D290 IonicContact CZ-OD1 3.81Å; R280-D290 IonicContact CZ-OD2 3.89Å; R280-D290 VanDerWaalsContact CZ-OD2 3.31Å; R280-D290 IonicContact NE-OD1 3.44Å; R280-D290 PolarHBondContact NE-OD1 2.95Å; R280-D290 IonicContact NE-OD2 3.65Å; R280-D290 PolarHBondContact NE-OD2 3.38Å; R280-D290 IonicContact NH2-OD1 2.69Å; R280-D290 PolarHBondContact NH2-OD1 3.48Å; R280-D290 IonicContact NH2-OD2 3.24Å; I281-D290 HydrophobicContact CD1-CB 4.19Å; I281-D290 HydrophobicContact CG1-CB 4.03Å; A286-D290 HydrophobicContact CB-CB 4.13Å; K287-D290 WeakPolarHBondContact CB-OD2 3.22Å; K287-D290 PolarHBondContact N-OD2 2.95Å; K287-D290 WeakPolarHBondContact O-CB 3.43Å; K287-D290 PolarHBondContact O-N 2.93Å; P288-D290 VanDerWaalsContact C-N 3.3Å; P288-D290 PolarHBondContact O-N 3.24Å; D290-A293 PolarHBondContact O-N 3.43Å; D290-K294 PolarHBondContact O-N 2.87Å
291	L	85.2	Confident	80.8	Confident	38 Å²	38	47 Å²	47	20%	0.199	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-41.2	177	-58.5	177	0	0	0	111.8	A286 K287 P288 I289 K294 Y295 V312 F320	A286-L291 HydrophobicContact CB-CD2 3.86Å; A286-L291 HydrophobicContact CB-CG 4.07Å; K287-L291 PolarHBondContact O-N 3.05Å; P288-L291 PolarHBondContact O-N 3.42Å; I289-L291 VanDerWaalsContact C-N 3.34Å; L291-K294 PolarHBondContact O-N 2.89Å; L291-Y295 PolarHBondContact O-N 3.23Å; L291-Y295 VanDerWaalsContact O-N 3.14Å; L291-V312 HydrophobicContact CD2-CG2 4.23Å; L291-F320 HydrophobicContact CB-CD1 4.32Å; L291-F320 HydrophobicContact CB-CD2 4.5Å; L291-F320 HydrophobicContact CB-CE1 4.44Å; L291-F320 HydrophobicContact CB-CG 4.35Å; L291-F320 HydrophobicContact CD1-CD1 3.68Å; L291-F320 HydrophobicContact CD1-CE1 4.01Å; L291-F320 HydrophobicContact CD1-CG 4.33Å
292	L	86.5	Confident	79.3	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-37.2	175.6	-64	171.1	0	0	0	112	P288 I289 Y295 P317 F320 L321 L332 Y351 W352 I355	P288-L292 WeakPolarHBondContact O-CG 3.44Å; P288-L292 PolarHBondContact O-N 3.15Å; I289-L292 PolarHBondContact O-N 3.25Å; L292-Y295 WeakPolarHBondContact O-CB 3.33Å; L292-Y295 PolarHBondContact O-N 3.43Å; L292-P317 HydrophobicContact CD2-CB 3.97Å; L292-F320 HydrophobicContact CD2-CD2 4.11Å; L292-L321 HydrophobicContact CD1-CD2 4.24Å; L292-L332 HydrophobicContact CD1-CD1 4.13Å; L292-L332 HydrophobicContact CD1-CD2 4.35Å; L292-Y351 PolarHBondContact O-OH 2.67Å; L292-W352 HydrophobicContact CB-CH2 4.3Å; L292-W352 HydrophobicContact CB-CZ3 4.22Å; L292-I355 HydrophobicContact CD1-CD1 4.33Å; L292-I355 HydrophobicContact CD1-CG2 4.3Å; L292-I355 HydrophobicContact CD2-CD1 3.97Å
293	A	85.4	Confident	77.7	Confident	8 Å²	8	50.7 Å²	50.7	7%	0.066	28%	0.276	C	S	.	.	H	α-helix	trans	-69.7	-39.7	174.8	0	0	0	0	0	112.4	I289 D290 Y295 I296 A297 Y340	I289-A293 VanDerWaalsContact O-CB 3.23Å; I289-A293 WeakPolarHBondContact O-CB 3.13Å; I289-A293 PolarHBondContact O-N 3.3Å; D290-A293 PolarHBondContact O-N 3.43Å; A293-Y295 VanDerWaalsContact C-N 3.26Å; A293-Y295 PolarHBondContact O-N 2.78Å; A293-I296 PolarHBondContact O-N 2.87Å; A293-I296 VanDerWaalsContact O-N 3.1Å; A293-A297 PolarHBondContact O-N 3.12Å; A293-Y340 HydrophobicContact CB-CE1 4.3Å; A293-Y340 WeakPolarHBondContact CB-OH 3.33Å
294	K	83	Confident	75.9	Confident	42 Å²	42	55.1 Å²	55.1	18%	0.183	30%	0.296	C	S	.	.	H	α-helix	trans	-56.6	-44.2	171.3	177.4	174.8	174.9	-179	0	110.4	I281 D290 L291 I296 A297 D298 V312	I281-K294 HydrophobicContact CD1-CB 3.83Å; I281-K294 HydrophobicContact CD1-CD 4.48Å; D290-K294 PolarHBondContact O-N 2.87Å; L291-K294 PolarHBondContact O-N 2.89Å; K294-I296 PolarHBondContact O-N 2.96Å; K294-A297 PolarHBondContact O-N 3.3Å; K294-D298 VanDerWaalsContact CE-CG 3.46Å; K294-D298 WeakPolarHBondContact CE-OD1 3.36Å; K294-D298 VanDerWaalsContact CE-OD2 3.24Å; K294-D298 WeakPolarHBondContact CE-OD2 3.5Å; K294-D298 WeakPolarHBondContact CG-OD1 3.24Å; K294-D298 WeakPolarHBondContact O-CB 3.22Å; K294-D298 VanDerWaalsContact O-CG 3.23Å; K294-D298 PolarHBondContact O-N 3.04Å; K294-V312 HydrophobicContact CD-CB 4.36Å; K294-V312 HydrophobicContact CD-CG1 4.32Å; K294-V312 HydrophobicContact CD-CG2 4.48Å
295	Y	83	Confident	74.3	Confident	5 Å²	5	60 Å²	60	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-59.1	-20.8	179.2	-175.6	-86.2	0	0	0	114.1	L291 L292 A293 Q299 P317 Y351 H453	L291-Y295 PolarHBondContact O-N 3.23Å; L291-Y295 VanDerWaalsContact O-N 3.14Å; L292-Y295 WeakPolarHBondContact O-CB 3.33Å; L292-Y295 PolarHBondContact O-N 3.43Å; A293-Y295 VanDerWaalsContact C-N 3.26Å; A293-Y295 PolarHBondContact O-N 2.78Å; Y295-Q299 VanDerWaalsContact CE1-NE2 3.32Å; Y295-Q299 VanDerWaalsContact O-CG 3.26Å; Y295-Q299 WeakPolarHBondContact O-CG 3.2Å; Y295-Q299 PolarHBondContact O-NE2 2.86Å; Y295-P317 HydrophobicContact CD1-CG 3.69Å; Y295-P317 HydrophobicContact CD2-CG 3.96Å; Y295-P317 HydrophobicContact CE1-CG 3.56Å; Y295-P317 HydrophobicContact CE2-CG 3.85Å; Y295-P317 HydrophobicContact CG-CG 3.9Å; Y295-Y351 AromaticContact CD1-CE2 3.47Å; Y295-Y351 HydrophobicContact CD1-CE2 3.47Å; Y295-Y351 VanDerWaalsContact CD1-CE2 3.47Å; Y295-Y351 AromaticContact CD1-CZ 3.55Å; Y295-Y351 WeakPolarHBondContact CD1-OH 3.44Å; Y295-Y351 HydrophobicContact CE1-CD2 4.45Å; Y295-Y351 AromaticContact CE1-CE2 3.61Å; Y295-Y351 HydrophobicContact CE1-CE2 3.61Å; Y295-H453 AromaticContact CE2-ND1 3.55Å; Y295-H453 AromaticContact CZ-ND1 3.74Å; Y295-H453 VanDerWaalsContact OH-CA 3.26Å; Y295-H453 WeakPolarHBondContact OH-CA 3.31Å; Y295-H453 PolarHBondContact OH-ND1 3.22Å; Y295-H453 VanDerWaalsContact OH-ND1 3.15Å
296	I	80.2	Confident	72.4	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-87.9	-45.6	169.9	-53.8	179.6	0	0	0	111.4	A293 K294 D298 Q299 E300 N348 Y351 W352	A293-I296 PolarHBondContact O-N 2.87Å; A293-I296 VanDerWaalsContact O-N 3.1Å; K294-I296 PolarHBondContact O-N 2.96Å; I296-D298 PolarHBondContact O-N 3.07Å; I296-Q299 WeakPolarHBondContact O-CA 3.44Å; I296-Q299 WeakPolarHBondContact O-CB 3.2Å; I296-Q299 WeakPolarHBondContact O-CG 3.4Å; I296-Q299 PolarHBondContact O-N 2.79Å; I296-E300 PolarHBondContact O-N 3.03Å; I296-N348 HydrophobicContact CD1-CB 4.4Å; I296-N348 HydrophobicContact CG2-CB 4.19Å; I296-N348 VanDerWaalsContact CG2-CG 3.5Å; I296-N348 VanDerWaalsContact CG2-ND2 3.27Å; I296-N348 WeakPolarHBondContact CG2-ND2 3.45Å; I296-Y351 HydrophobicContact CD1-CD1 3.48Å; I296-Y351 VanDerWaalsContact CD1-CD1 3.48Å; I296-Y351 HydrophobicContact CD1-CE1 3.51Å; I296-Y351 HydrophobicContact CG1-CD1 3.78Å; I296-Y351 HydrophobicContact CG1-CE1 3.5Å; I296-Y351 VanDerWaalsContact CG1-CE1 3.5Å; I296-W352 HydrophobicContact CD1-CD2 4.21Å; I296-W352 HydrophobicContact CD1-CH2 4.17Å; I296-W352 HydrophobicContact CD1-CZ2 3.31Å; I296-W352 VanDerWaalsContact CD1-NE1 3.33Å
297	A	75.4	Confident	70.6	Confident	14 Å²	14	62 Å²	62	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-55.9	-41.4	179.1	0	0	0	0	0	111.9	A293 K294 Q299 E300 E301	A293-A297 PolarHBondContact O-N 3.12Å; K294-A297 PolarHBondContact O-N 3.3Å; A297-Q299 PolarHBondContact O-N 2.88Å; A297-E300 PolarHBondContact O-N 2.91Å; A297-E301 PolarHBondContact O-N 2.76Å
298	D	68.2	Low	68.7	Low	32 Å²	32	66.3 Å²	66.3	17%	0.171	33%	0.333	C	S	.	.	H	α-helix	trans	-58.6	3.1	170.8	-73.8	16.7	0	0	0	115.2	K294 I296 E313 K460	K294-D298 VanDerWaalsContact CE-CG 3.46Å; K294-D298 WeakPolarHBondContact CE-OD1 3.36Å; K294-D298 VanDerWaalsContact CE-OD2 3.24Å; K294-D298 WeakPolarHBondContact CE-OD2 3.5Å; K294-D298 WeakPolarHBondContact CG-OD1 3.24Å; K294-D298 WeakPolarHBondContact O-CB 3.22Å; K294-D298 VanDerWaalsContact O-CG 3.23Å; K294-D298 PolarHBondContact O-N 3.04Å; I296-D298 PolarHBondContact O-N 3.07Å; D298-E313 WeakPolarHBondContact OD2-CG 3.5Å; D298-K460 WeakPolarHBondContact O-CE 3.24Å; D298-K460 IonicContact OD2-NZ 2.86Å; D298-K460 PolarHBondContact OD2-NZ 2.85Å
299	Q	66.2	Low	66.7	Low	70 Å²	70	69 Å²	69	33%	0.327	35%	0.352	S	S	.	.	H	α-helix	trans	-124	-11.8	174.8	-32	-167	41.8	0	0	113.4	Y295 I296 A297 N456	Y295-Q299 VanDerWaalsContact CE1-NE2 3.32Å; Y295-Q299 VanDerWaalsContact O-CG 3.26Å; Y295-Q299 WeakPolarHBondContact O-CG 3.2Å; Y295-Q299 PolarHBondContact O-NE2 2.86Å; I296-Q299 WeakPolarHBondContact O-CA 3.44Å; I296-Q299 WeakPolarHBondContact O-CB 3.2Å; I296-Q299 WeakPolarHBondContact O-CG 3.4Å; I296-Q299 PolarHBondContact O-N 2.79Å; A297-Q299 PolarHBondContact O-N 2.88Å; Q299-N456 WeakPolarHBondContact CG-ND2 3.28Å; Q299-N456 PolarHBondContact OE1-ND2 3.5Å
300	E	60.9	Low	64.9	Low	96 Å²	96	70.8 Å²	70.8	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-101.6	-28.8	178.6	-63.7	-176.1	145.1	0	0	112	K274 I296 A297 N348	K274-E300 IonicContact NZ-OE1 2.69Å; K274-E300 IonicContact NZ-OE2 2.72Å; K274-E300 PolarHBondContact NZ-OE2 2.86Å; I296-E300 PolarHBondContact O-N 3.03Å; A297-E300 PolarHBondContact O-N 2.91Å; E300-N348 PolarHBondContact OE1-ND2 2.93Å
301	E	57.8	Low	63	Low	101 Å²	101	76.4 Å²	76.4	47%	0.472	41%	0.406	S	S	.	.	S	Bend	trans	-76	139.5	178.1	-64	-174.7	146.9	0	0	110.9	R278 A297	R278-E301 IonicContact CZ-OE1 2.65Å; R278-E301 IonicContact NH1-OE1 2.59Å; R278-E301 VanDerWaalsContact NH2-CD 3.32Å; R278-E301 IonicContact NH2-OE1 2.66Å; R278-E301 PolarHBondContact NH2-OE1 2.61Å; R278-E301 IonicContact NH2-OE2 3.66Å; R278-E301 PolarHBondContact NH2-OE2 2.87Å; A297-E301 PolarHBondContact O-N 2.76Å
302	D	54.7	Low	61.6	Low	130 Å²	130	75.7 Å²	75.7	70%	0.695	40%	0.402	S	S	*	.			trans	-62.6	144.3	-168.5	-103.8	-50.6	0	0	0	112.1	M304 E305	D302-M304 PolarHBondContact O-N 3Å; D302-E305 PolarHBondContact O-N 2.92Å
303	P	54.7	Low	60.3	Low	80 Å²	80	77 Å²	77	52%	0.519	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-6.7	-170.1	-21.9	33	0	0	0	115.7	C463	P303-C463 HydrophobicContact CB-CB 4.2Å; P303-C463 PolarHBondContact O-SG 3.17Å
304	M	50	Low	59.3	Low	182 Å²	182	83.1 Å²	83.1	90%	0.897	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-19.1	-172.6	-164.5	165.1	63.5	0	0	114.3	D302 F306	D302-M304 PolarHBondContact O-N 3Å; M304-F306 PolarHBondContact O-N 3.38Å
305	E	51.7	Low	58.7	Low	170 Å²	170	84.8 Å²	84.8	79%	0.794	45%	0.449	S	S	*	.			trans	-88.3	25.5	178.1	-62.7	-157.7	145	0	0	113.3	D302 E307	D302-E305 PolarHBondContact O-N 2.92Å; E305-E307 PolarHBondContact O-N 3.4Å
306	F	48.4	Very low	58.5	Low	74 Å²	74	86.5 Å²	86.5	33%	0.325	46%	0.458	S	S	.	.			trans	-76	76.2	-172.5	-165.9	-101.9	0	0	0	113.7	M304 I308 E313 L464	M304-F306 PolarHBondContact O-N 3.38Å; F306-I308 HydrophobicContact CD1-CG1 3.94Å; F306-I308 HydrophobicContact CE1-CB 4.49Å; F306-I308 HydrophobicContact CE1-CG1 3.88Å; F306-I308 PolarHBondContact O-N 3.01Å; F306-E313 VanDerWaalsContact CE2-OE2 3.26Å; F306-E313 WeakPolarHBondContact CE2-OE2 3.4Å; F306-E313 WeakPolarHBondContact CZ-OE2 3.47Å; F306-L464 HydrophobicContact CD1-CD2 3.87Å; F306-L464 HydrophobicContact CE1-CD2 3.87Å
307	E	48.2	Very low	58.4	Low	168 Å²	168	86.5 Å²	86.5	79%	0.785	46%	0.457	S	S	*	.			trans	-63.7	120.4	161.8	-77.4	-158	160	0	0	110.1	E305 S309	E305-E307 PolarHBondContact O-N 3.4Å; E307-S309 PolarHBondContact O-N 3.33Å
308	I	44.3	Very low	58.5	Low	152 Å²	152	86.3 Å²	86.3	78%	0.779	46%	0.455	S	S	*	.			trans	-74.2	74.7	-174.9	-52.1	166.3	0	0	0	110.3	F306	F306-I308 HydrophobicContact CD1-CG1 3.94Å; F306-I308 HydrophobicContact CE1-CB 4.49Å; F306-I308 HydrophobicContact CE1-CG1 3.88Å; F306-I308 PolarHBondContact O-N 3.01Å
309	S	42.7	Very low	59.1	Low	81 Å²	81	88.7 Å²	88.7	57%	0.566	47%	0.465	S	S	*	.			trans	-135.5	92.3	-168.9	-161	0	0	0	0	113.9	E307	E307-S309 PolarHBondContact O-N 3.33Å
310	G	48.4	Very low	59.7	Low	41 Å²	41	86.9 Å²	86.9	42%	0.423	46%	0.456	S	S	.	.			trans	101.1	86.9	151.2	0	0	0	0	0	117.9	V312	G310-V312 PolarHBondContact O-N 2.88Å
311	V	48.7	Very low	60.6	Low	118 Å²	118	82.6 Å²	82.6	72%	0.715	44%	0.436	S	S	*	.	S	Bend	trans	49.7	-44.1	139.6	-174.5	0	0	0	0	120.5	E313 I314	V311-E313 PolarHBondContact O-N 3.5Å; V311-E313 VanDerWaalsContact O-N 3.1Å; V311-I314 PolarHBondContact O-N 3.2Å
312	V	55.2	Low	61.6	Low	22 Å²	22	83.3 Å²	83.3	13%	0.133	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-53.9	-33	-173.6	-178.8	0	0	0	0	112.4	L291 K294 G310 I314 L315 F320	L291-V312 HydrophobicContact CD2-CG2 4.23Å; K294-V312 HydrophobicContact CD-CB 4.36Å; K294-V312 HydrophobicContact CD-CG1 4.32Å; K294-V312 HydrophobicContact CD-CG2 4.48Å; G310-V312 PolarHBondContact O-N 2.88Å; V312-I314 VanDerWaalsContact C-N 3.28Å; V312-I314 PolarHBondContact O-N 3.26Å; V312-L315 PolarHBondContact O-N 3.25Å; V312-F320 HydrophobicContact CG1-CZ 3.97Å
313	E	59.6	Low	62.7	Low	29 Å²	29	80.9 Å²	80.9	14%	0.136	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-66.6	-21.1	-171.5	-57.7	-175.7	-125.7	0	0	115.6	D298 F306 V311 K460	D298-E313 WeakPolarHBondContact OD2-CG 3.5Å; F306-E313 VanDerWaalsContact CE2-OE2 3.26Å; F306-E313 WeakPolarHBondContact CE2-OE2 3.4Å; F306-E313 WeakPolarHBondContact CZ-OE2 3.47Å; V311-E313 PolarHBondContact O-N 3.5Å; V311-E313 VanDerWaalsContact O-N 3.1Å; E313-K460 IonicContact OE2-NZ 2.77Å; E313-K460 PolarHBondContact OE2-NZ 2.84Å
314	I	63.8	Low	64	Low	136 Å²	136	78.8 Å²	78.8	70%	0.697	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-94.5	-10.6	-171.2	-58.6	170.1	0	0	0	111.7	V311 V312	V311-I314 PolarHBondContact O-N 3.2Å; V312-I314 VanDerWaalsContact C-N 3.28Å; V312-I314 PolarHBondContact O-N 3.26Å
315	L	70.5	Confident	65.7	Low	76 Å²	76	71.5 Å²	71.5	40%	0.398	41%	0.409	S	S	.	.	S	Bend	trans	-95.7	135.3	-175.7	-62.6	173.9	0	0	0	111.3	V312 F320 H453	V312-L315 PolarHBondContact O-N 3.25Å; L315-F320 HydrophobicContact CB-CE1 4.32Å; L315-F320 HydrophobicContact CB-CE2 4.31Å; L315-F320 HydrophobicContact CB-CZ 3.79Å; L315-F320 HydrophobicContact CD1-CE1 3.73Å; L315-F320 HydrophobicContact CD1-CZ 3.97Å; L315-F320 HydrophobicContact CG-CZ 4.5Å; L315-H453 PolarHBondContact O-CE1 3.01Å
316	E	78.4	Confident	67.4	Low	42 Å²	42	65.6 Å²	65.6	20%	0.196	38%	0.382	C	S	.	.			trans	-61.1	136.7	171.1	-45.8	-172.2	127.6	0	0	108.9	T318 Q319 R450	E316-T318 PolarHBondContact O-N 3.43Å; E316-Q319 WeakPolarHBondContact O-CB 3.14Å; E316-Q319 PolarHBondContact O-N 2.82Å; E316-Q319 PolarHBondContact OE2-NE2 3.17Å; E316-R450 WeakPolarHBondContact OE1-CD 3.35Å; E316-R450 VanDerWaalsContact OE1-CG 3.24Å; E316-R450 WeakPolarHBondContact OE1-CG 3.5Å; E316-R450 IonicContact OE1-NE 2.7Å; E316-R450 PolarHBondContact OE1-NE 2.88Å; E316-R450 IonicContact OE2-CZ 3.69Å; E316-R450 IonicContact OE2-NE 3.04Å; E316-R450 PolarHBondContact OE2-NE 3.46Å; E316-R450 VanDerWaalsContact OE2-NE 3.1Å; E316-R450 IonicContact OE2-NH2 3.74Å
317	P	78.7	Confident	69.2	Low	2 Å²	2	70 Å²	70	1%	0.013	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-53.5	-26.7	-179	-30.8	36.3	0	0	0	114.9	L292 Y295 Q319 Y351	L292-P317 HydrophobicContact CD2-CB 3.97Å; Y295-P317 HydrophobicContact CD1-CG 3.69Å; Y295-P317 HydrophobicContact CD2-CG 3.96Å; Y295-P317 HydrophobicContact CE1-CG 3.56Å; Y295-P317 HydrophobicContact CE2-CG 3.85Å; Y295-P317 HydrophobicContact CG-CG 3.9Å; P317-Q319 PolarHBondContact O-N 3.14Å; P317-Y351 HydrophobicContact CB-CE2 4.23Å; P317-Y351 HydrophobicContact CG-CE2 3.99Å
318	T	78.1	Confident	71.1	Confident	10 Å²	10	65.9 Å²	65.9	6%	0.061	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-66.6	-18.8	176.3	46.9	0	0	0	0	114.3	E316 L321 V358 R446 L449	E316-T318 PolarHBondContact O-N 3.43Å; T318-L321 PolarHBondContact O-N 2.87Å; T318-V358 HydrophobicContact CG2-CG1 4.41Å; T318-R446 HydrophobicContact CG2-CG 4.14Å; T318-L449 HydrophobicContact CG2-CD1 3.98Å
319	Q	81.1	Confident	73.1	Confident	82 Å²	82	58.7 Å²	58.7	38%	0.383	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-78.9	-28.9	-174.8	-89.2	63.6	-45.4	0	0	111.4	E316 P317 L321 V322	E316-Q319 WeakPolarHBondContact O-CB 3.14Å; E316-Q319 PolarHBondContact O-N 2.82Å; E316-Q319 PolarHBondContact OE2-NE2 3.17Å; P317-Q319 PolarHBondContact O-N 3.14Å; Q319-L321 PolarHBondContact O-N 3.02Å; Q319-V322 PolarHBondContact O-N 3.28Å
320	F	77.8	Confident	75.3	Confident	33 Å²	33	58.5 Å²	58.5	15%	0.145	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-67	-13.8	174.2	-55.5	-63	0	0	0	113.6	L291 L292 V312 L315	L291-F320 HydrophobicContact CB-CD1 4.32Å; L291-F320 HydrophobicContact CB-CD2 4.5Å; L291-F320 HydrophobicContact CB-CE1 4.44Å; L291-F320 HydrophobicContact CB-CG 4.35Å; L291-F320 HydrophobicContact CD1-CD1 3.68Å; L291-F320 HydrophobicContact CD1-CE1 4.01Å; L291-F320 HydrophobicContact CD1-CG 4.33Å; L292-F320 HydrophobicContact CD2-CD2 4.11Å; V312-F320 HydrophobicContact CG1-CZ 3.97Å; L315-F320 HydrophobicContact CB-CE1 4.32Å; L315-F320 HydrophobicContact CB-CE2 4.31Å; L315-F320 HydrophobicContact CB-CZ 3.79Å; L315-F320 HydrophobicContact CD1-CE1 3.73Å; L315-F320 HydrophobicContact CD1-CZ 3.97Å; L315-F320 HydrophobicContact CG-CZ 4.5Å
321	L	79.8	Confident	77.2	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.026	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-89.8	-11.2	177	-54.7	179.3	0	0	0	113	L292 T318 Q319 G323 L324 L332 V358 V359	L292-L321 HydrophobicContact CD1-CD2 4.24Å; T318-L321 PolarHBondContact O-N 2.87Å; Q319-L321 PolarHBondContact O-N 3.02Å; L321-G323 PolarHBondContact O-N 3.43Å; L321-L324 HydrophobicContact CD2-CD1 4.29Å; L321-L332 HydrophobicContact CD2-CD2 3.5Å; L321-L332 VanDerWaalsContact CD2-CD2 3.5Å; L321-V358 HydrophobicContact CD1-CB 4.31Å; L321-V358 HydrophobicContact CD1-CG1 3.63Å; L321-V359 HydrophobicContact CD1-CG2 3.96Å; L321-V359 HydrophobicContact CD2-CG2 3.95Å
322	V	78.9	Confident	79.1	Confident	116 Å²	116	55.2 Å²	55.2	70%	0.703	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	102.2	-173.6	-177.2	0	0	0	0	110.4	Q319	Q319-V322 PolarHBondContact O-N 3.28Å
323	G	77.3	Confident	80.7	Confident	79 Å²	79	55.3 Å²	55.3	81%	0.814	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.7	8.9	175	0	0	0	0	0	115.6	L321	L321-G323 PolarHBondContact O-N 3.43Å
324	L	83.1	Confident	82	Confident	36 Å²	36	58.8 Å²	58.8	19%	0.188	33%	0.325	C	S	.	.			trans	-72.5	153.1	171.8	-62.4	179.6	0	0	0	112	P288 L321 D328 L329 L332	P288-L324 HydrophobicContact CB-CD1 3.83Å; P288-L324 HydrophobicContact CB-CD2 4.46Å; P288-L324 HydrophobicContact CG-CD1 3.72Å; P288-L324 HydrophobicContact CG-CD2 3.58Å; P288-L324 HydrophobicContact CG-CG 4.33Å; L321-L324 HydrophobicContact CD2-CD1 4.29Å; L324-D328 HydrophobicContact CB-CB 4.02Å; L324-D328 HydrophobicContact CD2-CB 4.43Å; L324-L329 HydrophobicContact CB-CD1 4.37Å; L324-L329 HydrophobicContact CB-CD2 4.12Å; L324-L329 HydrophobicContact CB-CG 3.92Å; L324-L329 HydrophobicContact CD1-CD2 3.87Å; L324-L329 HydrophobicContact CD1-CG 4.45Å; L324-L332 HydrophobicContact CD1-CD2 4.46Å
325	G	85.3	Confident	83	Confident	30 Å²	30	54.6 Å²	54.6	31%	0.309	30%	0.304	S	S	.	.			trans	-73	169.1	172.6	0	0	0	0	0	113	E327 D328 L329	G325-E327 VanDerWaalsContact C-N 3.32Å; G325-D328 WeakPolarHBondContact CA-OD2 3.39Å; G325-D328 PolarHBondContact N-OD2 3.47Å; G325-D328 PolarHBondContact O-N 3.08Å; G325-L329 WeakPolarHBondContact O-CD1 3.45Å; G325-L329 WeakPolarHBondContact O-CG 3.36Å; G325-L329 PolarHBondContact O-N 3.48Å; G325-L329 VanDerWaalsContact O-N 3.14Å
326	I	86.5	Confident	83.7	Confident	45 Å²	45	51 Å²	51	23%	0.231	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-44	172.8	-62	176.8	0	0	0	109.7	L329 E330 L366 R367	I326-L329 PolarHBondContact O-N 3.24Å; I326-E330 VanDerWaalsContact CG2-OE1 3.22Å; I326-E330 WeakPolarHBondContact CG2-OE1 3.44Å; I326-E330 WeakPolarHBondContact O-CG 3Å; I326-E330 PolarHBondContact O-N 3.26Å; I326-L366 HydrophobicContact CD1-CB 4.16Å; I326-L366 HydrophobicContact CG1-CB 3.81Å; I326-L366 HydrophobicContact CG1-CD1 4.17Å; I326-R367 HydrophobicContact CD1-CG 4.49Å
327	E	87.1	Confident	84	Confident	167 Å²	167	52.4 Å²	52.4	78%	0.78	29%	0.291	S	S	*	.	H	α-helix	trans	-57.9	-50.4	175.5	-63	177.3	-175.6	0	0	111.4	G325 L329 E330 D331	G325-E327 VanDerWaalsContact C-N 3.32Å; E327-L329 VanDerWaalsContact C-N 3.28Å; E327-L329 PolarHBondContact O-N 2.97Å; E327-E330 PolarHBondContact O-N 3.04Å; E327-D331 WeakPolarHBondContact O-CB 3.49Å; E327-D331 PolarHBondContact O-N 3.43Å
328	D	87.8	Confident	83.9	Confident	82 Å²	82	56 Å²	56	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-35.8	178.7	-61.2	-62.2	0	0	0	113.5	L324 G325 L332	L324-D328 HydrophobicContact CB-CB 4.02Å; L324-D328 HydrophobicContact CD2-CB 4.43Å; G325-D328 WeakPolarHBondContact CA-OD2 3.39Å; G325-D328 PolarHBondContact N-OD2 3.47Å; G325-D328 PolarHBondContact O-N 3.08Å; D328-L332 WeakPolarHBondContact O-CB 3.2Å; D328-L332 PolarHBondContact O-N 2.95Å
329	L	87.3	Confident	83.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-78.5	-30.2	179.8	-71.1	165.8	0	0	0	112.3	L324 G325 I326 E327 L332 L333 V359 L366	L324-L329 HydrophobicContact CB-CD1 4.37Å; L324-L329 HydrophobicContact CB-CD2 4.12Å; L324-L329 HydrophobicContact CB-CG 3.92Å; L324-L329 HydrophobicContact CD1-CD2 3.87Å; L324-L329 HydrophobicContact CD1-CG 4.45Å; G325-L329 WeakPolarHBondContact O-CD1 3.45Å; G325-L329 WeakPolarHBondContact O-CG 3.36Å; G325-L329 PolarHBondContact O-N 3.48Å; G325-L329 VanDerWaalsContact O-N 3.14Å; I326-L329 PolarHBondContact O-N 3.24Å; E327-L329 VanDerWaalsContact C-N 3.28Å; E327-L329 PolarHBondContact O-N 2.97Å; L329-L332 HydrophobicContact CD2-CD2 4.39Å; L329-L333 WeakPolarHBondContact O-CB 3.37Å; L329-L333 PolarHBondContact O-N 3.43Å; L329-V359 HydrophobicContact CB-CG1 4.35Å; L329-V359 HydrophobicContact CD2-CG1 4.08Å; L329-L366 HydrophobicContact CD1-CD1 3.47Å; L329-L366 VanDerWaalsContact CD1-CD1 3.47Å
330	E	88.5	Confident	83.3	Confident	77 Å²	77	53.6 Å²	53.6	36%	0.36	30%	0.303	S	S	.	.	H	α-helix	trans	-72.3	-43.9	171.4	-72.3	178.4	-158.2	0	0	110.8	I326 E327 L332 L333 E334 L363 R367	I326-E330 VanDerWaalsContact CG2-OE1 3.22Å; I326-E330 WeakPolarHBondContact CG2-OE1 3.44Å; I326-E330 WeakPolarHBondContact O-CG 3Å; I326-E330 PolarHBondContact O-N 3.26Å; E327-E330 PolarHBondContact O-N 3.04Å; E330-L332 PolarHBondContact O-N 3.29Å; E330-L333 PolarHBondContact O-N 2.93Å; E330-E334 PolarHBondContact O-N 3.32Å; E330-E334 VanDerWaalsContact O-N 3.08Å; E330-L363 HydrophobicContact CG-CD1 3.55Å; E330-R367 IonicContact OE1-CZ 3.85Å; E330-R367 IonicContact OE1-NE 3.24Å; E330-R367 PolarHBondContact OE1-NE 3.39Å; E330-R367 IonicContact OE1-NH2 3.17Å; E330-R367 PolarHBondContact OE1-NH2 2.92Å; E330-R367 IonicContact OE2-NH2 3.2Å
331	D	88.4	Confident	83	Confident	88 Å²	88	56.8 Å²	56.8	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-56.2	-47.2	170.8	-119.1	45.8	0	0	0	111.2	K287 E327 E334 D335	K287-D331 IonicContact NZ-OD2 2.64Å; K287-D331 PolarHBondContact NZ-OD2 3.26Å; E327-D331 WeakPolarHBondContact O-CB 3.49Å; E327-D331 PolarHBondContact O-N 3.43Å; D331-E334 PolarHBondContact O-N 3.42Å; D331-D335 VanDerWaalsContact O-CB 3.31Å; D331-D335 WeakPolarHBondContact O-CB 3.37Å; D331-D335 PolarHBondContact O-N 3.04Å
332	L	88.9	Confident	82.6	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-40.9	178	175.1	61.9	0	0	0	112.3	P288 I289 L292 L321 L324 D328 L329 E330 E334 I336 V359	P288-L332 HydrophobicContact CB-CD2 4.43Å; I289-L332 HydrophobicContact CB-CD1 3.59Å; I289-L332 HydrophobicContact CD1-CD1 4.29Å; I289-L332 HydrophobicContact CG1-CD1 3.96Å; L292-L332 HydrophobicContact CD1-CD1 4.13Å; L292-L332 HydrophobicContact CD1-CD2 4.35Å; L321-L332 HydrophobicContact CD2-CD2 3.5Å; L321-L332 VanDerWaalsContact CD2-CD2 3.5Å; L324-L332 HydrophobicContact CD1-CD2 4.46Å; D328-L332 WeakPolarHBondContact O-CB 3.2Å; D328-L332 PolarHBondContact O-N 2.95Å; L329-L332 HydrophobicContact CD2-CD2 4.39Å; E330-L332 PolarHBondContact O-N 3.29Å; L332-E334 VanDerWaalsContact C-N 3.32Å; L332-I336 HydrophobicContact CD1-CD1 3.76Å; L332-I336 HydrophobicContact CD1-CG1 4.04Å; L332-I336 HydrophobicContact CG-CD1 3.91Å; L332-I336 WeakPolarHBondContact O-CB 3.35Å; L332-I336 WeakPolarHBondContact O-CG1 3.5Å; L332-I336 PolarHBondContact O-N 2.9Å; L332-V359 HydrophobicContact CD2-CG2 3.76Å; L332-V359 HydrophobicContact CG-CG2 4.39Å
333	L	87.9	Confident	82.1	Confident	23 Å²	23	59 Å²	59	12%	0.12	32%	0.322	C	S	.	.	H	α-helix	trans	-68.4	-33.4	-178.6	-174.2	150.8	0	0	0	111.6	L329 E330 K337 V359 E360	L329-L333 WeakPolarHBondContact O-CB 3.37Å; L329-L333 PolarHBondContact O-N 3.43Å; E330-L333 PolarHBondContact O-N 2.93Å; L333-K337 HydrophobicContact CD2-CD 4.27Å; L333-K337 WeakPolarHBondContact O-CG 3.29Å; L333-K337 PolarHBondContact O-N 3.45Å; L333-V359 HydrophobicContact CB-CG1 4.1Å; L333-V359 HydrophobicContact CD1-CG1 4.2Å; L333-E360 HydrophobicContact CD1-CG 3.74Å
334	E	86.3	Confident	81.7	Confident	103 Å²	103	56 Å²	56	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-79.8	-44.2	174.3	-157.6	68.1	178.8	0	0	112.2	E330 D331 L332 I336 K337 V338	E330-E334 PolarHBondContact O-N 3.32Å; E330-E334 VanDerWaalsContact O-N 3.08Å; D331-E334 PolarHBondContact O-N 3.42Å; L332-E334 VanDerWaalsContact C-N 3.32Å; E334-I336 VanDerWaalsContact C-N 3.26Å; E334-I336 PolarHBondContact O-N 3.44Å; E334-K337 PolarHBondContact O-N 3.33Å; E334-K337 VanDerWaalsContact O-N 3.17Å; E334-K337 IonicContact OE2-NZ 2.93Å; E334-K337 PolarHBondContact OE2-NZ 2.97Å; E334-V338 HydrophobicContact CG-CG2 4.24Å; E334-V338 WeakPolarHBondContact O-CG2 3.42Å; E334-V338 PolarHBondContact O-N 3.14Å
335	D	86	Confident	80.7	Confident	48 Å²	48	61.8 Å²	61.8	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-55.4	-39.2	173.6	-86.3	-24.1	0	0	0	110.8	K287 I289 D331 V339	K287-D335 IonicContact NZ-OD2 3.91Å; K287-D335 PolarHBondContact NZ-OD2 3.41Å; I289-D335 HydrophobicContact CD1-CB 3.55Å; I289-D335 HydrophobicContact CG2-CB 4.47Å; D331-D335 VanDerWaalsContact O-CB 3.31Å; D331-D335 WeakPolarHBondContact O-CB 3.37Å; D331-D335 PolarHBondContact O-N 3.04Å; D335-V339 WeakPolarHBondContact O-CB 3.48Å; D335-V339 WeakPolarHBondContact O-CG2 3.47Å; D335-V339 PolarHBondContact O-N 3.14Å; D335-V339 VanDerWaalsContact O-N 3.14Å
336	I	85.6	Confident	79.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-46.9	176.4	-73.7	169.9	0	0	0	112.2	I289 L332 E334 Y340 M341 W352 I355	I289-I336 HydrophobicContact CD1-CB 4.49Å; I289-I336 HydrophobicContact CD1-CG1 3.7Å; I289-I336 HydrophobicContact CG1-CG1 4.29Å; L332-I336 HydrophobicContact CD1-CD1 3.76Å; L332-I336 HydrophobicContact CD1-CG1 4.04Å; L332-I336 HydrophobicContact CG-CD1 3.91Å; L332-I336 WeakPolarHBondContact O-CB 3.35Å; L332-I336 WeakPolarHBondContact O-CG1 3.5Å; L332-I336 PolarHBondContact O-N 2.9Å; E334-I336 VanDerWaalsContact C-N 3.26Å; E334-I336 PolarHBondContact O-N 3.44Å; I336-Y340 PolarHBondContact O-N 2.91Å; I336-Y340 VanDerWaalsContact O-N 3.14Å; I336-M341 PolarHBondContact O-N 3.46Å; I336-W352 HydrophobicContact CD1-CE3 4.07Å; I336-W352 HydrophobicContact CD1-CZ3 4.06Å; I336-W352 HydrophobicContact CG1-CE3 3.88Å; I336-W352 HydrophobicContact CG1-CZ3 3.77Å; I336-W352 HydrophobicContact CG2-CB 4.38Å; I336-W352 HydrophobicContact CG2-CD2 4.41Å; I336-W352 HydrophobicContact CG2-CE3 3.93Å; I336-I355 HydrophobicContact CD1-CG2 3.62Å
337	K	82.8	Confident	78.7	Confident	71 Å²	71	65.3 Å²	65.3	31%	0.309	34%	0.34	S	S	.	.	I	π-helix	trans	-62.8	-55	-178.2	-73.6	167.5	-176.3	166.8	0	111.2	L333 E334 M341 E342	L333-K337 HydrophobicContact CD2-CD 4.27Å; L333-K337 WeakPolarHBondContact O-CG 3.29Å; L333-K337 PolarHBondContact O-N 3.45Å; E334-K337 PolarHBondContact O-N 3.33Å; E334-K337 VanDerWaalsContact O-N 3.17Å; E334-K337 IonicContact OE2-NZ 2.93Å; E334-K337 PolarHBondContact OE2-NZ 2.97Å; K337-M341 HydrophobicContact CG-CE 4.28Å; K337-M341 PolarHBondContact O-N 2.99Å; K337-E342 PolarHBondContact O-N 2.76Å
338	V	76.6	Confident	78.1	Confident	79 Å²	79	58.5 Å²	58.5	48%	0.479	31%	0.309	S	S	.	.	I	π-helix	trans	-70.3	-36.6	-170.7	176.6	0	0	0	0	111.6	E334	E334-V338 HydrophobicContact CG-CG2 4.24Å; E334-V338 WeakPolarHBondContact O-CG2 3.42Å; E334-V338 PolarHBondContact O-N 3.14Å
339	V	72.8	Confident	77.8	Confident	33 Å²	33	56.2 Å²	56.2	20%	0.2	30%	0.302	C	S	.	.	I	π-helix	trans	-99.2	-28.4	-170.1	-173.4	0	0	0	0	113.3	A273 D335 L343	A273-V339 HydrophobicContact CB-CG1 3.34Å; D335-V339 WeakPolarHBondContact O-CB 3.48Å; D335-V339 WeakPolarHBondContact O-CG2 3.47Å; D335-V339 PolarHBondContact O-N 3.14Å; D335-V339 VanDerWaalsContact O-N 3.14Å; V339-L343 WeakPolarHBondContact O-CD1 3.44Å
340	Y	73.8	Confident	77.6	Confident	7 Å²	7	62 Å²	62	3%	0.027	33%	0.329	C	S	.	.	I	π-helix	trans	-122	-43.5	-173	-63.1	-84.3	0	0	0	113.3	L270 I289 A293 I336 E342 E344 W352	L270-Y340 HydrophobicContact CD1-CD1 4.07Å; L270-Y340 HydrophobicContact CD1-CE1 4.15Å; I289-Y340 HydrophobicContact CD1-CD2 3.8Å; I289-Y340 HydrophobicContact CD1-CE2 3.55Å; I289-Y340 HydrophobicContact CG1-CE2 3.99Å; A293-Y340 HydrophobicContact CB-CE1 4.3Å; A293-Y340 WeakPolarHBondContact CB-OH 3.33Å; I336-Y340 PolarHBondContact O-N 2.91Å; I336-Y340 VanDerWaalsContact O-N 3.14Å; Y340-E342 VanDerWaalsContact C-N 3.31Å; Y340-E342 PolarHBondContact O-N 3.33Å; Y340-E344 WeakPolarHBondContact O-CB 3.31Å; Y340-E344 PolarHBondContact O-N 2.88Å; Y340-W352 AromaticContact CD1-CE2 3.88Å; Y340-W352 HydrophobicContact CD1-CH2 4.4Å; Y340-W352 AromaticContact CD1-CZ2 3.47Å; Y340-W352 HydrophobicContact CD1-CZ2 3.47Å; Y340-W352 VanDerWaalsContact CD1-CZ2 3.47Å; Y340-W352 AromaticContact CD1-NE1 3.96Å; Y340-W352 HydrophobicContact CD2-CH2 4.09Å; Y340-W352 AromaticContact CD2-CZ2 3.88Å; Y340-W352 HydrophobicContact CD2-CZ2 3.88Å; Y340-W352 AromaticContact CE1-CZ2 3.91Å; Y340-W352 HydrophobicContact CE1-CZ2 3.91Å; Y340-W352 HydrophobicContact CE2-CH2 4.31Å; Y340-W352 HydrophobicContact CE2-CZ2 4.28Å; Y340-W352 AromaticContact CG-CE2 3.7Å; Y340-W352 HydrophobicContact CG-CH2 4.13Å; Y340-W352 AromaticContact CG-CZ2 3.46Å; Y340-W352 HydrophobicContact CG-CZ2 3.46Å; Y340-W352 VanDerWaalsContact CG-CZ2 3.46Å; Y340-W352 AromaticContact CG-NE1 3.97Å
341	M	72.9	Confident	77.6	Confident	100 Å²	100	59.2 Å²	59.2	49%	0.493	32%	0.315	S	S	.	.	I	π-helix	trans	-70.8	-24.9	-173.3	-157	177.4	68.6	0	0	114	I336 K337	I336-M341 PolarHBondContact O-N 3.46Å; K337-M341 HydrophobicContact CG-CE 4.28Å; K337-M341 PolarHBondContact O-N 2.99Å
342	E	70.6	Confident	77.5	Confident	140 Å²	140	55.1 Å²	55.1	65%	0.654	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-33.5	176.2	-64.1	-175.5	163.1	0	0	112.9	K337 Y340	K337-E342 PolarHBondContact O-N 2.76Å; Y340-E342 VanDerWaalsContact C-N 3.31Å; Y340-E342 PolarHBondContact O-N 3.33Å
343	L	69.7	Low	77.5	Confident	27 Å²	27	61 Å²	61	14%	0.141	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-33	-174.2	-61.8	178.8	0	0	0	113.9	D266 H269 L270 V339 K345	D266-L343 HydrophobicContact CB-CD2 3.64Å; D266-L343 VanDerWaalsContact CG-CD2 3.43Å; D266-L343 VanDerWaalsContact OD1-CD2 3.31Å; D266-L343 WeakPolarHBondContact OD1-CD2 3.5Å; H269-L343 HydrophobicContact CB-CD1 4.06Å; L270-L343 HydrophobicContact CB-CB 4.36Å; L270-L343 HydrophobicContact CB-CD1 4.33Å; L270-L343 HydrophobicContact CD1-CB 4.49Å; V339-L343 WeakPolarHBondContact O-CD1 3.44Å; L343-K345 PolarHBondContact O-N 3.34Å; L343-K345 VanDerWaalsContact O-N 3.13Å
344	E	68.7	Low	77.6	Confident	16 Å²	16	60.3 Å²	60.3	8%	0.075	31%	0.311	C	S	.	.			trans	-89.3	81.4	-170.3	-161.6	173.9	-178.8	0	0	112.9	Y340 G346 N348 W352	Y340-E344 WeakPolarHBondContact O-CB 3.31Å; Y340-E344 PolarHBondContact O-N 2.88Å; E344-G346 VanDerWaalsContact C-N 3.33Å; E344-G346 PolarHBondContact O-N 3.17Å; E344-N348 WeakPolarHBondContact OE1-CB 3.4Å; E344-N348 PolarHBondContact OE1-ND2 3.18Å; E344-W352 PolarHBondContact OE2-NE1 3.47Å
345	K	62.1	Low	77.8	Confident	158 Å²	158	55.4 Å²	55.4	69%	0.687	29%	0.289	S	S	*	.			trans	-73.8	74.9	-179.7	-65.4	156.4	-171.2	153.8	0	111.6	D266 L343	D266-K345 IonicContact OD2-NZ 2.71Å; D266-K345 PolarHBondContact OD2-NZ 2.89Å; L343-K345 PolarHBondContact O-N 3.34Å; L343-K345 VanDerWaalsContact O-N 3.13Å
346	G	66.1	Low	78	Confident	40 Å²	40	53.9 Å²	53.9	41%	0.412	28%	0.281	S	S	.	.	S	Bend	trans	-164.3	-171.2	-177	0	0	0	0	0	117.1	E344 N348 A349	E344-G346 VanDerWaalsContact C-N 3.33Å; E344-G346 PolarHBondContact O-N 3.17Å; G346-N348 PolarHBondContact O-N 3.46Å; G346-A349 VanDerWaalsContact O-CB 3.3Å; G346-A349 WeakPolarHBondContact O-CB 3.32Å; G346-A349 PolarHBondContact O-N 3.38Å
347	C	63.4	Low	78.2	Confident	110 Å²	110	56 Å²	56	74%	0.743	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.8	178.2	51	0	0	0	0	113.3	A349 E350	C347-A349 PolarHBondContact O-N 2.86Å; C347-A349 VanDerWaalsContact O-N 3.07Å; C347-E350 PolarHBondContact O-N 3.29Å
348	N	74.1	Confident	78.6	Confident	23 Å²	23	52.8 Å²	52.8	12%	0.123	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16	177.8	-55.9	-25.4	0	0	0	113	I296 E300 E344 G346 E350 Y351 W352	I296-N348 HydrophobicContact CD1-CB 4.4Å; I296-N348 HydrophobicContact CG2-CB 4.19Å; I296-N348 VanDerWaalsContact CG2-CG 3.5Å; I296-N348 VanDerWaalsContact CG2-ND2 3.27Å; I296-N348 WeakPolarHBondContact CG2-ND2 3.45Å; E300-N348 PolarHBondContact OE1-ND2 2.93Å; E344-N348 WeakPolarHBondContact OE1-CB 3.4Å; E344-N348 PolarHBondContact OE1-ND2 3.18Å; G346-N348 PolarHBondContact O-N 3.46Å; N348-E350 PolarHBondContact O-N 2.8Å; N348-E350 VanDerWaalsContact O-N 3.15Å; N348-Y351 WeakPolarHBondContact O-CB 3.33Å; N348-Y351 PolarHBondContact O-N 2.61Å; N348-W352 PolarHBondContact O-N 2.93Å; N348-W352 VanDerWaalsContact O-N 3.15Å
349	A	80.9	Confident	79.2	Confident	35 Å²	35	49 Å²	49	29%	0.289	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-17.8	174.4	0	0	0	0	0	114.3	G346 C347 R353	G346-A349 VanDerWaalsContact O-CB 3.3Å; G346-A349 WeakPolarHBondContact O-CB 3.32Å; G346-A349 PolarHBondContact O-N 3.38Å; C347-A349 PolarHBondContact O-N 2.86Å; C347-A349 VanDerWaalsContact O-N 3.07Å; A349-R353 WeakPolarHBondContact O-CG 3.32Å; A349-R353 PolarHBondContact O-NE 3.49Å; A349-R353 PolarHBondContact O-NH2 3.3Å
350	E	83.5	Confident	80	Confident	121 Å²	121	51.8 Å²	51.8	57%	0.565	27%	0.268	S	S	*	.	H	α-helix	trans	-76.8	-42.3	168.7	-74.7	-164.9	162.3	0	0	112.3	C347 N348 W352 R353 D354	C347-E350 PolarHBondContact O-N 3.29Å; N348-E350 PolarHBondContact O-N 2.8Å; N348-E350 VanDerWaalsContact O-N 3.15Å; E350-W352 PolarHBondContact O-N 3.04Å; E350-R353 PolarHBondContact O-N 3.29Å; E350-R353 IonicContact OE1-NH2 3.57Å; E350-D354 PolarHBondContact O-N 3.19Å
351	Y	87.6	Confident	80.7	Confident	19 Å²	19	52.3 Å²	52.3	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-58.9	-47.7	177.2	173.4	-92.8	0	0	0	111.8	L292 Y295 I296 P317 N348 R353 D354 I355 L449	L292-Y351 PolarHBondContact O-OH 2.67Å; Y295-Y351 AromaticContact CD1-CE2 3.47Å; Y295-Y351 HydrophobicContact CD1-CE2 3.47Å; Y295-Y351 VanDerWaalsContact CD1-CE2 3.47Å; Y295-Y351 AromaticContact CD1-CZ 3.55Å; Y295-Y351 WeakPolarHBondContact CD1-OH 3.44Å; Y295-Y351 HydrophobicContact CE1-CD2 4.45Å; Y295-Y351 AromaticContact CE1-CE2 3.61Å; Y295-Y351 HydrophobicContact CE1-CE2 3.61Å; I296-Y351 HydrophobicContact CD1-CD1 3.48Å; I296-Y351 VanDerWaalsContact CD1-CD1 3.48Å; I296-Y351 HydrophobicContact CD1-CE1 3.51Å; I296-Y351 HydrophobicContact CG1-CD1 3.78Å; I296-Y351 HydrophobicContact CG1-CE1 3.5Å; I296-Y351 VanDerWaalsContact CG1-CE1 3.5Å; P317-Y351 HydrophobicContact CB-CE2 4.23Å; P317-Y351 HydrophobicContact CG-CE2 3.99Å; N348-Y351 WeakPolarHBondContact O-CB 3.33Å; N348-Y351 PolarHBondContact O-N 2.61Å; Y351-R353 PolarHBondContact O-N 3.01Å; Y351-D354 PolarHBondContact O-N 3.2Å; Y351-I355 HydrophobicContact CD1-CD1 3.8Å; Y351-I355 HydrophobicContact CD2-CD1 4.4Å; Y351-I355 HydrophobicContact CE1-CD1 3.24Å; Y351-I355 HydrophobicContact CE1-CG1 4.44Å; Y351-I355 HydrophobicContact CE2-CD1 3.93Å; Y351-I355 HydrophobicContact CG-CD1 4.35Å; Y351-I355 WeakPolarHBondContact O-CG1 3.46Å; Y351-I355 PolarHBondContact O-N 3.13Å; Y351-L449 HydrophobicContact CD2-CD2 3.6Å; Y351-L449 HydrophobicContact CE2-CD2 3.95Å; Y351-L449 HydrophobicContact CG-CD2 4.36Å
352	W	88.2	Confident	81.3	Confident	2 Å²	2	50 Å²	50	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-34.9	177.6	-68.7	122.7	0	0	0	113.5	I289 L292 I296 I336 Y340 E344 N348 E350 I355 T356	I289-W352 HydrophobicContact CG1-CH2 4.26Å; I289-W352 HydrophobicContact CG1-CZ3 4.44Å; L292-W352 HydrophobicContact CB-CH2 4.3Å; L292-W352 HydrophobicContact CB-CZ3 4.22Å; I296-W352 HydrophobicContact CD1-CD2 4.21Å; I296-W352 HydrophobicContact CD1-CH2 4.17Å; I296-W352 HydrophobicContact CD1-CZ2 3.31Å; I296-W352 VanDerWaalsContact CD1-NE1 3.33Å; I336-W352 HydrophobicContact CD1-CE3 4.07Å; I336-W352 HydrophobicContact CD1-CZ3 4.06Å; I336-W352 HydrophobicContact CG1-CE3 3.88Å; I336-W352 HydrophobicContact CG1-CZ3 3.77Å; I336-W352 HydrophobicContact CG2-CB 4.38Å; I336-W352 HydrophobicContact CG2-CD2 4.41Å; I336-W352 HydrophobicContact CG2-CE3 3.93Å; Y340-W352 AromaticContact CD1-CE2 3.88Å; Y340-W352 HydrophobicContact CD1-CH2 4.4Å; Y340-W352 AromaticContact CD1-CZ2 3.47Å; Y340-W352 HydrophobicContact CD1-CZ2 3.47Å; Y340-W352 VanDerWaalsContact CD1-CZ2 3.47Å; Y340-W352 AromaticContact CD1-NE1 3.96Å; Y340-W352 HydrophobicContact CD2-CH2 4.09Å; Y340-W352 AromaticContact CD2-CZ2 3.88Å; Y340-W352 HydrophobicContact CD2-CZ2 3.88Å; Y340-W352 AromaticContact CE1-CZ2 3.91Å; Y340-W352 HydrophobicContact CE1-CZ2 3.91Å; Y340-W352 HydrophobicContact CE2-CH2 4.31Å; Y340-W352 HydrophobicContact CE2-CZ2 4.28Å; Y340-W352 AromaticContact CG-CE2 3.7Å; Y340-W352 HydrophobicContact CG-CH2 4.13Å; Y340-W352 AromaticContact CG-CZ2 3.46Å; Y340-W352 HydrophobicContact CG-CZ2 3.46Å; Y340-W352 VanDerWaalsContact CG-CZ2 3.46Å; Y340-W352 AromaticContact CG-NE1 3.97Å; E344-W352 PolarHBondContact OE2-NE1 3.47Å; N348-W352 PolarHBondContact O-N 2.93Å; N348-W352 VanDerWaalsContact O-N 3.15Å; E350-W352 PolarHBondContact O-N 3.04Å; W352-I355 HydrophobicContact CE3-CD1 4.36Å; W352-I355 HydrophobicContact CZ3-CD1 4.46Å; W352-T356 WeakPolarHBondContact O-CB 3.46Å; W352-T356 PolarHBondContact O-N 2.65Å; W352-T356 PolarHBondContact O-OG1 3.27Å
353	R	88.4	Confident	82	Confident	125 Å²	125	44 Å²	44	47%	0.472	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-42.7	174.8	-83.8	-179.1	-77.6	143.3	-10.1	112.2	A349 E350 Y351 T356 T357	A349-R353 WeakPolarHBondContact O-CG 3.32Å; A349-R353 PolarHBondContact O-NE 3.49Å; A349-R353 PolarHBondContact O-NH2 3.3Å; E350-R353 PolarHBondContact O-N 3.29Å; E350-R353 IonicContact OE1-NH2 3.57Å; Y351-R353 PolarHBondContact O-N 3.01Å; R353-T356 PolarHBondContact O-N 2.86Å; R353-T357 PolarHBondContact O-N 3.48Å; R353-T357 PolarHBondContact O-OG1 3.11Å
354	D	89.9	Confident	82.7	Confident	9 Å²	9	45.5 Å²	45.5	5%	0.048	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-41.6	175.8	-77.3	-29.8	0	0	0	111	E350 Y351 T357 V358 A445 R448 L449	E350-D354 PolarHBondContact O-N 3.19Å; Y351-D354 PolarHBondContact O-N 3.2Å; D354-T357 WeakPolarHBondContact O-CB 3.23Å; D354-T357 PolarHBondContact O-N 3.46Å; D354-V358 WeakPolarHBondContact O-CG2 3.45Å; D354-V358 PolarHBondContact O-N 3.13Å; D354-A445 HydrophobicContact CB-CB 3.84Å; D354-A445 WeakPolarHBondContact O-CB 3.35Å; D354-R448 WeakPolarHBondContact OD1-CD 3.42Å; D354-R448 IonicContact OD1-CZ 2.72Å; D354-R448 IonicContact OD1-NH1 2.65Å; D354-R448 PolarHBondContact OD1-NH1 2.66Å; D354-R448 WeakPolarHBondContact OD2-CB 3.41Å; D354-R448 WeakPolarHBondContact OD2-CD 3.23Å; D354-R448 IonicContact OD2-NH1 2.89Å; D354-L449 HydrophobicContact CB-CD1 4.21Å; D354-L449 HydrophobicContact CB-CD2 4.08Å; D354-L449 HydrophobicContact CB-CG 3.92Å
355	I	89.6	Confident	83.4	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-48.2	173	-74.6	178.4	0	0	0	111.3	L292 I336 Y351 W352 T357 V358 V359 L449	L292-I355 HydrophobicContact CD1-CD1 4.33Å; L292-I355 HydrophobicContact CD1-CG2 4.3Å; L292-I355 HydrophobicContact CD2-CD1 3.97Å; I336-I355 HydrophobicContact CD1-CG2 3.62Å; Y351-I355 HydrophobicContact CD1-CD1 3.8Å; Y351-I355 HydrophobicContact CD2-CD1 4.4Å; Y351-I355 HydrophobicContact CE1-CD1 3.24Å; Y351-I355 HydrophobicContact CE1-CG1 4.44Å; Y351-I355 HydrophobicContact CE2-CD1 3.93Å; Y351-I355 HydrophobicContact CG-CD1 4.35Å; Y351-I355 WeakPolarHBondContact O-CG1 3.46Å; Y351-I355 PolarHBondContact O-N 3.13Å; W352-I355 HydrophobicContact CE3-CD1 4.36Å; W352-I355 HydrophobicContact CZ3-CD1 4.46Å; I355-T357 PolarHBondContact O-N 2.89Å; I355-V358 CarbonylContact O-C 3.53Å; I355-V358 WeakPolarHBondContact O-CA 3.49Å; I355-V358 PolarHBondContact O-N 3.3Å; I355-V359 HydrophobicContact CG2-CG2 3.96Å; I355-V359 WeakPolarHBondContact O-CG2 3.42Å; I355-V359 PolarHBondContact O-N 3.21Å; I355-L449 HydrophobicContact CG1-CD1 3.96Å; I355-L449 HydrophobicContact CG1-CD2 4.05Å
356	T	90.6	Very high	84.4	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-55.6	-43.3	178.2	-56.1	0	0	0	0	110.5	W352 R353 V358 V359 E360	W352-T356 WeakPolarHBondContact O-CB 3.46Å; W352-T356 PolarHBondContact O-N 2.65Å; W352-T356 PolarHBondContact O-OG1 3.27Å; R353-T356 PolarHBondContact O-N 2.86Å; T356-V358 VanDerWaalsContact C-N 3.3Å; T356-V358 PolarHBondContact O-N 2.84Å; T356-V359 PolarHBondContact O-N 3.11Å; T356-E360 HydrophobicContact CG2-CG 4.48Å; T356-E360 WeakPolarHBondContact O-CB 3.34Å; T356-E360 WeakPolarHBondContact O-CG 3.28Å; T356-E360 PolarHBondContact O-N 3.41Å
357	T	90.4	Very high	85.2	Confident	45 Å²	45	45.8 Å²	45.8	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-32.6	176.2	-52.2	0	0	0	0	112.9	R353 D354 I355 D361 R441 A445	R353-T357 PolarHBondContact O-N 3.48Å; R353-T357 PolarHBondContact O-OG1 3.11Å; D354-T357 WeakPolarHBondContact O-CB 3.23Å; D354-T357 PolarHBondContact O-N 3.46Å; I355-T357 PolarHBondContact O-N 2.89Å; T357-D361 WeakPolarHBondContact O-CB 3.18Å; T357-D361 PolarHBondContact O-N 3.32Å; T357-R441 HydrophobicContact CG2-CB 4.27Å; T357-A445 HydrophobicContact CG2-CB 4.15Å
358	V	90.5	Very high	85.8	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-79	-39.3	176.8	174.9	0	0	0	0	112.1	T318 L321 D354 I355 T356 D361 E362 A445 R446 L449	T318-V358 HydrophobicContact CG2-CG1 4.41Å; L321-V358 HydrophobicContact CD1-CB 4.31Å; L321-V358 HydrophobicContact CD1-CG1 3.63Å; D354-V358 WeakPolarHBondContact O-CG2 3.45Å; D354-V358 PolarHBondContact O-N 3.13Å; I355-V358 CarbonylContact O-C 3.53Å; I355-V358 WeakPolarHBondContact O-CA 3.49Å; I355-V358 PolarHBondContact O-N 3.3Å; T356-V358 VanDerWaalsContact C-N 3.3Å; T356-V358 PolarHBondContact O-N 2.84Å; V358-D361 PolarHBondContact O-N 3.05Å; V358-E362 PolarHBondContact O-N 2.9Å; V358-A445 HydrophobicContact CG2-CB 3.86Å; V358-R446 HydrophobicContact CG1-CG 4.32Å; V358-R446 HydrophobicContact CG2-CG 3.68Å; V358-L449 HydrophobicContact CG2-CD1 4.13Å
359	V	89.8	Confident	85.9	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-46.3	174.5	172.2	0	0	0	0	110.1	L321 L329 L332 L333 I355 T356 D361 E362 L363	L321-V359 HydrophobicContact CD1-CG2 3.96Å; L321-V359 HydrophobicContact CD2-CG2 3.95Å; L329-V359 HydrophobicContact CB-CG1 4.35Å; L329-V359 HydrophobicContact CD2-CG1 4.08Å; L332-V359 HydrophobicContact CD2-CG2 3.76Å; L332-V359 HydrophobicContact CG-CG2 4.39Å; L333-V359 HydrophobicContact CB-CG1 4.1Å; L333-V359 HydrophobicContact CD1-CG1 4.2Å; I355-V359 HydrophobicContact CG2-CG2 3.96Å; I355-V359 WeakPolarHBondContact O-CG2 3.42Å; I355-V359 PolarHBondContact O-N 3.21Å; T356-V359 PolarHBondContact O-N 3.11Å; V359-D361 VanDerWaalsContact C-N 3.33Å; V359-D361 PolarHBondContact O-N 3.31Å; V359-E362 PolarHBondContact O-N 3Å; V359-L363 VanDerWaalsContact O-CB 3.24Å; V359-L363 WeakPolarHBondContact O-CB 3.42Å; V359-L363 PolarHBondContact O-N 2.94Å
360	E	89.8	Confident	85.7	Confident	92 Å²	92	50.6 Å²	50.6	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-57.8	-42.4	173.9	-76.4	-178.2	174.7	0	0	112.2	L333 T356 N364	L333-E360 HydrophobicContact CD1-CG 3.74Å; T356-E360 HydrophobicContact CG2-CG 4.48Å; T356-E360 WeakPolarHBondContact O-CB 3.34Å; T356-E360 WeakPolarHBondContact O-CG 3.28Å; T356-E360 PolarHBondContact O-N 3.41Å; E360-N364 VanDerWaalsContact O-CB 3.26Å; E360-N364 WeakPolarHBondContact O-CB 3.37Å; E360-N364 PolarHBondContact O-N 3.06Å; E360-N364 PolarHBondContact O-ND2 3.21Å
361	D	87.8	Confident	84.9	Confident	17 Å²	17	50.5 Å²	50.5	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-68.5	-37.2	177.8	175	63.9	0	0	0	112.9	T357 V358 V359 K365 A442 R446	T357-D361 WeakPolarHBondContact O-CB 3.18Å; T357-D361 PolarHBondContact O-N 3.32Å; V358-D361 PolarHBondContact O-N 3.05Å; V359-D361 VanDerWaalsContact C-N 3.33Å; V359-D361 PolarHBondContact O-N 3.31Å; D361-K365 VanDerWaalsContact CG-CE 3.42Å; D361-K365 WeakPolarHBondContact O-CE 3.18Å; D361-K365 WeakPolarHBondContact O-CG 3.16Å; D361-K365 PolarHBondContact O-N 2.92Å; D361-K365 VanDerWaalsContact O-N 3.08Å; D361-K365 WeakPolarHBondContact OD1-CE 2.74Å; D361-K365 WeakPolarHBondContact OD2-CE 3.41Å; D361-K365 IonicContact OD2-NZ 3.07Å; D361-K365 PolarHBondContact OD2-NZ 3.45Å; D361-A442 HydrophobicContact CB-CB 3.41Å; D361-A442 VanDerWaalsContact CB-CB 3.41Å; D361-A442 WeakPolarHBondContact OD2-CB 3.45Å; D361-R446 IonicContact OD2-CZ 3.31Å; D361-R446 IonicContact OD2-NH1 3.56Å; D361-R446 PolarHBondContact OD2-NH1 3.26Å; D361-R446 IonicContact OD2-NH2 3.94Å; D361-R446 PolarHBondContact OD2-NH2 2.84Å
362	E	86.3	Confident	83.8	Confident	53 Å²	53	54 Å²	54	25%	0.248	25%	0.252	C	S	.	.	H	α-helix	trans	-71.5	-43.4	176.7	-143.5	61.4	-134	0	0	111.9	V358 V359 N364 K365 L366 R446	V358-E362 PolarHBondContact O-N 2.9Å; V359-E362 PolarHBondContact O-N 3Å; E362-N364 VanDerWaalsContact C-N 3.32Å; E362-N364 PolarHBondContact O-N 3.49Å; E362-K365 WeakPolarHBondContact O-CB 3.3Å; E362-K365 PolarHBondContact O-N 3.28Å; E362-K365 WeakPolarHBondContact OE1-CD 3.3Å; E362-K365 IonicContact OE1-NZ 3.87Å; E362-K365 PolarHBondContact OE1-NZ 2.93Å; E362-K365 IonicContact OE2-NZ 3.89Å; E362-K365 PolarHBondContact OE2-NZ 3.24Å; E362-L366 PolarHBondContact O-N 2.94Å; E362-R446 IonicContact OE2-NH2 3.1Å; E362-R446 PolarHBondContact OE2-NH2 3.27Å
363	L	86	Confident	82.6	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-42.2	171.9	178.6	159.8	0	0	0	111.4	E330 V359 K365 L366 R367	E330-L363 HydrophobicContact CG-CD1 3.55Å; V359-L363 VanDerWaalsContact O-CB 3.24Å; V359-L363 WeakPolarHBondContact O-CB 3.42Å; V359-L363 PolarHBondContact O-N 2.94Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 3.42Å; L363-L366 PolarHBondContact O-N 2.98Å; L363-R367 HydrophobicContact CD2-CG 4.39Å; L363-R367 WeakPolarHBondContact O-CG 3.31Å; L363-R367 PolarHBondContact O-N 3.44Å
364	N	84.2	Confident	80.7	Confident	59 Å²	59	54.6 Å²	54.6	32%	0.316	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-32.6	174.2	-88.4	-74.5	0	0	0	112.9	E360 E362 R368	E360-N364 VanDerWaalsContact O-CB 3.26Å; E360-N364 WeakPolarHBondContact O-CB 3.37Å; E360-N364 PolarHBondContact O-N 3.06Å; E360-N364 PolarHBondContact O-ND2 3.21Å; E362-N364 VanDerWaalsContact C-N 3.32Å; E362-N364 PolarHBondContact O-N 3.49Å; N364-R368 WeakPolarHBondContact O-CB 3.33Å; N364-R368 WeakPolarHBondContact O-CD 3.34Å; N364-R368 WeakPolarHBondContact O-CG 3.23Å; N364-R368 PolarHBondContact O-N 3.29Å
365	K	82.4	Confident	78.9	Confident	57 Å²	57	60.1 Å²	60.1	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-70.8	-45.6	172.6	-70	165.8	-144.1	160.5	0	111.7	D361 E362 L363 R368 L369	D361-K365 VanDerWaalsContact CG-CE 3.42Å; D361-K365 WeakPolarHBondContact O-CE 3.18Å; D361-K365 WeakPolarHBondContact O-CG 3.16Å; D361-K365 PolarHBondContact O-N 2.92Å; D361-K365 VanDerWaalsContact O-N 3.08Å; D361-K365 WeakPolarHBondContact OD1-CE 2.74Å; D361-K365 WeakPolarHBondContact OD2-CE 3.41Å; D361-K365 IonicContact OD2-NZ 3.07Å; D361-K365 PolarHBondContact OD2-NZ 3.45Å; E362-K365 WeakPolarHBondContact O-CB 3.3Å; E362-K365 PolarHBondContact O-N 3.28Å; E362-K365 WeakPolarHBondContact OE1-CD 3.3Å; E362-K365 IonicContact OE1-NZ 3.87Å; E362-K365 PolarHBondContact OE1-NZ 2.93Å; E362-K365 IonicContact OE2-NZ 3.89Å; E362-K365 PolarHBondContact OE2-NZ 3.24Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 3.42Å; K365-R368 PolarHBondContact O-N 3.11Å; K365-L369 WeakPolarHBondContact O-CG 3.22Å; K365-L369 PolarHBondContact O-N 2.83Å
366	L	83.7	Confident	76.8	Confident	50 Å²	50	64 Å²	64	26%	0.262	35%	0.351	S	S	.	.	H	α-helix	trans	-62.7	-46.1	-178.8	-69.8	174.1	0	0	0	111.4	I326 L329 E362 L363 R368 L369 E370	I326-L366 HydrophobicContact CD1-CB 4.16Å; I326-L366 HydrophobicContact CG1-CB 3.81Å; I326-L366 HydrophobicContact CG1-CD1 4.17Å; L329-L366 HydrophobicContact CD1-CD1 3.47Å; L329-L366 VanDerWaalsContact CD1-CD1 3.47Å; E362-L366 PolarHBondContact O-N 2.94Å; L363-L366 PolarHBondContact O-N 2.98Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.04Å; L366-L369 WeakPolarHBondContact O-CB 3.44Å; L366-L369 PolarHBondContact O-N 3.08Å; L366-L369 VanDerWaalsContact O-N 3.09Å; L366-E370 PolarHBondContact O-N 3.44Å
367	R	82.7	Confident	74.5	Confident	114 Å²	114	66.8 Å²	66.8	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-59.6	-41.1	173.6	-70.7	-177.2	178.5	178.9	-3.4	112.3	I326 E330 L363 L369 E370 E371	I326-R367 HydrophobicContact CD1-CG 4.49Å; E330-R367 IonicContact OE1-CZ 3.85Å; E330-R367 IonicContact OE1-NE 3.24Å; E330-R367 PolarHBondContact OE1-NE 3.39Å; E330-R367 IonicContact OE1-NH2 3.17Å; E330-R367 PolarHBondContact OE1-NH2 2.92Å; E330-R367 IonicContact OE2-NH2 3.2Å; L363-R367 HydrophobicContact CD2-CG 4.39Å; L363-R367 WeakPolarHBondContact O-CG 3.31Å; L363-R367 PolarHBondContact O-N 3.44Å; R367-L369 VanDerWaalsContact C-N 3.33Å; R367-L369 PolarHBondContact O-N 3.48Å; R367-E370 PolarHBondContact O-N 3.42Å; R367-E371 WeakPolarHBondContact O-CG 3.2Å; R367-E371 PolarHBondContact O-N 3.36Å
368	R	76.4	Confident	72.3	Confident	70 Å²	70	69 Å²	69	26%	0.264	41%	0.406	S	S	.	.	H	α-helix	trans	-66.9	-30.5	174.4	-72.3	171.8	-165.5	174.1	10.3	113.2	N364 K365 L366 N372	N364-R368 WeakPolarHBondContact O-CB 3.33Å; N364-R368 WeakPolarHBondContact O-CD 3.34Å; N364-R368 WeakPolarHBondContact O-CG 3.23Å; N364-R368 PolarHBondContact O-N 3.29Å; K365-R368 PolarHBondContact O-N 3.11Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.04Å; R368-N372 WeakPolarHBondContact O-CB 3.48Å; R368-N372 PolarHBondContact O-N 2.77Å; R368-N372 VanDerWaalsContact O-N 3.11Å
369	L	75.6	Confident	69.7	Low	87 Å²	87	74.9 Å²	74.9	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-73	-38.9	173.9	-73.8	167.4	0	0	0	111.4	K365 L366 R367 N372 S373	K365-L369 WeakPolarHBondContact O-CG 3.22Å; K365-L369 PolarHBondContact O-N 2.83Å; L366-L369 WeakPolarHBondContact O-CB 3.44Å; L366-L369 PolarHBondContact O-N 3.08Å; L366-L369 VanDerWaalsContact O-N 3.09Å; R367-L369 VanDerWaalsContact C-N 3.33Å; R367-L369 PolarHBondContact O-N 3.48Å; L369-N372 PolarHBondContact O-N 3.15Å; L369-S373 VanDerWaalsContact O-CB 3.28Å; L369-S373 WeakPolarHBondContact O-CB 3.42Å; L369-S373 PolarHBondContact O-N 2.97Å
370	E	76.4	Confident	67.2	Low	111 Å²	111	78.3 Å²	78.3	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-47.5	173	-175.4	179.8	-156.3	0	0	111.7	L366 R367 N372 S373 G374	L366-E370 PolarHBondContact O-N 3.44Å; R367-E370 PolarHBondContact O-N 3.42Å; E370-N372 VanDerWaalsContact C-N 3.31Å; E370-N372 PolarHBondContact O-N 2.84Å; E370-S373 PolarHBondContact O-N 2.92Å; E370-G374 PolarHBondContact O-N 3.01Å
371	E	67.6	Low	64.7	Low	119 Å²	119	78.6 Å²	78.6	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-56.7	-43.5	174	-74.7	-174.4	139.8	0	0	111.9	R367 S373	R367-E371 WeakPolarHBondContact O-CG 3.2Å; R367-E371 PolarHBondContact O-N 3.36Å; E371-S373 VanDerWaalsContact C-N 3.33Å; E371-S373 PolarHBondContact O-N 3.34Å
372	N	64.3	Low	62.6	Low	93 Å²	93	85.4 Å²	85.4	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-71.3	-23.2	175	-81.6	0.9	0	0	0	113.7	R368 L369 E370 G374	R368-N372 WeakPolarHBondContact O-CB 3.48Å; R368-N372 PolarHBondContact O-N 2.77Å; R368-N372 VanDerWaalsContact O-N 3.11Å; L369-N372 PolarHBondContact O-N 3.15Å; E370-N372 VanDerWaalsContact C-N 3.31Å; E370-N372 PolarHBondContact O-N 2.84Å; N372-G374 VanDerWaalsContact C-N 3.32Å
373	S	61.5	Low	60.4	Low	83 Å²	83	88.6 Å²	88.6	58%	0.58	56%	0.559	S	S	*	*	H	α-helix	trans	-81.5	-8.7	-178.5	-168.1	0	0	0	0	113.7	L369 E370 E371 V375	L369-S373 VanDerWaalsContact O-CB 3.28Å; L369-S373 WeakPolarHBondContact O-CB 3.42Å; L369-S373 PolarHBondContact O-N 2.97Å; E370-S373 PolarHBondContact O-N 2.92Å; E371-S373 VanDerWaalsContact C-N 3.33Å; E371-S373 PolarHBondContact O-N 3.34Å; S373-V375 VanDerWaalsContact C-N 3.28Å; S373-V375 PolarHBondContact O-N 3.5Å; S373-V375 VanDerWaalsContact O-N 3.07Å
374	G	50.1	Low	58	Low	57 Å²	57	100.1 Å²	100.1	59%	0.588	60%	0.601	S	S	*	*			trans	72.8	-1.3	161.4	0	0	0	0	0	117.9	E370 N372 A376	E370-G374 PolarHBondContact O-N 3.01Å; N372-G374 VanDerWaalsContact C-N 3.32Å; G374-A376 PolarHBondContact O-N 2.73Å
375	V	52	Low	55.8	Low	125 Å²	125	101 Å²	101	76%	0.758	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-70.5	-30.1	-176.1	-176.4	0	0	0	0	112.6	S373 G377	S373-V375 VanDerWaalsContact C-N 3.28Å; S373-V375 PolarHBondContact O-N 3.5Å; S373-V375 VanDerWaalsContact O-N 3.07Å; V375-G377 PolarHBondContact O-N 3.47Å; V375-G377 VanDerWaalsContact O-N 3.13Å
376	A	44	Very low	53.8	Low	82 Å²	82	107.9 Å²	107.9	68%	0.678	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-71.5	-1.3	-179.2	0	0	0	0	0	115.1	G374 A378	G374-A376 PolarHBondContact O-N 2.73Å; A376-A378 VanDerWaalsContact C-N 3.27Å; A376-A378 PolarHBondContact O-N 2.83Å
377	G	42.8	Very low	51.6	Low	74 Å²	74	111.3 Å²	111.3	76%	0.763	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-73.7	-1.2	-173	0	0	0	0	0	116.9	V375	V375-G377 PolarHBondContact O-N 3.47Å; V375-G377 VanDerWaalsContact O-N 3.13Å
378	A	45.3	Very low	49.6	Very low	92 Å²	92	111 Å²	111	76%	0.76	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-86.5	-17.8	-166.4	0	0	0	0	0	116.1	A376	A376-A378 VanDerWaalsContact C-N 3.27Å; A376-A378 PolarHBondContact O-N 2.83Å
379	C	34.4	Very low	48.4	Very low	126 Å²	126	109.9 Å²	109.9	85%	0.851	70%	0.697	S	S	*	*	S	Bend	trans	-141.5	96.7	-178	-74.6	0	0	0	0	112
380	G	38	Very low	47.5	Very low	72 Å²	72	111.4 Å²	111.4	74%	0.742	71%	0.71	S	S	*	*			trans	158.2	47.7	177.3	0	0	0	0	0	115.3	D382	G380-D382 PolarHBondContact O-N 3.49Å
381	A	36.9	Very low	47.1	Very low	97 Å²	97	107.5 Å²	107.5	80%	0.802	69%	0.692	S	S	*	*			trans	-81.2	71.9	-174.6	0	0	0	0	0	113.6
382	D	43.6	Very low	47.3	Very low	161 Å²	161	105.4 Å²	105.4	86%	0.861	69%	0.691	S	S	*	*			trans	-143.1	53.4	170.7	-101.5	-43.5	0	0	0	112.2	G380 R384	G380-D382 PolarHBondContact O-N 3.49Å; D382-R384 PolarHBondContact O-N 2.76Å
383	T	40.2	Very low	47.9	Very low	120 Å²	120	105.5 Å²	105.5	74%	0.736	69%	0.689	S	S	*	*			trans	-81.3	95.6	-169.1	-11.5	0	0	0	0	113.3
384	R	35.6	Very low	48.8	Very low	254 Å²	254	105.2 Å²	105.2	96%	0.958	69%	0.687	S	S	*	*	S	Bend	trans	-135.4	19.6	173.8	-74.3	-164.3	172.8	-169	-1.2	117.2	D382	D382-R384 PolarHBondContact O-N 2.76Å
385	G	38.2	Very low	50.2	Low	76 Å²	76	105.2 Å²	105.2	78%	0.784	68%	0.675	S	S	*	*	S	Bend	trans	-153.6	-3.2	177	0	0	0	0	0	118.1	S387	G385-S387 PolarHBondContact O-N 3.28Å
386	R	41.4	Very low	51.5	Low	203 Å²	203	102.2 Å²	102.2	77%	0.766	65%	0.653	S	S	*	*			trans	-98.5	79.7	-172.3	-172.6	-178.2	-84.4	-163.5	-7.5	111.1
387	S	36.9	Very low	53.3	Low	122 Å²	122	103.4 Å²	103.4	85%	0.853	65%	0.645	S	S	*	*			trans	-149.2	18.3	-178.8	-54.2	0	0	0	0	114.8	G385	G385-S387 PolarHBondContact O-N 3.28Å
388	S	39.8	Very low	55.3	Low	108 Å²	108	103 Å²	103	76%	0.755	63%	0.63	S	S	*	*	S	Bend	trans	-100.3	108	177.1	-161.3	0	0	0	0	111
389	A	50.7	Low	57.2	Low	46 Å²	46	99.6 Å²	99.6	38%	0.38	60%	0.6	S	S	.	*			trans	66.3	60	154.9	0	0	0	0	0	121.1	I391 T431	A389-I391 PolarHBondContact O-N 2.86Å; A389-T431 HydrophobicContact CB-CG2 3.54Å; A389-T431 WeakPolarHBondContact CB-OG1 3.26Å
390	T	57.3	Low	59.5	Low	118 Å²	118	94.5 Å²	94.5	72%	0.724	57%	0.567	S	S	*	*			trans	-80	104	153.9	-47.6	0	0	0	0	109.6
391	I	68	Low	61.7	Low	29 Å²	29	96.9 Å²	96.9	15%	0.149	56%	0.559	C	S	.	*			trans	-76.8	139.1	178.9	-67.6	158.9	0	0	0	110.4	A389 Q393 V395 M396 T435	A389-I391 PolarHBondContact O-N 2.86Å; I391-Q393 PolarHBondContact O-N 2.92Å; I391-V395 HydrophobicContact CG2-CB 4.14Å; I391-V395 HydrophobicContact CG2-CG1 4.21Å; I391-M396 HydrophobicContact CG2-CG 4.18Å; I391-T435 HydrophobicContact CD1-CG2 3.96Å; I391-T435 WeakPolarHBondContact CD1-OG1 3.42Å
392	S	71.9	Confident	64	Low	75 Å²	75	96 Å²	96	52%	0.524	54%	0.543	S	S	.	.			trans	-54.7	130	-179	-57.5	0	0	0	0	112.6	S394 V395 M396	S392-S394 PolarHBondContact O-N 3.03Å; S392-S394 VanDerWaalsContact O-N 3.14Å; S392-V395 WeakPolarHBondContact O-CB 3.37Å; S392-V395 PolarHBondContact O-N 3.44Å; S392-M396 PolarHBondContact O-N 3.46Å
393	Q	76.3	Confident	65.9	Low	96 Å²	96	88.5 Å²	88.5	45%	0.449	50%	0.503	S	S	.	.	H	α-helix	trans	-56	-34.2	-178.5	-168.7	179.6	17.2	0	0	113.1	I391 V395 M396 Q397	I391-Q393 PolarHBondContact O-N 2.92Å; Q393-V395 PolarHBondContact O-N 3.42Å; Q393-M396 PolarHBondContact O-N 2.88Å; Q393-Q397 WeakPolarHBondContact O-CB 3.22Å; Q393-Q397 WeakPolarHBondContact O-CG 3.41Å; Q393-Q397 PolarHBondContact O-N 2.97Å
394	S	80.5	Confident	67.8	Low	77 Å²	77	89.3 Å²	89.3	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-36.9	174.3	50.3	0	0	0	0	113.6	S392 S398	S392-S394 PolarHBondContact O-N 3.03Å; S392-S394 VanDerWaalsContact O-N 3.14Å; S394-S398 WeakPolarHBondContact O-CB 3.09Å; S394-S398 PolarHBondContact O-N 3.29Å
395	V	80.6	Confident	70	Confident	57 Å²	57	80.9 Å²	80.9	35%	0.345	49%	0.488	S	S	.	.	H	α-helix	trans	-68.5	-43.4	175	178	0	0	0	0	109.7	I391 S392 Q393 Q397 S398 V399 Y432	I391-V395 HydrophobicContact CG2-CB 4.14Å; I391-V395 HydrophobicContact CG2-CG1 4.21Å; S392-V395 WeakPolarHBondContact O-CB 3.37Å; S392-V395 PolarHBondContact O-N 3.44Å; Q393-V395 PolarHBondContact O-N 3.42Å; V395-Q397 PolarHBondContact O-N 2.95Å; V395-S398 PolarHBondContact O-N 3.03Å; V395-V399 HydrophobicContact CG1-CG2 4.39Å; V395-V399 WeakPolarHBondContact O-CB 3.38Å; V395-V399 VanDerWaalsContact O-CG2 3.28Å; V395-V399 WeakPolarHBondContact O-CG2 3.47Å; V395-V399 PolarHBondContact O-N 3.04Å; V395-Y432 HydrophobicContact CG1-CE2 3.94Å
396	M	78.2	Confident	72.3	Confident	61 Å²	61	80 Å²	80	30%	0.3	46%	0.463	S	S	.	.	H	α-helix	trans	-63.5	-39.9	175.7	-65.3	-169	-71.4	0	0	112.5	I391 S392 Q393 A400	I391-M396 HydrophobicContact CG2-CG 4.18Å; S392-M396 PolarHBondContact O-N 3.46Å; Q393-M396 PolarHBondContact O-N 2.88Å; M396-A400 WeakPolarHBondContact O-CB 3.29Å; M396-A400 PolarHBondContact O-N 3.25Å
397	Q	83.2	Confident	74.6	Confident	108 Å²	108	74 Å²	74	51%	0.505	45%	0.449	S	S	.	.	H	α-helix	trans	-62.7	-47.2	174.6	-75.8	169.7	-10	0	0	111.9	Q393 V395 A400 E401	Q393-Q397 WeakPolarHBondContact O-CB 3.22Å; Q393-Q397 WeakPolarHBondContact O-CG 3.41Å; Q393-Q397 PolarHBondContact O-N 2.97Å; V395-Q397 PolarHBondContact O-N 2.95Å; Q397-A400 WeakPolarHBondContact O-CB 3.46Å; Q397-A400 PolarHBondContact O-N 3.02Å; Q397-E401 WeakPolarHBondContact O-CG 3.4Å; Q397-E401 PolarHBondContact O-N 2.77Å
398	S	85.5	Confident	77.1	Confident	64 Å²	64	71.6 Å²	71.6	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-43.6	176.8	-174.1	0	0	0	0	112	S394 V395 A400 E401 T402	S394-S398 WeakPolarHBondContact O-CB 3.09Å; S394-S398 PolarHBondContact O-N 3.29Å; V395-S398 PolarHBondContact O-N 3.03Å; S398-A400 VanDerWaalsContact C-N 3.32Å; S398-A400 PolarHBondContact O-N 2.66Å; S398-E401 PolarHBondContact O-N 2.86Å; S398-E401 VanDerWaalsContact O-N 3.12Å; S398-T402 WeakPolarHBondContact O-CG2 3.36Å; S398-T402 PolarHBondContact O-N 3.12Å
399	V	83.9	Confident	79.5	Confident	22 Å²	22	72.5 Å²	72.5	13%	0.133	42%	0.418	C	S	.	.	H	α-helix	trans	-55.2	-48.4	172.9	162.8	0	0	0	0	110.6	V395 E401 T402 L403 L436 F439	V395-V399 HydrophobicContact CG1-CG2 4.39Å; V395-V399 WeakPolarHBondContact O-CB 3.38Å; V395-V399 VanDerWaalsContact O-CG2 3.28Å; V395-V399 WeakPolarHBondContact O-CG2 3.47Å; V395-V399 PolarHBondContact O-N 3.04Å; V399-E401 VanDerWaalsContact C-N 3.34Å; V399-E401 PolarHBondContact O-N 3.04Å; V399-T402 PolarHBondContact O-N 2.83Å; V399-T402 PolarHBondContact O-OG1 3.25Å; V399-L403 HydrophobicContact CG1-CD1 3.69Å; V399-L403 WeakPolarHBondContact O-CB 3.42Å; V399-L403 WeakPolarHBondContact O-CD1 3.42Å; V399-L403 VanDerWaalsContact O-CG 3.3Å; V399-L403 WeakPolarHBondContact O-CG 3.31Å; V399-L403 PolarHBondContact O-N 3Å; V399-L403 VanDerWaalsContact O-N 3.17Å; V399-L436 HydrophobicContact CG1-CD1 3.5Å; V399-L436 VanDerWaalsContact CG1-CD1 3.5Å; V399-L436 HydrophobicContact CG2-CD1 4.37Å; V399-F439 HydrophobicContact CG1-CD1 4.12Å
400	A	82.7	Confident	81.5	Confident	18 Å²	18	75 Å²	75	15%	0.149	42%	0.422	C	S	.	.	H	α-helix	trans	-59	-42.9	175.9	0	0	0	0	0	112.3	M396 Q397 S398 L403 K404 F439	M396-A400 WeakPolarHBondContact O-CB 3.29Å; M396-A400 PolarHBondContact O-N 3.25Å; Q397-A400 WeakPolarHBondContact O-CB 3.46Å; Q397-A400 PolarHBondContact O-N 3.02Å; S398-A400 VanDerWaalsContact C-N 3.32Å; S398-A400 PolarHBondContact O-N 2.66Å; A400-L403 PolarHBondContact O-N 3.19Å; A400-L403 VanDerWaalsContact O-N 3.16Å; A400-K404 WeakPolarHBondContact O-CG 3.19Å; A400-K404 PolarHBondContact O-N 3.35Å; A400-F439 HydrophobicContact CB-CE1 4.07Å; A400-F439 HydrophobicContact CB-CE2 4.13Å; A400-F439 HydrophobicContact CB-CZ 3.45Å; A400-F439 VanDerWaalsContact CB-CZ 3.45Å
401	E	84.6	Confident	83	Confident	122 Å²	122	69.4 Å²	69.4	57%	0.57	39%	0.387	S	S	*	.	H	α-helix	trans	-63.7	-41.8	175.9	-74.2	171.6	177.4	0	0	113.2	Q397 S398 V399 L403	Q397-E401 WeakPolarHBondContact O-CG 3.4Å; Q397-E401 PolarHBondContact O-N 2.77Å; S398-E401 PolarHBondContact O-N 2.86Å; S398-E401 VanDerWaalsContact O-N 3.12Å; V399-E401 VanDerWaalsContact C-N 3.34Å; V399-E401 PolarHBondContact O-N 3.04Å; E401-L403 PolarHBondContact O-N 2.96Å
402	T	84.7	Confident	84.1	Confident	78 Å²	78	68.8 Å²	68.8	48%	0.479	39%	0.386	S	S	.	.	H	α-helix	trans	-68	-13.6	174.4	70.9	0	0	0	0	113.8	S398 V399 K406	S398-T402 WeakPolarHBondContact O-CG2 3.36Å; S398-T402 PolarHBondContact O-N 3.12Å; V399-T402 PolarHBondContact O-N 2.83Å; V399-T402 PolarHBondContact O-OG1 3.25Å; T402-K406 WeakPolarHBondContact O-CD 3.49Å; T402-K406 WeakPolarHBondContact O-CE 3.49Å; T402-K406 PolarHBondContact O-NZ 2.88Å
403	L	83.2	Confident	85.1	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-106.6	-20	-177.2	-68.4	169.1	0	0	0	113	V399 A400 E401 G405 K406 L411 L414 L436 F439 V440 Q443	V399-L403 HydrophobicContact CG1-CD1 3.69Å; V399-L403 WeakPolarHBondContact O-CB 3.42Å; V399-L403 WeakPolarHBondContact O-CD1 3.42Å; V399-L403 VanDerWaalsContact O-CG 3.3Å; V399-L403 WeakPolarHBondContact O-CG 3.31Å; V399-L403 PolarHBondContact O-N 3Å; V399-L403 VanDerWaalsContact O-N 3.17Å; A400-L403 PolarHBondContact O-N 3.19Å; A400-L403 VanDerWaalsContact O-N 3.16Å; E401-L403 PolarHBondContact O-N 2.96Å; L403-G405 PolarHBondContact O-N 3.18Å; L403-K406 HydrophobicContact CD2-CD 3.99Å; L403-K406 PolarHBondContact O-N 2.76Å; L403-L411 HydrophobicContact CD2-CD2 3.76Å; L403-L414 HydrophobicContact CD2-CD1 3.88Å; L403-L436 HydrophobicContact CD1-CD1 4.31Å; L403-F439 HydrophobicContact CB-CE1 4.12Å; L403-F439 HydrophobicContact CD1-CD1 3.41Å; L403-F439 VanDerWaalsContact CD1-CD1 3.41Å; L403-F439 HydrophobicContact CD1-CE1 3.62Å; L403-V440 HydrophobicContact CD1-CG2 4.02Å; L403-V440 HydrophobicContact CD2-CG2 4.23Å; L403-Q443 HydrophobicContact CB-CG 4.34Å
404	K	80.3	Confident	85.7	Confident	138 Å²	138	64.7 Å²	64.7	60%	0.6	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	124.4	165.9	-73.5	166.6	-162.1	168.5	0	109.6	A400	A400-K404 WeakPolarHBondContact O-CG 3.19Å; A400-K404 PolarHBondContact O-N 3.35Å
405	G	82.1	Confident	86.1	Confident	76 Å²	76	64.4 Å²	64.4	78%	0.784	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	-2.1	175.1	0	0	0	0	0	116.5	L403	L403-G405 PolarHBondContact O-N 3.18Å
406	K	86.7	Confident	86.6	Confident	59 Å²	59	68.7 Å²	68.7	26%	0.257	37%	0.371	S	S	.	.			trans	-74	143.1	169.6	-78.1	173.6	179	152.4	0	111.3	T402 L403 Q410 L411 L414	T402-K406 WeakPolarHBondContact O-CD 3.49Å; T402-K406 WeakPolarHBondContact O-CE 3.49Å; T402-K406 PolarHBondContact O-NZ 2.88Å; L403-K406 HydrophobicContact CD2-CD 3.99Å; L403-K406 PolarHBondContact O-N 2.76Å; K406-Q410 VanDerWaalsContact CA-OE1 3.27Å; K406-Q410 HydrophobicContact CB-CB 4.27Å; K406-L411 HydrophobicContact CB-CD2 3.96Å; K406-L411 HydrophobicContact CB-CG 4.1Å; K406-L411 HydrophobicContact CD-CD2 4.32Å; K406-L414 HydrophobicContact CD-CD1 3.83Å
407	T	89.5	Confident	87.1	Confident	76 Å²	76	71.7 Å²	71.7	47%	0.466	38%	0.384	S	S	.	.			trans	-78.9	158.6	177.3	65.5	0	0	0	0	111.7	N409 Q410 L411	T407-N409 PolarHBondContact O-N 3.35Å; T407-N409 VanDerWaalsContact O-N 3.17Å; T407-Q410 WeakPolarHBondContact O-CB 3.47Å; T407-Q410 PolarHBondContact O-N 3.49Å; T407-Q410 WeakPolarHBondContact OG1-CG 3.2Å; T407-L411 WeakPolarHBondContact O-CG 3.18Å; T407-L411 PolarHBondContact O-N 2.92Å
408	Y	88.8	Confident	87.3	Confident	72 Å²	72	67 Å²	67	28%	0.282	36%	0.362	S	S	.	.	H	α-helix	trans	-50.8	-41.6	177.5	176.7	-107.1	0	0	0	113.2	Q410 L411 S412 M444 R448	Y408-Q410 PolarHBondContact O-N 2.89Å; Y408-L411 PolarHBondContact O-N 3.11Å; Y408-S412 PolarHBondContact O-N 3.48Å; Y408-M444 HydrophobicContact CD2-CB 4.41Å; Y408-M444 HydrophobicContact CD2-CE 4.49Å; Y408-M444 HydrophobicContact CD2-CG 4.45Å; Y408-M444 HydrophobicContact CE2-CB 4.33Å; Y408-M444 HydrophobicContact CE2-CE 3.72Å; Y408-M444 HydrophobicContact CE2-CG 4.47Å; Y408-R448 HydrophobicContact CD2-CG 3.96Å; Y408-R448 HydrophobicContact CE2-CG 3.92Å; Y408-R448 PolarHBondContact OH-NE 2.94Å; Y408-R448 PolarHBondContact OH-NH2 3.06Å
409	N	91.6	Very high	87.3	Confident	127 Å²	127	65.3 Å²	65.3	68%	0.679	35%	0.352	S	S	*	.	H	α-helix	trans	-62.9	-38.4	177.2	-69.4	-26	0	0	0	112.9	T407 A413	T407-N409 PolarHBondContact O-N 3.35Å; T407-N409 VanDerWaalsContact O-N 3.17Å; N409-A413 WeakPolarHBondContact O-CB 3.28Å; N409-A413 PolarHBondContact O-N 3.14Å; N409-A413 VanDerWaalsContact O-N 3.07Å
410	Q	91.5	Very high	87.4	Confident	98 Å²	98	67.5 Å²	67.5	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-70	-36.7	175.3	-67	167.2	-8.6	0	0	111.5	K406 T407 Y408 A413 L414	K406-Q410 VanDerWaalsContact CA-OE1 3.27Å; K406-Q410 HydrophobicContact CB-CB 4.27Å; T407-Q410 WeakPolarHBondContact O-CB 3.47Å; T407-Q410 PolarHBondContact O-N 3.49Å; T407-Q410 WeakPolarHBondContact OG1-CG 3.2Å; Y408-Q410 PolarHBondContact O-N 2.89Å; Q410-A413 PolarHBondContact O-N 3.41Å; Q410-L414 WeakPolarHBondContact O-CG 3.12Å; Q410-L414 PolarHBondContact O-N 3.47Å
411	L	90.4	Very high	87.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-70.3	-42	177.3	-63.5	168.6	0	0	0	111.9	L403 K406 T407 Y408 A413 L414 E415 Q443 M444 T447	L403-L411 HydrophobicContact CD2-CD2 3.76Å; K406-L411 HydrophobicContact CB-CD2 3.96Å; K406-L411 HydrophobicContact CB-CG 4.1Å; K406-L411 HydrophobicContact CD-CD2 4.32Å; T407-L411 WeakPolarHBondContact O-CG 3.18Å; T407-L411 PolarHBondContact O-N 2.92Å; Y408-L411 PolarHBondContact O-N 3.11Å; L411-A413 VanDerWaalsContact C-N 3.29Å; L411-A413 PolarHBondContact O-N 2.87Å; L411-L414 WeakPolarHBondContact O-CB 3.39Å; L411-L414 PolarHBondContact O-N 3.24Å; L411-L414 VanDerWaalsContact O-N 3.1Å; L411-E415 PolarHBondContact O-N 2.85Å; L411-Q443 HydrophobicContact CD1-CB 4.49Å; L411-Q443 HydrophobicContact CD1-CG 3.88Å; L411-Q443 HydrophobicContact CD2-CG 4.12Å; L411-M444 HydrophobicContact CB-CG 3.43Å; L411-M444 VanDerWaalsContact CB-CG 3.43Å; L411-M444 HydrophobicContact CB-SD 4.22Å; L411-M444 HydrophobicContact CD1-CG 4.14Å; L411-M444 HydrophobicContact CG-CG 4.38Å; L411-T447 HydrophobicContact CD1-CG2 3.62Å
412	S	90.8	Very high	87.4	Confident	17 Å²	17	68.5 Å²	68.5	12%	0.119	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-33.8	172.3	-176.5	0	0	0	0	112.3	Y408 E415 K416	Y408-S412 PolarHBondContact O-N 3.48Å; S412-E415 PolarHBondContact O-N 3.48Å; S412-K416 WeakPolarHBondContact O-CB 3.4Å; S412-K416 WeakPolarHBondContact O-CD 3.25Å; S412-K416 VanDerWaalsContact O-CG 3.28Å; S412-K416 WeakPolarHBondContact O-CG 3.44Å; S412-K416 PolarHBondContact O-N 2.81Å
413	A	91.9	Very high	87.1	Confident	42 Å²	42	74.6 Å²	74.6	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-64.9	-38.2	171.4	0	0	0	0	0	112.2	N409 Q410 L411 Q417	N409-A413 WeakPolarHBondContact O-CB 3.28Å; N409-A413 PolarHBondContact O-N 3.14Å; N409-A413 VanDerWaalsContact O-N 3.07Å; Q410-A413 PolarHBondContact O-N 3.41Å; L411-A413 VanDerWaalsContact C-N 3.29Å; L411-A413 PolarHBondContact O-N 2.87Å; A413-Q417 WeakPolarHBondContact O-CG 3.41Å; A413-Q417 PolarHBondContact O-N 3.06Å
414	L	89.8	Confident	86.5	Confident	43 Å²	43	76.8 Å²	76.8	23%	0.225	41%	0.406	C	S	.	.	H	α-helix	trans	-69.3	-42.3	174	-70.8	168.4	0	0	0	112.2	L403 K406 Q410 L411 K416 Q417 I418	L403-L414 HydrophobicContact CD2-CD1 3.88Å; K406-L414 HydrophobicContact CD-CD1 3.83Å; Q410-L414 WeakPolarHBondContact O-CG 3.12Å; Q410-L414 PolarHBondContact O-N 3.47Å; L411-L414 WeakPolarHBondContact O-CB 3.39Å; L411-L414 PolarHBondContact O-N 3.24Å; L411-L414 VanDerWaalsContact O-N 3.1Å; L414-K416 VanDerWaalsContact C-N 3.3Å; L414-K416 PolarHBondContact O-N 3.43Å; L414-Q417 CarbonylContact O-C 3.59Å; L414-Q417 WeakPolarHBondContact O-CA 3.3Å; L414-Q417 WeakPolarHBondContact O-CB 3.25Å; L414-Q417 PolarHBondContact O-N 2.83Å; L414-I418 WeakPolarHBondContact O-CD1 3.49Å; L414-I418 VanDerWaalsContact O-CG1 3.28Å; L414-I418 WeakPolarHBondContact O-CG1 3.4Å; L414-I418 PolarHBondContact O-N 3.38Å
415	E	89.2	Confident	85.6	Confident	70 Å²	70	72.2 Å²	72.2	33%	0.327	40%	0.399	S	S	.	.	H	α-helix	trans	-55.6	-46.1	173.6	-177	-175.4	-138.5	0	0	111.2	L411 S412 Q417 I418 A419 V440 M444	L411-E415 PolarHBondContact O-N 2.85Å; S412-E415 PolarHBondContact O-N 3.48Å; E415-Q417 PolarHBondContact O-N 3.38Å; E415-I418 PolarHBondContact O-N 3.15Å; E415-I418 VanDerWaalsContact O-N 3.12Å; E415-A419 WeakPolarHBondContact O-CB 3.41Å; E415-A419 PolarHBondContact O-N 3.4Å; E415-V440 HydrophobicContact CB-CG1 4.29Å; E415-M444 HydrophobicContact CB-SD 4.12Å
416	K	89.9	Confident	84.2	Confident	148 Å²	148	78.8 Å²	78.8	64%	0.643	41%	0.409	S	S	*	.	H	α-helix	trans	-62.7	-25.2	175.6	-72.2	165.6	-177	165	0	113.5	S412 L414 P420	S412-K416 WeakPolarHBondContact O-CB 3.4Å; S412-K416 WeakPolarHBondContact O-CD 3.25Å; S412-K416 VanDerWaalsContact O-CG 3.28Å; S412-K416 WeakPolarHBondContact O-CG 3.44Å; S412-K416 PolarHBondContact O-N 2.81Å; L414-K416 VanDerWaalsContact C-N 3.3Å; L414-K416 PolarHBondContact O-N 3.43Å; K416-P420 WeakPolarHBondContact O-CD 3.31Å
417	Q	88.7	Confident	83.3	Confident	123 Å²	123	80 Å²	80	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-83.6	-30.3	173.2	-69.2	170	20.7	0	0	113	A413 L414 E415 P420	A413-Q417 WeakPolarHBondContact O-CG 3.41Å; A413-Q417 PolarHBondContact O-N 3.06Å; L414-Q417 CarbonylContact O-C 3.59Å; L414-Q417 WeakPolarHBondContact O-CA 3.3Å; L414-Q417 WeakPolarHBondContact O-CB 3.25Å; L414-Q417 PolarHBondContact O-N 2.83Å; E415-Q417 PolarHBondContact O-N 3.38Å; Q417-P420 WeakPolarHBondContact O-CD 3.43Å; Q417-P420 WeakPolarHBondContact O-CG 3.27Å
418	I	87.4	Confident	82.5	Confident	9 Å²	9	78.6 Å²	78.6	5%	0.046	43%	0.43	C	S	.	.	H	α-helix	trans	-79.9	-39.4	179	-64.4	159.5	0	0	0	111.4	L414 E415 K421 L422 W433 L436 A437 V440	L414-I418 WeakPolarHBondContact O-CD1 3.49Å; L414-I418 VanDerWaalsContact O-CG1 3.28Å; L414-I418 WeakPolarHBondContact O-CG1 3.4Å; L414-I418 PolarHBondContact O-N 3.38Å; E415-I418 PolarHBondContact O-N 3.15Å; E415-I418 VanDerWaalsContact O-N 3.12Å; I418-K421 WeakPolarHBondContact O-CA 3.42Å; I418-K421 WeakPolarHBondContact O-CB 3.44Å; I418-K421 PolarHBondContact O-N 3.17Å; I418-L422 HydrophobicContact CG2-CD1 3.97Å; I418-L422 HydrophobicContact CG2-CG 4.18Å; I418-L422 PolarHBondContact O-N 2.85Å; I418-W433 HydrophobicContact CB-CE3 4.42Å; I418-W433 HydrophobicContact CG1-CE3 3.96Å; I418-W433 HydrophobicContact CG1-CZ3 3.99Å; I418-W433 HydrophobicContact CG2-CE3 4.07Å; I418-L436 HydrophobicContact CD1-CD2 4.15Å; I418-L436 HydrophobicContact CD1-CG 3.99Å; I418-L436 HydrophobicContact CG1-CD2 4.44Å; I418-A437 HydrophobicContact CG2-CB 3.94Å; I418-V440 HydrophobicContact CD1-CB 4.39Å; I418-V440 HydrophobicContact CD1-CG2 3.89Å
419	A	86.3	Confident	82.1	Confident	29 Å²	29	79.2 Å²	79.2	24%	0.24	44%	0.438	C	S	.	.	H	α-helix	trans	-52	-38.9	179.9	0	0	0	0	0	115.9	E415	E415-A419 WeakPolarHBondContact O-CB 3.41Å; E415-A419 PolarHBondContact O-N 3.4Å
420	P	85.3	Confident	81.6	Confident	69 Å²	69	76.4 Å²	76.4	45%	0.448	43%	0.425	S	S	.	.	H	α-helix	trans	-75.5	-29.5	172.1	27.6	-34.6	0	0	0	113.2	K416 Q417 L422 R423 G424	K416-P420 WeakPolarHBondContact O-CD 3.31Å; Q417-P420 WeakPolarHBondContact O-CD 3.43Å; Q417-P420 WeakPolarHBondContact O-CG 3.27Å; P420-L422 VanDerWaalsContact C-N 3.32Å; P420-L422 PolarHBondContact O-N 3.01Å; P420-R423 PolarHBondContact O-N 2.79Å; P420-R423 VanDerWaalsContact O-N 3.11Å; P420-G424 PolarHBondContact O-N 3.47Å
421	K	83.5	Confident	81.1	Confident	105 Å²	105	73.2 Å²	73.2	46%	0.457	41%	0.412	S	S	.	.	H	α-helix	trans	-66.9	-33.4	176.1	-63.9	-66.4	-176.4	178.5	0	112.5	I418 R423 W433	I418-K421 WeakPolarHBondContact O-CA 3.42Å; I418-K421 WeakPolarHBondContact O-CB 3.44Å; I418-K421 PolarHBondContact O-N 3.17Å; K421-R423 VanDerWaalsContact C-N 3.28Å; K421-R423 PolarHBondContact O-N 2.86Å; K421-W433 HydrophobicContact CB-CD2 4.04Å; K421-W433 HydrophobicContact CB-CE3 4.3Å; K421-W433 HydrophobicContact CB-CG 4.24Å
422	L	83	Confident	80.9	Confident	55 Å²	55	76.6 Å²	76.6	29%	0.288	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.6	171	-72	169.8	0	0	0	113.9	I418 P420 W433 E434 A437	I418-L422 HydrophobicContact CG2-CD1 3.97Å; I418-L422 HydrophobicContact CG2-CG 4.18Å; I418-L422 PolarHBondContact O-N 2.85Å; P420-L422 VanDerWaalsContact C-N 3.32Å; P420-L422 PolarHBondContact O-N 3.01Å; L422-W433 HydrophobicContact CD2-CB 3.8Å; L422-W433 HydrophobicContact CG-CB 4.26Å; L422-E434 HydrophobicContact CD2-CB 4.4Å; L422-E434 HydrophobicContact CD2-CG 3.61Å; L422-A437 HydrophobicContact CD1-CB 3.96Å
423	R	79.8	Confident	80.6	Confident	206 Å²	206	79 Å²	79	78%	0.777	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-4.8	-175.6	-80.3	-167.4	-70.7	-101.6	0.7	115	P420 K421	P420-R423 PolarHBondContact O-N 2.79Å; P420-R423 VanDerWaalsContact O-N 3.11Å; K421-R423 VanDerWaalsContact C-N 3.28Å; K421-R423 PolarHBondContact O-N 2.86Å
424	G	70.1	Confident	80.4	Confident	50 Å²	50	81.5 Å²	81.5	52%	0.515	44%	0.437	S	S	.	.			trans	-171.6	137.4	-179.7	0	0	0	0	0	115.3	P420	P420-G424 PolarHBondContact O-N 3.47Å
425	G	60.9	Low	80	Confident	43 Å²	43	80.8 Å²	80.8	44%	0.443	43%	0.434	S	S	.	.			trans	141.1	94.9	173.8	0	0	0	0	0	112	G427 V428	G425-G427 PolarHBondContact O-N 3.47Å; G425-V428 WeakPolarHBondContact O-CB 3.44Å; G425-V428 PolarHBondContact O-N 2.84Å
426	E	54.2	Low	80	Confident	213 Å²	213	78.5 Å²	78.5	100%	0.995	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	124.9	162.4	-173.1	175	-175.6	0	0	108.4
427	G	66.8	Low	79.9	Confident	85 Å²	85	71.8 Å²	71.8	88%	0.876	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	5.9	-171.6	0	0	0	0	0	116	G425	G425-G427 PolarHBondContact O-N 3.47Å
428	V	72.6	Confident	79.8	Confident	46 Å²	46	69.6 Å²	69.6	28%	0.279	39%	0.386	S	S	.	.			trans	-90.8	131.4	167.9	176	0	0	0	0	109.8	G425 V430 W433	G425-V428 WeakPolarHBondContact O-CB 3.44Å; G425-V428 PolarHBondContact O-N 2.84Å; V428-V430 PolarHBondContact O-N 2.77Å; V428-W433 HydrophobicContact CG1-CG 4.45Å
429	D	79.8	Confident	79.8	Confident	86 Å²	86	71.1 Å²	71.1	46%	0.46	39%	0.392	S	S	.	.			trans	-71	90.4	171.2	-179.9	-1.1	0	0	0	110.4	T431 Y432 W433	D429-T431 PolarHBondContact O-N 3.3Å; D429-T431 WeakPolarHBondContact OD1-CB 3.29Å; D429-T431 PolarHBondContact OD1-N 3.47Å; D429-T431 PolarHBondContact OD1-OG1 2.9Å; D429-Y432 PolarHBondContact O-N 2.77Å; D429-Y432 PolarHBondContact OD1-N 2.7Å; D429-Y432 WeakPolarHBondContact OD2-CB 3.42Å; D429-W433 PolarHBondContact O-N 3.13Å
430	V	82.6	Confident	79.9	Confident	68 Å²	68	69.8 Å²	69.8	41%	0.412	38%	0.381	S	S	.	.	H	α-helix	trans	-50.8	-40.2	178.2	-179.4	0	0	0	0	111.2	V428 W433 E434	V428-V430 PolarHBondContact O-N 2.77Å; V430-W433 CarbonylContact O-C 3.54Å; V430-W433 PolarHBondContact O-N 3.03Å; V430-W433 VanDerWaalsContact O-N 3.12Å; V430-E434 HydrophobicContact CG1-CG 4.06Å; V430-E434 WeakPolarHBondContact O-CG 3.36Å; V430-E434 PolarHBondContact O-N 3.49Å
431	T	80.9	Confident	80.2	Confident	30 Å²	30	72.4 Å²	72.4	18%	0.184	38%	0.382	C	S	.	.	H	α-helix	trans	-73	-34.3	-172.2	70.9	0	0	0	0	112.7	A389 D429 E434 T435	A389-T431 HydrophobicContact CB-CG2 3.54Å; A389-T431 WeakPolarHBondContact CB-OG1 3.26Å; D429-T431 PolarHBondContact O-N 3.3Å; D429-T431 WeakPolarHBondContact OD1-CB 3.29Å; D429-T431 PolarHBondContact OD1-N 3.47Å; D429-T431 PolarHBondContact OD1-OG1 2.9Å; T431-E434 PolarHBondContact O-N 3.14Å; T431-T435 WeakPolarHBondContact O-CG2 3.38Å; T431-T435 PolarHBondContact O-N 2.88Å; T431-T435 PolarHBondContact O-OG1 2.89Å
432	Y	84.6	Confident	80.5	Confident	71 Å²	71	67.4 Å²	67.4	28%	0.278	36%	0.361	S	S	.	.	H	α-helix	trans	-61.6	-43.7	167.6	172.2	-94.2	0	0	0	111.6	V395 D429 T435 L436	V395-Y432 HydrophobicContact CG1-CE2 3.94Å; D429-Y432 PolarHBondContact O-N 2.77Å; D429-Y432 PolarHBondContact OD1-N 2.7Å; D429-Y432 WeakPolarHBondContact OD2-CB 3.42Å; Y432-T435 PolarHBondContact O-OG1 3.2Å; Y432-L436 HydrophobicContact CE1-CD2 4Å; Y432-L436 WeakPolarHBondContact O-CB 3.17Å; Y432-L436 PolarHBondContact O-N 3.45Å
433	W	86.4	Confident	80.8	Confident	67 Å²	67	65.5 Å²	65.5	25%	0.254	35%	0.35	S	S	.	.	H	α-helix	trans	-73.7	-29.3	178.5	-65.8	102.4	0	0	0	113.2	I418 K421 L422 V428 D429 V430 L436 A437	I418-W433 HydrophobicContact CB-CE3 4.42Å; I418-W433 HydrophobicContact CG1-CE3 3.96Å; I418-W433 HydrophobicContact CG1-CZ3 3.99Å; I418-W433 HydrophobicContact CG2-CE3 4.07Å; K421-W433 HydrophobicContact CB-CD2 4.04Å; K421-W433 HydrophobicContact CB-CE3 4.3Å; K421-W433 HydrophobicContact CB-CG 4.24Å; L422-W433 HydrophobicContact CD2-CB 3.8Å; L422-W433 HydrophobicContact CG-CB 4.26Å; V428-W433 HydrophobicContact CG1-CG 4.45Å; D429-W433 PolarHBondContact O-N 3.13Å; V430-W433 CarbonylContact O-C 3.54Å; V430-W433 PolarHBondContact O-N 3.03Å; V430-W433 VanDerWaalsContact O-N 3.12Å; W433-L436 HydrophobicContact CE3-CD2 3.76Å; W433-L436 HydrophobicContact CZ3-CD2 3.68Å; W433-A437 WeakPolarHBondContact O-CB 3.32Å; W433-A437 PolarHBondContact O-N 2.59Å
434	E	85.9	Confident	81.3	Confident	96 Å²	96	56 Å²	56	45%	0.449	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-48.2	174.7	-77.5	176.2	153.4	0	0	111.5	L422 V430 T431 A437 Q438	L422-E434 HydrophobicContact CD2-CB 4.4Å; L422-E434 HydrophobicContact CD2-CG 3.61Å; V430-E434 HydrophobicContact CG1-CG 4.06Å; V430-E434 WeakPolarHBondContact O-CG 3.36Å; V430-E434 PolarHBondContact O-N 3.49Å; T431-E434 PolarHBondContact O-N 3.14Å; E434-A437 WeakPolarHBondContact O-CB 3.31Å; E434-A437 PolarHBondContact O-N 2.87Å; E434-Q438 WeakPolarHBondContact O-CG 3.4Å; E434-Q438 PolarHBondContact O-N 3.27Å
435	T	83.1	Confident	82.3	Confident	28 Å²	28	53.6 Å²	53.6	17%	0.172	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-35.8	176.9	54.2	0	0	0	0	112.3	I391 T431 Y432 A437 Q438 F439	I391-T435 HydrophobicContact CD1-CG2 3.96Å; I391-T435 WeakPolarHBondContact CD1-OG1 3.42Å; T431-T435 WeakPolarHBondContact O-CG2 3.38Å; T431-T435 PolarHBondContact O-N 2.88Å; T431-T435 PolarHBondContact O-OG1 2.89Å; Y432-T435 PolarHBondContact O-OG1 3.2Å; T435-A437 VanDerWaalsContact C-N 3.34Å; T435-Q438 PolarHBondContact O-N 2.93Å; T435-F439 WeakPolarHBondContact O-CB 3.49Å; T435-F439 PolarHBondContact O-N 3.12Å
436	L	87.5	Confident	83.7	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.11	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-37.9	170.2	-178.2	61.5	0	0	0	111.5	V399 L403 I418 Y432 W433 F439 V440	V399-L436 HydrophobicContact CG1-CD1 3.5Å; V399-L436 VanDerWaalsContact CG1-CD1 3.5Å; V399-L436 HydrophobicContact CG2-CD1 4.37Å; L403-L436 HydrophobicContact CD1-CD1 4.31Å; I418-L436 HydrophobicContact CD1-CD2 4.15Å; I418-L436 HydrophobicContact CD1-CG 3.99Å; I418-L436 HydrophobicContact CG1-CD2 4.44Å; Y432-L436 HydrophobicContact CE1-CD2 4Å; Y432-L436 WeakPolarHBondContact O-CB 3.17Å; Y432-L436 PolarHBondContact O-N 3.45Å; W433-L436 HydrophobicContact CE3-CD2 3.76Å; W433-L436 HydrophobicContact CZ3-CD2 3.68Å; L436-F439 PolarHBondContact O-N 2.58Å; L436-V440 HydrophobicContact CD1-CG2 4.23Å; L436-V440 HydrophobicContact CG-CG2 4.48Å; L436-V440 WeakPolarHBondContact O-CB 3.38Å; L436-V440 VanDerWaalsContact O-CG2 3.26Å; L436-V440 WeakPolarHBondContact O-CG2 3.42Å; L436-V440 PolarHBondContact O-N 3.09Å
437	A	87.9	Confident	85.4	Confident	8 Å²	8	43 Å²	43	7%	0.066	23%	0.229	C	C	.	.	H	α-helix	trans	-67.5	-42.2	174.4	0	0	0	0	0	112.5	I418 L422 W433 E434 T435 V440 R441	I418-A437 HydrophobicContact CG2-CB 3.94Å; L422-A437 HydrophobicContact CD1-CB 3.96Å; W433-A437 WeakPolarHBondContact O-CB 3.32Å; W433-A437 PolarHBondContact O-N 2.59Å; E434-A437 WeakPolarHBondContact O-CB 3.31Å; E434-A437 PolarHBondContact O-N 2.87Å; T435-A437 VanDerWaalsContact C-N 3.34Å; A437-V440 PolarHBondContact O-N 2.65Å; A437-R441 WeakPolarHBondContact O-CG 3.49Å; A437-R441 PolarHBondContact O-N 2.66Å
438	Q	86.7	Confident	86.4	Confident	76 Å²	76	43.1 Å²	43.1	36%	0.355	20%	0.203	S	C	.	.	H	α-helix	trans	-54.6	-53.2	171.2	-72.9	168.3	-6.6	0	0	110.3	E434 T435 V440 R441 A442	E434-Q438 WeakPolarHBondContact O-CG 3.4Å; E434-Q438 PolarHBondContact O-N 3.27Å; T435-Q438 PolarHBondContact O-N 2.93Å; Q438-V440 PolarHBondContact O-N 2.84Å; Q438-R441 PolarHBondContact O-N 2.85Å; Q438-A442 WeakPolarHBondContact O-CB 3.44Å; Q438-A442 PolarHBondContact O-N 3.34Å
439	F	87.2	Confident	87.2	Confident	41 Å²	41	41.1 Å²	41.1	18%	0.18	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-35	-177.4	-168.8	-84.4	0	0	0	112.8	V399 A400 L403 T435 L436 A442 Q443	V399-F439 HydrophobicContact CG1-CD1 4.12Å; A400-F439 HydrophobicContact CB-CE1 4.07Å; A400-F439 HydrophobicContact CB-CE2 4.13Å; A400-F439 HydrophobicContact CB-CZ 3.45Å; A400-F439 VanDerWaalsContact CB-CZ 3.45Å; L403-F439 HydrophobicContact CB-CE1 4.12Å; L403-F439 HydrophobicContact CD1-CD1 3.41Å; L403-F439 VanDerWaalsContact CD1-CD1 3.41Å; L403-F439 HydrophobicContact CD1-CE1 3.62Å; T435-F439 WeakPolarHBondContact O-CB 3.49Å; T435-F439 PolarHBondContact O-N 3.12Å; L436-F439 PolarHBondContact O-N 2.58Å; F439-A442 PolarHBondContact O-N 2.96Å; F439-Q443 WeakPolarHBondContact O-CB 3.45Å; F439-Q443 PolarHBondContact O-N 2.94Å
440	V	90.3	Very high	87.6	Confident	2 Å²	2	41 Å²	41	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-42.5	173	166.1	0	0	0	0	111.4	L403 E415 I418 L436 A437 Q438 Q443 M444	L403-V440 HydrophobicContact CD1-CG2 4.02Å; L403-V440 HydrophobicContact CD2-CG2 4.23Å; E415-V440 HydrophobicContact CB-CG1 4.29Å; I418-V440 HydrophobicContact CD1-CB 4.39Å; I418-V440 HydrophobicContact CD1-CG2 3.89Å; L436-V440 HydrophobicContact CD1-CG2 4.23Å; L436-V440 HydrophobicContact CG-CG2 4.48Å; L436-V440 WeakPolarHBondContact O-CB 3.38Å; L436-V440 VanDerWaalsContact O-CG2 3.26Å; L436-V440 WeakPolarHBondContact O-CG2 3.42Å; L436-V440 PolarHBondContact O-N 3.09Å; A437-V440 PolarHBondContact O-N 2.65Å; Q438-V440 PolarHBondContact O-N 2.84Å; V440-Q443 PolarHBondContact O-N 3.17Å; V440-M444 HydrophobicContact CG1-CG 4.45Å; V440-M444 HydrophobicContact CG1-SD 3.95Å; V440-M444 WeakPolarHBondContact O-CB 3.34Å; V440-M444 VanDerWaalsContact O-CG 3.28Å; V440-M444 WeakPolarHBondContact O-CG 3.39Å; V440-M444 PolarHBondContact O-N 2.9Å
441	R	90.4	Very high	87.9	Confident	123 Å²	123	40.9 Å²	40.9	46%	0.464	18%	0.181	S	C	.	.	H	α-helix	trans	-61.4	-45.8	173.7	-70.2	174.1	-159.4	143	7.1	111.7	T357 A437 Q438 Q443 M444 A445	T357-R441 HydrophobicContact CG2-CB 4.27Å; A437-R441 WeakPolarHBondContact O-CG 3.49Å; A437-R441 PolarHBondContact O-N 2.66Å; Q438-R441 PolarHBondContact O-N 2.85Å; R441-Q443 VanDerWaalsContact C-N 3.31Å; R441-Q443 PolarHBondContact O-N 2.79Å; R441-M444 WeakPolarHBondContact O-CB 3.43Å; R441-M444 PolarHBondContact O-N 2.87Å; R441-M444 VanDerWaalsContact O-N 3.15Å; R441-A445 PolarHBondContact O-N 3.15Å
442	A	89.7	Confident	88	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-38.6	176.8	0	0	0	0	0	112.2	D361 Q438 F439 R446	D361-A442 HydrophobicContact CB-CB 3.41Å; D361-A442 VanDerWaalsContact CB-CB 3.41Å; D361-A442 WeakPolarHBondContact OD2-CB 3.45Å; Q438-A442 WeakPolarHBondContact O-CB 3.44Å; Q438-A442 PolarHBondContact O-N 3.34Å; F439-A442 PolarHBondContact O-N 2.96Å; A442-R446 WeakPolarHBondContact O-CG 3.47Å; A442-R446 PolarHBondContact O-N 3Å
443	Q	89.7	Confident	88.1	Confident	14 Å²	14	41.4 Å²	41.4	7%	0.065	19%	0.185	C	C	.	.	H	α-helix	trans	-72.2	-31.7	174.4	-173.4	53.1	36.5	0	0	112.5	L403 L411 F439 V440 R441 R446 T447	L403-Q443 HydrophobicContact CB-CG 4.34Å; L411-Q443 HydrophobicContact CD1-CB 4.49Å; L411-Q443 HydrophobicContact CD1-CG 3.88Å; L411-Q443 HydrophobicContact CD2-CG 4.12Å; F439-Q443 WeakPolarHBondContact O-CB 3.45Å; F439-Q443 PolarHBondContact O-N 2.94Å; V440-Q443 PolarHBondContact O-N 3.17Å; R441-Q443 VanDerWaalsContact C-N 3.31Å; R441-Q443 PolarHBondContact O-N 2.79Å; Q443-R446 PolarHBondContact O-N 2.84Å; Q443-T447 PolarHBondContact O-N 2.92Å; Q443-T447 PolarHBondContact O-OG1 2.88Å
444	M	90.7	Very high	88.2	Confident	7 Å²	7	42.9 Å²	42.9	3%	0.034	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-47.5	171.2	-76.4	170.3	62.9	0	0	111.3	Y408 L411 E415 V440 R441 T447 R448	Y408-M444 HydrophobicContact CD2-CB 4.41Å; Y408-M444 HydrophobicContact CD2-CE 4.49Å; Y408-M444 HydrophobicContact CD2-CG 4.45Å; Y408-M444 HydrophobicContact CE2-CB 4.33Å; Y408-M444 HydrophobicContact CE2-CE 3.72Å; Y408-M444 HydrophobicContact CE2-CG 4.47Å; L411-M444 HydrophobicContact CB-CG 3.43Å; L411-M444 VanDerWaalsContact CB-CG 3.43Å; L411-M444 HydrophobicContact CB-SD 4.22Å; L411-M444 HydrophobicContact CD1-CG 4.14Å; L411-M444 HydrophobicContact CG-CG 4.38Å; E415-M444 HydrophobicContact CB-SD 4.12Å; V440-M444 HydrophobicContact CG1-CG 4.45Å; V440-M444 HydrophobicContact CG1-SD 3.95Å; V440-M444 WeakPolarHBondContact O-CB 3.34Å; V440-M444 VanDerWaalsContact O-CG 3.28Å; V440-M444 WeakPolarHBondContact O-CG 3.39Å; V440-M444 PolarHBondContact O-N 2.9Å; R441-M444 WeakPolarHBondContact O-CB 3.43Å; R441-M444 PolarHBondContact O-N 2.87Å; R441-M444 VanDerWaalsContact O-N 3.15Å; M444-T447 WeakPolarHBondContact CA-OG1 3.47Å; M444-T447 PolarHBondContact O-N 3.41Å; M444-T447 VanDerWaalsContact O-N 3.13Å; M444-T447 PolarHBondContact O-OG1 3.46Å; M444-R448 PolarHBondContact O-N 2.89Å
445	A	90.6	Very high	88.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.6	-47	173.7	0	0	0	0	0	111.4	D354 T357 V358 R441 T447 R448 L449	D354-A445 HydrophobicContact CB-CB 3.84Å; D354-A445 WeakPolarHBondContact O-CB 3.35Å; T357-A445 HydrophobicContact CG2-CB 4.15Å; V358-A445 HydrophobicContact CG2-CB 3.86Å; R441-A445 PolarHBondContact O-N 3.15Å; A445-T447 VanDerWaalsContact C-N 3.32Å; A445-T447 PolarHBondContact O-N 3.34Å; A445-R448 PolarHBondContact O-N 3.25Å; A445-L449 WeakPolarHBondContact O-CG 3.47Å; A445-L449 PolarHBondContact O-N 2.95Å
446	R	89.8	Confident	88.1	Confident	23 Å²	23	40.5 Å²	40.5	9%	0.087	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-39.9	172.4	-71.1	-174.7	-175.7	90.3	4.8	112.7	T318 V358 D361 E362 A442 Q443 R450	T318-R446 HydrophobicContact CG2-CG 4.14Å; V358-R446 HydrophobicContact CG1-CG 4.32Å; V358-R446 HydrophobicContact CG2-CG 3.68Å; D361-R446 IonicContact OD2-CZ 3.31Å; D361-R446 IonicContact OD2-NH1 3.56Å; D361-R446 PolarHBondContact OD2-NH1 3.26Å; D361-R446 IonicContact OD2-NH2 3.94Å; D361-R446 PolarHBondContact OD2-NH2 2.84Å; E362-R446 IonicContact OE2-NH2 3.1Å; E362-R446 PolarHBondContact OE2-NH2 3.27Å; A442-R446 WeakPolarHBondContact O-CG 3.47Å; A442-R446 PolarHBondContact O-N 3Å; Q443-R446 PolarHBondContact O-N 2.84Å; R446-R450 WeakPolarHBondContact O-CG 3.35Å; R446-R450 PolarHBondContact O-N 2.85Å; R446-R450 VanDerWaalsContact O-N 3.13Å
447	T	89.6	Confident	87.8	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-42.7	175.1	47.8	0	0	0	0	112.8	L411 Q443 M444 A445 L449 R450 D451	L411-T447 HydrophobicContact CD1-CG2 3.62Å; Q443-T447 PolarHBondContact O-N 2.92Å; Q443-T447 PolarHBondContact O-OG1 2.88Å; M444-T447 WeakPolarHBondContact CA-OG1 3.47Å; M444-T447 PolarHBondContact O-N 3.41Å; M444-T447 VanDerWaalsContact O-N 3.13Å; M444-T447 PolarHBondContact O-OG1 3.46Å; A445-T447 VanDerWaalsContact C-N 3.32Å; A445-T447 PolarHBondContact O-N 3.34Å; T447-L449 PolarHBondContact O-N 3.38Å; T447-R450 PolarHBondContact O-N 3.17Å; T447-D451 WeakPolarHBondContact O-CB 3.27Å; T447-D451 VanDerWaalsContact O-CG 3.23Å; T447-D451 PolarHBondContact O-N 2.9Å
448	R	89.3	Confident	87.7	Confident	87 Å²	87	47.9 Å²	47.9	33%	0.328	22%	0.217	S	C	.	.	H	α-helix	trans	-61.7	-44.7	176.4	-72.2	174.7	-175.3	155	-2.3	112	D354 Y408 M444 A445 R450 D451 M452	D354-R448 WeakPolarHBondContact OD1-CD 3.42Å; D354-R448 IonicContact OD1-CZ 2.72Å; D354-R448 IonicContact OD1-NH1 2.65Å; D354-R448 PolarHBondContact OD1-NH1 2.66Å; D354-R448 WeakPolarHBondContact OD2-CB 3.41Å; D354-R448 WeakPolarHBondContact OD2-CD 3.23Å; D354-R448 IonicContact OD2-NH1 2.89Å; Y408-R448 HydrophobicContact CD2-CG 3.96Å; Y408-R448 HydrophobicContact CE2-CG 3.92Å; Y408-R448 PolarHBondContact OH-NE 2.94Å; Y408-R448 PolarHBondContact OH-NH2 3.06Å; M444-R448 PolarHBondContact O-N 2.89Å; A445-R448 PolarHBondContact O-N 3.25Å; R448-R450 VanDerWaalsContact C-N 3.27Å; R448-R450 PolarHBondContact O-N 3.44Å; R448-D451 PolarHBondContact O-N 3.03Å; R448-M452 WeakPolarHBondContact O-CB 3.29Å; R448-M452 VanDerWaalsContact O-CG 3.31Å; R448-M452 WeakPolarHBondContact O-CG 3.49Å; R448-M452 PolarHBondContact O-N 2.84Å
449	L	88.4	Confident	87.5	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-61	-36.1	176.4	-69.2	171.1	0	0	0	111.9	T318 Y351 D354 I355 V358 A445 T447 H453	T318-L449 HydrophobicContact CG2-CD1 3.98Å; Y351-L449 HydrophobicContact CD2-CD2 3.6Å; Y351-L449 HydrophobicContact CE2-CD2 3.95Å; Y351-L449 HydrophobicContact CG-CD2 4.36Å; D354-L449 HydrophobicContact CB-CD1 4.21Å; D354-L449 HydrophobicContact CB-CD2 4.08Å; D354-L449 HydrophobicContact CB-CG 3.92Å; I355-L449 HydrophobicContact CG1-CD1 3.96Å; I355-L449 HydrophobicContact CG1-CD2 4.05Å; V358-L449 HydrophobicContact CG2-CD1 4.13Å; A445-L449 WeakPolarHBondContact O-CG 3.47Å; A445-L449 PolarHBondContact O-N 2.95Å; T447-L449 PolarHBondContact O-N 3.38Å; L449-H453 VanDerWaalsContact O-CB 3.23Å; L449-H453 WeakPolarHBondContact O-CB 3.38Å; L449-H453 PolarHBondContact O-N 2.95Å
450	R	87.6	Confident	86.9	Confident	82 Å²	82	51.7 Å²	51.7	31%	0.309	23%	0.227	S	C	.	.	H	α-helix	trans	-71.6	-40.7	172	-71.4	-166.8	-172.3	129.1	8.6	113.8	E316 R446 T447 R448 M452 H453 Q454	E316-R450 WeakPolarHBondContact OE1-CD 3.35Å; E316-R450 VanDerWaalsContact OE1-CG 3.24Å; E316-R450 WeakPolarHBondContact OE1-CG 3.5Å; E316-R450 IonicContact OE1-NE 2.7Å; E316-R450 PolarHBondContact OE1-NE 2.88Å; E316-R450 IonicContact OE2-CZ 3.69Å; E316-R450 IonicContact OE2-NE 3.04Å; E316-R450 PolarHBondContact OE2-NE 3.46Å; E316-R450 VanDerWaalsContact OE2-NE 3.1Å; E316-R450 IonicContact OE2-NH2 3.74Å; R446-R450 WeakPolarHBondContact O-CG 3.35Å; R446-R450 PolarHBondContact O-N 2.85Å; R446-R450 VanDerWaalsContact O-N 3.13Å; T447-R450 PolarHBondContact O-N 3.17Å; R448-R450 VanDerWaalsContact C-N 3.27Å; R448-R450 PolarHBondContact O-N 3.44Å; R450-M452 VanDerWaalsContact C-N 3.33Å; R450-H453 PolarHBondContact O-N 3.17Å; R450-Q454 WeakPolarHBondContact O-CG 3.3Å; R450-Q454 PolarHBondContact O-N 3.05Å
451	D	88.9	Confident	86.4	Confident	66 Å²	66	56 Å²	56	35%	0.353	25%	0.25	S	S	.	.	H	α-helix	trans	-66	-40.1	178	-67.1	-23.1	0	0	0	110.1	T447 R448 N455	T447-D451 WeakPolarHBondContact O-CB 3.27Å; T447-D451 VanDerWaalsContact O-CG 3.23Å; T447-D451 PolarHBondContact O-N 2.9Å; R448-D451 PolarHBondContact O-N 3.03Å; D451-N455 WeakPolarHBondContact O-CB 3.2Å; D451-N455 PolarHBondContact O-N 2.76Å; D451-N455 PolarHBondContact O-ND2 2.92Å
452	M	84.3	Confident	86	Confident	104 Å²	104	55.4 Å²	55.4	51%	0.512	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-45.7	168.3	-73.9	-64.2	106.6	0	0	111.9	R448 R450 N455 N456	R448-M452 WeakPolarHBondContact O-CB 3.29Å; R448-M452 VanDerWaalsContact O-CG 3.31Å; R448-M452 WeakPolarHBondContact O-CG 3.49Å; R448-M452 PolarHBondContact O-N 2.84Å; R450-M452 VanDerWaalsContact C-N 3.33Å; M452-N455 CarbonylContact O-C 3.52Å; M452-N455 PolarHBondContact O-N 3.46Å; M452-N456 WeakPolarHBondContact O-CB 3.37Å; M452-N456 PolarHBondContact O-N 2.81Å
453	H	86.5	Confident	85.3	Confident	9 Å²	9	56.5 Å²	56.5	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-43.9	178.3	-176.7	64	0	0	0	113	Y295 L315 L449 R450 N455 N456 L457	Y295-H453 AromaticContact CE2-ND1 3.55Å; Y295-H453 AromaticContact CZ-ND1 3.74Å; Y295-H453 VanDerWaalsContact OH-CA 3.26Å; Y295-H453 WeakPolarHBondContact OH-CA 3.31Å; Y295-H453 PolarHBondContact OH-ND1 3.22Å; Y295-H453 VanDerWaalsContact OH-ND1 3.15Å; L315-H453 PolarHBondContact O-CE1 3.01Å; L449-H453 VanDerWaalsContact O-CB 3.23Å; L449-H453 WeakPolarHBondContact O-CB 3.38Å; L449-H453 PolarHBondContact O-N 2.95Å; R450-H453 PolarHBondContact O-N 3.17Å; H453-N455 PolarHBondContact O-N 2.92Å; H453-N456 PolarHBondContact O-N 3.43Å; H453-L457 WeakPolarHBondContact O-CB 3.47Å; H453-L457 WeakPolarHBondContact O-CG 3.43Å; H453-L457 PolarHBondContact O-N 2.88Å
454	Q	87.6	Confident	84.6	Confident	98 Å²	98	58.6 Å²	58.6	46%	0.458	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-33.6	172.7	-71.7	178.6	31	0	0	112.3	R450 K458	R450-Q454 WeakPolarHBondContact O-CG 3.3Å; R450-Q454 PolarHBondContact O-N 3.05Å; Q454-K458 WeakPolarHBondContact O-CD 3.36Å; Q454-K458 VanDerWaalsContact O-CE 3.27Å; Q454-K458 WeakPolarHBondContact O-CE 3.36Å; Q454-K458 WeakPolarHBondContact O-CG 3.43Å; Q454-K458 PolarHBondContact O-N 2.93Å; Q454-K458 VanDerWaalsContact O-N 3.12Å
455	N	85.8	Confident	83.9	Confident	67 Å²	67	64.3 Å²	64.3	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-77.1	-34.8	176.8	-68.1	-19.8	0	0	0	112.4	D451 M452 H453 K458 R459	D451-N455 WeakPolarHBondContact O-CB 3.2Å; D451-N455 PolarHBondContact O-N 2.76Å; D451-N455 PolarHBondContact O-ND2 2.92Å; M452-N455 CarbonylContact O-C 3.52Å; M452-N455 PolarHBondContact O-N 3.46Å; H453-N455 PolarHBondContact O-N 2.92Å; N455-K458 PolarHBondContact O-N 3.23Å; N455-K458 PolarHBondContact OD1-NZ 2.91Å; N455-R459 WeakPolarHBondContact O-CG 3.35Å; N455-R459 PolarHBondContact O-N 2.97Å
456	N	81.4	Confident	83.4	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.032	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-48.6	170.9	-174.9	-88.2	0	0	0	111.2	Q299 M452 H453 K458 R459 K460	Q299-N456 WeakPolarHBondContact CG-ND2 3.28Å; Q299-N456 PolarHBondContact OE1-ND2 3.5Å; M452-N456 WeakPolarHBondContact O-CB 3.37Å; M452-N456 PolarHBondContact O-N 2.81Å; H453-N456 PolarHBondContact O-N 3.43Å; N456-K458 VanDerWaalsContact C-N 3.28Å; N456-K458 PolarHBondContact O-N 2.83Å; N456-R459 PolarHBondContact O-N 2.86Å; N456-R459 VanDerWaalsContact O-N 3.08Å; N456-K460 PolarHBondContact O-N 2.84Å; N456-K460 WeakPolarHBondContact OD1-CD 3.45Å; N456-K460 WeakPolarHBondContact OD1-CE 3.12Å
457	L	82.5	Confident	82.6	Confident	70 Å²	70	73.5 Å²	73.5	37%	0.366	35%	0.35	S	S	.	.	H	α-helix	trans	-58.5	-37.4	175.2	-70.5	175.7	0	0	0	112.5	H453 L461	H453-L457 WeakPolarHBondContact O-CB 3.47Å; H453-L457 WeakPolarHBondContact O-CG 3.43Å; H453-L457 PolarHBondContact O-N 2.88Å; L457-L461 WeakPolarHBondContact O-CB 3.38Å; L457-L461 PolarHBondContact O-N 3.02Å
458	K	85.9	Confident	82	Confident	115 Å²	115	79.5 Å²	79.5	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-62.4	-48.9	172.2	-72.8	162.5	-150.9	161.3	0	111.5	Q454 N455 N456 L461 E462	Q454-K458 WeakPolarHBondContact O-CD 3.36Å; Q454-K458 VanDerWaalsContact O-CE 3.27Å; Q454-K458 WeakPolarHBondContact O-CE 3.36Å; Q454-K458 WeakPolarHBondContact O-CG 3.43Å; Q454-K458 PolarHBondContact O-N 2.93Å; Q454-K458 VanDerWaalsContact O-N 3.12Å; N455-K458 PolarHBondContact O-N 3.23Å; N455-K458 PolarHBondContact OD1-NZ 2.91Å; N456-K458 VanDerWaalsContact C-N 3.28Å; N456-K458 PolarHBondContact O-N 2.83Å; K458-L461 PolarHBondContact O-N 2.77Å; K458-E462 WeakPolarHBondContact O-CB 3.47Å; K458-E462 PolarHBondContact O-N 2.89Å
459	R	81.5	Confident	80.8	Confident	164 Å²	164	78 Å²	78	62%	0.619	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-45.9	177.7	-73	178	-179	166.9	-1.3	112.1	N455 N456 L461 E462 C463	N455-R459 WeakPolarHBondContact O-CG 3.35Å; N455-R459 PolarHBondContact O-N 2.97Å; N456-R459 PolarHBondContact O-N 2.86Å; N456-R459 VanDerWaalsContact O-N 3.08Å; R459-L461 VanDerWaalsContact C-N 3.35Å; R459-L461 PolarHBondContact O-N 2.83Å; R459-E462 PolarHBondContact O-N 2.93Å; R459-C463 WeakPolarHBondContact O-CB 3.15Å; R459-C463 PolarHBondContact O-N 3.38Å
460	K	74.7	Confident	79.6	Confident	32 Å²	32	82 Å²	82	14%	0.139	41%	0.41	C	S	.	.	H	α-helix	trans	-61.7	-41.5	176	-72	-168.2	170.6	-165.6	0	111.7	D298 E313 N456 L464	D298-K460 WeakPolarHBondContact O-CE 3.24Å; D298-K460 IonicContact OD2-NZ 2.86Å; D298-K460 PolarHBondContact OD2-NZ 2.85Å; E313-K460 IonicContact OE2-NZ 2.77Å; E313-K460 PolarHBondContact OE2-NZ 2.84Å; N456-K460 PolarHBondContact O-N 2.84Å; N456-K460 WeakPolarHBondContact OD1-CD 3.45Å; N456-K460 WeakPolarHBondContact OD1-CE 3.12Å; K460-L464 WeakPolarHBondContact O-CB 3.24Å; K460-L464 VanDerWaalsContact O-CG 3.26Å; K460-L464 WeakPolarHBondContact O-CG 3.44Å; K460-L464 PolarHBondContact O-N 3.06Å
461	L	80.7	Confident	77.9	Confident	93 Å²	93	84.3 Å²	84.3	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-67.7	-32.7	175.4	-174.5	149.8	0	0	0	113	L457 K458 R459 R465	L457-L461 WeakPolarHBondContact O-CB 3.38Å; L457-L461 PolarHBondContact O-N 3.02Å; K458-L461 PolarHBondContact O-N 2.77Å; R459-L461 VanDerWaalsContact C-N 3.35Å; R459-L461 PolarHBondContact O-N 2.83Å; L461-R465 WeakPolarHBondContact O-CG 3.48Å; L461-R465 PolarHBondContact O-N 2.93Å; L461-R465 VanDerWaalsContact O-N 3.16Å
462	E	80.6	Confident	76.2	Confident	111 Å²	111	85.4 Å²	85.4	52%	0.519	45%	0.446	S	S	.	.	H	α-helix	trans	-72.7	-45	175	-175.3	165.2	-159.6	0	0	112	K458 R459 R465 Q466	K458-E462 WeakPolarHBondContact O-CB 3.47Å; K458-E462 PolarHBondContact O-N 2.89Å; R459-E462 PolarHBondContact O-N 2.93Å; E462-R465 WeakPolarHBondContact O-CB 3.33Å; E462-R465 PolarHBondContact O-N 2.99Å; E462-Q466 WeakPolarHBondContact O-CG 3.41Å; E462-Q466 PolarHBondContact O-N 2.72Å
463	C	75.8	Confident	74.3	Confident	23 Å²	23	88 Å²	88	16%	0.155	46%	0.457	C	S	.	.	H	α-helix	trans	-53.3	-52.8	168	162.5	0	0	0	0	111.2	P303 R459 R465 Q466 A467	P303-C463 HydrophobicContact CB-CB 4.2Å; P303-C463 PolarHBondContact O-SG 3.17Å; R459-C463 WeakPolarHBondContact O-CB 3.15Å; R459-C463 PolarHBondContact O-N 3.38Å; C463-R465 PolarHBondContact O-N 3.02Å; C463-R465 VanDerWaalsContact O-N 3.17Å; C463-Q466 WeakPolarHBondContact O-CA 2.93Å; C463-Q466 WeakPolarHBondContact O-CB 3.48Å; C463-Q466 PolarHBondContact O-N 3.07Å; C463-A467 PolarHBondContact O-N 2.89Å
464	L	74.9	Confident	72.5	Confident	59 Å²	59	93.2 Å²	93.2	31%	0.309	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-29.7	-179.5	-73.7	169.2	0	0	0	112.7	F306 K460 Q468	F306-L464 HydrophobicContact CD1-CD2 3.87Å; F306-L464 HydrophobicContact CE1-CD2 3.87Å; K460-L464 WeakPolarHBondContact O-CB 3.24Å; K460-L464 VanDerWaalsContact O-CG 3.26Å; K460-L464 WeakPolarHBondContact O-CG 3.44Å; K460-L464 PolarHBondContact O-N 3.06Å; L464-Q468 VanDerWaalsContact O-CB 3.27Å; L464-Q468 WeakPolarHBondContact O-CB 3.11Å; L464-Q468 VanDerWaalsContact O-CD 3.3Å; L464-Q468 WeakPolarHBondContact O-CG 3.28Å; L464-Q468 PolarHBondContact O-N 3.3Å; L464-Q468 VanDerWaalsContact O-N 3.07Å
465	R	76.6	Confident	70.4	Confident	127 Å²	127	95.3 Å²	95.3	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-42.6	170.9	-76.8	171.5	174.3	-177.1	-0.7	112.5	L461 E462 C463 Q468 G469 I470	L461-R465 WeakPolarHBondContact O-CG 3.48Å; L461-R465 PolarHBondContact O-N 2.93Å; L461-R465 VanDerWaalsContact O-N 3.16Å; E462-R465 WeakPolarHBondContact O-CB 3.33Å; E462-R465 PolarHBondContact O-N 2.99Å; C463-R465 PolarHBondContact O-N 3.02Å; C463-R465 VanDerWaalsContact O-N 3.17Å; R465-Q468 CarbonylContact O-C 3.6Å; R465-Q468 PolarHBondContact O-N 2.79Å; R465-G469 PolarHBondContact O-N 3.34Å; R465-I470 HydrophobicContact CB-CB 4.29Å; R465-I470 HydrophobicContact CG-CD1 4.46Å; R465-I470 WeakPolarHBondContact O-CB 3.39Å; R465-I470 PolarHBondContact O-N 2.81Å
466	Q	78.5	Confident	68.3	Low	133 Å²	133	101.2 Å²	101.2	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-46.2	176.8	-67.2	172.7	13.2	0	0	111	E462 C463 Q468 G469	E462-Q466 WeakPolarHBondContact O-CG 3.41Å; E462-Q466 PolarHBondContact O-N 2.72Å; C463-Q466 WeakPolarHBondContact O-CA 2.93Å; C463-Q466 WeakPolarHBondContact O-CB 3.48Å; C463-Q466 PolarHBondContact O-N 3.07Å; Q466-Q468 VanDerWaalsContact C-N 3.28Å; Q466-Q468 PolarHBondContact O-N 3.24Å; Q466-G469 WeakPolarHBondContact O-CA 3.44Å; Q466-G469 PolarHBondContact O-N 3.06Å
467	A	73.4	Confident	66.3	Low	82 Å²	82	107 Å²	107	68%	0.678	57%	0.565	S	S	*	*	H	α-helix	trans	-62.9	-30.7	174.9	0	0	0	0	0	113.2	C463 G469	C463-A467 PolarHBondContact O-N 2.89Å; A467-G469 PolarHBondContact O-N 2.72Å
468	Q	76.5	Confident	63.8	Low	137 Å²	137	109.9 Å²	109.9	64%	0.64	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	7	171.7	-71.7	169.6	13.6	0	0	113.6	L464 R465 Q466 I470	L464-Q468 VanDerWaalsContact O-CB 3.27Å; L464-Q468 WeakPolarHBondContact O-CB 3.11Å; L464-Q468 VanDerWaalsContact O-CD 3.3Å; L464-Q468 WeakPolarHBondContact O-CG 3.28Å; L464-Q468 PolarHBondContact O-N 3.3Å; L464-Q468 VanDerWaalsContact O-N 3.07Å; R465-Q468 CarbonylContact O-C 3.6Å; R465-Q468 PolarHBondContact O-N 2.79Å; Q466-Q468 VanDerWaalsContact C-N 3.28Å; Q466-Q468 PolarHBondContact O-N 3.24Å; Q468-I470 HydrophobicContact CB-CD1 4.08Å; Q468-I470 HydrophobicContact CB-CG1 4.04Å; Q468-I470 PolarHBondContact O-N 3.1Å
469	G	65.1	Low	61.5	Low	57 Å²	57	109.2 Å²	109.2	59%	0.588	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.7	13.9	179.2	0	0	0	0	0	114.6	R465 Q466 A467 V471	R465-G469 PolarHBondContact O-N 3.34Å; Q466-G469 WeakPolarHBondContact O-CA 3.44Å; Q466-G469 PolarHBondContact O-N 3.06Å; A467-G469 PolarHBondContact O-N 2.72Å; G469-V471 VanDerWaalsContact C-N 3.26Å; G469-V471 PolarHBondContact O-N 3.35Å
470	I	63.1	Low	59.3	Low	87 Å²	87	105.9 Å²	105.9	45%	0.446	62%	0.615	S	S	.	*			trans	-82.1	74.7	-177.4	-50.7	176.4	0	0	0	109.1	R465 Q468 S472	R465-I470 HydrophobicContact CB-CB 4.29Å; R465-I470 HydrophobicContact CG-CD1 4.46Å; R465-I470 WeakPolarHBondContact O-CB 3.39Å; R465-I470 PolarHBondContact O-N 2.81Å; Q468-I470 HydrophobicContact CB-CD1 4.08Å; Q468-I470 HydrophobicContact CB-CG1 4.04Å; Q468-I470 PolarHBondContact O-N 3.1Å; I470-S472 PolarHBondContact O-N 2.94Å; I470-S472 VanDerWaalsContact O-N 3.13Å
471	V	51.3	Low	57.5	Low	130 Å²	130	110.7 Å²	110.7	79%	0.788	65%	0.647	S	S	*	*			trans	-55	117.7	172.7	179.7	0	0	0	0	108.8	G469 E473	G469-V471 VanDerWaalsContact C-N 3.26Å; G469-V471 PolarHBondContact O-N 3.35Å; V471-E473 PolarHBondContact O-N 2.65Å
472	S	53.5	Low	55.3	Low	89 Å²	89	115.7 Å²	115.7	62%	0.622	67%	0.665	S	S	*	*			trans	-82.9	67	-175.9	-67.7	0	0	0	0	111.2	I470	I470-S472 PolarHBondContact O-N 2.94Å; I470-S472 VanDerWaalsContact O-N 3.13Å
473	E	44.8	Very low	53.3	Low	159 Å²	159	118.6 Å²	118.6	74%	0.743	68%	0.678	S	S	*	*			trans	-61	126.3	170.2	-168.3	176.1	-135.2	0	0	109.4	V471 L475	V471-E473 PolarHBondContact O-N 2.65Å; E473-L475 PolarHBondContact O-N 3.24Å
474	P	49	Very low	51.2	Low	118 Å²	118	122.1 Å²	122.1	77%	0.766	70%	0.703	S	S	*	*			trans	-74.5	93.9	-171.1	28.3	-34.5	0	0	0	111.4	F476	P474-F476 PolarHBondContact O-N 2.8Å
475	L	43.8	Very low	49.4	Very low	143 Å²	143	126 Å²	126	75%	0.749	72%	0.724	S	S	*	*			trans	-68.9	31.4	-170.2	-155	79.1	0	0	0	116.3	E473	E473-L475 PolarHBondContact O-N 3.24Å
476	F	42	Very low	47.5	Very low	191 Å²	191	126.3 Å²	126.3	84%	0.838	74%	0.735	S	S	*	*			trans	-146	112.7	171.4	-79.1	-69.1	0	0	0	112.4	P474	P474-F476 PolarHBondContact O-N 2.8Å
477	P	39	Very low	45.4	Very low	126 Å²	126	130.3 Å²	130.3	82%	0.818	74%	0.744	S	S	*	*			trans	-69.7	160.7	173.9	-19.7	33.1	0	0	0	113.9	A479	P477-A479 PolarHBondContact O-N 3.15Å
478	S	30	Very low	43.7	Very low	131 Å²	131	132 Å²	132	92%	0.916	75%	0.747	S	S	*	*			trans	-60.2	131.5	-179.2	-51.3	0	0	0	0	114.3
479	A	37.2	Very low	41.8	Very low	101 Å²	101	132.6 Å²	132.6	84%	0.835	75%	0.749	S	S	*	*			trans	-118.8	124.9	159.9	0	0	0	0	0	109.1	P477	P477-A479 PolarHBondContact O-N 3.15Å
480	A	34.8	Very low	40.6	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	76%	0.76	S	S	*	*			trans	-92.7	142.5	-171.5	0	0	0	0	0	113.1
481	V	37	Very low	39.2	Very low	133 Å²	133	137.8 Å²	137.8	81%	0.806	77%	0.774	S	S	*	*			trans	-124.6	115.6	158.4	-179.9	0	0	0	0	108.3
482	K	33.6	Very low	38.8	Very low	199 Å²	199	140.1 Å²	140.1	87%	0.865	78%	0.779	S	S	*	*			trans	-102	119	170.9	-69.9	-178.8	177.9	-179.9	0	109.2
483	Q	38.9	Very low	38	Very low	172 Å²	172	142.8 Å²	142.8	80%	0.804	78%	0.782	S	S	*	*			trans	-158.2	103.6	160.6	-98.9	159.3	28.1	0	0	105.7
484	S	32.6	Very low	37.5	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	78%	0.782	S	S	*	*				64.9	87.8	63.5	80.2	0	0	0	0	114
485	N	36.6	Very low	36.8	Very low	142 Å²	142	142.2 Å²	142.2	76%	0.759	78%	0.779	S	S	*	*				178.6	137.6	110.4	-86.5	4.9	0	0	0	113.9
486	D	36.8	Very low	36.3	Very low	132 Å²	132	139.4 Å²	139.4	71%	0.706	78%	0.776	S	S	*	*			trans	45.6	104.8	139.7	-62.1	-41.7	0	0	0	123.3
487	R	33.7	Very low	35.8	Very low	217 Å²	217	138.9 Å²	138.9	82%	0.819	78%	0.776	S	S	*	*				67.9	123	103.2	-169.4	-169.9	-177.9	167.6	1.8	120.4
488	V	38.8	Very low	35.5	Very low	119 Å²	119	138.1 Å²	138.1	72%	0.721	77%	0.772	S	S	*	*				179	151.6	119.7	148.6	0	0	0	0	110
489	E	36.7	Very low	35.5	Very low	148 Å²	148	138.1 Å²	138.1	69%	0.692	77%	0.766	S	S	*	*			trans	-30	160.5	176.5	-71.2	106.1	110.4	0	0	119.4
490	S	38.9	Very low	35.5	Very low	116 Å²	116	141.6 Å²	141.6	81%	0.811	77%	0.765	S	S	*	*			cis	-150.9	160	30.6	40.2	0	0	0	0	116.6
491	D	33.4	Very low	35.5	Very low	138 Å²	138	143.7 Å²	143.7	74%	0.738	76%	0.763	S	S	*	*			trans	-88.5	150.1	-174.2	-39	-98.4	0	0	0	114.9
492	I	43.1	Very low	35.5	Very low	178 Å²	178	146.1 Å²	146.1	91%	0.913	77%	0.766	S	S	*	*			trans	-138.3	134.8	146.3	-61.4	-174.3	0	0	0	107.7
493	E	37.4	Very low	35.7	Very low	146 Å²	146	144 Å²	144	68%	0.682	76%	0.764	S	S	*	*			trans	-106.7	150.5	-166	-73.7	-168.9	87.5	0	0	115.5
494	Q	34.4	Very low	35.8	Very low	156 Å²	156	142.1 Å²	142.1	73%	0.729	76%	0.759	S	S	*	*			trans	66.2	164.3	140.6	-75.9	-177.1	55.5	0	0	120.6
495	P	34.5	Very low	36.3	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	77%	0.765	S	S	*	*			cis	-137.3	152.1	-31.8	34.6	-17	0	0	0	116.7
496	A	32	Very low	36.3	Very low	84 Å²	84	144.6 Å²	144.6	69%	0.694	77%	0.766	S	S	*	*			trans	15.1	133.4	143.8	0	0	0	0	0	124.9
497	Q	32.3	Very low	36.3	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	77%	0.767	S	S	*	*				73.4	162	129.7	-77.6	-171.3	-20.1	0	0	121.4
498	P	33.3	Very low	36.5	Very low	111 Å²	111	144.4 Å²	144.4	72%	0.721	77%	0.772	S	S	*	*			cis	-117.6	-178.5	3.8	41.2	-28.6	0	0	0	115.8
499	T	30.5	Very low	36.7	Very low	130 Å²	130	146 Å²	146	80%	0.798	78%	0.775	S	S	*	*			trans	-128.7	135.8	178.6	48.2	0	0	0	0	111.1
500	E	36.4	Very low	37.4	Very low	174 Å²	174	144 Å²	144	81%	0.813	77%	0.774	S	S	*	*			trans	-146.8	140.3	171.6	-62.9	172.4	174.6	0	0	105.3
501	D	34.8	Very low	38	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	77%	0.768	S	S	*	*			cis	-147.9	141	-13.5	-95.2	-27	0	0	0	107.6
502	E	36.8	Very low	38.6	Very low	185 Å²	185	143 Å²	143	86%	0.864	77%	0.772	S	S	*	*			trans	-105.7	133.7	171.1	-70	-104.8	119.5	0	0	109.4
503	N	38.4	Very low	38.4	Very low	155 Å²	155	142 Å²	142	83%	0.829	77%	0.768	S	S	*	*			trans	-128.6	97	171.8	-86.8	-85.6	0	0	0	109.2
504	D	39.7	Very low	38.6	Very low	132 Å²	132	139.8 Å²	139.8	71%	0.706	77%	0.767	S	S	*	*			trans	-113.8	113.7	-177.4	-168.1	13	0	0	0	110.1	E506	D504-E506 PolarHBondContact O-N 2.94Å
505	P	42.9	Very low	38.7	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	77%	0.773	S	S	*	*			trans	-98.3	35.6	-165.8	38.5	-36.7	0	0	0	115.4	N507	P505-N507 PolarHBondContact O-N 2.8Å
506	E	38.3	Very low	38.9	Very low	170 Å²	170	141.4 Å²	141.4	79%	0.794	78%	0.78	S	S	*	*			trans	-71.3	85.6	170.1	-75.9	-150.8	150.2	0	0	112.4	D504	D504-E506 PolarHBondContact O-N 2.94Å
507	N	36	Very low	39.1	Very low	136 Å²	136	146.1 Å²	146.1	73%	0.727	79%	0.787	S	S	*	*			trans	-161.9	72.6	159.8	-117.6	-72.6	0	0	0	114.4	P505	P505-N507 PolarHBondContact O-N 2.8Å
508	F	38	Very low	39.1	Very low	209 Å²	209	145.8 Å²	145.8	92%	0.917	79%	0.791	S	S	*	*			trans	-137.5	91.7	162	-104.7	-83.1	0	0	0	111.5	P510	F508-P510 WeakPolarHBondContact O-CD 3.48Å
509	I	43.2	Very low	39.4	Very low	152 Å²	152	148.7 Å²	148.7	78%	0.779	80%	0.8	S	S	*	*			trans	-91.5	110.2	169.1	-60.9	169.8	0	0	0	107.9
510	P	51.6	Low	39.9	Very low	105 Å²	105	153.3 Å²	153.3	68%	0.682	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.3	148	171.8	30	-33.6	0	0	0	111	F508	F508-P510 WeakPolarHBondContact O-CD 3.48Å
511	P	50.3	Low	40	Very low	104 Å²	104	153.2 Å²	153.2	68%	0.675	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-79.9	152.9	-174.4	32.5	-36	0	0	0	113.1
512	P	45.9	Very low	40	Very low	129 Å²	129	150 Å²	150	84%	0.838	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.7	137.6	173.9	30.3	-34.6	0	0	0	111.7
513	L	40.6	Very low	39.9	Very low	157 Å²	157	149.2 Å²	149.2	82%	0.822	81%	0.809	S	S	*	*			trans	-113.1	160.4	176.1	-75.7	175.8	0	0	0	111.5
514	P	41.5	Very low	39.7	Very low	101 Å²	101	147.1 Å²	147.1	66%	0.656	80%	0.804	S	S	*	*			trans	-92.8	165.9	-141.6	34.8	-37.9	0	0	0	115.9
515	P	35.1	Very low	39.6	Very low	131 Å²	131	147.7 Å²	147.7	85%	0.851	81%	0.812	S	S	*	*			trans	-66.6	145.6	175.5	-15.8	30.5	0	0	0	112.6
516	I	39	Very low	39.5	Very low	167 Å²	167	147.1 Å²	147.1	86%	0.856	81%	0.811	S	S	*	*			trans	-113.7	136.4	171.9	-62.4	179	0	0	0	108.9
517	E	36.7	Very low	39.2	Very low	182 Å²	182	146 Å²	146	85%	0.85	81%	0.81	S	S	*	*			trans	-82	158.1	-170.1	-61	-172.4	129.8	0	0	114.1
518	L	31.7	Very low	39.3	Very low	173 Å²	173	147.3 Å²	147.3	91%	0.906	82%	0.817	S	S	*	*			trans	-63	136.6	174.5	-70.2	162.9	0	0	0	111.6
519	N	39.9	Very low	39.3	Very low	172 Å²	172	141.2 Å²	141.2	92%	0.92	81%	0.806	S	S	*	*			trans	-109.5	149.8	161.6	-109.7	-43.6	0	0	0	111.9
520	R	40.3	Very low	39.4	Very low	228 Å²	228	139.5 Å²	139.5	86%	0.86	80%	0.797	S	S	*	*			trans	-129.2	96.8	-160.2	171.9	-160.5	178.4	176	0.8	109.8
521	D	39.5	Very low	39.6	Very low	172 Å²	172	143.5 Å²	143.5	92%	0.92	81%	0.807	S	S	*	*			trans	-170.5	132.5	150.9	-92.2	-29.9	0	0	0	107.6
522	G	34.3	Very low	39.8	Very low	70 Å²	70	143 Å²	143	72%	0.722	80%	0.798	S	S	*	*			trans	-126.6	144.8	-158.5	0	0	0	0	0	116.3
523	N	34.8	Very low	40.3	Very low	168 Å²	168	144.3 Å²	144.3	90%	0.898	80%	0.797	S	S	*	*			trans	-151.9	147.6	134.3	-107	-37.1	0	0	0	110.3
524	P	33.7	Very low	41.3	Very low	112 Å²	112	144.6 Å²	144.6	73%	0.727	79%	0.794	S	S	*	*			trans	-99.5	157.6	-161.5	37.6	-36	0	0	0	114.7
525	V	38.9	Very low	42.7	Very low	143 Å²	143	141.4 Å²	141.4	87%	0.867	77%	0.774	S	S	*	*			trans	-129.5	116.3	159.5	-179.8	0	0	0	0	109.9
526	S	39.6	Very low	44.7	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	76%	0.762	S	S	*	*			trans	25.2	110.5	161.4	-160.7	0	0	0	0	120
527	N	33.3	Very low	46.4	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	76%	0.755	S	S	*	*			trans	-36.3	144.7	154.5	-46	-23.6	0	0	0	114.1
528	N	37.9	Very low	48.3	Very low	164 Å²	164	129.9 Å²	129.9	88%	0.877	72%	0.72	S	S	*	*				-148.5	131.7	114	-93	-25.1	0	0	0	108.2
529	A	38.2	Very low	50.4	Low	82 Å²	82	126.4 Å²	126.4	68%	0.678	70%	0.701	S	S	*	*			trans	-88.1	130.5	179.1	0	0	0	0	0	110	E531	A529-E531 HydrophobicContact CB-CG 3.99Å; A529-E531 PolarHBondContact O-N 3.01Å
530	I	45.6	Very low	52.3	Low	115 Å²	115	125.7 Å²	125.7	59%	0.59	69%	0.69	S	S	*	*			trans	-93.2	92.2	166	-58.6	176.9	0	0	0	106.1	D532 A538	I530-D532 PolarHBondContact O-N 2.85Å; I530-A538 HydrophobicContact CG2-CB 4.34Å
531	E	54.9	Low	54.1	Low	190 Å²	190	117.4 Å²	117.4	89%	0.888	67%	0.671	S	S	*	*			trans	-81.4	0.4	-178.4	-63.4	-171.6	134.1	0	0	113.3	A529	A529-E531 HydrophobicContact CB-CG 3.99Å; A529-E531 PolarHBondContact O-N 3.01Å
532	D	54.9	Low	56	Low	94 Å²	94	113.9 Å²	113.9	50%	0.503	66%	0.655	S	S	.	*			trans	-123	103.1	-179.3	-169.6	-10.4	0	0	0	112.2	I530 H534 S535	I530-D532 PolarHBondContact O-N 2.85Å; D532-H534 PolarHBondContact O-N 3.36Å; D532-H534 PolarHBondContact OD1-N 3.21Å; D532-S535 WeakPolarHBondContact O-CB 3.21Å; D532-S535 PolarHBondContact O-N 2.89Å; D532-S535 PolarHBondContact O-OG 2.92Å
533	L	56.4	Low	58.1	Low	156 Å²	156	118.9 Å²	118.9	82%	0.817	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-21.3	178.1	-80.7	159.7	0	0	0	113.8
534	H	62.1	Low	60.3	Low	163 Å²	163	113.4 Å²	113.4	76%	0.755	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	3.1	-178.6	-64.4	174.6	0	0	0	112.9	D532	D532-H534 PolarHBondContact O-N 3.36Å; D532-H534 PolarHBondContact OD1-N 3.21Å
535	S	71.2	Confident	62.5	Low	33 Å²	33	110.6 Å²	110.6	23%	0.231	62%	0.616	C	S	.	*	S	Bend	trans	-61.1	138.1	174.4	62.8	0	0	0	0	111.6	D532 E537 A538 I539	D532-S535 WeakPolarHBondContact O-CB 3.21Å; D532-S535 PolarHBondContact O-N 2.89Å; D532-S535 PolarHBondContact O-OG 2.92Å; S535-E537 PolarHBondContact O-N 3.22Å; S535-A538 WeakPolarHBondContact O-CA 3.32Å; S535-A538 WeakPolarHBondContact O-CB 3.19Å; S535-A538 PolarHBondContact O-N 2.66Å; S535-A538 VanDerWaalsContact OG-CB 3.28Å; S535-A538 WeakPolarHBondContact OG-CB 3.46Å; S535-A538 PolarHBondContact OG-N 2.84Å; S535-I539 PolarHBondContact O-N 2.65Å
536	A	75.1	Confident	64.4	Low	72 Å²	72	110 Å²	110	60%	0.595	60%	0.604	S	S	*	*	H	α-helix	trans	-61.7	-18.5	-178.4	0	0	0	0	0	113.7	K540	A536-K540 WeakPolarHBondContact O-CG 3.35Å; A536-K540 PolarHBondContact O-N 2.84Å
537	E	76.7	Confident	66.2	Low	152 Å²	152	110.5 Å²	110.5	71%	0.71	60%	0.598	S	S	*	*	H	α-helix	trans	-79.8	-38.7	172.4	-168.1	158.3	-146.8	0	0	111.9	S535 K540 A541	S535-E537 PolarHBondContact O-N 3.22Å; E537-K540 PolarHBondContact O-N 2.69Å; E537-A541 WeakPolarHBondContact O-CB 3.19Å; E537-A541 PolarHBondContact O-N 2.8Å
538	A	75.3	Confident	68.3	Low	15 Å²	15	110.3 Å²	110.3	12%	0.124	59%	0.592	C	S	.	*	H	α-helix	trans	-62.8	-43.8	170	0	0	0	0	0	111.8	I530 S535 K540 A541 V542	I530-A538 HydrophobicContact CG2-CB 4.34Å; S535-A538 WeakPolarHBondContact O-CA 3.32Å; S535-A538 WeakPolarHBondContact O-CB 3.19Å; S535-A538 PolarHBondContact O-N 2.66Å; S535-A538 VanDerWaalsContact OG-CB 3.28Å; S535-A538 WeakPolarHBondContact OG-CB 3.46Å; S535-A538 PolarHBondContact OG-N 2.84Å; A538-K540 VanDerWaalsContact C-N 3.31Å; A538-K540 PolarHBondContact O-N 3.41Å; A538-A541 PolarHBondContact O-N 3.33Å; A538-A541 VanDerWaalsContact O-N 3.11Å; A538-V542 WeakPolarHBondContact O-CG2 3.41Å; A538-V542 PolarHBondContact O-N 2.99Å
539	I	76.7	Confident	70.2	Confident	99 Å²	99	104.8 Å²	104.8	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-60.6	-41	176.6	-63.3	170.9	0	0	0	110.9	S535 R543	S535-I539 PolarHBondContact O-N 2.65Å; I539-R543 WeakPolarHBondContact O-CB 3.41Å; I539-R543 PolarHBondContact O-N 2.9Å
540	K	78.2	Confident	72	Confident	157 Å²	157	103.4 Å²	103.4	68%	0.683	56%	0.558	S	S	*	*	H	α-helix	trans	-64.6	-41.4	172.9	-79.8	174.8	178.8	176.7	0	112.5	A536 E537 A538 R543 A544	A536-K540 WeakPolarHBondContact O-CG 3.35Å; A536-K540 PolarHBondContact O-N 2.84Å; E537-K540 PolarHBondContact O-N 2.69Å; A538-K540 VanDerWaalsContact C-N 3.31Å; A538-K540 PolarHBondContact O-N 3.41Å; K540-R543 PolarHBondContact O-N 2.72Å; K540-A544 VanDerWaalsContact O-CB 3.28Å; K540-A544 WeakPolarHBondContact O-CB 3.31Å; K540-A544 PolarHBondContact O-N 3.44Å
541	A	79.1	Confident	73.4	Confident	55 Å²	55	100.3 Å²	100.3	46%	0.455	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-42.8	178.6	0	0	0	0	0	112.1	E537 A538 A544 A545	E537-A541 WeakPolarHBondContact O-CB 3.19Å; E537-A541 PolarHBondContact O-N 2.8Å; A538-A541 PolarHBondContact O-N 3.33Å; A538-A541 VanDerWaalsContact O-N 3.11Å; A541-A544 PolarHBondContact O-N 3.47Å; A541-A545 WeakPolarHBondContact O-CB 3.46Å; A541-A545 PolarHBondContact O-N 3.04Å
542	V	80	Confident	74.3	Confident	98 Å²	98	96.1 Å²	96.1	59%	0.594	53%	0.532	S	S	*	.	H	α-helix	trans	-60.9	-50.2	174.2	171.9	0	0	0	0	110.5	A538 A544 A545 E546	A538-V542 WeakPolarHBondContact O-CG2 3.41Å; A538-V542 PolarHBondContact O-N 2.99Å; V542-A544 VanDerWaalsContact C-N 3.29Å; V542-A544 PolarHBondContact O-N 2.61Å; V542-A545 PolarHBondContact O-N 3.33Å; V542-A545 VanDerWaalsContact O-N 3.14Å; V542-E546 WeakPolarHBondContact O-CB 3.48Å; V542-E546 PolarHBondContact O-N 2.78Å
543	R	77.4	Confident	75.1	Confident	175 Å²	175	97.1 Å²	97.1	66%	0.66	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-31.7	179.9	-159.5	174.2	-165.9	154.9	5.3	112.9	I539 K540 L547	I539-R543 WeakPolarHBondContact O-CB 3.41Å; I539-R543 PolarHBondContact O-N 2.9Å; K540-R543 PolarHBondContact O-N 2.72Å; R543-L547 WeakPolarHBondContact O-CB 3.28Å; R543-L547 VanDerWaalsContact O-CG 3.28Å; R543-L547 WeakPolarHBondContact O-CG 3.31Å; R543-L547 PolarHBondContact O-N 3.12Å
544	A	80.6	Confident	75.6	Confident	52 Å²	52	96.2 Å²	96.2	43%	0.43	53%	0.528	S	S	.	.	H	α-helix	trans	-71	-39.6	173	0	0	0	0	0	112.3	K540 A541 V542 Q548	K540-A544 VanDerWaalsContact O-CB 3.28Å; K540-A544 WeakPolarHBondContact O-CB 3.31Å; K540-A544 PolarHBondContact O-N 3.44Å; A541-A544 PolarHBondContact O-N 3.47Å; V542-A544 VanDerWaalsContact C-N 3.29Å; V542-A544 PolarHBondContact O-N 2.61Å; A544-Q548 WeakPolarHBondContact O-CG 3.41Å; A544-Q548 PolarHBondContact O-N 3.31Å
545	A	80.9	Confident	75.7	Confident	54 Å²	54	93.8 Å²	93.8	45%	0.446	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-37.6	174.6	0	0	0	0	0	112.1	A541 V542 Q548 A549	A541-A545 WeakPolarHBondContact O-CB 3.46Å; A541-A545 PolarHBondContact O-N 3.04Å; V542-A545 PolarHBondContact O-N 3.33Å; V542-A545 VanDerWaalsContact O-N 3.14Å; A545-Q548 PolarHBondContact O-N 2.85Å; A545-A549 WeakPolarHBondContact O-CB 3.48Å; A545-A549 PolarHBondContact O-N 2.77Å
546	E	78.3	Confident	75.4	Confident	131 Å²	131	100 Å²	100	61%	0.612	54%	0.542	S	S	*	.	H	α-helix	trans	-64.6	-44	174.3	-174.7	173.4	-137.4	0	0	111.7	V542 Q548 A549 A550	V542-E546 WeakPolarHBondContact O-CB 3.48Å; V542-E546 PolarHBondContact O-N 2.78Å; E546-Q548 PolarHBondContact O-N 2.93Å; E546-A549 PolarHBondContact O-N 2.89Å; E546-A550 WeakPolarHBondContact O-CB 3.4Å; E546-A550 PolarHBondContact O-N 3.29Å
547	L	77.3	Confident	75	Confident	119 Å²	119	100.7 Å²	100.7	62%	0.623	54%	0.543	S	S	*	.	H	α-helix	trans	-63.8	-36.9	172.1	-73.8	168.8	0	0	0	112.7	R543 A551	R543-L547 WeakPolarHBondContact O-CB 3.28Å; R543-L547 VanDerWaalsContact O-CG 3.28Å; R543-L547 WeakPolarHBondContact O-CG 3.31Å; R543-L547 PolarHBondContact O-N 3.12Å; L547-A551 WeakPolarHBondContact O-CB 3.09Å; L547-A551 PolarHBondContact O-N 3.28Å
548	Q	78.7	Confident	74.6	Confident	140 Å²	140	96 Å²	96	65%	0.654	52%	0.52	S	S	*	.	H	α-helix	trans	-68	-36.5	172.8	-78.3	-174.4	-19.9	0	0	112.6	A544 A545 E546 L552	A544-Q548 WeakPolarHBondContact O-CG 3.41Å; A544-Q548 PolarHBondContact O-N 3.31Å; A545-Q548 PolarHBondContact O-N 2.85Å; E546-Q548 PolarHBondContact O-N 2.93Å; Q548-L552 WeakPolarHBondContact O-CB 3.4Å; Q548-L552 PolarHBondContact O-N 3.32Å
549	A	76.4	Confident	74.2	Confident	49 Å²	49	98.8 Å²	98.8	41%	0.405	53%	0.532	S	S	.	.	H	α-helix	trans	-67.6	-43.2	174.9	0	0	0	0	0	111.6	A545 E546 L552 I553	A545-A549 WeakPolarHBondContact O-CB 3.48Å; A545-A549 PolarHBondContact O-N 2.77Å; E546-A549 PolarHBondContact O-N 2.89Å; A549-L552 PolarHBondContact O-N 3.45Å; A549-I553 VanDerWaalsContact O-CG1 3.3Å; A549-I553 WeakPolarHBondContact O-CG1 3.31Å; A549-I553 PolarHBondContact O-N 2.98Å
550	A	75.4	Confident	73.6	Confident	52 Å²	52	99 Å²	99	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-60.3	-46.1	173.5	0	0	0	0	0	111.6	E546 L552 I553 E554	E546-A550 WeakPolarHBondContact O-CB 3.4Å; E546-A550 PolarHBondContact O-N 3.29Å; A550-L552 VanDerWaalsContact C-N 3.34Å; A550-L552 PolarHBondContact O-N 3.47Å; A550-I553 PolarHBondContact O-N 3.31Å; A550-E554 PolarHBondContact O-N 3.32Å
551	A	75	Confident	73.3	Confident	50 Å²	50	96.4 Å²	96.4	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-60	-41	174.9	0	0	0	0	0	112.3	L547 E554 E555	L547-A551 WeakPolarHBondContact O-CB 3.09Å; L547-A551 PolarHBondContact O-N 3.28Å; A551-E554 CarbonylContact O-C 3.56Å; A551-E554 PolarHBondContact O-N 3.01Å; A551-E555 WeakPolarHBondContact O-CG 3.29Å; A551-E555 PolarHBondContact O-N 2.88Å
552	L	74.4	Confident	72.5	Confident	102 Å²	102	99.5 Å²	99.5	53%	0.534	55%	0.55	S	S	.	.	H	α-helix	trans	-65.4	-36.4	175.1	-87	165.7	0	0	0	113.1	Q548 A549 A550 E555 E556	Q548-L552 WeakPolarHBondContact O-CB 3.4Å; Q548-L552 PolarHBondContact O-N 3.32Å; A549-L552 PolarHBondContact O-N 3.45Å; A550-L552 VanDerWaalsContact C-N 3.34Å; A550-L552 PolarHBondContact O-N 3.47Å; L552-E555 WeakPolarHBondContact O-CA 3.49Å; L552-E555 WeakPolarHBondContact O-CB 3.46Å; L552-E555 PolarHBondContact O-N 3.22Å; L552-E555 VanDerWaalsContact O-N 3.14Å; L552-E556 PolarHBondContact O-N 3.41Å
553	I	72	Confident	72.1	Confident	116 Å²	116	106.6 Å²	106.6	60%	0.595	57%	0.568	S	S	*	*	H	α-helix	trans	-66.9	-40	174.8	-68	162.4	0	0	0	110.5	A549 A550 E555 E556 S557	A549-I553 VanDerWaalsContact O-CG1 3.3Å; A549-I553 WeakPolarHBondContact O-CG1 3.31Å; A549-I553 PolarHBondContact O-N 2.98Å; A550-I553 PolarHBondContact O-N 3.31Å; I553-E555 VanDerWaalsContact C-N 3.31Å; I553-E556 PolarHBondContact O-N 3.03Å; I553-S557 PolarHBondContact O-N 3.25Å
554	E	66.6	Low	71.9	Confident	136 Å²	136	100.2 Å²	100.2	64%	0.636	55%	0.55	S	S	*	*	H	α-helix	trans	-65.4	-33.5	169.4	-69.7	-165.1	159.7	0	0	112.1	A550 A551 S557 Y558 R567	A550-E554 PolarHBondContact O-N 3.32Å; A551-E554 CarbonylContact O-C 3.56Å; A551-E554 PolarHBondContact O-N 3.01Å; E554-S557 PolarHBondContact O-OG 3.13Å; E554-Y558 PolarHBondContact O-N 3.27Å; E554-R567 PolarHBondContact O-NH2 2.87Å
555	E	64.7	Low	71.6	Confident	113 Å²	113	102.6 Å²	102.6	53%	0.528	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-46.8	173.1	-73.2	-150	125.8	0	0	112.5	A551 L552 I553 Y558 R567	A551-E555 WeakPolarHBondContact O-CG 3.29Å; A551-E555 PolarHBondContact O-N 2.88Å; L552-E555 WeakPolarHBondContact O-CA 3.49Å; L552-E555 WeakPolarHBondContact O-CB 3.46Å; L552-E555 PolarHBondContact O-N 3.22Å; L552-E555 VanDerWaalsContact O-N 3.14Å; I553-E555 VanDerWaalsContact C-N 3.31Å; E555-Y558 PolarHBondContact O-N 2.82Å; E555-R567 PolarHBondContact O-NH1 2.82Å
556	E	64.3	Low	71.3	Confident	162 Å²	162	105.2 Å²	105.2	76%	0.757	57%	0.574	S	S	*	*	H	α-helix	trans	-66.8	-33.1	176.8	-70.9	-167.8	158.6	0	0	113.3	L552 I553 Y558 N559	L552-E556 PolarHBondContact O-N 3.41Å; I553-E556 PolarHBondContact O-N 3.03Å; E556-Y558 PolarHBondContact O-N 3.33Å; E556-N559 PolarHBondContact O-ND2 2.92Å
557	S	67.4	Low	71	Confident	87 Å²	87	104.9 Å²	104.9	61%	0.608	57%	0.567	S	S	*	*	H	α-helix	trans	-61.4	-33	176.7	80.8	0	0	0	0	112.2	I553 E554 N559	I553-S557 PolarHBondContact O-N 3.25Å; E554-S557 PolarHBondContact O-OG 3.13Å; S557-N559 PolarHBondContact O-N 2.85Å; S557-N559 VanDerWaalsContact O-N 3.08Å; S557-N559 PolarHBondContact O-ND2 3.04Å
558	Y	68.8	Low	70.9	Confident	55 Å²	55	104.5 Å²	104.5	22%	0.216	56%	0.564	C	S	.	*			trans	-79.1	96.4	-175.3	-179.7	-96.6	0	0	0	111.5	E554 E555 E556 P560 P565 P566 R567	E554-Y558 PolarHBondContact O-N 3.27Å; E555-Y558 PolarHBondContact O-N 2.82Å; E556-Y558 PolarHBondContact O-N 3.33Å; Y558-P560 HydrophobicContact CE1-CB 3.96Å; Y558-P560 HydrophobicContact CE1-CG 4.5Å; Y558-P560 WeakPolarHBondContact O-CD 3.16Å; Y558-P565 WeakPolarHBondContact CE2-O 3.29Å; Y558-P565 PolarHBondContact OH-O 3.45Å; Y558-P566 WeakPolarHBondContact OH-CA 3.46Å; Y558-R567 HydrophobicContact CD1-CG 4.26Å; Y558-R567 HydrophobicContact CD2-CG 4.28Å; Y558-R567 HydrophobicContact CE1-CB 4.43Å; Y558-R567 HydrophobicContact CE1-CG 3.92Å; Y558-R567 HydrophobicContact CE2-CG 3.93Å; Y558-R567 HydrophobicContact CG-CG 4.43Å; Y558-R567 VanDerWaalsContact CG-CZ 3.5Å; Y558-R567 PolarHBondContact OH-N 2.89Å; Y558-R567 VanDerWaalsContact OH-N 3.08Å
559	N	65.1	Low	70.8	Confident	73 Å²	73	102.4 Å²	102.4	39%	0.39	56%	0.557	S	S	.	*			trans	-90.9	108.2	171.8	-78.9	-101.4	0	0	0	109.4	E556 S557 S561 L562 S564	E556-N559 PolarHBondContact O-ND2 2.92Å; S557-N559 PolarHBondContact O-N 2.85Å; S557-N559 VanDerWaalsContact O-N 3.08Å; S557-N559 PolarHBondContact O-ND2 3.04Å; N559-S561 PolarHBondContact O-N 3.13Å; N559-S561 VanDerWaalsContact O-N 3.12Å; N559-L562 HydrophobicContact CB-CB 4.42Å; N559-L562 HydrophobicContact CB-CD1 4.05Å; N559-L562 HydrophobicContact CB-CG 4.28Å; N559-L562 PolarHBondContact O-N 3.12Å; N559-L562 VanDerWaalsContact O-N 3.15Å; N559-S564 PolarHBondContact O-OG 3.03Å
560	P	64.7	Low	70.6	Confident	103 Å²	103	105.5 Å²	105.5	67%	0.669	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-2.8	177.1	29.5	-36.3	0	0	0	113.5	Y558	Y558-P560 HydrophobicContact CE1-CB 3.96Å; Y558-P560 HydrophobicContact CE1-CG 4.5Å; Y558-P560 WeakPolarHBondContact O-CD 3.16Å
561	S	73	Confident	70.8	Confident	102 Å²	102	110.5 Å²	110.5	71%	0.713	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-4.1	173.7	52.4	0	0	0	0	113.9	N559	N559-S561 PolarHBondContact O-N 3.13Å; N559-S561 VanDerWaalsContact O-N 3.12Å
562	L	61.8	Low	71	Confident	121 Å²	121	113.5 Å²	113.5	63%	0.634	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	179.5	172	-69.2	173.5	0	0	0	110.1	N559 S564	N559-L562 HydrophobicContact CB-CB 4.42Å; N559-L562 HydrophobicContact CB-CD1 4.05Å; N559-L562 HydrophobicContact CB-CG 4.28Å; N559-L562 PolarHBondContact O-N 3.12Å; N559-L562 VanDerWaalsContact O-N 3.15Å; L562-S564 PolarHBondContact O-N 3.16Å
563	Y	70.3	Confident	70.9	Confident	246 Å²	246	111.5 Å²	111.5	97%	0.965	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	17	-174.1	-101.1	-92.6	0	0	0	115.6
564	S	74.9	Confident	70.7	Confident	42 Å²	42	113.2 Å²	113.2	29%	0.294	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-57.3	132.5	173.9	-41.8	0	0	0	0	111.1	N559 L562	N559-S564 PolarHBondContact O-OG 3.03Å; L562-S564 PolarHBondContact O-N 3.16Å
565	P	74.2	Confident	70.3	Confident	101 Å²	101	114.4 Å²	114.4	66%	0.656	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-58.1	152.4	170.3	-23.5	34.2	0	0	0	111.6	Y558 R567	Y558-P565 WeakPolarHBondContact CE2-O 3.29Å; Y558-P565 PolarHBondContact OH-O 3.45Å; P565-R567 PolarHBondContact O-N 2.61Å
566	P	73.9	Confident	70.1	Confident	110 Å²	110	113.7 Å²	113.7	71%	0.714	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-60.3	130.9	172.7	26.2	-33.8	0	0	0	110.4	Y558 I568	Y558-P566 WeakPolarHBondContact OH-CA 3.46Å; P566-I568 PolarHBondContact O-N 3.28Å
567	R	71.5	Confident	70.2	Confident	124 Å²	124	108.2 Å²	108.2	47%	0.468	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-61	130	171.8	-92.3	-179.9	167.1	146.9	7.7	109.7	E554 E555 Y558 P565	E554-R567 PolarHBondContact O-NH2 2.87Å; E555-R567 PolarHBondContact O-NH1 2.82Å; Y558-R567 HydrophobicContact CD1-CG 4.26Å; Y558-R567 HydrophobicContact CD2-CG 4.28Å; Y558-R567 HydrophobicContact CE1-CB 4.43Å; Y558-R567 HydrophobicContact CE1-CG 3.92Å; Y558-R567 HydrophobicContact CE2-CG 3.93Å; Y558-R567 HydrophobicContact CG-CG 4.43Å; Y558-R567 VanDerWaalsContact CG-CZ 3.5Å; Y558-R567 PolarHBondContact OH-N 2.89Å; Y558-R567 VanDerWaalsContact OH-N 3.08Å; P565-R567 PolarHBondContact O-N 2.61Å
568	I	75.5	Confident	70.3	Confident	110 Å²	110	108.8 Å²	108.8	56%	0.564	59%	0.589	S	S	*	*			trans	-110.3	132.8	174.1	-60.4	171.9	0	0	0	106.5	P566 D572 L573	P566-I568 PolarHBondContact O-N 3.28Å; I568-D572 HydrophobicContact CG2-CB 3.93Å; I568-L573 HydrophobicContact CG2-CD1 4.09Å
569	N	76.2	Confident	70.6	Confident	96 Å²	96	112.5 Å²	112.5	51%	0.513	61%	0.611	S	S	.	*			trans	-69.3	148.6	175.3	-58.2	-59.2	0	0	0	109.8	D571 D572 L573	N569-D571 PolarHBondContact O-N 3.21Å; N569-D571 VanDerWaalsContact O-N 3.11Å; N569-D572 HydrophobicContact CB-CB 4.28Å; N569-D572 WeakPolarHBondContact CB-OD2 3.49Å; N569-D572 PolarHBondContact ND2-OD2 3.03Å; N569-D572 PolarHBondContact O-N 2.84Å; N569-L573 PolarHBondContact O-N 2.78Å
570	P	73.7	Confident	71.1	Confident	115 Å²	115	115.5 Å²	115.5	75%	0.747	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-27.8	175.8	24.2	-34.1	0	0	0	112.9
571	D	78.7	Confident	71.8	Confident	157 Å²	157	115 Å²	115	84%	0.84	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-22.9	176.6	-57.9	-38.3	0	0	0	114.1	N569 L573	N569-D571 PolarHBondContact O-N 3.21Å; N569-D571 VanDerWaalsContact O-N 3.11Å; D571-L573 VanDerWaalsContact C-N 3.34Å
572	D	80	Confident	72.3	Confident	112 Å²	112	114.6 Å²	114.6	60%	0.599	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-6.7	175.9	-76.8	-52.7	0	0	0	112.2	I568 N569 E574	I568-D572 HydrophobicContact CG2-CB 3.93Å; N569-D572 HydrophobicContact CB-CB 4.28Å; N569-D572 WeakPolarHBondContact CB-OD2 3.49Å; N569-D572 PolarHBondContact ND2-OD2 3.03Å; N569-D572 PolarHBondContact O-N 2.84Å; D572-E574 PolarHBondContact O-N 3.39Å
573	L	71.5	Confident	73.4	Confident	60 Å²	60	116.2 Å²	116.2	31%	0.314	61%	0.609	S	S	.	*	S	Bend	trans	-75.8	124.5	-177.1	-159.4	77.7	0	0	0	110.4	I568 N569 D571 L575 A577 I579	I568-L573 HydrophobicContact CG2-CD1 4.09Å; N569-L573 PolarHBondContact O-N 2.78Å; D571-L573 VanDerWaalsContact C-N 3.34Å; L573-L575 PolarHBondContact O-N 3.41Å; L573-A577 HydrophobicContact CD1-CB 4.11Å; L573-A577 HydrophobicContact CD2-CB 3.89Å; L573-A577 HydrophobicContact CG-CB 3.71Å; L573-I579 HydrophobicContact CD2-CD1 3.67Å; L573-I579 HydrophobicContact CD2-CG1 3.71Å
574	E	67.3	Low	74	Confident	153 Å²	153	109 Å²	109	72%	0.715	59%	0.587	S	S	*	*			trans	-55.5	136.2	175.9	-66.6	-174.3	174.9	0	0	110.7	D572 D576 A577	D572-E574 PolarHBondContact O-N 3.39Å; E574-D576 PolarHBondContact O-N 3.2Å; E574-A577 VanDerWaalsContact O-CB 3.24Å; E574-A577 WeakPolarHBondContact O-CB 3.42Å; E574-A577 PolarHBondContact O-N 2.8Å
575	L	58	Low	74.4	Confident	160 Å²	160	109.7 Å²	109.7	84%	0.838	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-0.9	179.7	-61.6	172.8	0	0	0	114.1	L573 R644	L573-L575 PolarHBondContact O-N 3.41Å; L575-R644 VanDerWaalsContact O-CZ 3.3Å; L575-R644 PolarHBondContact O-NH1 2.8Å; L575-R644 PolarHBondContact O-NH2 2.98Å
576	D	60.6	Low	75.1	Confident	99 Å²	99	111.1 Å²	111.1	53%	0.529	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-12.5	174.3	-81.4	85.7	0	0	0	112.7	E574 V578 R644	E574-D576 PolarHBondContact O-N 3.2Å; D576-V578 PolarHBondContact O-N 3.49Å; D576-R644 VanDerWaalsContact CG-NE 3.32Å; D576-R644 IonicContact OD1-CZ 3.79Å; D576-R644 IonicContact OD1-NE 2.61Å; D576-R644 PolarHBondContact OD1-NE 3.4Å; D576-R644 VanDerWaalsContact OD1-NE 3.13Å; D576-R644 IonicContact OD1-NH2 4Å; D576-R644 PolarHBondContact OD1-NH2 2.9Å; D576-R644 VanDerWaalsContact OD2-CD 3.29Å; D576-R644 WeakPolarHBondContact OD2-CD 3.33Å; D576-R644 IonicContact OD2-CZ 2.66Å; D576-R644 IonicContact OD2-NE 2.61Å; D576-R644 PolarHBondContact OD2-NE 3.02Å; D576-R644 IonicContact OD2-NH1 3.41Å; D576-R644 IonicContact OD2-NH2 3.54Å
577	A	67.5	Low	75.7	Confident	47 Å²	47	109 Å²	109	39%	0.388	58%	0.577	S	S	.	*			trans	-71.6	113.2	-174.8	0	0	0	0	0	111.8	L573 E574 I579	L573-A577 HydrophobicContact CD1-CB 4.11Å; L573-A577 HydrophobicContact CD2-CB 3.89Å; L573-A577 HydrophobicContact CG-CB 3.71Å; E574-A577 VanDerWaalsContact O-CB 3.24Å; E574-A577 WeakPolarHBondContact O-CB 3.42Å; E574-A577 PolarHBondContact O-N 2.8Å; A577-I579 PolarHBondContact O-N 3.36Å
578	V	69.7	Low	76.3	Confident	99 Å²	99	107.1 Å²	107.1	60%	0.6	57%	0.572	S	S	*	*			trans	-79	102.1	172	-174	0	0	0	0	108.8	D576 Y580	D576-V578 PolarHBondContact O-N 3.49Å; V578-Y580 HydrophobicContact CB-CE2 3.97Å; V578-Y580 HydrophobicContact CG1-CD1 4.46Å; V578-Y580 HydrophobicContact CG1-CD2 4.14Å; V578-Y580 HydrophobicContact CG1-CE1 3.94Å; V578-Y580 HydrophobicContact CG1-CE2 3.6Å; V578-Y580 VanDerWaalsContact CG1-CZ 3.48Å; V578-Y580 WeakPolarHBondContact O-CD2 3.06Å; V578-Y580 PolarHBondContact O-N 3.49Å
579	I	73.9	Confident	76.8	Confident	132 Å²	132	104.8 Å²	104.8	68%	0.677	56%	0.56	S	S	*	*			trans	-68.6	124.6	168.4	-51.8	175.2	0	0	0	107.8	L573 A577	L573-I579 HydrophobicContact CD2-CD1 3.67Å; L573-I579 HydrophobicContact CD2-CG1 3.71Å; A577-I579 PolarHBondContact O-N 3.36Å
580	Y	75.4	Confident	77.4	Confident	137 Å²	137	104.3 Å²	104.3	54%	0.537	56%	0.555	S	S	.	*			trans	-108.8	130.5	168.4	-67.9	-79.4	0	0	0	108.5	V578	V578-Y580 HydrophobicContact CB-CE2 3.97Å; V578-Y580 HydrophobicContact CG1-CD1 4.46Å; V578-Y580 HydrophobicContact CG1-CD2 4.14Å; V578-Y580 HydrophobicContact CG1-CE1 3.94Å; V578-Y580 HydrophobicContact CG1-CE2 3.6Å; V578-Y580 VanDerWaalsContact CG1-CZ 3.48Å; V578-Y580 WeakPolarHBondContact O-CD2 3.06Å; V578-Y580 PolarHBondContact O-N 3.49Å
581	N	80.4	Confident	77.9	Confident	91 Å²	91	105.8 Å²	105.8	49%	0.487	55%	0.546	S	S	.	.			trans	-67.6	145.2	168.4	-57.1	-49.1	0	0	0	109	E583 D584 D585	N581-E583 PolarHBondContact O-N 3.32Å; N581-D584 HydrophobicContact CB-CB 4.22Å; N581-D584 WeakPolarHBondContact CB-OD2 3.46Å; N581-D584 PolarHBondContact ND2-OD2 2.83Å; N581-D584 PolarHBondContact O-N 3.46Å; N581-D585 PolarHBondContact O-N 2.93Å; N581-D585 VanDerWaalsContact O-N 3.1Å
582	P	83.6	Confident	78.1	Confident	95 Å²	95	103.2 Å²	103.2	62%	0.617	53%	0.529	S	S	*	.	H	α-helix	trans	-64.6	-26.3	-178.6	26.3	-34.7	0	0	0	112.7	Q586	P582-Q586 WeakPolarHBondContact O-CB 3.41Å; P582-Q586 VanDerWaalsContact O-CG 3.26Å; P582-Q586 WeakPolarHBondContact O-CG 3.38Å; P582-Q586 PolarHBondContact O-N 3.37Å; P582-Q586 PolarHBondContact O-NE2 2.9Å
583	E	84.6	Confident	78.4	Confident	155 Å²	155	104.4 Å²	104.4	72%	0.724	53%	0.525	S	S	*	.	H	α-helix	trans	-75.1	-46.1	176.1	-61.9	178	175.2	0	0	111.4	N581 D585 Q586 A587	N581-E583 PolarHBondContact O-N 3.32Å; E583-D585 PolarHBondContact O-N 3.11Å; E583-Q586 PolarHBondContact O-N 3.4Å; E583-A587 WeakPolarHBondContact O-CB 3.35Å; E583-A587 PolarHBondContact O-N 3.28Å
584	D	83.4	Confident	79.1	Confident	94 Å²	94	107.4 Å²	107.4	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-60.6	-43	177	-75	-44.6	0	0	0	112.1	N581 K588	N581-D584 HydrophobicContact CB-CB 4.22Å; N581-D584 WeakPolarHBondContact CB-OD2 3.46Å; N581-D584 PolarHBondContact ND2-OD2 2.83Å; N581-D584 PolarHBondContact O-N 3.46Å; D584-K588 WeakPolarHBondContact O-CB 3.47Å; D584-K588 PolarHBondContact O-N 2.88Å
585	D	83.5	Confident	79.6	Confident	56 Å²	56	101.4 Å²	101.4	30%	0.299	51%	0.51	S	S	.	.	H	α-helix	trans	-71.8	-35.3	179.2	-157.9	57.3	0	0	0	111.9	N581 E583 K588 I589	N581-D585 PolarHBondContact O-N 2.93Å; N581-D585 VanDerWaalsContact O-N 3.1Å; E583-D585 PolarHBondContact O-N 3.11Å; D585-K588 PolarHBondContact O-N 2.94Å; D585-K588 IonicContact OD1-NZ 2.66Å; D585-K588 PolarHBondContact OD1-NZ 3.2Å; D585-I589 WeakPolarHBondContact O-CB 3.42Å; D585-I589 WeakPolarHBondContact O-CD1 3.42Å; D585-I589 WeakPolarHBondContact O-CG1 3.48Å; D585-I589 PolarHBondContact O-N 2.97Å
586	Q	87.9	Confident	80.8	Confident	132 Å²	132	96.3 Å²	96.3	62%	0.617	49%	0.485	S	S	*	.	H	α-helix	trans	-61.9	-50	170.3	-80.8	176.7	74	0	0	111.9	P582 E583 K588 I589 E590	P582-Q586 WeakPolarHBondContact O-CB 3.41Å; P582-Q586 VanDerWaalsContact O-CG 3.26Å; P582-Q586 WeakPolarHBondContact O-CG 3.38Å; P582-Q586 PolarHBondContact O-N 3.37Å; P582-Q586 PolarHBondContact O-NE2 2.9Å; E583-Q586 PolarHBondContact O-N 3.4Å; Q586-K588 VanDerWaalsContact C-N 3.29Å; Q586-K588 PolarHBondContact O-N 3.05Å; Q586-I589 PolarHBondContact O-N 2.85Å; Q586-E590 WeakPolarHBondContact O-CB 3.24Å; Q586-E590 PolarHBondContact O-N 3.22Å
587	A	87.7	Confident	81.7	Confident	65 Å²	65	98.8 Å²	98.8	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-59.5	-40.2	178.5	0	0	0	0	0	112	E583 E590 Y591	E583-A587 WeakPolarHBondContact O-CB 3.35Å; E583-A587 PolarHBondContact O-N 3.28Å; A587-E590 PolarHBondContact O-N 3.24Å; A587-Y591 WeakPolarHBondContact O-CB 3.49Å; A587-Y591 PolarHBondContact O-N 3.29Å
588	K	84.3	Confident	82.2	Confident	84 Å²	84	104.5 Å²	104.5	37%	0.365	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-40.7	174.9	173.1	178.8	152.4	-135.9	0	112.9	D584 D585 Q586 Q592	D584-K588 WeakPolarHBondContact O-CB 3.47Å; D584-K588 PolarHBondContact O-N 2.88Å; D585-K588 PolarHBondContact O-N 2.94Å; D585-K588 IonicContact OD1-NZ 2.66Å; D585-K588 PolarHBondContact OD1-NZ 3.2Å; Q586-K588 VanDerWaalsContact C-N 3.29Å; Q586-K588 PolarHBondContact O-N 3.05Å; K588-Q592 WeakPolarHBondContact O-CG 3.44Å; K588-Q592 PolarHBondContact O-N 3.45Å
589	I	85	Confident	82.3	Confident	62 Å²	62	102.6 Å²	102.6	32%	0.318	50%	0.498	S	S	.	.	H	α-helix	trans	-65	-42.6	173.2	-73.5	164.5	0	0	0	110.4	D585 Q586 Q592 R593	D585-I589 WeakPolarHBondContact O-CB 3.42Å; D585-I589 WeakPolarHBondContact O-CD1 3.42Å; D585-I589 WeakPolarHBondContact O-CG1 3.48Å; D585-I589 PolarHBondContact O-N 2.97Å; Q586-I589 PolarHBondContact O-N 2.85Å; I589-Q592 PolarHBondContact O-N 3.25Å; I589-R593 WeakPolarHBondContact O-CG 3.46Å; I589-R593 PolarHBondContact O-N 3.05Å
590	E	87.9	Confident	82.2	Confident	86 Å²	86	99.6 Å²	99.6	40%	0.402	50%	0.499	S	S	.	.	H	α-helix	trans	-68.3	-40.4	-179.2	-144.1	56.6	-143	0	0	111.8	Q586 A587 Q592 R593 Q594	Q586-E590 WeakPolarHBondContact O-CB 3.24Å; Q586-E590 PolarHBondContact O-N 3.22Å; A587-E590 PolarHBondContact O-N 3.24Å; E590-Q592 PolarHBondContact O-N 2.84Å; E590-R593 WeakPolarHBondContact O-CB 3.46Å; E590-R593 PolarHBondContact O-N 2.83Å; E590-R593 IonicContact OE1-NH1 3.49Å; E590-R593 WeakPolarHBondContact OE2-CD 3.26Å; E590-R593 IonicContact OE2-CZ 2.65Å; E590-R593 IonicContact OE2-NE 2.78Å; E590-R593 IonicContact OE2-NH1 2.61Å; E590-R593 PolarHBondContact OE2-NH1 3.2Å; E590-Q594 WeakPolarHBondContact O-CG 3.47Å; E590-Q594 PolarHBondContact O-N 3.37Å
591	Y	85.8	Confident	81.6	Confident	145 Å²	145	97.2 Å²	97.2	57%	0.569	50%	0.499	S	S	*	.	H	α-helix	trans	-58.2	-46.4	169.8	177.8	-97.6	0	0	0	112.1	A587 R593 Q594 E595	A587-Y591 WeakPolarHBondContact O-CB 3.49Å; A587-Y591 PolarHBondContact O-N 3.29Å; Y591-R593 VanDerWaalsContact C-N 3.34Å; Y591-R593 PolarHBondContact O-N 2.95Å; Y591-Q594 PolarHBondContact O-N 2.92Å; Y591-E595 WeakPolarHBondContact O-CB 3.43Å; Y591-E595 PolarHBondContact O-N 2.96Å
592	Q	82	Confident	80.5	Confident	103 Å²	103	99.9 Å²	99.9	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-37.7	176.7	-74	179.4	13.1	0	0	112.4	K588 I589 E590 V596	K588-Q592 WeakPolarHBondContact O-CG 3.44Å; K588-Q592 PolarHBondContact O-N 3.45Å; I589-Q592 PolarHBondContact O-N 3.25Å; E590-Q592 PolarHBondContact O-N 2.84Å; Q592-V596 WeakPolarHBondContact O-CB 3.5Å; Q592-V596 VanDerWaalsContact O-CG2 3.23Å; Q592-V596 WeakPolarHBondContact O-CG2 3.31Å; Q592-V596 PolarHBondContact O-N 3.2Å
593	R	87.3	Confident	79.3	Confident	137 Å²	137	101.4 Å²	101.4	52%	0.517	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-48	173.1	-73.7	166.7	174.6	173.2	-0.2	111.5	I589 E590 Y591 E595 V596 L597	I589-R593 WeakPolarHBondContact O-CG 3.46Å; I589-R593 PolarHBondContact O-N 3.05Å; E590-R593 WeakPolarHBondContact O-CB 3.46Å; E590-R593 PolarHBondContact O-N 2.83Å; E590-R593 IonicContact OE1-NH1 3.49Å; E590-R593 WeakPolarHBondContact OE2-CD 3.26Å; E590-R593 IonicContact OE2-CZ 2.65Å; E590-R593 IonicContact OE2-NE 2.78Å; E590-R593 IonicContact OE2-NH1 2.61Å; E590-R593 PolarHBondContact OE2-NH1 3.2Å; Y591-R593 VanDerWaalsContact C-N 3.34Å; Y591-R593 PolarHBondContact O-N 2.95Å; R593-E595 PolarHBondContact O-N 3.49Å; R593-V596 PolarHBondContact O-N 3.3Å; R593-L597 WeakPolarHBondContact O-CB 3.33Å; R593-L597 VanDerWaalsContact O-CG 3.28Å; R593-L597 WeakPolarHBondContact O-CG 3.43Å; R593-L597 PolarHBondContact O-N 3.44Å
594	Q	84.7	Confident	78	Confident	123 Å²	123	95 Å²	95	58%	0.575	48%	0.483	S	S	*	.	H	α-helix	trans	-60.7	-43.7	178	-70.8	176.4	22.1	0	0	111.7	E590 Y591 V596 L597 R598	E590-Q594 WeakPolarHBondContact O-CG 3.47Å; E590-Q594 PolarHBondContact O-N 3.37Å; Y591-Q594 PolarHBondContact O-N 2.92Å; Q594-V596 PolarHBondContact O-N 3.01Å; Q594-L597 PolarHBondContact O-N 2.97Å; Q594-R598 WeakPolarHBondContact O-CB 3.43Å; Q594-R598 PolarHBondContact O-N 3.11Å
595	E	79.4	Confident	77.2	Confident	28 Å²	28	95.1 Å²	95.1	13%	0.131	49%	0.487	C	S	.	.	H	α-helix	trans	-67.4	-36	178.9	-179.1	64.9	174.1	0	0	112.7	Y591 R593 R598 T599 Q603	Y591-E595 WeakPolarHBondContact O-CB 3.43Å; Y591-E595 PolarHBondContact O-N 2.96Å; R593-E595 PolarHBondContact O-N 3.49Å; E595-R598 PolarHBondContact O-N 2.89Å; E595-R598 IonicContact OE1-CZ 3.97Å; E595-R598 IonicContact OE1-NH2 3.56Å; E595-R598 PolarHBondContact OE1-NH2 2.98Å; E595-R598 IonicContact OE2-CZ 3.91Å; E595-R598 IonicContact OE2-NE 2.68Å; E595-R598 PolarHBondContact OE2-NE 3.45Å; E595-R598 IonicContact OE2-NH2 3.4Å; E595-R598 PolarHBondContact OE2-NH2 3.49Å; E595-T599 VanDerWaalsContact O-CB 3.23Å; E595-T599 WeakPolarHBondContact O-CB 3.42Å; E595-T599 PolarHBondContact O-N 3.3Å; E595-T599 PolarHBondContact O-OG1 2.96Å; E595-T599 PolarHBondContact OE1-OG1 3.21Å; E595-Q603 HydrophobicContact CG-CG 3.95Å; E595-Q603 PolarHBondContact OE1-NE2 2.94Å
596	V	82.4	Confident	76.4	Confident	53 Å²	53	99.7 Å²	99.7	32%	0.321	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-44.3	171.4	167.8	0	0	0	0	111.5	Q592 R593 Q594 R598 T599 G600 M602	Q592-V596 WeakPolarHBondContact O-CB 3.5Å; Q592-V596 VanDerWaalsContact O-CG2 3.23Å; Q592-V596 WeakPolarHBondContact O-CG2 3.31Å; Q592-V596 PolarHBondContact O-N 3.2Å; R593-V596 PolarHBondContact O-N 3.3Å; Q594-V596 PolarHBondContact O-N 3.01Å; V596-R598 VanDerWaalsContact C-N 3.3Å; V596-R598 PolarHBondContact O-N 3.43Å; V596-T599 PolarHBondContact O-N 2.99Å; V596-G600 WeakPolarHBondContact O-CA 3.4Å; V596-G600 PolarHBondContact O-N 2.85Å; V596-M602 HydrophobicContact CG2-CB 4.26Å; V596-M602 HydrophobicContact CG2-CG 3.68Å
597	L	79.7	Confident	75.5	Confident	151 Å²	151	97.2 Å²	97.2	79%	0.791	50%	0.495	S	S	*	.	H	α-helix	trans	-63	-37.4	176	-71.9	167.4	0	0	0	111.7	R593 Q594	R593-L597 WeakPolarHBondContact O-CB 3.33Å; R593-L597 VanDerWaalsContact O-CG 3.28Å; R593-L597 WeakPolarHBondContact O-CG 3.43Å; R593-L597 PolarHBondContact O-N 3.44Å; Q594-L597 PolarHBondContact O-N 2.97Å
598	R	77.4	Confident	74.8	Confident	167 Å²	167	99.2 Å²	99.2	63%	0.63	49%	0.493	S	S	*	.	H	α-helix	trans	-72.7	-36.7	178.4	-165.4	-171.6	66.8	67.4	3.8	113.3	Q594 E595 V596	Q594-R598 WeakPolarHBondContact O-CB 3.43Å; Q594-R598 PolarHBondContact O-N 3.11Å; E595-R598 PolarHBondContact O-N 2.89Å; E595-R598 IonicContact OE1-CZ 3.97Å; E595-R598 IonicContact OE1-NH2 3.56Å; E595-R598 PolarHBondContact OE1-NH2 2.98Å; E595-R598 IonicContact OE2-CZ 3.91Å; E595-R598 IonicContact OE2-NE 2.68Å; E595-R598 PolarHBondContact OE2-NE 3.45Å; E595-R598 IonicContact OE2-NH2 3.4Å; E595-R598 PolarHBondContact OE2-NH2 3.49Å; V596-R598 VanDerWaalsContact C-N 3.3Å; V596-R598 PolarHBondContact O-N 3.43Å
599	T	72.9	Confident	74.2	Confident	59 Å²	59	99.9 Å²	99.9	36%	0.362	50%	0.498	S	S	.	.	H	α-helix	trans	-108.6	-13.3	-166.9	-41.7	0	0	0	0	113.4	E595 V596 T601	E595-T599 VanDerWaalsContact O-CB 3.23Å; E595-T599 WeakPolarHBondContact O-CB 3.42Å; E595-T599 PolarHBondContact O-N 3.3Å; E595-T599 PolarHBondContact O-OG1 2.96Å; E595-T599 PolarHBondContact OE1-OG1 3.21Å; V596-T599 PolarHBondContact O-N 2.99Å; T599-T601 PolarHBondContact O-N 2.66Å; T599-T601 VanDerWaalsContact O-N 3.14Å; T599-T601 PolarHBondContact O-OG1 2.69Å
600	G	70.5	Confident	73.6	Confident	68 Å²	68	98.6 Å²	98.6	70%	0.701	49%	0.491	S	S	*	.	S	Bend	trans	69.1	3.5	-178.9	0	0	0	0	0	114.4	V596	V596-G600 WeakPolarHBondContact O-CA 3.4Å; V596-G600 PolarHBondContact O-N 2.85Å
601	T	62.5	Low	73	Confident	87 Å²	87	96.6 Å²	96.6	53%	0.534	48%	0.483	S	S	.	.	S	Bend	trans	-142.5	146.4	-179.2	50.1	0	0	0	0	108.7	T599	T599-T601 PolarHBondContact O-N 2.66Å; T599-T601 VanDerWaalsContact O-N 3.14Å; T599-T601 PolarHBondContact O-OG1 2.69Å
602	M	58.6	Low	72.7	Confident	148 Å²	148	94.9 Å²	94.9	73%	0.729	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-69.6	134.3	167.7	-64.7	178.7	73	0	0	108.7	V596 A604	V596-M602 HydrophobicContact CG2-CB 4.26Å; V596-M602 HydrophobicContact CG2-CG 3.68Å; M602-A604 PolarHBondContact O-N 3.09Å
603	Q	57.4	Low	72.4	Confident	126 Å²	126	96.1 Å²	96.1	59%	0.589	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-58.5	123.4	162.6	-71.7	-165.7	5.4	0	0	107.5	E595	E595-Q603 HydrophobicContact CG-CG 3.95Å; E595-Q603 PolarHBondContact OE1-NE2 2.94Å
604	A	57.8	Low	71.7	Confident	20 Å²	20	89.6 Å²	89.6	17%	0.165	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-67.8	136	178.2	0	0	0	0	0	109.3	M602 E608 E609	M602-A604 PolarHBondContact O-N 3.09Å; A604-E608 HydrophobicContact CB-CB 4.02Å; A604-E608 HydrophobicContact CB-CG 4.02Å; A604-E608 WeakPolarHBondContact CB-OE2 3.29Å; A604-E609 HydrophobicContact CB-CG 4Å
605	T	67.1	Low	71.4	Confident	97 Å²	97	89.8 Å²	89.8	60%	0.595	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-59.1	152.5	170.1	49	0	0	0	0	109.6	E607 E608 E609	T605-E607 CarbonylContact O-C 3.58Å; T605-E607 PolarHBondContact O-N 3.3Å; T605-E608 PolarHBondContact O-N 3.19Å; T605-E609 PolarHBondContact O-N 3.36Å; T605-E609 VanDerWaalsContact O-N 3.12Å
606	E	66.6	Low	71	Confident	152 Å²	152	94.6 Å²	94.6	71%	0.71	47%	0.469	S	S	*	.	H	α-helix	trans	-51.6	-30.4	-178.5	-57.4	-176.7	144.8	0	0	112.9	L610	E606-L610 VanDerWaalsContact O-CB 3.3Å; E606-L610 WeakPolarHBondContact O-CB 3.49Å; E606-L610 WeakPolarHBondContact O-CD1 3.46Å; E606-L610 WeakPolarHBondContact O-CG 3.38Å; E606-L610 PolarHBondContact O-N 3Å
607	E	68.2	Low	70.1	Confident	80 Å²	80	94 Å²	94	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-57.6	-53	170.6	173.5	152.1	-110.7	0	0	113.3	T605 E609 L610 I611 R649	T605-E607 CarbonylContact O-C 3.58Å; T605-E607 PolarHBondContact O-N 3.3Å; E607-E609 VanDerWaalsContact C-N 3.3Å; E607-E609 PolarHBondContact O-N 2.9Å; E607-L610 PolarHBondContact O-N 3.4Å; E607-I611 HydrophobicContact CG-CD1 3.6Å; E607-I611 HydrophobicContact CG-CG1 4.43Å; E607-I611 WeakPolarHBondContact O-CB 3.31Å; E607-I611 VanDerWaalsContact O-CG1 3.25Å; E607-I611 WeakPolarHBondContact O-CG1 3.27Å; E607-I611 PolarHBondContact O-N 2.89Å; E607-R649 IonicContact OE1-CZ 3.9Å; E607-R649 VanDerWaalsContact OE1-CZ 3.24Å; E607-R649 IonicContact OE1-NE 2.65Å; E607-R649 PolarHBondContact OE1-NE 3.41Å; E607-R649 IonicContact OE1-NH2 2.75Å; E607-R649 PolarHBondContact OE1-NH2 3Å; E607-R649 IonicContact OE2-CZ 3.78Å; E607-R649 IonicContact OE2-NH2 3.16Å; E607-R649 PolarHBondContact OE2-NH2 3.1Å
608	E	72.8	Confident	69.5	Low	107 Å²	107	87 Å²	87	50%	0.5	44%	0.437	S	S	.	.	H	α-helix	trans	-68.3	-33.5	-178.4	177.2	175.8	-160.3	0	0	110.8	A604 T605 I611 R612	A604-E608 HydrophobicContact CB-CB 4.02Å; A604-E608 HydrophobicContact CB-CG 4.02Å; A604-E608 WeakPolarHBondContact CB-OE2 3.29Å; T605-E608 PolarHBondContact O-N 3.19Å; E608-I611 PolarHBondContact O-N 3.38Å; E608-R612 WeakPolarHBondContact O-CB 3.36Å; E608-R612 PolarHBondContact O-N 3.21Å
609	E	72.4	Confident	68.8	Low	98 Å²	98	87.1 Å²	87.1	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-62.4	-47.7	171.2	-62	-108.1	115.5	0	0	111.7	A604 T605 E607 R612 R613	A604-E609 HydrophobicContact CB-CG 4Å; T605-E609 PolarHBondContact O-N 3.36Å; T605-E609 VanDerWaalsContact O-N 3.12Å; E607-E609 VanDerWaalsContact C-N 3.3Å; E607-E609 PolarHBondContact O-N 2.9Å; E609-R612 PolarHBondContact O-N 3.34Å; E609-R612 IonicContact OE1-CZ 3.27Å; E609-R612 IonicContact OE1-NH1 3.31Å; E609-R612 PolarHBondContact OE1-NH1 2.93Å; E609-R613 WeakPolarHBondContact O-CB 3.34Å; E609-R613 PolarHBondContact O-N 3.32Å
610	L	72	Confident	68.3	Low	35 Å²	35	90.3 Å²	90.3	18%	0.183	46%	0.459	C	S	.	.	H	α-helix	trans	-62.3	-42.2	175.9	-75.9	165.1	0	0	0	111.9	E606 E607 R613 A614 F686	E606-L610 VanDerWaalsContact O-CB 3.3Å; E606-L610 WeakPolarHBondContact O-CB 3.49Å; E606-L610 WeakPolarHBondContact O-CD1 3.46Å; E606-L610 WeakPolarHBondContact O-CG 3.38Å; E606-L610 PolarHBondContact O-N 3Å; E607-L610 PolarHBondContact O-N 3.4Å; L610-R613 PolarHBondContact O-N 3.35Å; L610-A614 WeakPolarHBondContact O-CB 3.37Å; L610-A614 PolarHBondContact O-N 2.84Å; L610-F686 HydrophobicContact CB-CD1 3.98Å; L610-F686 HydrophobicContact CB-CE1 3.8Å; L610-F686 HydrophobicContact CB-CG 4.43Å; L610-F686 HydrophobicContact CB-CZ 4.11Å; L610-F686 HydrophobicContact CD2-CD1 3.82Å; L610-F686 HydrophobicContact CD2-CE1 4.25Å; L610-F686 HydrophobicContact CG-CD1 4.36Å; L610-F686 WeakPolarHBondContact O-CE1 3.44Å; L610-F686 WeakPolarHBondContact O-CZ 3.23Å
611	I	76.6	Confident	67.9	Low	44 Å²	44	89.2 Å²	89.2	23%	0.226	45%	0.448	C	S	.	.	H	α-helix	trans	-67.5	-42	176	-70.1	168.5	0	0	0	110.9	E607 E608 A614 R615 F651 F686	E607-I611 HydrophobicContact CG-CD1 3.6Å; E607-I611 HydrophobicContact CG-CG1 4.43Å; E607-I611 WeakPolarHBondContact O-CB 3.31Å; E607-I611 VanDerWaalsContact O-CG1 3.25Å; E607-I611 WeakPolarHBondContact O-CG1 3.27Å; E607-I611 PolarHBondContact O-N 2.89Å; E608-I611 PolarHBondContact O-N 3.38Å; I611-A614 PolarHBondContact O-N 2.86Å; I611-R615 WeakPolarHBondContact O-CG 3.3Å; I611-R615 PolarHBondContact O-N 3.44Å; I611-F651 HydrophobicContact CG1-CD2 4.39Å; I611-F651 HydrophobicContact CG2-CD2 3.98Å; I611-F651 HydrophobicContact CG2-CE2 4.03Å; I611-F651 HydrophobicContact CG2-CG 4.4Å; I611-F651 HydrophobicContact CG2-CZ 4.48Å; I611-F686 HydrophobicContact CG1-CE2 4.49Å
612	R	78.9	Confident	68.2	Low	110 Å²	110	89.1 Å²	89.1	42%	0.415	44%	0.442	S	S	.	.	H	α-helix	trans	-58.7	-47.8	174.7	-173.2	-171.2	-58.5	144.6	3.4	110	E608 E609 A614 R615 E616	E608-R612 WeakPolarHBondContact O-CB 3.36Å; E608-R612 PolarHBondContact O-N 3.21Å; E609-R612 PolarHBondContact O-N 3.34Å; E609-R612 IonicContact OE1-CZ 3.27Å; E609-R612 IonicContact OE1-NH1 3.31Å; E609-R612 PolarHBondContact OE1-NH1 2.93Å; R612-A614 VanDerWaalsContact C-N 3.33Å; R612-A614 PolarHBondContact O-N 3.4Å; R612-R615 CarbonylContact O-C 3.55Å; R612-R615 WeakPolarHBondContact O-CA 3.32Å; R612-R615 WeakPolarHBondContact O-CB 3.39Å; R612-R615 PolarHBondContact O-N 3.37Å; R612-E616 WeakPolarHBondContact O-CG 3.45Å; R612-E616 PolarHBondContact O-N 2.91Å
613	R	74.9	Confident	69.1	Low	129 Å²	129	82.5 Å²	82.5	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-67.8	-28.4	178.1	-162.4	143.5	-169	79.3	-20.4	113.9	E609 L610 E616 I750	E609-R613 WeakPolarHBondContact O-CB 3.34Å; E609-R613 PolarHBondContact O-N 3.32Å; L610-R613 PolarHBondContact O-N 3.35Å; R613-E616 IonicContact CZ-OE2 3.71Å; R613-E616 IonicContact NH1-OE1 2.76Å; R613-E616 IonicContact NH1-OE2 3.78Å; R613-E616 PolarHBondContact NH1-OE2 2.84Å; R613-I750 HydrophobicContact CB-CD1 4.49Å; R613-I750 HydrophobicContact CG-CD1 4.29Å
614	A	73.3	Confident	70.3	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-71.8	-36.9	168.2	0	0	0	0	0	112.3	L610 I611 R612 M618 F651 N684 F686	L610-A614 WeakPolarHBondContact O-CB 3.37Å; L610-A614 PolarHBondContact O-N 2.84Å; I611-A614 PolarHBondContact O-N 2.86Å; R612-A614 VanDerWaalsContact C-N 3.33Å; R612-A614 PolarHBondContact O-N 3.4Å; A614-M618 WeakPolarHBondContact O-CG 3.37Å; A614-F651 HydrophobicContact CB-CB 4.45Å; A614-F651 HydrophobicContact CB-CD1 3.95Å; A614-N684 HydrophobicContact CB-CB 4.26Å; A614-F686 HydrophobicContact CB-CE1 4.08Å; A614-F686 HydrophobicContact CB-CZ 3.8Å
615	R	78	Confident	71.6	Confident	126 Å²	126	83.9 Å²	83.9	48%	0.475	42%	0.421	S	S	.	.	H	α-helix	trans	-69.1	-34.6	175.7	-75.5	177.5	177.8	-122.9	8.4	113.5	I611 R612 G617 M618 F651	I611-R615 WeakPolarHBondContact O-CG 3.3Å; I611-R615 PolarHBondContact O-N 3.44Å; R612-R615 CarbonylContact O-C 3.55Å; R612-R615 WeakPolarHBondContact O-CA 3.32Å; R612-R615 WeakPolarHBondContact O-CB 3.39Å; R612-R615 PolarHBondContact O-N 3.37Å; R615-G617 PolarHBondContact O-N 2.94Å; R615-M618 PolarHBondContact O-N 2.94Å; R615-F651 HydrophobicContact CG-CE1 3.76Å; R615-F651 HydrophobicContact CG-CZ 3.89Å
616	E	70.9	Confident	72.4	Confident	130 Å²	130	80.8 Å²	80.8	61%	0.607	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-29.4	179.6	-76.6	175.3	150.3	0	0	114.1	R612 R613	R612-E616 WeakPolarHBondContact O-CG 3.45Å; R612-E616 PolarHBondContact O-N 2.91Å; R613-E616 IonicContact CZ-OE2 3.71Å; R613-E616 IonicContact NH1-OE1 2.76Å; R613-E616 IonicContact NH1-OE2 3.78Å; R613-E616 PolarHBondContact NH1-OE2 2.84Å
617	G	63.4	Low	73.2	Confident	40 Å²	40	77.4 Å²	77.4	41%	0.412	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-3.8	176	0	0	0	0	0	115.6	R615 W754	R615-G617 PolarHBondContact O-N 2.94Å; G617-W754 WeakPolarHBondContact O-CH2 3.28Å
618	M	66.8	Low	73.8	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.025	41%	0.406	C	S	.	.	S	Bend	trans	-113.1	97.6	-170.1	-68.7	-179.7	130	0	0	111.5	A614 R615 D620 F651 R653 K682 N684 W754	A614-M618 WeakPolarHBondContact O-CG 3.37Å; R615-M618 PolarHBondContact O-N 2.94Å; M618-D620 PolarHBondContact O-N 3.39Å; M618-F651 HydrophobicContact SD-CD1 4.05Å; M618-F651 HydrophobicContact SD-CE1 3.81Å; M618-R653 HydrophobicContact CE-CB 4.12Å; M618-R653 HydrophobicContact CE-CG 4.04Å; M618-R653 VanDerWaalsContact SD-CD 3.58Å; M618-R653 HydrophobicContact SD-CG 4.26Å; M618-K682 HydrophobicContact CE-CB 3.33Å; M618-K682 HydrophobicContact CE-CD 3.87Å; M618-K682 HydrophobicContact CE-CG 4.24Å; M618-N684 WeakPolarHBondContact CE-ND2 3.43Å; M618-N684 PolarHBondContact SD-ND2 3.3Å; M618-N684 VanDerWaalsContact SD-ND2 3.38Å; M618-W754 HydrophobicContact CG-CH2 4.34Å; M618-W754 HydrophobicContact CG-CZ2 4.04Å
619	E	64.2	Low	74.3	Confident	169 Å²	169	77.4 Å²	77.4	79%	0.79	40%	0.4	S	S	*	.			trans	-49.9	131.8	170.4	-175.9	174.4	-146.9	0	0	111.9	G621	E619-G621 PolarHBondContact O-N 2.87Å
620	D	60.9	Low	75	Confident	125 Å²	125	75 Å²	75	67%	0.668	39%	0.39	S	S	*	.	S	Bend	trans	-78	49.7	-175.2	-71.7	-47.5	0	0	0	113.9	M618 R653	M618-D620 PolarHBondContact O-N 3.39Å; D620-R653 IonicContact OD1-CZ 3.48Å; D620-R653 IonicContact OD1-NH1 2.67Å; D620-R653 PolarHBondContact OD1-NH1 2.96Å; D620-R653 VanDerWaalsContact OD1-NH1 3.07Å; D620-R653 IonicContact OD1-NH2 3.61Å
621	G	61.9	Low	75.4	Confident	45 Å²	45	79.1 Å²	79.1	46%	0.464	42%	0.419	S	S	.	.	S	Bend	trans	-79.8	-153.2	172.2	0	0	0	0	0	113.4	E619 D623	E619-G621 PolarHBondContact O-N 2.87Å; G621-D623 PolarHBondContact O-N 3.16Å
622	E	68.6	Low	75.4	Confident	86 Å²	86	78.9 Å²	78.9	40%	0.402	42%	0.42	S	S	.	.	S	Bend	trans	-72.4	31.2	-176.6	-57.2	-174.3	-127.3	0	0	114.8	T656 K676	E622-T656 WeakPolarHBondContact CB-O 3.25Å; E622-T656 PolarHBondContact O-N 3.48Å; E622-T656 PolarHBondContact O-OG1 3.21Å; E622-K676 WeakPolarHBondContact OE2-CE 3.21Å; E622-K676 IonicContact OE2-NZ 3.08Å; E622-K676 PolarHBondContact OE2-NZ 3.43Å
623	D	78.7	Confident	75	Confident	9 Å²	9	82.1 Å²	82.1	5%	0.048	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	99.6	-175.1	-81.9	15.6	0	0	0	111.5	G621 R653 V654 H655 K682	G621-D623 PolarHBondContact O-N 3.16Å; D623-R653 HydrophobicContact CB-CB 4.08Å; D623-R653 VanDerWaalsContact CB-NE 3.31Å; D623-R653 PolarHBondContact O-NE 3.18Å; D623-R653 PolarHBondContact O-NH2 3.13Å; D623-V654 WeakPolarHBondContact CA-O 3.5Å; D623-H655 WeakPolarHBondContact OD1-CA 3.32Å; D623-H655 WeakPolarHBondContact OD1-CB 3.47Å; D623-H655 IonicContact OD1-CE1 3.98Å; D623-H655 IonicContact OD1-CG 3.17Å; D623-H655 IonicContact OD1-ND1 3.61Å; D623-H655 PolarHBondContact OD1-ND1 3.28Å; D623-K682 IonicContact OD1-NZ 2.7Å; D623-K682 WeakPolarHBondContact OD2-CD 3.18Å; D623-K682 WeakPolarHBondContact OD2-CE 3.44Å; D623-K682 IonicContact OD2-NZ 3.75Å; D623-K682 PolarHBondContact OD2-NZ 3.23Å
624	A	82.6	Confident	74.5	Confident	51 Å²	51	84 Å²	84	42%	0.421	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.3	177.7	0	0	0	0	0	111.7	R653 V654	A624-R653 CarbonylContact O-C 3.55Å; A624-R653 VanDerWaalsContact O-CA 3.24Å; A624-R653 WeakPolarHBondContact O-CA 3.44Å; A624-V654 PolarHBondContact N-O 2.95Å; A624-V654 PolarHBondContact O-N 3.28Å
625	Q	84.8	Confident	74.2	Confident	123 Å²	123	87 Å²	87	58%	0.575	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	144.8	174.4	-175.8	175.5	-14.1	0	0	111.1	F651 N652	Q625-F651 HydrophobicContact CG-CE2 4.29Å; Q625-N652 WeakPolarHBondContact CA-O 3.35Å
626	F	84.9	Confident	74	Confident	33 Å²	33	86.8 Å²	86.8	15%	0.145	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154	173.2	81.6	-69.2	0	0	0	112.5	N652 V654 Y681 F683 F727	F626-N652 HydrophobicContact CD1-CB 3.8Å; F626-N652 HydrophobicContact CE1-CB 3.46Å; F626-N652 VanDerWaalsContact CE1-CB 3.46Å; F626-N652 HydrophobicContact CZ-CB 4.06Å; F626-N652 PolarHBondContact N-O 3.03Å; F626-V654 HydrophobicContact CB-CG2 4.05Å; F626-V654 HydrophobicContact CD1-CB 4.49Å; F626-V654 HydrophobicContact CD1-CG2 3.25Å; F626-V654 HydrophobicContact CD2-CG2 4.34Å; F626-V654 HydrophobicContact CE1-CG2 3.64Å; F626-V654 HydrophobicContact CG-CG2 3.64Å; F626-V654 HydrophobicContact CZ-CG2 4.34Å; F626-Y681 AromaticContact CE1-CD1 3.85Å; F626-Y681 HydrophobicContact CE1-CD1 3.85Å; F626-Y681 HydrophobicContact CE1-CE1 4.34Å; F626-Y681 HydrophobicContact CE2-CE1 4.4Å; F626-Y681 AromaticContact CZ-CD1 3.66Å; F626-Y681 HydrophobicContact CZ-CD1 3.66Å; F626-Y681 AromaticContact CZ-CE1 3.93Å; F626-Y681 HydrophobicContact CZ-CE1 3.93Å; F626-F683 HydrophobicContact CE1-CE1 4.4Å; F626-F683 HydrophobicContact CE2-CE1 4.45Å; F626-F683 HydrophobicContact CZ-CD1 4.5Å; F626-F683 AromaticContact CZ-CE1 3.63Å; F626-F683 HydrophobicContact CZ-CE1 3.63Å; F626-F683 AromaticContact CZ-CZ 3.77Å; F626-F683 HydrophobicContact CZ-CZ 3.77Å; F626-F727 HydrophobicContact CE2-CD1 4.14Å
627	S	82.1	Confident	74.2	Confident	80 Å²	80	82.6 Å²	82.6	56%	0.559	47%	0.471	S	S	*	.			trans	-137.3	6.9	-172.8	52.6	0	0	0	0	115.3	M629	S627-M629 PolarHBondContact O-N 2.88Å
628	V	81.8	Confident	75	Confident	109 Å²	109	89.2 Å²	89.2	66%	0.661	50%	0.496	S	S	*	.			trans	-73	98.1	-175.4	-174.3	0	0	0	0	111.1	F727	V628-F727 WeakPolarHBondContact O-CD1 3.43Å
629	M	83.1	Confident	75.8	Confident	78 Å²	78	90.9 Å²	90.9	38%	0.384	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	156.6	167	-68	-174.3	-72.4	0	0	111.4	S627 F650 I725 A726 F727	S627-M629 PolarHBondContact O-N 2.88Å; M629-F650 HydrophobicContact CE-CE1 4Å; M629-F650 HydrophobicContact CE-CZ 4.08Å; M629-F650 HydrophobicContact CG-CE1 4Å; M629-F650 HydrophobicContact CG-CZ 3.89Å; M629-F650 HydrophobicContact SD-CE1 3.49Å; M629-F650 WeakPolarHBondContact SD-CE1 3.47Å; M629-F650 HydrophobicContact SD-CZ 3.9Å; M629-I725 HydrophobicContact SD-CB 4.32Å; M629-I725 HydrophobicContact SD-CG2 4.08Å; M629-A726 CarbonylContact C-O 3.56Å; M629-A726 WeakPolarHBondContact CA-O 3.48Å; M629-F727 HydrophobicContact CG-CD1 4.32Å; M629-F727 HydrophobicContact CG-CE1 3.66Å; M629-F727 HydrophobicContact CG-CZ 3.94Å
630	I	85.6	Confident	76.6	Confident	49 Å²	49	85.3 Å²	85.3	25%	0.251	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.6	161.8	-44.4	-179.4	0	0	0	107.1	V632 I713 A726 K728	I630-V632 PolarHBondContact O-N 3.5Å; I630-I713 HydrophobicContact CD1-CB 4.42Å; I630-I713 HydrophobicContact CD1-CD1 3.96Å; I630-I713 HydrophobicContact CD1-CG1 3.76Å; I630-I713 HydrophobicContact CD1-CG2 4.09Å; I630-A726 HydrophobicContact CB-CB 4.41Å; I630-A726 PolarHBondContact N-O 3.01Å; I630-K728 HydrophobicContact CD1-CB 3.84Å; I630-K728 HydrophobicContact CG1-CB 4.2Å
631	P	81.3	Confident	77.6	Confident	121 Å²	121	86.5 Å²	86.5	79%	0.786	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-59	130.9	165.5	26.1	-34.1	0	0	0	110.1
632	V	76.6	Confident	78.6	Confident	39 Å²	39	92.5 Å²	92.5	24%	0.236	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-85.8	147.2	166.2	-176	0	0	0	0	107.4	I630 Q635 A726	I630-V632 PolarHBondContact O-N 3.5Å; V632-Q635 HydrophobicContact CG1-CG 4.16Å; V632-A726 HydrophobicContact CG2-CB 3.55Å
633	E	70.8	Confident	79.3	Confident	178 Å²	178	92.9 Å²	92.9	83%	0.832	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-55.5	142	173.9	-62	169.7	152.1	0	0	110.8	Q635	E633-Q635 VanDerWaalsContact O-CG 3.22Å; E633-Q635 WeakPolarHBondContact O-CG 3.23Å; E633-Q635 PolarHBondContact O-N 3.34Å
634	D	64.2	Low	79.5	Confident	167 Å²	167	98.5 Å²	98.5	89%	0.893	52%	0.52	S	S	*	.			trans	-54.4	108.7	-167	-60.3	-48.3	0	0	0	113	S636	D634-S636 PolarHBondContact O-N 3.18Å
635	Q	67.1	Low	79.7	Confident	64 Å²	64	98.4 Å²	98.4	30%	0.299	52%	0.515	S	S	.	.			trans	-86.9	99.7	-172.8	-62.4	-165.9	-42.1	0	0	111.4	V632 E633 F637 D724	V632-Q635 HydrophobicContact CG1-CG 4.16Å; E633-Q635 VanDerWaalsContact O-CG 3.22Å; E633-Q635 WeakPolarHBondContact O-CG 3.23Å; E633-Q635 PolarHBondContact O-N 3.34Å; Q635-F637 HydrophobicContact CB-CD2 4.27Å; Q635-F637 HydrophobicContact CB-CE1 4.12Å; Q635-F637 HydrophobicContact CB-CE2 3.71Å; Q635-F637 HydrophobicContact CB-CZ 3.65Å; Q635-F637 HydrophobicContact CG-CZ 4.42Å; Q635-F637 WeakPolarHBondContact O-CD2 3.5Å; Q635-F637 PolarHBondContact O-N 3.27Å; Q635-D724 PolarHBondContact NE2-OD2 3.01Å; Q635-D724 PolarHBondContact OE1-OD2 3.33Å
636	S	73	Confident	79.9	Confident	122 Å²	122	97.6 Å²	97.6	85%	0.853	51%	0.507	S	S	*	.			trans	-70.1	91.4	172.7	62.9	0	0	0	0	111.3	D634	D634-S636 PolarHBondContact O-N 3.18Å
637	F	76.6	Confident	80.1	Confident	41 Å²	41	102.6 Å²	102.6	18%	0.18	53%	0.529	C	S	.	.			trans	-80.5	126.3	-178.5	-66.4	-69.2	0	0	0	112.9	Q635 W639 S640 E723	Q635-F637 HydrophobicContact CB-CD2 4.27Å; Q635-F637 HydrophobicContact CB-CE1 4.12Å; Q635-F637 HydrophobicContact CB-CE2 3.71Å; Q635-F637 HydrophobicContact CB-CZ 3.65Å; Q635-F637 HydrophobicContact CG-CZ 4.42Å; Q635-F637 WeakPolarHBondContact O-CD2 3.5Å; Q635-F637 PolarHBondContact O-N 3.27Å; F637-W639 HydrophobicContact CB-CD2 3.85Å; F637-W639 HydrophobicContact CB-CE3 4.46Å; F637-W639 HydrophobicContact CB-CG 4.1Å; F637-W639 HydrophobicContact CB-CZ2 3.97Å; F637-W639 AromaticContact CD1-CE2 3.55Å; F637-W639 AromaticContact CD1-CZ2 3.55Å; F637-W639 HydrophobicContact CD1-CZ2 3.55Å; F637-W639 AromaticContact CD1-NE1 3.31Å; F637-W639 VanDerWaalsContact CD1-NE1 3.31Å; F637-W639 AromaticContact CD2-CH2 3.97Å; F637-W639 HydrophobicContact CD2-CH2 3.97Å; F637-W639 AromaticContact CD2-CZ2 3.67Å; F637-W639 HydrophobicContact CD2-CZ2 3.67Å; F637-W639 AromaticContact CE1-CZ2 3.81Å; F637-W639 HydrophobicContact CE1-CZ2 3.81Å; F637-W639 HydrophobicContact CE2-CH2 4.26Å; F637-W639 AromaticContact CE2-CZ2 3.95Å; F637-W639 HydrophobicContact CE2-CZ2 3.95Å; F637-W639 HydrophobicContact CG-CD2 4.28Å; F637-W639 AromaticContact CG-CE2 3.51Å; F637-W639 HydrophobicContact CG-CH2 4.14Å; F637-W639 AromaticContact CG-CZ2 3.45Å; F637-W639 HydrophobicContact CG-CZ2 3.45Å; F637-W639 VanDerWaalsContact CG-CZ2 3.45Å; F637-W639 AromaticContact CG-NE1 3.66Å; F637-W639 AromaticContact CZ-CZ2 3.99Å; F637-W639 HydrophobicContact CZ-CZ2 3.99Å; F637-W639 PolarHBondContact O-N 3.16Å; F637-S640 PolarHBondContact O-N 3.4Å; F637-S640 VanDerWaalsContact O-N 3.11Å; F637-S640 PolarHBondContact O-OG 3.4Å; F637-E723 HydrophobicContact CE2-CB 4.4Å; F637-E723 HydrophobicContact CE2-CG 4.09Å
638	L	80.3	Confident	80.6	Confident	180 Å²	180	99 Å²	99	94%	0.942	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	3.3	172.1	-65.3	172.4	0	0	0	115.3
639	W	83.5	Confident	81	Confident	39 Å²	39	99.1 Å²	99.1	15%	0.148	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-2.5	-178.8	55.7	-103.1	0	0	0	113.5	F637 D641 K642 Y643 P645 P720 P721	F637-W639 HydrophobicContact CB-CD2 3.85Å; F637-W639 HydrophobicContact CB-CE3 4.46Å; F637-W639 HydrophobicContact CB-CG 4.1Å; F637-W639 HydrophobicContact CB-CZ2 3.97Å; F637-W639 AromaticContact CD1-CE2 3.55Å; F637-W639 AromaticContact CD1-CZ2 3.55Å; F637-W639 HydrophobicContact CD1-CZ2 3.55Å; F637-W639 AromaticContact CD1-NE1 3.31Å; F637-W639 VanDerWaalsContact CD1-NE1 3.31Å; F637-W639 AromaticContact CD2-CH2 3.97Å; F637-W639 HydrophobicContact CD2-CH2 3.97Å; F637-W639 AromaticContact CD2-CZ2 3.67Å; F637-W639 HydrophobicContact CD2-CZ2 3.67Å; F637-W639 AromaticContact CE1-CZ2 3.81Å; F637-W639 HydrophobicContact CE1-CZ2 3.81Å; F637-W639 HydrophobicContact CE2-CH2 4.26Å; F637-W639 AromaticContact CE2-CZ2 3.95Å; F637-W639 HydrophobicContact CE2-CZ2 3.95Å; F637-W639 HydrophobicContact CG-CD2 4.28Å; F637-W639 AromaticContact CG-CE2 3.51Å; F637-W639 HydrophobicContact CG-CH2 4.14Å; F637-W639 AromaticContact CG-CZ2 3.45Å; F637-W639 HydrophobicContact CG-CZ2 3.45Å; F637-W639 VanDerWaalsContact CG-CZ2 3.45Å; F637-W639 AromaticContact CG-NE1 3.66Å; F637-W639 AromaticContact CZ-CZ2 3.99Å; F637-W639 HydrophobicContact CZ-CZ2 3.99Å; F637-W639 PolarHBondContact O-N 3.16Å; W639-D641 PolarHBondContact O-N 3.03Å; W639-K642 PolarHBondContact O-N 2.56Å; W639-Y643 WeakPolarHBondContact CZ3-O 3.49Å; W639-Y643 PolarHBondContact O-N 2.94Å; W639-P645 HydrophobicContact CH2-CB 3.86Å; W639-P645 HydrophobicContact CZ3-CB 3.93Å; W639-P720 HydrophobicContact CB-CB 4.49Å; W639-P720 HydrophobicContact CB-CG 4.17Å; W639-P720 HydrophobicContact CD2-CB 3.74Å; W639-P720 HydrophobicContact CD2-CG 3.87Å; W639-P720 HydrophobicContact CE3-CB 3.98Å; W639-P720 HydrophobicContact CG-CB 3.99Å; W639-P720 HydrophobicContact CG-CG 3.65Å; W639-P721 WeakPolarHBondContact CH2-O 3.34Å; W639-P721 HydrophobicContact CZ3-CB 4.29Å
640	S	80.9	Confident	81.4	Confident	52 Å²	52	97.7 Å²	97.7	36%	0.364	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.5	177.7	48.5	0	0	0	0	112.2	F637 K642 Y643	F637-S640 PolarHBondContact O-N 3.4Å; F637-S640 VanDerWaalsContact O-N 3.11Å; F637-S640 PolarHBondContact O-OG 3.4Å; S640-K642 PolarHBondContact O-N 3.42Å; S640-Y643 CarbonylContact O-C 3.22Å; S640-Y643 PolarHBondContact O-N 3.09Å
641	D	80.1	Confident	81.6	Confident	151 Å²	151	95.6 Å²	95.6	81%	0.807	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.5	179	-49.2	-3.2	0	0	0	113.4	W639	W639-D641 PolarHBondContact O-N 3.03Å
642	K	83.6	Confident	82.1	Confident	171 Å²	171	89.9 Å²	89.9	74%	0.743	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-29	-178.3	-62.8	-168.5	177.8	-170.6	0	113.6	W639 S640	W639-K642 PolarHBondContact O-N 2.56Å; S640-K642 PolarHBondContact O-N 3.42Å
643	Y	84	Confident	82.8	Confident	94 Å²	94	89.1 Å²	89.1	37%	0.369	43%	0.428	S	S	.	.	S	Bend	trans	-143.5	125.6	-178.7	-47.7	-75.1	0	0	0	110	W639 S640 I691 P720	W639-Y643 WeakPolarHBondContact CZ3-O 3.49Å; W639-Y643 PolarHBondContact O-N 2.94Å; S640-Y643 CarbonylContact O-C 3.22Å; S640-Y643 PolarHBondContact O-N 3.09Å; Y643-I691 HydrophobicContact CD1-CD1 4.04Å; Y643-I691 HydrophobicContact CD1-CG1 4.21Å; Y643-I691 HydrophobicContact CD2-CG1 4.49Å; Y643-I691 HydrophobicContact CE1-CD1 3.78Å; Y643-I691 HydrophobicContact CE1-CG1 3.98Å; Y643-I691 HydrophobicContact CE2-CG1 4.26Å; Y643-I691 HydrophobicContact CG-CG1 4.47Å; Y643-P720 HydrophobicContact CD2-CB 3.87Å; Y643-P720 HydrophobicContact CE2-CB 4.3Å
644	R	82.1	Confident	83.8	Confident	126 Å²	126	81.5 Å²	81.5	48%	0.475	39%	0.394	S	S	.	.			trans	-55.8	120.3	175	178.2	176.9	-105.2	136.7	0.4	109.9	L575 D576	L575-R644 VanDerWaalsContact O-CZ 3.3Å; L575-R644 PolarHBondContact O-NH1 2.8Å; L575-R644 PolarHBondContact O-NH2 2.98Å; D576-R644 VanDerWaalsContact CG-NE 3.32Å; D576-R644 IonicContact OD1-CZ 3.79Å; D576-R644 IonicContact OD1-NE 2.61Å; D576-R644 PolarHBondContact OD1-NE 3.4Å; D576-R644 VanDerWaalsContact OD1-NE 3.13Å; D576-R644 IonicContact OD1-NH2 4Å; D576-R644 PolarHBondContact OD1-NH2 2.9Å; D576-R644 VanDerWaalsContact OD2-CD 3.29Å; D576-R644 WeakPolarHBondContact OD2-CD 3.33Å; D576-R644 IonicContact OD2-CZ 2.66Å; D576-R644 IonicContact OD2-NE 2.61Å; D576-R644 PolarHBondContact OD2-NE 3.02Å; D576-R644 IonicContact OD2-NH1 3.41Å; D576-R644 IonicContact OD2-NH2 3.54Å
645	P	87.5	Confident	85.1	Confident	49 Å²	49	75.7 Å²	75.7	32%	0.318	36%	0.361	S	S	.	.			trans	-65.6	143.6	177.4	28.3	-34.4	0	0	0	110.6	W639 P721 E723	W639-P645 HydrophobicContact CH2-CB 3.86Å; W639-P645 HydrophobicContact CZ3-CB 3.93Å; P645-P721 WeakPolarHBondContact CA-O 3.47Å; P645-E723 HydrophobicContact CB-CG 3.98Å
646	R	88.4	Confident	86.2	Confident	107 Å²	107	74.1 Å²	74.1	40%	0.404	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-151.2	149.5	179.6	47.9	175.3	158.6	166.7	-1.4	112.9	D689 P721 Y722 E723	R646-D689 IonicContact CZ-OD2 2.71Å; R646-D689 VanDerWaalsContact CZ-OD2 3.23Å; R646-D689 IonicContact NH1-OD2 2.69Å; R646-D689 PolarHBondContact NH1-OD2 3.37Å; R646-D689 IonicContact NH2-OD2 2.77Å; R646-D689 PolarHBondContact NH2-OD2 3.16Å; R646-P721 HydrophobicContact CG-CB 4.49Å; R646-P721 HydrophobicContact CG-CG 4.3Å; R646-P721 WeakPolarHBondContact CG-O 3.15Å; R646-P721 PolarHBondContact N-O 3.41Å; R646-Y722 HydrophobicContact CG-CD1 4.15Å; R646-Y722 HydrophobicContact CG-CE1 4.23Å; R646-Y722 VanDerWaalsContact O-CA 3.31Å; R646-Y722 WeakPolarHBondContact O-CA 3.36Å; R646-E723 PolarHBondContact O-N 2.84Å
647	K	90.5	Very high	87	Confident	138 Å²	138	68.5 Å²	68.5	60%	0.6	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-78.7	126.4	178.4	-67.3	172	-172.9	170.7	0	110	E723	K647-E723 WeakPolarHBondContact CE-OE2 3.45Å; K647-E723 HydrophobicContact CG-CB 4.35Å; K647-E723 WeakPolarHBondContact CG-OE2 3.25Å; K647-E723 IonicContact NZ-OE2 2.66Å
648	P	91.6	Very high	87.6	Confident	3 Å²	3	69.3 Å²	69.3	2%	0.019	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-66.2	143.7	176.1	27.9	-35.2	0	0	0	111	V685 F686 Y687 Y722 E723 I725	P648-V685 HydrophobicContact CB-CG1 3.81Å; P648-V685 HydrophobicContact CG-CG1 3.92Å; P648-F686 WeakPolarHBondContact CB-O 3.38Å; P648-Y687 HydrophobicContact CB-CD1 3.67Å; P648-Y687 HydrophobicContact CB-CE1 3.45Å; P648-Y687 VanDerWaalsContact CB-CE1 3.45Å; P648-Y687 HydrophobicContact CG-CD1 4.29Å; P648-Y687 HydrophobicContact CG-CE1 3.57Å; P648-Y722 HydrophobicContact CB-CD1 3.68Å; P648-Y722 HydrophobicContact CB-CE1 4.11Å; P648-Y722 HydrophobicContact CB-CG 4.25Å; P648-Y722 HydrophobicContact CG-CD1 4.35Å; P648-E723 WeakPolarHBondContact CD-O 3.31Å; P648-I725 HydrophobicContact CG-CD1 3.96Å; P648-I725 HydrophobicContact CG-CG1 4.1Å; P648-I725 HydrophobicContact CG-CG2 4Å
649	R	90.5	Very high	87.9	Confident	113 Å²	113	62.5 Å²	62.5	43%	0.426	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	156.1	176.4	-50.9	175.9	96.2	130.5	17.4	109.5	E607 F686	E607-R649 IonicContact OE1-CZ 3.9Å; E607-R649 VanDerWaalsContact OE1-CZ 3.24Å; E607-R649 IonicContact OE1-NE 2.65Å; E607-R649 PolarHBondContact OE1-NE 3.41Å; E607-R649 IonicContact OE1-NH2 2.75Å; E607-R649 PolarHBondContact OE1-NH2 3Å; E607-R649 IonicContact OE2-CZ 3.78Å; E607-R649 IonicContact OE2-NH2 3.16Å; E607-R649 PolarHBondContact OE2-NH2 3.1Å; R649-F686 HydrophobicContact CB-CB 4.24Å; R649-F686 HydrophobicContact CB-CD2 3.87Å; R649-F686 WeakPolarHBondContact O-CD2 3.35Å; R649-F686 PolarHBondContact O-N 3.04Å
650	F	91.4	Very high	88.1	Confident	47 Å²	47	65 Å²	65	21%	0.206	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	151.7	176.6	53.1	-95.5	0	0	0	113.3	M629 N652 N684 V685 I725 F727	M629-F650 HydrophobicContact CE-CE1 4Å; M629-F650 HydrophobicContact CE-CZ 4.08Å; M629-F650 HydrophobicContact CG-CE1 4Å; M629-F650 HydrophobicContact CG-CZ 3.89Å; M629-F650 HydrophobicContact SD-CE1 3.49Å; M629-F650 WeakPolarHBondContact SD-CE1 3.47Å; M629-F650 HydrophobicContact SD-CZ 3.9Å; F650-N652 VanDerWaalsContact CD2-ND2 3.28Å; F650-N652 WeakPolarHBondContact CD2-ND2 3.4Å; F650-N684 CarbonylContact C-O 3.57Å; F650-N684 WeakPolarHBondContact CA-O 3.39Å; F650-N684 WeakPolarHBondContact CB-O 3.46Å; F650-V685 HydrophobicContact CB-CG2 4.25Å; F650-I725 HydrophobicContact CD1-CD1 3.74Å; F650-I725 HydrophobicContact CE1-CD1 4.39Å; F650-I725 HydrophobicContact CG-CD1 4.45Å; F650-F727 AromaticContact CD1-CZ 3.92Å; F650-F727 HydrophobicContact CD1-CZ 3.92Å; F650-F727 HydrophobicContact CD2-CE1 4.26Å; F650-F727 HydrophobicContact CD2-CZ 4.03Å; F650-F727 HydrophobicContact CE1-CE1 4.48Å; F650-F727 HydrophobicContact CE1-CZ 4.03Å; F650-F727 HydrophobicContact CE2-CE1 4.04Å; F650-F727 HydrophobicContact CE2-CZ 4.14Å; F650-F727 AromaticContact CG-CZ 3.93Å; F650-F727 HydrophobicContact CG-CZ 3.93Å; F650-F727 HydrophobicContact CZ-CE1 4.15Å; F650-F727 HydrophobicContact CZ-CZ 4.13Å
651	F	90.2	Very high	88.4	Confident	5 Å²	5	66 Å²	66	2%	0.022	30%	0.298	C	S	.	.			trans	-128.9	89.4	173.2	-177.7	-105.2	0	0	0	109.5	I611 A614 R615 M618 Q625 R653 N684 F686	I611-F651 HydrophobicContact CG1-CD2 4.39Å; I611-F651 HydrophobicContact CG2-CD2 3.98Å; I611-F651 HydrophobicContact CG2-CE2 4.03Å; I611-F651 HydrophobicContact CG2-CG 4.4Å; I611-F651 HydrophobicContact CG2-CZ 4.48Å; A614-F651 HydrophobicContact CB-CB 4.45Å; A614-F651 HydrophobicContact CB-CD1 3.95Å; R615-F651 HydrophobicContact CG-CE1 3.76Å; R615-F651 HydrophobicContact CG-CZ 3.89Å; M618-F651 HydrophobicContact SD-CD1 4.05Å; M618-F651 HydrophobicContact SD-CE1 3.81Å; Q625-F651 HydrophobicContact CG-CE2 4.29Å; F651-R653 HydrophobicContact CE1-CG 4.32Å; F651-N684 PolarHBondContact N-O 2.82Å; F651-N684 WeakPolarHBondContact O-CB 3.41Å; F651-N684 PolarHBondContact O-ND2 3.21Å; F651-F686 HydrophobicContact CB-CE2 3.8Å; F651-F686 HydrophobicContact CB-CZ 3.93Å
652	N	91.2	Very high	88.7	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.6	-171.7	-57.5	-29.6	0	0	0	111.6	Q625 F626 F650 K682 F683 N684 F727	Q625-N652 WeakPolarHBondContact CA-O 3.35Å; F626-N652 HydrophobicContact CD1-CB 3.8Å; F626-N652 HydrophobicContact CE1-CB 3.46Å; F626-N652 VanDerWaalsContact CE1-CB 3.46Å; F626-N652 HydrophobicContact CZ-CB 4.06Å; F626-N652 PolarHBondContact N-O 3.03Å; F650-N652 VanDerWaalsContact CD2-ND2 3.28Å; F650-N652 WeakPolarHBondContact CD2-ND2 3.4Å; N652-K682 WeakPolarHBondContact CA-O 3.2Å; N652-F683 HydrophobicContact CB-CD1 4.16Å; N652-F683 VanDerWaalsContact CG-CD1 3.49Å; N652-F683 VanDerWaalsContact OD1-CA 3.31Å; N652-F683 WeakPolarHBondContact OD1-CA 3.39Å; N652-N684 PolarHBondContact OD1-N 3.4Å; N652-N684 VanDerWaalsContact OD1-N 3.17Å; N652-F727 VanDerWaalsContact ND2-CE1 3.32Å; N652-F727 WeakPolarHBondContact ND2-CE1 3.44Å; N652-F727 WeakPolarHBondContact ND2-CZ 3.31Å
653	R	91	Very high	88.9	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.087	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141	173.9	-61	176.4	83.9	168.5	0.4	111.3	M618 D620 D623 A624 F651 K682	M618-R653 HydrophobicContact CE-CB 4.12Å; M618-R653 HydrophobicContact CE-CG 4.04Å; M618-R653 VanDerWaalsContact SD-CD 3.58Å; M618-R653 HydrophobicContact SD-CG 4.26Å; D620-R653 IonicContact OD1-CZ 3.48Å; D620-R653 IonicContact OD1-NH1 2.67Å; D620-R653 PolarHBondContact OD1-NH1 2.96Å; D620-R653 VanDerWaalsContact OD1-NH1 3.07Å; D620-R653 IonicContact OD1-NH2 3.61Å; D623-R653 HydrophobicContact CB-CB 4.08Å; D623-R653 VanDerWaalsContact CB-NE 3.31Å; D623-R653 PolarHBondContact O-NE 3.18Å; D623-R653 PolarHBondContact O-NH2 3.13Å; A624-R653 CarbonylContact O-C 3.55Å; A624-R653 VanDerWaalsContact O-CA 3.24Å; A624-R653 WeakPolarHBondContact O-CA 3.44Å; F651-R653 HydrophobicContact CE1-CG 4.32Å; R653-K682 PolarHBondContact N-O 3.09Å; R653-K682 PolarHBondContact O-N 3.1Å
654	V	92.2	Very high	89.3	Confident	18 Å²	18	61.5 Å²	61.5	11%	0.109	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.1	171.1	-170	0	0	0	0	108.5	D623 A624 F626 T656 V678 Y681	D623-V654 WeakPolarHBondContact CA-O 3.5Å; A624-V654 PolarHBondContact N-O 2.95Å; A624-V654 PolarHBondContact O-N 3.28Å; F626-V654 HydrophobicContact CB-CG2 4.05Å; F626-V654 HydrophobicContact CD1-CB 4.49Å; F626-V654 HydrophobicContact CD1-CG2 3.25Å; F626-V654 HydrophobicContact CD2-CG2 4.34Å; F626-V654 HydrophobicContact CE1-CG2 3.64Å; F626-V654 HydrophobicContact CG-CG2 3.64Å; F626-V654 HydrophobicContact CZ-CG2 4.34Å; V654-T656 HydrophobicContact CB-CG2 4.25Å; V654-T656 HydrophobicContact CG1-CG2 3.9Å; V654-T656 PolarHBondContact O-N 2.86Å; V654-V678 HydrophobicContact CG1-CB 4.35Å; V654-V678 HydrophobicContact CG1-CG1 3.62Å; V654-V678 HydrophobicContact CG1-CG2 3.94Å; V654-Y681 HydrophobicContact CG1-CD1 4.28Å; V654-Y681 HydrophobicContact CG1-CE1 4.05Å; V654-Y681 HydrophobicContact CG2-CD1 4.09Å; V654-Y681 HydrophobicContact CG2-CE1 3.95Å
655	H	91	Very high	89.6	Confident	45 Å²	45	61.3 Å²	61.3	21%	0.208	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	105	171.9	-173.7	62	0	0	0	109.1	D623 Q679 G680 H756	D623-H655 WeakPolarHBondContact OD1-CA 3.32Å; D623-H655 WeakPolarHBondContact OD1-CB 3.47Å; D623-H655 IonicContact OD1-CE1 3.98Å; D623-H655 IonicContact OD1-CG 3.17Å; D623-H655 IonicContact OD1-ND1 3.61Å; D623-H655 PolarHBondContact OD1-ND1 3.28Å; H655-Q679 PolarHBondContact O-N 3.06Å; H655-G680 PolarHBondContact N-O 2.91Å; H655-G680 PolarHBondContact O-N 3.49Å; H655-H756 AromaticContact CD2-CE1 3.32Å; H655-H756 PolarHBondContact CD2-CE1 2.89Å; H655-H756 AromaticContact CD2-ND1 3.47Å; H655-H756 PolarHBondContact CD2-ND1 3.16Å; H655-H756 AromaticContact CG-CE1 3.63Å; H655-H756 AromaticContact NE2-CE1 3.92Å
656	T	91.6	Very high	89.8	Confident	32 Å²	32	63.4 Å²	63.4	20%	0.196	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	146.6	180	70.1	0	0	0	0	110.8	E622 V654	E622-T656 WeakPolarHBondContact CB-O 3.25Å; E622-T656 PolarHBondContact O-N 3.48Å; E622-T656 PolarHBondContact O-OG1 3.21Å; V654-T656 HydrophobicContact CB-CG2 4.25Å; V654-T656 HydrophobicContact CG1-CG2 3.9Å; V654-T656 PolarHBondContact O-N 2.86Å
657	G	89.3	Confident	89.9	Confident	3 Å²	3	63.8 Å²	63.8	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	167.9	172.9	0	0	0	0	0	112.9	I677 Q679	G657-I677 PolarHBondContact N-O 2.99Å; G657-I677 VanDerWaalsContact O-CG1 3.29Å; G657-I677 WeakPolarHBondContact O-CG1 3.32Å; G657-I677 PolarHBondContact O-N 3.45Å; G657-I677 VanDerWaalsContact O-O 3.09Å; G657-Q679 PolarHBondContact O-NE2 3.15Å
658	F	88.7	Confident	90	Very high	58 Å²	58	60.4 Å²	60.4	25%	0.254	28%	0.278	S	S	.	.			trans	-92.2	161.8	175.5	43.8	-98.9	0	0	0	112.7	W660 P673 P674 K676 Q679	F658-W660 AromaticContact CD2-NE1 3.69Å; F658-W660 AromaticContact CE2-NE1 3.41Å; F658-P673 HydrophobicContact CD1-CB 4.17Å; F658-P673 HydrophobicContact CE1-CB 3.95Å; F658-P673 HydrophobicContact CZ-CB 4.47Å; F658-P674 HydrophobicContact CB-CB 3.78Å; F658-P674 HydrophobicContact CB-CG 3.9Å; F658-P674 HydrophobicContact CG-CG 4.26Å; F658-K676 HydrophobicContact CD1-CG 4.46Å; F658-Q679 PolarHBondContact O-NE2 2.79Å
659	V	87.1	Confident	89.9	Confident	38 Å²	38	65.8 Å²	65.8	23%	0.23	31%	0.306	C	S	.	.			trans	-119.4	118.8	170.8	177.7	0	0	0	0	109	N661 N664 I677	V659-N661 PolarHBondContact O-N 3.2Å; V659-N664 PolarHBondContact O-ND2 3.13Å; V659-I677 HydrophobicContact CG2-CD1 4.42Å
660	W	87	Confident	89.8	Confident	91 Å²	91	67.8 Å²	67.8	35%	0.345	32%	0.324	S	S	.	.			trans	-71.7	67.1	172.7	-72.5	117.1	0	0	0	112	F658 N664 Q665 Y668 P674	F658-W660 AromaticContact CD2-NE1 3.69Å; F658-W660 AromaticContact CE2-NE1 3.41Å; W660-N664 HydrophobicContact CE3-CB 4.24Å; W660-Q665 HydrophobicContact CB-CG 4.25Å; W660-Q665 HydrophobicContact CE3-CG 3.91Å; W660-Q665 PolarHBondContact O-NE2 3.01Å; W660-Y668 WeakPolarHBondContact CH2-O 3.45Å; W660-Y668 VanDerWaalsContact CZ3-O 3.3Å; W660-Y668 WeakPolarHBondContact CZ3-O 3.4Å; W660-P674 HydrophobicContact CE3-CG 4.15Å; W660-P674 HydrophobicContact CH2-CG 3.99Å; W660-P674 HydrophobicContact CZ2-CG 4.34Å; W660-P674 HydrophobicContact CZ3-CG 3.88Å
661	N	86.8	Confident	89.9	Confident	74 Å²	74	72.6 Å²	72.6	40%	0.396	35%	0.352	S	S	.	.			trans	-75.3	169.7	165.9	74	39.3	0	0	0	110.2	V659 Y663 N664 Q665	V659-N661 PolarHBondContact O-N 3.2Å; N661-Y663 VanDerWaalsContact C-N 3.27Å; N661-Y663 PolarHBondContact O-N 3.48Å; N661-Y663 WeakPolarHBondContact OD1-CA 3.46Å; N661-Y663 WeakPolarHBondContact OD1-CB 3.15Å; N661-Y663 PolarHBondContact OD1-N 3.34Å; N661-N664 PolarHBondContact O-N 3.01Å; N661-N664 PolarHBondContact OD1-N 3.25Å; N661-Q665 VanDerWaalsContact O-CG 3.31Å; N661-Q665 WeakPolarHBondContact O-CG 3.29Å; N661-Q665 PolarHBondContact O-N 3.24Å
662	K	86.9	Confident	89.8	Confident	154 Å²	154	78 Å²	78	67%	0.67	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.7	-175.7	-177.1	166.6	-179.9	171.2	0	114.2	T666	K662-T666 PolarHBondContact O-OG1 3Å
663	Y	88.6	Confident	89.7	Confident	144 Å²	144	81 Å²	81	57%	0.565	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-44	175.6	169.6	-89.6	0	0	0	110.6	N661 Q665 T666 H667	N661-Y663 VanDerWaalsContact C-N 3.27Å; N661-Y663 PolarHBondContact O-N 3.48Å; N661-Y663 WeakPolarHBondContact OD1-CA 3.46Å; N661-Y663 WeakPolarHBondContact OD1-CB 3.15Å; N661-Y663 PolarHBondContact OD1-N 3.34Å; Y663-Q665 VanDerWaalsContact C-N 3.35Å; Y663-Q665 PolarHBondContact O-N 3.18Å; Y663-T666 PolarHBondContact O-N 2.88Å; Y663-T666 PolarHBondContact O-OG1 3.17Å; Y663-H667 AromaticContact CD2-CD2 3.49Å; Y663-H667 VanDerWaalsContact CD2-CD2 3.49Å; Y663-H667 WeakPolarHBondContact CD2-CD2 3.47Å; Y663-H667 AromaticContact CD2-NE2 3.68Å; Y663-H667 AromaticContact CE1-CD2 3.91Å; Y663-H667 AromaticContact CE2-CD2 3.29Å; Y663-H667 WeakPolarHBondContact CE2-CD2 3.42Å; Y663-H667 AromaticContact CE2-NE2 3.36Å; Y663-H667 WeakPolarHBondContact CE2-NE2 3.47Å; Y663-H667 AromaticContact CG-CD2 3.89Å; Y663-H667 AromaticContact CZ-CD2 3.51Å; Y663-H667 AromaticContact CZ-NE2 3.96Å; Y663-H667 PolarHBondContact O-CD2 2.6Å; Y663-H667 VanDerWaalsContact O-CD2 3.22Å; Y663-H667 PolarHBondContact O-N 3.03Å
664	N	91.3	Very high	89.8	Confident	23 Å²	23	80 Å²	80	12%	0.123	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-64.5	-40.6	177.4	-76.3	-1.2	0	0	0	111.5	V659 W660 N661 T666 H667 Y668 P674	V659-N664 PolarHBondContact O-ND2 3.13Å; W660-N664 HydrophobicContact CE3-CB 4.24Å; N661-N664 PolarHBondContact O-N 3.01Å; N661-N664 PolarHBondContact OD1-N 3.25Å; N664-T666 PolarHBondContact O-N 3.25Å; N664-H667 PolarHBondContact O-N 2.87Å; N664-Y668 HydrophobicContact CB-CD2 4.05Å; N664-Y668 PolarHBondContact O-N 3.07Å; N664-P674 HydrophobicContact CB-CB 4.31Å; N664-P674 HydrophobicContact CB-CG 3.85Å
665	Q	88.8	Confident	89.7	Confident	122 Å²	122	83.3 Å²	83.3	57%	0.57	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-63.3	-4.7	172.7	-67.9	173.6	23.1	0	0	114.8	W660 N661 Y663	W660-Q665 HydrophobicContact CB-CG 4.25Å; W660-Q665 HydrophobicContact CE3-CG 3.91Å; W660-Q665 PolarHBondContact O-NE2 3.01Å; N661-Q665 VanDerWaalsContact O-CG 3.31Å; N661-Q665 WeakPolarHBondContact O-CG 3.29Å; N661-Q665 PolarHBondContact O-N 3.24Å; Y663-Q665 VanDerWaalsContact C-N 3.35Å; Y663-Q665 PolarHBondContact O-N 3.18Å
666	T	91.5	Very high	89.8	Confident	93 Å²	93	86.7 Å²	86.7	57%	0.571	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-118.8	0	176.5	53.3	0	0	0	0	114	K662 Y663 N664	K662-T666 PolarHBondContact O-OG1 3Å; Y663-T666 PolarHBondContact O-N 2.88Å; Y663-T666 PolarHBondContact O-OG1 3.17Å; N664-T666 PolarHBondContact O-N 3.25Å
667	H	90.7	Very high	89.7	Confident	115 Å²	115	89 Å²	89	53%	0.532	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	-11.2	-178.6	-70.2	-60.7	0	0	0	114	Y663 N664	Y663-H667 AromaticContact CD2-CD2 3.49Å; Y663-H667 VanDerWaalsContact CD2-CD2 3.49Å; Y663-H667 WeakPolarHBondContact CD2-CD2 3.47Å; Y663-H667 AromaticContact CD2-NE2 3.68Å; Y663-H667 AromaticContact CE1-CD2 3.91Å; Y663-H667 AromaticContact CE2-CD2 3.29Å; Y663-H667 WeakPolarHBondContact CE2-CD2 3.42Å; Y663-H667 AromaticContact CE2-NE2 3.36Å; Y663-H667 WeakPolarHBondContact CE2-NE2 3.47Å; Y663-H667 AromaticContact CG-CD2 3.89Å; Y663-H667 AromaticContact CZ-CD2 3.51Å; Y663-H667 AromaticContact CZ-NE2 3.96Å; Y663-H667 PolarHBondContact O-CD2 2.6Å; Y663-H667 VanDerWaalsContact O-CD2 3.22Å; Y663-H667 PolarHBondContact O-N 3.03Å; N664-H667 PolarHBondContact O-N 2.87Å
668	Y	93	Very high	89.9	Confident	67 Å²	67	90.5 Å²	90.5	26%	0.263	45%	0.452	S	S	.	.			trans	-136.8	142.9	-177.8	-59.1	-71.1	0	0	0	109.1	W660 N664 N672 P674 P675	W660-Y668 WeakPolarHBondContact CH2-O 3.45Å; W660-Y668 VanDerWaalsContact CZ3-O 3.3Å; W660-Y668 WeakPolarHBondContact CZ3-O 3.4Å; N664-Y668 HydrophobicContact CB-CD2 4.05Å; N664-Y668 PolarHBondContact O-N 3.07Å; Y668-N672 WeakPolarHBondContact CA-O 3.2Å; Y668-N672 VanDerWaalsContact CB-O 3.26Å; Y668-N672 WeakPolarHBondContact CB-O 3.45Å; Y668-P674 HydrophobicContact CD1-CB 4.46Å; Y668-P674 HydrophobicContact CD2-CB 3.55Å; Y668-P674 HydrophobicContact CD2-CG 3.71Å; Y668-P674 HydrophobicContact CE2-CB 3.93Å; Y668-P674 HydrophobicContact CG-CB 3.85Å; Y668-P674 HydrophobicContact CG-CG 3.82Å; Y668-P675 VanDerWaalsContact CZ-CD 3.45Å; Y668-P675 WeakPolarHBondContact OH-CD 3.47Å
669	D	89.5	Confident	90.1	Very high	116 Å²	116	89 Å²	89	62%	0.62	45%	0.446	S	S	*	.			trans	-116.8	-178.8	179.5	-77.4	-55.8	0	0	0	110.1	D671 N672 P673	D669-D671 VanDerWaalsContact C-N 3.27Å; D669-D671 PolarHBondContact O-N 3.18Å; D669-N672 PolarHBondContact N-O 3.16Å; D669-N672 CarbonylContact O-C 3.33Å; D669-N672 PolarHBondContact O-N 2.81Å; D669-P673 WeakPolarHBondContact O-CA 3.48Å
670	L	89.1	Confident	90.3	Very high	154 Å²	154	87.2 Å²	87.2	81%	0.806	44%	0.435	S	S	*	.	S	Bend	trans	-62.1	-35.9	177.4	-68.4	172.9	0	0	0	112.5
671	D	92.2	Very high	90.7	Very high	148 Å²	148	83.5 Å²	83.5	79%	0.791	42%	0.421	S	S	*	.	S	Bend	trans	-82.4	-20.3	-179	-52.1	-39.6	0	0	0	112.7	D669	D669-D671 VanDerWaalsContact C-N 3.27Å; D669-D671 PolarHBondContact O-N 3.18Å
672	N	88.7	Confident	91	Very high	118 Å²	118	81.1 Å²	81.1	63%	0.631	41%	0.407	S	S	*	.	S	Bend	trans	-130	72.2	178.1	-71.4	-70.7	0	0	0	109.3	Y668 D669	Y668-N672 WeakPolarHBondContact CA-O 3.2Å; Y668-N672 VanDerWaalsContact CB-O 3.26Å; Y668-N672 WeakPolarHBondContact CB-O 3.45Å; D669-N672 PolarHBondContact N-O 3.16Å; D669-N672 CarbonylContact O-C 3.33Å; D669-N672 PolarHBondContact O-N 2.81Å
673	P	89.4	Confident	91.4	Very high	65 Å²	65	73.8 Å²	73.8	42%	0.422	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-68.1	158.3	-173	27.6	-35.8	0	0	0	112.7	F658 D669	F658-P673 HydrophobicContact CD1-CB 4.17Å; F658-P673 HydrophobicContact CE1-CB 3.95Å; F658-P673 HydrophobicContact CZ-CB 4.47Å; D669-P673 WeakPolarHBondContact O-CA 3.48Å
674	P	91.7	Very high	91.6	Very high	3 Å²	3	67 Å²	67	2%	0.019	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-63.1	149.6	179.5	-13.8	25.3	0	0	0	111.8	F658 W660 N664 Y668 K676	F658-P674 HydrophobicContact CB-CB 3.78Å; F658-P674 HydrophobicContact CB-CG 3.9Å; F658-P674 HydrophobicContact CG-CG 4.26Å; W660-P674 HydrophobicContact CE3-CG 4.15Å; W660-P674 HydrophobicContact CH2-CG 3.99Å; W660-P674 HydrophobicContact CZ2-CG 4.34Å; W660-P674 HydrophobicContact CZ3-CG 3.88Å; N664-P674 HydrophobicContact CB-CB 4.31Å; N664-P674 HydrophobicContact CB-CG 3.85Å; Y668-P674 HydrophobicContact CD1-CB 4.46Å; Y668-P674 HydrophobicContact CD2-CB 3.55Å; Y668-P674 HydrophobicContact CD2-CG 3.71Å; Y668-P674 HydrophobicContact CE2-CB 3.93Å; Y668-P674 HydrophobicContact CG-CB 3.85Å; Y668-P674 HydrophobicContact CG-CG 3.82Å; P674-K676 PolarHBondContact O-N 3.16Å
675	P	91.5	Very high	91.7	Very high	86 Å²	86	65.9 Å²	65.9	56%	0.558	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-49.9	131.2	172.6	-28.9	35.2	0	0	0	112	Y668 I677	Y668-P675 VanDerWaalsContact CZ-CD 3.45Å; Y668-P675 WeakPolarHBondContact OH-CD 3.47Å; P675-I677 PolarHBondContact O-N 3.46Å
676	K	91.7	Very high	91.9	Very high	117 Å²	117	60.3 Å²	60.3	51%	0.509	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-66.6	130.1	177.3	-62.3	-163.4	-173.2	-162.4	0	109.5	E622 F658 P674	E622-K676 WeakPolarHBondContact OE2-CE 3.21Å; E622-K676 IonicContact OE2-NZ 3.08Å; E622-K676 PolarHBondContact OE2-NZ 3.43Å; F658-K676 HydrophobicContact CD1-CG 4.46Å; P674-K676 PolarHBondContact O-N 3.16Å
677	I	91	Very high	91.9	Very high	79 Å²	79	55.9 Å²	55.9	41%	0.405	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.4	170.4	56.6	168.9	0	0	0	109.3	G657 V659 P675 Q679	G657-I677 PolarHBondContact N-O 2.99Å; G657-I677 VanDerWaalsContact O-CG1 3.29Å; G657-I677 WeakPolarHBondContact O-CG1 3.32Å; G657-I677 PolarHBondContact O-N 3.45Å; G657-I677 VanDerWaalsContact O-O 3.09Å; V659-I677 HydrophobicContact CG2-CD1 4.42Å; P675-I677 PolarHBondContact O-N 3.46Å; I677-Q679 HydrophobicContact CG1-CG 4.24Å; I677-Q679 PolarHBondContact O-N 2.84Å
678	V	92.5	Very high	91.9	Very high	35 Å²	35	51.9 Å²	51.9	21%	0.212	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	122.6	168.6	-173.4	0	0	0	0	108.7	V654 Y681 V730 F757	V654-V678 HydrophobicContact CG1-CB 4.35Å; V654-V678 HydrophobicContact CG1-CG1 3.62Å; V654-V678 HydrophobicContact CG1-CG2 3.94Å; V678-Y681 HydrophobicContact CG1-CD2 4.15Å; V678-Y681 HydrophobicContact CG1-CE2 3.61Å; V678-V730 HydrophobicContact CB-CG2 4.35Å; V678-V730 HydrophobicContact CG2-CG2 4.27Å; V678-F757 HydrophobicContact CB-CE2 4.36Å; V678-F757 HydrophobicContact CG1-CD2 4.42Å; V678-F757 HydrophobicContact CG1-CE2 3.81Å
679	Q	92.1	Very high	91.7	Very high	28 Å²	28	52 Å²	52	13%	0.131	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-10.6	177	-67.2	-164.1	39.6	0	0	112.6	H655 G657 F658 I677 H756 F757	H655-Q679 PolarHBondContact O-N 3.06Å; G657-Q679 PolarHBondContact O-NE2 3.15Å; F658-Q679 PolarHBondContact O-NE2 2.79Å; I677-Q679 HydrophobicContact CG1-CG 4.24Å; I677-Q679 PolarHBondContact O-N 2.84Å; Q679-H756 CarbonylContact O-C 3.53Å; Q679-H756 VanDerWaalsContact O-CA 3.31Å; Q679-H756 WeakPolarHBondContact O-CA 3.43Å; Q679-H756 PolarHBondContact O-ND1 2.96Å; Q679-F757 PolarHBondContact O-N 2.98Å
680	G	93.3	Very high	91.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176	175.4	175.6	0	0	0	0	0	112.5	H655 F755	H655-G680 PolarHBondContact N-O 2.91Å; H655-G680 PolarHBondContact O-N 3.49Å; G680-F755 CarbonylContact C-O 3.6Å; G680-F755 WeakPolarHBondContact CA-O 3.39Å
681	Y	94.6	Very high	91.6	Very high	13 Å²	13	43.6 Å²	43.6	5%	0.051	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.2	172.9	-67.1	-94.8	0	0	0	109.8	F626 V654 V678 F683 I729 V730 W754 F755 F757	F626-Y681 AromaticContact CE1-CD1 3.85Å; F626-Y681 HydrophobicContact CE1-CD1 3.85Å; F626-Y681 HydrophobicContact CE1-CE1 4.34Å; F626-Y681 HydrophobicContact CE2-CE1 4.4Å; F626-Y681 AromaticContact CZ-CD1 3.66Å; F626-Y681 HydrophobicContact CZ-CD1 3.66Å; F626-Y681 AromaticContact CZ-CE1 3.93Å; F626-Y681 HydrophobicContact CZ-CE1 3.93Å; V654-Y681 HydrophobicContact CG1-CD1 4.28Å; V654-Y681 HydrophobicContact CG1-CE1 4.05Å; V654-Y681 HydrophobicContact CG2-CD1 4.09Å; V654-Y681 HydrophobicContact CG2-CE1 3.95Å; V678-Y681 HydrophobicContact CG1-CD2 4.15Å; V678-Y681 HydrophobicContact CG1-CE2 3.61Å; Y681-F683 VanDerWaalsContact CB-CE2 3.44Å; Y681-F683 HydrophobicContact CD1-CE2 4.27Å; Y681-F683 HydrophobicContact CD1-CZ 4.18Å; Y681-F683 HydrophobicContact CG-CE2 4Å; Y681-F683 HydrophobicContact CG-CZ 4.35Å; Y681-I729 HydrophobicContact CD1-CG2 4.14Å; Y681-I729 HydrophobicContact CD2-CB 4.22Å; Y681-I729 HydrophobicContact CD2-CG2 4.12Å; Y681-I729 HydrophobicContact CE1-CB 4.42Å; Y681-I729 HydrophobicContact CE1-CG2 3.92Å; Y681-I729 HydrophobicContact CE2-CB 3.68Å; Y681-I729 HydrophobicContact CE2-CG2 3.91Å; Y681-I729 HydrophobicContact CG-CG2 4.23Å; Y681-I729 WeakPolarHBondContact OH-CA 3.38Å; Y681-V730 PolarHBondContact OH-N 2.62Å; Y681-W754 WeakPolarHBondContact O-CA 3.46Å; Y681-F755 AromaticContact CD2-CE2 3.84Å; Y681-F755 HydrophobicContact CD2-CE2 3.84Å; Y681-F755 AromaticContact CD2-CZ 3.81Å; Y681-F755 HydrophobicContact CD2-CZ 3.81Å; Y681-F755 HydrophobicContact CG-CZ 4.19Å; Y681-F755 PolarHBondContact N-O 2.74Å; Y681-F755 PolarHBondContact O-N 2.75Å; Y681-F757 HydrophobicContact CD2-CE2 4.21Å; Y681-F757 HydrophobicContact CD2-CZ 4.04Å; Y681-F757 AromaticContact CE2-CE2 3.88Å; Y681-F757 HydrophobicContact CE2-CE2 3.88Å; Y681-F757 AromaticContact CE2-CZ 3.76Å; Y681-F757 HydrophobicContact CE2-CZ 3.76Å
682	K	93.3	Very high	91.4	Very high	24 Å²	24	38.6 Å²	38.6	10%	0.104	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	99.7	173.7	-59.2	-177.1	-174.7	167.1	0	108.4	M618 D623 N652 R653 W754	M618-K682 HydrophobicContact CE-CB 3.33Å; M618-K682 HydrophobicContact CE-CD 3.87Å; M618-K682 HydrophobicContact CE-CG 4.24Å; D623-K682 IonicContact OD1-NZ 2.7Å; D623-K682 WeakPolarHBondContact OD2-CD 3.18Å; D623-K682 WeakPolarHBondContact OD2-CE 3.44Å; D623-K682 IonicContact OD2-NZ 3.75Å; D623-K682 PolarHBondContact OD2-NZ 3.23Å; N652-K682 WeakPolarHBondContact CA-O 3.2Å; R653-K682 PolarHBondContact N-O 3.09Å; R653-K682 PolarHBondContact O-N 3.1Å; K682-W754 HydrophobicContact CB-CB 4.39Å; K682-W754 HydrophobicContact CB-CG 3.94Å; K682-W754 HydrophobicContact CD-CD2 4.42Å; K682-W754 HydrophobicContact CD-CG 4.48Å; K682-W754 HydrophobicContact CG-CB 4.06Å; K682-W754 HydrophobicContact CG-CD2 4.4Å; K682-W754 HydrophobicContact CG-CG 3.95Å
683	F	94.1	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.4	174.5	-64.5	-91.3	0	0	0	110.3	F626 N652 Y681 L714 F716 F727 I729 Q752 L753 F755	F626-F683 HydrophobicContact CE1-CE1 4.4Å; F626-F683 HydrophobicContact CE2-CE1 4.45Å; F626-F683 HydrophobicContact CZ-CD1 4.5Å; F626-F683 AromaticContact CZ-CE1 3.63Å; F626-F683 HydrophobicContact CZ-CE1 3.63Å; F626-F683 AromaticContact CZ-CZ 3.77Å; F626-F683 HydrophobicContact CZ-CZ 3.77Å; N652-F683 HydrophobicContact CB-CD1 4.16Å; N652-F683 VanDerWaalsContact CG-CD1 3.49Å; N652-F683 VanDerWaalsContact OD1-CA 3.31Å; N652-F683 WeakPolarHBondContact OD1-CA 3.39Å; Y681-F683 VanDerWaalsContact CB-CE2 3.44Å; Y681-F683 HydrophobicContact CD1-CE2 4.27Å; Y681-F683 HydrophobicContact CD1-CZ 4.18Å; Y681-F683 HydrophobicContact CG-CE2 4Å; Y681-F683 HydrophobicContact CG-CZ 4.35Å; F683-L714 HydrophobicContact CD2-CD2 3.97Å; F683-L714 HydrophobicContact CE2-CD2 3.48Å; F683-L714 VanDerWaalsContact CE2-CD2 3.48Å; F683-L714 HydrophobicContact CZ-CD2 3.8Å; F683-F716 HydrophobicContact CB-CE1 4.36Å; F683-F716 HydrophobicContact CB-CE2 4.48Å; F683-F716 HydrophobicContact CB-CZ 3.71Å; F683-F716 AromaticContact CD1-CE2 3.7Å; F683-F716 HydrophobicContact CD1-CE2 3.7Å; F683-F716 AromaticContact CD1-CZ 3.7Å; F683-F716 HydrophobicContact CD1-CZ 3.7Å; F683-F716 AromaticContact CD2-CZ 4Å; F683-F716 HydrophobicContact CD2-CZ 4Å; F683-F716 HydrophobicContact CE1-CE2 4.04Å; F683-F716 HydrophobicContact CE1-CZ 4.31Å; F683-F716 HydrophobicContact CG-CE2 4.04Å; F683-F716 AromaticContact CG-CZ 3.53Å; F683-F716 HydrophobicContact CG-CZ 3.53Å; F683-F727 HydrophobicContact CD1-CD2 4.17Å; F683-F727 HydrophobicContact CD1-CE2 4.34Å; F683-F727 HydrophobicContact CE1-CB 3.87Å; F683-F727 HydrophobicContact CE1-CD1 4.24Å; F683-F727 AromaticContact CE1-CD2 3.69Å; F683-F727 HydrophobicContact CE1-CD2 3.69Å; F683-F727 HydrophobicContact CE1-CE2 4.26Å; F683-F727 AromaticContact CE1-CG 3.67Å; F683-F727 HydrophobicContact CE1-CG 3.67Å; F683-F727 HydrophobicContact CZ-CB 4.2Å; F683-F727 HydrophobicContact CZ-CG 4.48Å; F683-I729 HydrophobicContact CE2-CG2 4.19Å; F683-I729 HydrophobicContact CZ-CG2 3.69Å; F683-Q752 WeakPolarHBondContact O-CA 3.37Å; F683-L753 HydrophobicContact CB-CB 4.36Å; F683-L753 PolarHBondContact N-O 3.28Å; F683-L753 PolarHBondContact O-N 2.8Å; F683-F755 HydrophobicContact CD2-CE1 4.13Å; F683-F755 AromaticContact CE2-CE1 3.91Å; F683-F755 HydrophobicContact CE2-CE1 3.91Å; F683-F755 HydrophobicContact CE2-CZ 4.2Å
684	N	93.3	Very high	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	111.9	164.7	-49.7	-68.4	0	0	0	106.9	A614 M618 F650 F651 N652 I750 F751 W754	A614-N684 HydrophobicContact CB-CB 4.26Å; M618-N684 WeakPolarHBondContact CE-ND2 3.43Å; M618-N684 PolarHBondContact SD-ND2 3.3Å; M618-N684 VanDerWaalsContact SD-ND2 3.38Å; F650-N684 CarbonylContact C-O 3.57Å; F650-N684 WeakPolarHBondContact CA-O 3.39Å; F650-N684 WeakPolarHBondContact CB-O 3.46Å; F651-N684 PolarHBondContact N-O 2.82Å; F651-N684 WeakPolarHBondContact O-CB 3.41Å; F651-N684 PolarHBondContact O-ND2 3.21Å; N652-N684 PolarHBondContact OD1-N 3.4Å; N652-N684 VanDerWaalsContact OD1-N 3.17Å; N684-I750 HydrophobicContact CB-CG2 4.14Å; N684-F751 CarbonylContact C-O 3.56Å; N684-F751 WeakPolarHBondContact CA-O 3.45Å; N684-W754 PolarHBondContact OD1-NE1 3.02Å
685	V	93.2	Very high	91.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.1	179.3	-171.5	0	0	0	0	108.7	P648 F650 Y687 F716 I725 F751	P648-V685 HydrophobicContact CB-CG1 3.81Å; P648-V685 HydrophobicContact CG-CG1 3.92Å; F650-V685 HydrophobicContact CB-CG2 4.25Å; V685-Y687 HydrophobicContact CB-CD2 4.48Å; V685-Y687 HydrophobicContact CB-CE2 3.77Å; V685-Y687 HydrophobicContact CG1-CD2 4.23Å; V685-Y687 HydrophobicContact CG1-CE1 4.15Å; V685-Y687 HydrophobicContact CG1-CE2 3.5Å; V685-Y687 VanDerWaalsContact CG1-CZ 3.46Å; V685-F716 HydrophobicContact CG2-CD1 4.38Å; V685-F716 HydrophobicContact CG2-CD2 4.43Å; V685-F716 HydrophobicContact CG2-CE1 4.46Å; V685-F716 HydrophobicContact CG2-CG 4.37Å; V685-I725 HydrophobicContact CG1-CD1 3.78Å; V685-I725 HydrophobicContact CG2-CD1 4.16Å; V685-F751 HydrophobicContact CB-CB 4.46Å; V685-F751 PolarHBondContact N-O 2.85Å; V685-F751 PolarHBondContact O-N 2.99Å
686	F	93	Very high	91.2	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.7	-172.3	-53.2	-73.1	0	0	0	110.7	L610 I611 A614 P648 R649 F651 P688 I750	L610-F686 HydrophobicContact CB-CD1 3.98Å; L610-F686 HydrophobicContact CB-CE1 3.8Å; L610-F686 HydrophobicContact CB-CG 4.43Å; L610-F686 HydrophobicContact CB-CZ 4.11Å; L610-F686 HydrophobicContact CD2-CD1 3.82Å; L610-F686 HydrophobicContact CD2-CE1 4.25Å; L610-F686 HydrophobicContact CG-CD1 4.36Å; L610-F686 WeakPolarHBondContact O-CE1 3.44Å; L610-F686 WeakPolarHBondContact O-CZ 3.23Å; I611-F686 HydrophobicContact CG1-CE2 4.49Å; A614-F686 HydrophobicContact CB-CE1 4.08Å; A614-F686 HydrophobicContact CB-CZ 3.8Å; P648-F686 WeakPolarHBondContact CB-O 3.38Å; R649-F686 HydrophobicContact CB-CB 4.24Å; R649-F686 HydrophobicContact CB-CD2 3.87Å; R649-F686 WeakPolarHBondContact O-CD2 3.35Å; R649-F686 PolarHBondContact O-N 3.04Å; F651-F686 HydrophobicContact CB-CE2 3.8Å; F651-F686 HydrophobicContact CB-CZ 3.93Å; F686-P688 VanDerWaalsContact C-CD 3.44Å; F686-I750 HydrophobicContact CD1-CB 4.37Å; F686-I750 HydrophobicContact CD1-CD1 4.35Å; F686-I750 HydrophobicContact CD1-CG1 3.97Å; F686-I750 HydrophobicContact CD1-CG2 3.88Å; F686-I750 HydrophobicContact CE1-CD1 4.06Å; F686-I750 HydrophobicContact CE1-CG1 4.18Å; F686-I750 HydrophobicContact CE1-CG2 3.89Å
687	Y	92.6	Very high	91.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.			trans	-129.5	53.2	-176.8	-61.9	-78	0	0	0	111.9	P648 V685 D689 L690 P697 A718 Y722 F746 N749 F751	P648-Y687 HydrophobicContact CB-CD1 3.67Å; P648-Y687 HydrophobicContact CB-CE1 3.45Å; P648-Y687 VanDerWaalsContact CB-CE1 3.45Å; P648-Y687 HydrophobicContact CG-CD1 4.29Å; P648-Y687 HydrophobicContact CG-CE1 3.57Å; V685-Y687 HydrophobicContact CB-CD2 4.48Å; V685-Y687 HydrophobicContact CB-CE2 3.77Å; V685-Y687 HydrophobicContact CG1-CD2 4.23Å; V685-Y687 HydrophobicContact CG1-CE1 4.15Å; V685-Y687 HydrophobicContact CG1-CE2 3.5Å; V685-Y687 VanDerWaalsContact CG1-CZ 3.46Å; Y687-D689 PolarHBondContact O-N 2.81Å; Y687-L690 PolarHBondContact O-N 3.39Å; Y687-P697 HydrophobicContact CD2-CB 4.25Å; Y687-P697 HydrophobicContact CD2-CG 3.58Å; Y687-P697 HydrophobicContact CE2-CB 3.71Å; Y687-P697 HydrophobicContact CE2-CG 3.57Å; Y687-P697 HydrophobicContact CG-CG 4.18Å; Y687-A718 HydrophobicContact CD1-CB 4.13Å; Y687-A718 HydrophobicContact CE1-CB 3.44Å; Y687-A718 VanDerWaalsContact CE1-CB 3.44Å; Y687-Y722 HydrophobicContact CD1-CD1 4.26Å; Y687-Y722 AromaticContact CD1-CD2 3.55Å; Y687-Y722 HydrophobicContact CD1-CD2 3.55Å; Y687-Y722 AromaticContact CD1-CE2 3.95Å; Y687-Y722 HydrophobicContact CD1-CE2 3.95Å; Y687-Y722 AromaticContact CD1-CG 3.7Å; Y687-Y722 HydrophobicContact CD1-CG 3.7Å; Y687-Y722 HydrophobicContact CE1-CD2 4.37Å; Y687-Y722 HydrophobicContact CE1-CG 4.15Å; Y687-Y722 HydrophobicContact CG-CD2 4.44Å; Y687-Y722 HydrophobicContact CG-CE2 4.49Å; Y687-F746 HydrophobicContact CD2-CE2 4.13Å; Y687-N749 PolarHBondContact N-O 3.05Å; Y687-F751 HydrophobicContact CD2-CB 4.09Å; Y687-F751 HydrophobicContact CE2-CB 3.8Å
688	P	90.2	Very high	91.4	Very high	32 Å²	32	42.5 Å²	42.5	21%	0.208	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-37.6	-174.7	20.7	-32.8	0	0	0	113.9	F686 Y722 N749	F686-P688 VanDerWaalsContact C-CD 3.44Å; P688-Y722 VanDerWaalsContact CD-OH 3.26Å; P688-Y722 WeakPolarHBondContact CD-OH 3.37Å; P688-N749 PolarHBondContact O-ND2 3.28Å
689	D	88.9	Confident	91.5	Very high	69 Å²	69	44 Å²	44	37%	0.369	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	22.7	-167.2	-43.9	-46.6	0	0	0	112.8	R646 Y687 I691 P721 Y722	R646-D689 IonicContact CZ-OD2 2.71Å; R646-D689 VanDerWaalsContact CZ-OD2 3.23Å; R646-D689 IonicContact NH1-OD2 2.69Å; R646-D689 PolarHBondContact NH1-OD2 3.37Å; R646-D689 IonicContact NH2-OD2 2.77Å; R646-D689 PolarHBondContact NH2-OD2 3.16Å; Y687-D689 PolarHBondContact O-N 2.81Å; D689-I691 PolarHBondContact O-N 3.23Å; D689-I691 VanDerWaalsContact O-N 3.15Å; D689-P721 WeakPolarHBondContact O-CD 3.45Å; D689-Y722 HydrophobicContact CB-CE2 4.46Å; D689-Y722 WeakPolarHBondContact CB-OH 3.44Å; D689-Y722 PolarHBondContact N-OH 2.61Å; D689-Y722 PolarHBondContact OD2-OH 3.3Å
690	L	90	Very high	91.6	Very high	2 Å²	2	45 Å²	45	1%	0.01	24%	0.235	C	C	.	.			trans	-62.3	117	178.4	-174.9	66.8	0	0	0	108.7	Y687 D692 K693 P697 Y722 F746	Y687-L690 PolarHBondContact O-N 3.39Å; L690-D692 VanDerWaalsContact C-N 3.31Å; L690-D692 PolarHBondContact O-N 3.19Å; L690-K693 WeakPolarHBondContact O-CE 3.5Å; L690-K693 WeakPolarHBondContact O-CG 3.31Å; L690-P697 HydrophobicContact CD2-CG 4.47Å; L690-Y722 HydrophobicContact CB-CE2 4.31Å; L690-Y722 HydrophobicContact CD1-CD2 4.26Å; L690-F746 HydrophobicContact CD2-CE1 4.17Å; L690-F746 HydrophobicContact CD2-CZ 3.91Å
691	I	87.5	Confident	91.6	Very high	92 Å²	92	48.6 Å²	48.6	47%	0.472	25%	0.254	S	S	.	.	S	Bend	trans	-60.3	-44.7	-174.2	-59.5	-58.8	0	0	0	110.4	Y643 D689 P720	Y643-I691 HydrophobicContact CD1-CD1 4.04Å; Y643-I691 HydrophobicContact CD1-CG1 4.21Å; Y643-I691 HydrophobicContact CD2-CG1 4.49Å; Y643-I691 HydrophobicContact CE1-CD1 3.78Å; Y643-I691 HydrophobicContact CE1-CG1 3.98Å; Y643-I691 HydrophobicContact CE2-CG1 4.26Å; Y643-I691 HydrophobicContact CG-CG1 4.47Å; D689-I691 PolarHBondContact O-N 3.23Å; D689-I691 VanDerWaalsContact O-N 3.15Å; I691-P720 HydrophobicContact CG1-CB 4.4Å; I691-P720 WeakPolarHBondContact CG1-O 3.41Å; I691-P720 PolarHBondContact N-O 2.92Å
692	D	87.9	Confident	91.5	Very high	43 Å²	43	51.6 Å²	51.6	23%	0.23	27%	0.274	C	S	.	.			trans	-102.4	85.3	176.4	-170.3	-16.4	0	0	0	111.2	L690 T694 K695	L690-D692 VanDerWaalsContact C-N 3.31Å; L690-D692 PolarHBondContact O-N 3.19Å; D692-T694 PolarHBondContact O-N 3.09Å; D692-T694 VanDerWaalsContact O-N 3.09Å; D692-T694 WeakPolarHBondContact OD1-CA 3.3Å; D692-T694 VanDerWaalsContact OD1-CB 3.29Å; D692-T694 WeakPolarHBondContact OD1-CB 3.25Å; D692-T694 PolarHBondContact OD1-N 2.94Å; D692-T694 PolarHBondContact OD1-OG1 2.8Å; D692-K695 HydrophobicContact CB-CB 4.5Å; D692-K695 HydrophobicContact CB-CG 4.49Å; D692-K695 PolarHBondContact O-N 3.31Å; D692-K695 VanDerWaalsContact O-N 3.12Å; D692-K695 PolarHBondContact OD1-N 3.1Å; D692-K695 WeakPolarHBondContact OD2-CG 3.38Å; D692-K695 IonicContact OD2-NZ 3.64Å; D692-K695 PolarHBondContact OD2-NZ 3.38Å
693	K	87.3	Confident	91.4	Very high	126 Å²	126	53.4 Å²	53.4	55%	0.548	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.9	176.5	-59.7	-176	176.5	173	0	113.8	L690	L690-K693 WeakPolarHBondContact O-CE 3.5Å; L690-K693 WeakPolarHBondContact O-CG 3.31Å
694	T	89	Confident	90.9	Very high	124 Å²	124	54.8 Å²	54.8	76%	0.761	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-26.6	173.6	80.4	0	0	0	0	112.4	D692 T696	D692-T694 PolarHBondContact O-N 3.09Å; D692-T694 VanDerWaalsContact O-N 3.09Å; D692-T694 WeakPolarHBondContact OD1-CA 3.3Å; D692-T694 VanDerWaalsContact OD1-CB 3.29Å; D692-T694 WeakPolarHBondContact OD1-CB 3.25Å; D692-T694 PolarHBondContact OD1-N 2.94Å; D692-T694 PolarHBondContact OD1-OG1 2.8Å; T694-T696 PolarHBondContact O-N 2.94Å
695	K	89	Confident	90.3	Very high	134 Å²	134	57.5 Å²	57.5	58%	0.583	33%	0.33	S	S	*	.	S	Bend	trans	-85.7	106.5	176.6	-72.3	-173.7	-179.4	85	0	110.3	D692	D692-K695 HydrophobicContact CB-CB 4.5Å; D692-K695 HydrophobicContact CB-CG 4.49Å; D692-K695 PolarHBondContact O-N 3.31Å; D692-K695 VanDerWaalsContact O-N 3.12Å; D692-K695 PolarHBondContact OD1-N 3.1Å; D692-K695 WeakPolarHBondContact OD2-CG 3.38Å; D692-K695 IonicContact OD2-NZ 3.64Å; D692-K695 PolarHBondContact OD2-NZ 3.38Å
696	T	90.3	Very high	89.4	Confident	87 Å²	87	64.8 Å²	64.8	53%	0.534	36%	0.364	S	S	.	.			trans	-64.1	134.9	173.5	55.5	0	0	0	0	111.1	T694 F746	T694-T696 PolarHBondContact O-N 2.94Å; T696-F746 HydrophobicContact CG2-CB 4.11Å; T696-F746 HydrophobicContact CG2-CD1 4.24Å
697	P	93.8	Very high	88.6	Confident	6 Å²	6	70.4 Å²	70.4	4%	0.039	40%	0.401	C	S	.	.			trans	-53.3	147.8	167.2	-24.9	34	0	0	0	111.9	Y687 L690 F746 F751	Y687-P697 HydrophobicContact CD2-CB 4.25Å; Y687-P697 HydrophobicContact CD2-CG 3.58Å; Y687-P697 HydrophobicContact CE2-CB 3.71Å; Y687-P697 HydrophobicContact CE2-CG 3.57Å; Y687-P697 HydrophobicContact CG-CG 4.18Å; L690-P697 HydrophobicContact CD2-CG 4.47Å; P697-F746 HydrophobicContact CG-CD2 3.96Å; P697-F746 HydrophobicContact CG-CE2 3.8Å; P697-F746 HydrophobicContact CG-CG 4.49Å; P697-F746 HydrophobicContact CG-CZ 4.2Å; P697-F751 HydrophobicContact CB-CB 4.43Å; P697-F751 HydrophobicContact CB-CD2 4.04Å; P697-F751 HydrophobicContact CB-CG 4.15Å; P697-F751 HydrophobicContact CG-CB 4.47Å; P697-F751 HydrophobicContact CG-CD2 4.46Å; P697-F751 WeakPolarHBondContact O-CE2 3.2Å
698	T	93.9	Very high	88.1	Confident	73 Å²	73	74.3 Å²	74.3	45%	0.448	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	175.4	-177.8	65.3	0	0	0	0	110.7	F716 I717	T698-F716 WeakPolarHBondContact O-CA 3.29Å; T698-I717 PolarHBondContact N-O 3.37Å; T698-I717 PolarHBondContact O-N 2.92Å
699	Y	94.7	Very high	87.8	Confident	67 Å²	67	78.5 Å²	78.5	26%	0.263	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.7	173.5	68.2	-87.1	0	0	0	111.3	L714 R715 W734 F751 L753	Y699-L714 HydrophobicContact CD2-CD1 3.55Å; Y699-L714 HydrophobicContact CE2-CD1 4.44Å; Y699-L714 HydrophobicContact CG-CD1 4.1Å; Y699-R715 CarbonylContact C-O 3.6Å; Y699-R715 VanDerWaalsContact CA-O 3.3Å; Y699-R715 WeakPolarHBondContact CA-O 3.35Å; Y699-W734 HydrophobicContact CD2-CH2 4.17Å; Y699-W734 HydrophobicContact CD2-CZ3 4.48Å; Y699-W734 AromaticContact CE2-CH2 3.65Å; Y699-W734 HydrophobicContact CE2-CH2 3.65Å; Y699-W734 AromaticContact CE2-CZ3 3.56Å; Y699-W734 HydrophobicContact CE2-CZ3 3.56Å; Y699-W734 AromaticContact CZ-CZ3 3.89Å; Y699-F751 HydrophobicContact CD1-CE1 4.36Å; Y699-F751 HydrophobicContact CD1-CZ 4.13Å; Y699-L753 HydrophobicContact CD1-CD2 3.76Å; Y699-L753 HydrophobicContact CD2-CD2 4.11Å; Y699-L753 HydrophobicContact CE1-CD1 3.99Å; Y699-L753 HydrophobicContact CE1-CD2 3.98Å; Y699-L753 HydrophobicContact CE2-CD2 4.31Å; Y699-L753 HydrophobicContact CG-CD2 3.82Å
700	T	94.1	Very high	87.9	Confident	47 Å²	47	81.1 Å²	81.1	29%	0.288	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.1	174.9	52.8	0	0	0	0	109.3	R715 I717	T700-R715 PolarHBondContact N-O 3.26Å; T700-R715 PolarHBondContact O-N 3.47Å; T700-R715 PolarHBondContact OG1-NE 3.05Å; T700-R715 PolarHBondContact OG1-NH2 3.17Å; T700-R715 PolarHBondContact OG1-O 2.79Å; T700-I717 HydrophobicContact CG2-CD1 3.8Å
701	L	93.6	Very high	88	Confident	77 Å²	77	84.4 Å²	84.4	40%	0.403	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.6	-179.3	-177.7	65.8	0	0	0	109.4	A712 L714 I729 W734	L701-A712 HydrophobicContact CD1-CB 3.66Å; L701-A712 HydrophobicContact CG-CB 4.34Å; L701-L714 HydrophobicContact CD1-CB 4.3Å; L701-I729 HydrophobicContact CD1-CD1 3.83Å; L701-I729 HydrophobicContact CD1-CG1 4.29Å; L701-W734 HydrophobicContact CD1-CZ2 4.3Å; L701-W734 HydrophobicContact CD2-CZ2 3.9Å
702	T	92.2	Very high	88.3	Confident	76 Å²	76	80 Å²	80	47%	0.466	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.6	179.9	-54.6	0	0	0	0	108.8	A712 I713	T702-A712 CarbonylContact O-C 3.59Å; T702-A712 WeakPolarHBondContact O-CA 3.3Å; T702-I713 PolarHBondContact N-O 3.02Å; T702-I713 PolarHBondContact O-N 2.89Å
703	A	90.5	Very high	88.5	Confident	62 Å²	62	80.6 Å²	80.6	51%	0.512	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	140.4	175.4	0	0	0	0	0	110.6
704	C	84.4	Confident	88.8	Confident	29 Å²	29	74.6 Å²	74.6	20%	0.196	42%	0.417	C	S	.	.			trans	-68.2	147	173.3	-67.7	0	0	0	0	110.7	E708 F711	C704-E708 HydrophobicContact CB-CB 4.08Å; C704-E708 WeakPolarHBondContact CB-O 3.34Å; C704-F711 WeakPolarHBondContact CB-O 3.22Å; C704-F711 PolarHBondContact N-O 3.23Å
705	G	79.6	Confident	89.1	Confident	56 Å²	56	72.2 Å²	72.2	58%	0.577	39%	0.394	S	S	*	.			trans	-69.6	-179.3	170.2	0	0	0	0	0	112.6	E708	G705-E708 PolarHBondContact O-N 2.72Å
706	E	74.4	Confident	89.4	Confident	153 Å²	153	65.9 Å²	65.9	72%	0.715	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	137.7	167.1	-73	-172.6	-155.6	0	0	110.3	K709	E706-K709 HydrophobicContact CG-CD 4.34Å; E706-K709 HydrophobicContact CG-CG 4.21Å; E706-K709 WeakPolarHBondContact OE1-CE 3.31Å; E706-K709 IonicContact OE1-NZ 3.78Å; E706-K709 PolarHBondContact OE1-NZ 3.21Å
707	P	77.1	Confident	89.5	Confident	124 Å²	124	64 Å²	64	81%	0.805	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.7	-11.2	11.2	34	-35.9	0	0	0	116.1	K709	P707-K709 PolarHBondContact O-N 2.7Å
708	E	80.8	Confident	89.4	Confident	81 Å²	81	65 Å²	65	38%	0.379	36%	0.361	S	S	.	.			trans	-91.7	42.5	-163.1	-60.6	-155.7	117.3	0	0	116	C704 G705 D710 F711 K728	C704-E708 HydrophobicContact CB-CB 4.08Å; C704-E708 WeakPolarHBondContact CB-O 3.34Å; G705-E708 PolarHBondContact O-N 2.72Å; E708-D710 PolarHBondContact O-N 3.41Å; E708-F711 HydrophobicContact CB-CD2 4.32Å; E708-F711 PolarHBondContact O-N 2.89Å; E708-K728 IonicContact OE1-NZ 2.94Å; E708-K728 PolarHBondContact OE1-NZ 3.09Å; E708-K728 WeakPolarHBondContact OE2-CE 3.31Å; E708-K728 IonicContact OE2-NZ 2.8Å; E708-K728 PolarHBondContact OE2-NZ 2.81Å
709	K	85.8	Confident	89.1	Confident	120 Å²	120	62.2 Å²	62.2	52%	0.522	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.4	-175.6	-62.3	-168.9	-171.8	-176.6	0	115.3	E706 P707 F711 N731	E706-K709 HydrophobicContact CG-CD 4.34Å; E706-K709 HydrophobicContact CG-CG 4.21Å; E706-K709 WeakPolarHBondContact OE1-CE 3.31Å; E706-K709 IonicContact OE1-NZ 3.78Å; E706-K709 PolarHBondContact OE1-NZ 3.21Å; P707-K709 PolarHBondContact O-N 2.7Å; K709-F711 PolarHBondContact O-N 3.47Å; K709-N731 PolarHBondContact O-ND2 3.35Å
710	D	89.5	Confident	88.8	Confident	125 Å²	125	60.8 Å²	60.8	67%	0.668	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.8	178.9	-70.8	-20.9	0	0	0	113.3	E708 V730 N731	E708-D710 PolarHBondContact O-N 3.41Å; D710-V730 WeakPolarHBondContact O-CA 3.26Å; D710-N731 PolarHBondContact O-N 3.06Å
711	F	92.5	Very high	88.7	Confident	71 Å²	71	58.7 Å²	58.7	31%	0.311	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	154.4	178	-63.5	-81.2	0	0	0	112.9	C704 E708 K709 K728 I729 V730	C704-F711 WeakPolarHBondContact CB-O 3.22Å; C704-F711 PolarHBondContact N-O 3.23Å; E708-F711 HydrophobicContact CB-CD2 4.32Å; E708-F711 PolarHBondContact O-N 2.89Å; K709-F711 PolarHBondContact O-N 3.47Å; F711-K728 HydrophobicContact CB-CG 4.1Å; F711-K728 HydrophobicContact CD1-CD 4.35Å; F711-K728 HydrophobicContact CD1-CG 3.86Å; F711-K728 HydrophobicContact CG-CD 4.42Å; F711-K728 VanDerWaalsContact CG-CE 3.43Å; F711-K728 HydrophobicContact CG-CG 4.16Å; F711-I729 CarbonylContact C-O 3.59Å; F711-I729 VanDerWaalsContact CA-O 3.28Å; F711-I729 WeakPolarHBondContact CA-O 3.42Å; F711-V730 HydrophobicContact CE1-CG2 4.22Å
712	A	93	Very high	88.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.7	174.4	0	0	0	0	0	109.6	L701 T702 I729 N731	L701-A712 HydrophobicContact CD1-CB 3.66Å; L701-A712 HydrophobicContact CG-CB 4.34Å; T702-A712 CarbonylContact O-C 3.59Å; T702-A712 WeakPolarHBondContact O-CA 3.3Å; A712-I729 HydrophobicContact CB-CG1 4.44Å; A712-I729 PolarHBondContact N-O 3.29Å; A712-I729 WeakPolarHBondContact O-CG1 3.46Å; A712-I729 PolarHBondContact O-N 2.91Å; A712-N731 HydrophobicContact CB-CB 4.04Å
713	I	92.9	Very high	88.5	Confident	54 Å²	54	54.1 Å²	54.1	28%	0.277	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.7	176.3	-55.1	-174.9	0	0	0	108	I630 T702 A726	I630-I713 HydrophobicContact CD1-CB 4.42Å; I630-I713 HydrophobicContact CD1-CD1 3.96Å; I630-I713 HydrophobicContact CD1-CG1 3.76Å; I630-I713 HydrophobicContact CD1-CG2 4.09Å; T702-I713 PolarHBondContact N-O 3.02Å; T702-I713 PolarHBondContact O-N 2.89Å; I713-A726 HydrophobicContact CG2-CB 3.77Å
714	L	94.7	Very high	88.6	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	104.3	170.4	178.2	62.1	0	0	0	108.3	F683 Y699 L701 F716 A726 F727 I729 W734 L753 F755	F683-L714 HydrophobicContact CD2-CD2 3.97Å; F683-L714 HydrophobicContact CE2-CD2 3.48Å; F683-L714 VanDerWaalsContact CE2-CD2 3.48Å; F683-L714 HydrophobicContact CZ-CD2 3.8Å; Y699-L714 HydrophobicContact CD2-CD1 3.55Å; Y699-L714 HydrophobicContact CE2-CD1 4.44Å; Y699-L714 HydrophobicContact CG-CD1 4.1Å; L701-L714 HydrophobicContact CD1-CB 4.3Å; L714-F716 HydrophobicContact CD2-CE2 3.95Å; L714-F716 HydrophobicContact CD2-CZ 3.71Å; L714-F716 HydrophobicContact CG-CE2 3.95Å; L714-F716 HydrophobicContact CG-CZ 4.04Å; L714-A726 WeakPolarHBondContact O-CA 3.5Å; L714-F727 PolarHBondContact N-O 2.84Å; L714-F727 PolarHBondContact O-N 2.79Å; L714-I729 HydrophobicContact CB-CD1 4.01Å; L714-I729 HydrophobicContact CB-CG1 4.21Å; L714-I729 HydrophobicContact CB-CG2 4.46Å; L714-I729 HydrophobicContact CD2-CD1 4.26Å; L714-W734 HydrophobicContact CD1-CH2 4.01Å; L714-W734 HydrophobicContact CD1-CZ2 4.45Å; L714-W734 HydrophobicContact CD2-CH2 4.48Å; L714-L753 HydrophobicContact CD1-CD2 4.42Å; L714-L753 HydrophobicContact CD2-CD2 4.11Å; L714-F755 HydrophobicContact CD2-CE1 4.23Å
715	R	93.9	Very high	89	Confident	75 Å²	75	50.8 Å²	50.8	28%	0.283	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120.4	176.8	-178.6	179.4	60.3	-143.8	-12.1	110	Y699 T700 I717 D724 I725 A726	Y699-R715 CarbonylContact C-O 3.6Å; Y699-R715 VanDerWaalsContact CA-O 3.3Å; Y699-R715 WeakPolarHBondContact CA-O 3.35Å; T700-R715 PolarHBondContact N-O 3.26Å; T700-R715 PolarHBondContact O-N 3.47Å; T700-R715 PolarHBondContact OG1-NE 3.05Å; T700-R715 PolarHBondContact OG1-NH2 3.17Å; T700-R715 PolarHBondContact OG1-O 2.79Å; R715-I717 HydrophobicContact CG-CG1 4.27Å; R715-D724 WeakPolarHBondContact CD-OD2 3.16Å; R715-D724 HydrophobicContact CG-CB 3.87Å; R715-D724 IonicContact NE-OD2 2.94Å; R715-I725 CarbonylContact C-O 3.56Å; R715-I725 WeakPolarHBondContact CA-O 3.45Å; R715-A726 HydrophobicContact CB-CB 4.22Å; R715-A726 HydrophobicContact CG-CB 4.45Å
716	F	94.7	Very high	89.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.1	169.6	-62.3	-89	0	0	0	108.9	F683 V685 T698 L714 D724 I725 F727 F751 L753	F683-F716 HydrophobicContact CB-CE1 4.36Å; F683-F716 HydrophobicContact CB-CE2 4.48Å; F683-F716 HydrophobicContact CB-CZ 3.71Å; F683-F716 AromaticContact CD1-CE2 3.7Å; F683-F716 HydrophobicContact CD1-CE2 3.7Å; F683-F716 AromaticContact CD1-CZ 3.7Å; F683-F716 HydrophobicContact CD1-CZ 3.7Å; F683-F716 AromaticContact CD2-CZ 4Å; F683-F716 HydrophobicContact CD2-CZ 4Å; F683-F716 HydrophobicContact CE1-CE2 4.04Å; F683-F716 HydrophobicContact CE1-CZ 4.31Å; F683-F716 HydrophobicContact CG-CE2 4.04Å; F683-F716 AromaticContact CG-CZ 3.53Å; F683-F716 HydrophobicContact CG-CZ 3.53Å; V685-F716 HydrophobicContact CG2-CD1 4.38Å; V685-F716 HydrophobicContact CG2-CD2 4.43Å; V685-F716 HydrophobicContact CG2-CE1 4.46Å; V685-F716 HydrophobicContact CG2-CG 4.37Å; T698-F716 WeakPolarHBondContact O-CA 3.29Å; L714-F716 HydrophobicContact CD2-CE2 3.95Å; L714-F716 HydrophobicContact CD2-CZ 3.71Å; L714-F716 HydrophobicContact CG-CE2 3.95Å; L714-F716 HydrophobicContact CG-CZ 4.04Å; F716-D724 VanDerWaalsContact O-CA 3.29Å; F716-D724 WeakPolarHBondContact O-CA 3.2Å; F716-D724 WeakPolarHBondContact O-CB 3.18Å; F716-I725 HydrophobicContact CB-CG1 4.14Å; F716-I725 HydrophobicContact CD2-CG1 4.29Å; F716-I725 PolarHBondContact N-O 2.96Å; F716-I725 PolarHBondContact O-N 3.25Å; F716-F727 AromaticContact CD2-CD2 3.92Å; F716-F727 HydrophobicContact CD2-CD2 3.92Å; F716-F727 AromaticContact CD2-CE2 3.95Å; F716-F727 HydrophobicContact CD2-CE2 3.95Å; F716-F727 AromaticContact CE2-CD2 3.66Å; F716-F727 HydrophobicContact CE2-CD2 3.66Å; F716-F727 AromaticContact CE2-CE2 3.9Å; F716-F727 HydrophobicContact CE2-CE2 3.9Å; F716-F751 AromaticContact CD1-CD1 3.8Å; F716-F751 HydrophobicContact CD1-CD1 3.8Å; F716-F751 AromaticContact CD1-CE1 3.71Å; F716-F751 HydrophobicContact CD1-CE1 3.71Å; F716-F751 AromaticContact CE1-CD1 3.88Å; F716-F751 HydrophobicContact CE1-CD1 3.88Å; F716-F751 AromaticContact CE1-CE1 3.71Å; F716-F751 HydrophobicContact CE1-CE1 3.71Å; F716-L753 HydrophobicContact CE1-CB 4.14Å; F716-L753 HydrophobicContact CE1-CD2 3.7Å; F716-L753 HydrophobicContact CZ-CD2 4.01Å
717	I	93.2	Very high	90.6	Very high	48 Å²	48	41 Å²	41	25%	0.246	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126	-176.1	-53.3	-175.9	0	0	0	108.7	T698 T700 R715 D724	T698-I717 PolarHBondContact N-O 3.37Å; T698-I717 PolarHBondContact O-N 2.92Å; T700-I717 HydrophobicContact CG2-CD1 3.8Å; R715-I717 HydrophobicContact CG-CG1 4.27Å; I717-D724 VanDerWaalsContact CA-OD1 3.31Å; I717-D724 WeakPolarHBondContact CA-OD1 3.03Å; I717-D724 WeakPolarHBondContact CG2-OD1 3.47Å
718	A	90.8	Very high	91.3	Very high	26 Å²	26	38.5 Å²	38.5	22%	0.215	19%	0.192	C	C	.	.			trans	-115.1	-175.8	-172.6	0	0	0	0	0	112.4	Y687	Y687-A718 HydrophobicContact CD1-CB 4.13Å; Y687-A718 HydrophobicContact CE1-CB 3.44Å; Y687-A718 VanDerWaalsContact CE1-CB 3.44Å
719	G	88.5	Confident	91.9	Very high	16 Å²	16	34.7 Å²	34.7	17%	0.165	17%	0.174	C	C	.	.			trans	-100.7	174.6	163.7	0	0	0	0	0	111.3	Y722	G719-Y722 PolarHBondContact O-N 2.76Å
720	P	89.2	Confident	92.3	Very high	36 Å²	36	30.4 Å²	30.4	23%	0.234	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	138.9	172.5	-19	29.1	0	0	0	110.6	W639 Y643 I691	W639-P720 HydrophobicContact CB-CB 4.49Å; W639-P720 HydrophobicContact CB-CG 4.17Å; W639-P720 HydrophobicContact CD2-CB 3.74Å; W639-P720 HydrophobicContact CD2-CG 3.87Å; W639-P720 HydrophobicContact CE3-CB 3.98Å; W639-P720 HydrophobicContact CG-CB 3.99Å; W639-P720 HydrophobicContact CG-CG 3.65Å; Y643-P720 HydrophobicContact CD2-CB 3.87Å; Y643-P720 HydrophobicContact CE2-CB 4.3Å; I691-P720 HydrophobicContact CG1-CB 4.4Å; I691-P720 WeakPolarHBondContact CG1-O 3.41Å; I691-P720 PolarHBondContact N-O 2.92Å
721	P	90.6	Very high	92.5	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.026	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	cis	-100.4	22.9	8.3	41.3	-37.5	0	0	0	113.9	W639 P645 R646 D689	W639-P721 WeakPolarHBondContact CH2-O 3.34Å; W639-P721 HydrophobicContact CZ3-CB 4.29Å; P645-P721 WeakPolarHBondContact CA-O 3.47Å; R646-P721 HydrophobicContact CG-CB 4.49Å; R646-P721 HydrophobicContact CG-CG 4.3Å; R646-P721 WeakPolarHBondContact CG-O 3.15Å; R646-P721 PolarHBondContact N-O 3.41Å; D689-P721 WeakPolarHBondContact O-CD 3.45Å
722	Y	92.1	Very high	92.5	Very high	8 Å²	8	29.7 Å²	29.7	3%	0.031	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-96.6	137.5	-168.3	-67.1	-73.4	0	0	0	113.7	R646 P648 Y687 P688 D689 L690 G719	R646-Y722 HydrophobicContact CG-CD1 4.15Å; R646-Y722 HydrophobicContact CG-CE1 4.23Å; R646-Y722 VanDerWaalsContact O-CA 3.31Å; R646-Y722 WeakPolarHBondContact O-CA 3.36Å; P648-Y722 HydrophobicContact CB-CD1 3.68Å; P648-Y722 HydrophobicContact CB-CE1 4.11Å; P648-Y722 HydrophobicContact CB-CG 4.25Å; P648-Y722 HydrophobicContact CG-CD1 4.35Å; Y687-Y722 HydrophobicContact CD1-CD1 4.26Å; Y687-Y722 AromaticContact CD1-CD2 3.55Å; Y687-Y722 HydrophobicContact CD1-CD2 3.55Å; Y687-Y722 AromaticContact CD1-CE2 3.95Å; Y687-Y722 HydrophobicContact CD1-CE2 3.95Å; Y687-Y722 AromaticContact CD1-CG 3.7Å; Y687-Y722 HydrophobicContact CD1-CG 3.7Å; Y687-Y722 HydrophobicContact CE1-CD2 4.37Å; Y687-Y722 HydrophobicContact CE1-CG 4.15Å; Y687-Y722 HydrophobicContact CG-CD2 4.44Å; Y687-Y722 HydrophobicContact CG-CE2 4.49Å; P688-Y722 VanDerWaalsContact CD-OH 3.26Å; P688-Y722 WeakPolarHBondContact CD-OH 3.37Å; D689-Y722 HydrophobicContact CB-CE2 4.46Å; D689-Y722 WeakPolarHBondContact CB-OH 3.44Å; D689-Y722 PolarHBondContact N-OH 2.61Å; D689-Y722 PolarHBondContact OD2-OH 3.3Å; L690-Y722 HydrophobicContact CB-CE2 4.31Å; L690-Y722 HydrophobicContact CD1-CD2 4.26Å; G719-Y722 PolarHBondContact O-N 2.76Å
723	E	90.9	Very high	92.5	Very high	49 Å²	49	34.8 Å²	34.8	23%	0.229	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-75.7	152.7	171.6	-59.1	-178.2	-175.7	0	0	112.2	F637 P645 R646 K647 P648 I725	F637-E723 HydrophobicContact CE2-CB 4.4Å; F637-E723 HydrophobicContact CE2-CG 4.09Å; P645-E723 HydrophobicContact CB-CG 3.98Å; R646-E723 PolarHBondContact O-N 2.84Å; K647-E723 WeakPolarHBondContact CE-OE2 3.45Å; K647-E723 HydrophobicContact CG-CB 4.35Å; K647-E723 WeakPolarHBondContact CG-OE2 3.25Å; K647-E723 IonicContact NZ-OE2 2.66Å; P648-E723 WeakPolarHBondContact CD-O 3.31Å; E723-I725 PolarHBondContact O-N 3.47Å
724	D	92.2	Very high	92.6	Very high	17 Å²	17	32.8 Å²	32.8	9%	0.091	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-67.7	130.3	171.1	-70.2	-2	0	0	0	110.8	Q635 R715 F716 I717	Q635-D724 PolarHBondContact NE2-OD2 3.01Å; Q635-D724 PolarHBondContact OE1-OD2 3.33Å; R715-D724 WeakPolarHBondContact CD-OD2 3.16Å; R715-D724 HydrophobicContact CG-CB 3.87Å; R715-D724 IonicContact NE-OD2 2.94Å; F716-D724 VanDerWaalsContact O-CA 3.29Å; F716-D724 WeakPolarHBondContact O-CA 3.2Å; F716-D724 WeakPolarHBondContact O-CB 3.18Å; I717-D724 VanDerWaalsContact CA-OD1 3.31Å; I717-D724 WeakPolarHBondContact CA-OD1 3.03Å; I717-D724 WeakPolarHBondContact CG2-OD1 3.47Å
725	I	92.8	Very high	92.5	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.6	174.4	60.2	166.7	0	0	0	111.6	M629 P648 F650 V685 R715 F716 E723 F727	M629-I725 HydrophobicContact SD-CB 4.32Å; M629-I725 HydrophobicContact SD-CG2 4.08Å; P648-I725 HydrophobicContact CG-CD1 3.96Å; P648-I725 HydrophobicContact CG-CG1 4.1Å; P648-I725 HydrophobicContact CG-CG2 4Å; F650-I725 HydrophobicContact CD1-CD1 3.74Å; F650-I725 HydrophobicContact CE1-CD1 4.39Å; F650-I725 HydrophobicContact CG-CD1 4.45Å; V685-I725 HydrophobicContact CG1-CD1 3.78Å; V685-I725 HydrophobicContact CG2-CD1 4.16Å; R715-I725 CarbonylContact C-O 3.56Å; R715-I725 WeakPolarHBondContact CA-O 3.45Å; F716-I725 HydrophobicContact CB-CG1 4.14Å; F716-I725 HydrophobicContact CD2-CG1 4.29Å; F716-I725 PolarHBondContact N-O 2.96Å; F716-I725 PolarHBondContact O-N 3.25Å; E723-I725 PolarHBondContact O-N 3.47Å; I725-F727 HydrophobicContact CB-CE2 4.41Å; I725-F727 HydrophobicContact CD1-CE2 3.59Å; I725-F727 HydrophobicContact CD1-CZ 3.83Å; I725-F727 HydrophobicContact CG1-CE2 3.98Å
726	A	93.6	Very high	92.4	Very high	3 Å²	3	38 Å²	38	3%	0.025	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140	-175.8	0	0	0	0	0	112.7	M629 I630 V632 I713 L714 R715	M629-A726 CarbonylContact C-O 3.56Å; M629-A726 WeakPolarHBondContact CA-O 3.48Å; I630-A726 HydrophobicContact CB-CB 4.41Å; I630-A726 PolarHBondContact N-O 3.01Å; V632-A726 HydrophobicContact CG2-CB 3.55Å; I713-A726 HydrophobicContact CG2-CB 3.77Å; L714-A726 WeakPolarHBondContact O-CA 3.5Å; R715-A726 HydrophobicContact CB-CB 4.22Å; R715-A726 HydrophobicContact CG-CB 4.45Å
727	F	94	Very high	92.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.4	178.3	-61.3	-89.2	0	0	0	111.6	F626 V628 M629 F650 N652 F683 L714 F716 I725 I729	F626-F727 HydrophobicContact CE2-CD1 4.14Å; V628-F727 WeakPolarHBondContact O-CD1 3.43Å; M629-F727 HydrophobicContact CG-CD1 4.32Å; M629-F727 HydrophobicContact CG-CE1 3.66Å; M629-F727 HydrophobicContact CG-CZ 3.94Å; F650-F727 AromaticContact CD1-CZ 3.92Å; F650-F727 HydrophobicContact CD1-CZ 3.92Å; F650-F727 HydrophobicContact CD2-CE1 4.26Å; F650-F727 HydrophobicContact CD2-CZ 4.03Å; F650-F727 HydrophobicContact CE1-CE1 4.48Å; F650-F727 HydrophobicContact CE1-CZ 4.03Å; F650-F727 HydrophobicContact CE2-CE1 4.04Å; F650-F727 HydrophobicContact CE2-CZ 4.14Å; F650-F727 AromaticContact CG-CZ 3.93Å; F650-F727 HydrophobicContact CG-CZ 3.93Å; F650-F727 HydrophobicContact CZ-CE1 4.15Å; F650-F727 HydrophobicContact CZ-CZ 4.13Å; N652-F727 VanDerWaalsContact ND2-CE1 3.32Å; N652-F727 WeakPolarHBondContact ND2-CE1 3.44Å; N652-F727 WeakPolarHBondContact ND2-CZ 3.31Å; F683-F727 HydrophobicContact CD1-CD2 4.17Å; F683-F727 HydrophobicContact CD1-CE2 4.34Å; F683-F727 HydrophobicContact CE1-CB 3.87Å; F683-F727 HydrophobicContact CE1-CD1 4.24Å; F683-F727 AromaticContact CE1-CD2 3.69Å; F683-F727 HydrophobicContact CE1-CD2 3.69Å; F683-F727 HydrophobicContact CE1-CE2 4.26Å; F683-F727 AromaticContact CE1-CG 3.67Å; F683-F727 HydrophobicContact CE1-CG 3.67Å; F683-F727 HydrophobicContact CZ-CB 4.2Å; F683-F727 HydrophobicContact CZ-CG 4.48Å; L714-F727 PolarHBondContact N-O 2.84Å; L714-F727 PolarHBondContact O-N 2.79Å; F716-F727 AromaticContact CD2-CD2 3.92Å; F716-F727 HydrophobicContact CD2-CD2 3.92Å; F716-F727 AromaticContact CD2-CE2 3.95Å; F716-F727 HydrophobicContact CD2-CE2 3.95Å; F716-F727 AromaticContact CE2-CD2 3.66Å; F716-F727 HydrophobicContact CE2-CD2 3.66Å; F716-F727 AromaticContact CE2-CE2 3.9Å; F716-F727 HydrophobicContact CE2-CE2 3.9Å; I725-F727 HydrophobicContact CB-CE2 4.41Å; I725-F727 HydrophobicContact CD1-CE2 3.59Å; I725-F727 HydrophobicContact CD1-CZ 3.83Å; I725-F727 HydrophobicContact CG1-CE2 3.98Å; F727-I729 PolarHBondContact O-N 2.84Å
728	K	92	Very high	92	Very high	72 Å²	72	46.7 Å²	46.7	31%	0.313	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	116.8	172.5	-167.9	166.2	172.8	170.8	0	109.7	I630 E708 F711	I630-K728 HydrophobicContact CD1-CB 3.84Å; I630-K728 HydrophobicContact CG1-CB 4.2Å; E708-K728 IonicContact OE1-NZ 2.94Å; E708-K728 PolarHBondContact OE1-NZ 3.09Å; E708-K728 WeakPolarHBondContact OE2-CE 3.31Å; E708-K728 IonicContact OE2-NZ 2.8Å; E708-K728 PolarHBondContact OE2-NZ 2.81Å; F711-K728 HydrophobicContact CB-CG 4.1Å; F711-K728 HydrophobicContact CD1-CD 4.35Å; F711-K728 HydrophobicContact CD1-CG 3.86Å; F711-K728 HydrophobicContact CG-CD 4.42Å; F711-K728 VanDerWaalsContact CG-CE 3.43Å; F711-K728 HydrophobicContact CG-CG 4.16Å
729	I	93.3	Very high	91.8	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	159.1	176.5	64.1	164	0	0	0	111.7	Y681 F683 L701 F711 A712 L714 F727 W734 F755	Y681-I729 HydrophobicContact CD1-CG2 4.14Å; Y681-I729 HydrophobicContact CD2-CB 4.22Å; Y681-I729 HydrophobicContact CD2-CG2 4.12Å; Y681-I729 HydrophobicContact CE1-CB 4.42Å; Y681-I729 HydrophobicContact CE1-CG2 3.92Å; Y681-I729 HydrophobicContact CE2-CB 3.68Å; Y681-I729 HydrophobicContact CE2-CG2 3.91Å; Y681-I729 HydrophobicContact CG-CG2 4.23Å; Y681-I729 WeakPolarHBondContact OH-CA 3.38Å; F683-I729 HydrophobicContact CE2-CG2 4.19Å; F683-I729 HydrophobicContact CZ-CG2 3.69Å; L701-I729 HydrophobicContact CD1-CD1 3.83Å; L701-I729 HydrophobicContact CD1-CG1 4.29Å; F711-I729 CarbonylContact C-O 3.59Å; F711-I729 VanDerWaalsContact CA-O 3.28Å; F711-I729 WeakPolarHBondContact CA-O 3.42Å; A712-I729 HydrophobicContact CB-CG1 4.44Å; A712-I729 PolarHBondContact N-O 3.29Å; A712-I729 WeakPolarHBondContact O-CG1 3.46Å; A712-I729 PolarHBondContact O-N 2.91Å; L714-I729 HydrophobicContact CB-CD1 4.01Å; L714-I729 HydrophobicContact CB-CG1 4.21Å; L714-I729 HydrophobicContact CB-CG2 4.46Å; L714-I729 HydrophobicContact CD2-CD1 4.26Å; F727-I729 PolarHBondContact O-N 2.84Å; I729-W734 HydrophobicContact CD1-CZ2 3.81Å; I729-F755 HydrophobicContact CD1-CE2 4.43Å; I729-F755 HydrophobicContact CD1-CZ 3.83Å
730	V	93.7	Very high	91.7	Very high	30 Å²	30	58.8 Å²	58.8	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	131	173.3	174.7	0	0	0	0	110.8	V678 Y681 D710 F711 R732 F757	V678-V730 HydrophobicContact CB-CG2 4.35Å; V678-V730 HydrophobicContact CG2-CG2 4.27Å; Y681-V730 PolarHBondContact OH-N 2.62Å; D710-V730 WeakPolarHBondContact O-CA 3.26Å; F711-V730 HydrophobicContact CE1-CG2 4.22Å; V730-R732 HydrophobicContact CG1-CG 3.82Å; V730-R732 PolarHBondContact O-N 3.46Å; V730-R732 VanDerWaalsContact O-N 3.15Å; V730-F757 HydrophobicContact CB-CE2 3.98Å; V730-F757 HydrophobicContact CB-CZ 3.93Å; V730-F757 HydrophobicContact CG1-CE2 4.32Å; V730-F757 HydrophobicContact CG1-CZ 4.39Å; V730-F757 WeakPolarHBondContact O-CE1 3.44Å; V730-F757 WeakPolarHBondContact O-CZ 3.49Å
731	N	93.3	Very high	91.6	Very high	70 Å²	70	58.8 Å²	58.8	37%	0.374	27%	0.272	S	S	.	.			trans	-83.7	83.4	-177.1	-172.9	13.9	0	0	0	111.8	K709 D710 A712	K709-N731 PolarHBondContact O-ND2 3.35Å; D710-N731 PolarHBondContact O-N 3.06Å; A712-N731 HydrophobicContact CB-CB 4.04Å
732	R	92.3	Very high	91.7	Very high	110 Å²	110	59.5 Å²	59.5	42%	0.415	28%	0.275	S	S	.	.			trans	-139.1	153.1	178.3	-69.5	171.9	73.6	-172	5	110.5	V730 W734 F757	V730-R732 HydrophobicContact CG1-CG 3.82Å; V730-R732 PolarHBondContact O-N 3.46Å; V730-R732 VanDerWaalsContact O-N 3.15Å; R732-W734 PolarHBondContact O-N 2.77Å; R732-F757 HydrophobicContact CB-CB 4.47Å; R732-F757 HydrophobicContact CB-CD1 3.59Å; R732-F757 HydrophobicContact CB-CE1 3.88Å; R732-F757 HydrophobicContact CB-CG 4Å; R732-F757 HydrophobicContact CB-CZ 4.49Å; R732-F757 WeakPolarHBondContact O-CD1 3.23Å; R732-F757 WeakPolarHBondContact O-CE1 3.28Å
733	E	93.3	Very high	91.7	Very high	107 Å²	107	62.7 Å²	62.7	50%	0.5	29%	0.287	S	S	.	.			trans	-54.8	127.4	177.5	-70.9	-175.5	-136.1	0	0	112.4	F757 K758	E733-F757 WeakPolarHBondContact O-CA 3.11Å; E733-K758 HydrophobicContact CB-CB 4.15Å; E733-K758 HydrophobicContact CB-CD 4.11Å; E733-K758 WeakPolarHBondContact O-CB 3.49Å; E733-K758 PolarHBondContact O-N 3.06Å; E733-K758 VanDerWaalsContact OE2-CD 3.24Å; E733-K758 WeakPolarHBondContact OE2-CD 3.26Å; E733-K758 WeakPolarHBondContact OE2-CE 3.22Å; E733-K758 IonicContact OE2-NZ 2.61Å; E733-K758 PolarHBondContact OE2-NZ 3.27Å
734	W	94.6	Very high	91.8	Very high	12 Å²	12	62.9 Å²	62.9	5%	0.045	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-80.3	148.2	175	-57.3	-1	0	0	0	110.9	Y699 L701 L714 I729 R732 Y736 L753 F755 F757	Y699-W734 HydrophobicContact CD2-CH2 4.17Å; Y699-W734 HydrophobicContact CD2-CZ3 4.48Å; Y699-W734 AromaticContact CE2-CH2 3.65Å; Y699-W734 HydrophobicContact CE2-CH2 3.65Å; Y699-W734 AromaticContact CE2-CZ3 3.56Å; Y699-W734 HydrophobicContact CE2-CZ3 3.56Å; Y699-W734 AromaticContact CZ-CZ3 3.89Å; L701-W734 HydrophobicContact CD1-CZ2 4.3Å; L701-W734 HydrophobicContact CD2-CZ2 3.9Å; L714-W734 HydrophobicContact CD1-CH2 4.01Å; L714-W734 HydrophobicContact CD1-CZ2 4.45Å; L714-W734 HydrophobicContact CD2-CH2 4.48Å; I729-W734 HydrophobicContact CD1-CZ2 3.81Å; R732-W734 PolarHBondContact O-N 2.77Å; W734-Y736 HydrophobicContact CB-CE1 4.39Å; W734-Y736 HydrophobicContact CB-CE2 4.05Å; W734-Y736 AromaticContact CE3-CE1 3.89Å; W734-Y736 HydrophobicContact CE3-CE1 3.89Å; W734-Y736 WeakPolarHBondContact O-CD2 3.34Å; W734-L753 HydrophobicContact CH2-CD2 4.43Å; W734-L753 HydrophobicContact CZ3-CD1 4.48Å; W734-F755 HydrophobicContact CB-CB 4.48Å; W734-F755 HydrophobicContact CB-CD2 4.33Å; W734-F755 AromaticContact CD1-CD2 3.63Å; W734-F755 AromaticContact CD1-CE2 3.69Å; W734-F755 HydrophobicContact CD2-CB 4.34Å; W734-F755 HydrophobicContact CD2-CD1 4.17Å; W734-F755 AromaticContact CD2-CD2 3.67Å; W734-F755 HydrophobicContact CD2-CD2 3.67Å; W734-F755 HydrophobicContact CD2-CE1 4.41Å; W734-F755 AromaticContact CD2-CE2 3.94Å; W734-F755 HydrophobicContact CD2-CE2 3.94Å; W734-F755 AromaticContact CD2-CG 3.8Å; W734-F755 HydrophobicContact CD2-CG 3.8Å; W734-F755 HydrophobicContact CD2-CZ 4.3Å; W734-F755 AromaticContact CE2-CD2 3.77Å; W734-F755 AromaticContact CE2-CE2 3.5Å; W734-F755 AromaticContact CE2-CZ 3.64Å; W734-F755 HydrophobicContact CE3-CB 4.26Å; W734-F755 HydrophobicContact CE3-CD1 4.06Å; W734-F755 HydrophobicContact CE3-CD2 4.31Å; W734-F755 HydrophobicContact CE3-CE1 4.49Å; W734-F755 AromaticContact CE3-CG 3.96Å; W734-F755 HydrophobicContact CE3-CG 3.96Å; W734-F755 HydrophobicContact CG-CB 4.43Å; W734-F755 AromaticContact CG-CD2 3.63Å; W734-F755 HydrophobicContact CG-CD2 3.63Å; W734-F755 HydrophobicContact CG-CE2 4.09Å; W734-F755 HydrophobicContact CG-CG 4.1Å; W734-F755 HydrophobicContact CH2-CD1 4.18Å; W734-F755 AromaticContact CH2-CE1 3.88Å; W734-F755 HydrophobicContact CH2-CE1 3.88Å; W734-F755 HydrophobicContact CH2-CZ 4.21Å; W734-F755 HydrophobicContact CZ2-CD1 4.29Å; W734-F755 HydrophobicContact CZ2-CD2 4.48Å; W734-F755 AromaticContact CZ2-CE1 3.78Å; W734-F755 HydrophobicContact CZ2-CE1 3.78Å; W734-F755 AromaticContact CZ2-CE2 4Å; W734-F755 HydrophobicContact CZ2-CE2 4Å; W734-F755 AromaticContact CZ2-CZ 3.61Å; W734-F755 HydrophobicContact CZ2-CZ 3.61Å; W734-F755 HydrophobicContact CZ3-CD1 4.06Å; W734-F755 HydrophobicContact CZ3-CE1 4.24Å; W734-F755 HydrophobicContact CZ3-CG 4.42Å; W734-F755 AromaticContact NE1-CD2 3.74Å; W734-F755 AromaticContact NE1-CE2 3.35Å; W734-F755 VanDerWaalsContact NE1-CE2 3.35Å; W734-F755 AromaticContact NE1-CZ 3.87Å; W734-F757 AromaticContact CD1-CD1 3.93Å; W734-F757 AromaticContact CD1-CE1 3.69Å; W734-F757 AromaticContact NE1-CE1 3.9Å
735	E	93.3	Very high	91.9	Very high	44 Å²	44	64 Å²	64	21%	0.206	30%	0.298	C	S	.	.			trans	-95.7	91.1	172.5	-175.7	150.2	-161.8	0	0	110.3	S737 H740 F742 H756 K758	E735-S737 PolarHBondContact O-N 3.49Å; E735-H740 HydrophobicContact CG-CB 4.04Å; E735-H740 IonicContact OE1-CD2 3.35Å; E735-H740 IonicContact OE1-CE1 3.63Å; E735-H740 PolarHBondContact OE1-CE1 3.36Å; E735-H740 IonicContact OE1-CG 2.7Å; E735-H740 IonicContact OE1-ND1 3.56Å; E735-H740 PolarHBondContact OE1-ND1 3.26Å; E735-H740 IonicContact OE1-NE2 3.77Å; E735-F742 WeakPolarHBondContact O-CB 3.25Å; E735-H756 PolarHBondContact N-O 2.82Å; E735-K758 HydrophobicContact CB-CB 4.3Å
736	Y	91.8	Very high	91.8	Very high	142 Å²	142	65.8 Å²	65.8	56%	0.557	31%	0.306	S	S	*	.			trans	-65.9	26.1	179.3	-59.1	-82.9	0	0	0	115.1	W734 F742	W734-Y736 HydrophobicContact CB-CE1 4.39Å; W734-Y736 HydrophobicContact CB-CE2 4.05Å; W734-Y736 AromaticContact CE3-CE1 3.89Å; W734-Y736 HydrophobicContact CE3-CE1 3.89Å; W734-Y736 WeakPolarHBondContact O-CD2 3.34Å; Y736-F742 HydrophobicContact CD1-CD2 4.28Å; Y736-F742 HydrophobicContact CD1-CE1 4.26Å; Y736-F742 AromaticContact CD1-CE2 3.7Å; Y736-F742 HydrophobicContact CD1-CE2 3.7Å; Y736-F742 AromaticContact CD1-CZ 3.69Å; Y736-F742 HydrophobicContact CD1-CZ 3.69Å; Y736-F742 HydrophobicContact CE1-CE2 4.17Å; Y736-F742 HydrophobicContact CE1-CZ 4.26Å
737	S	90.4	Very high	91.6	Very high	40 Å²	40	70.8 Å²	70.8	28%	0.28	33%	0.329	S	S	.	.			trans	-99.1	115.4	-177.3	-165.8	0	0	0	0	110.5	E735 K739 H740 F742	E735-S737 PolarHBondContact O-N 3.49Å; S737-K739 PolarHBondContact O-N 2.85Å; S737-H740 WeakPolarHBondContact CB-ND1 3.35Å; S737-H740 CarbonylContact O-C 3.59Å; S737-H740 WeakPolarHBondContact O-CA 3.28Å; S737-H740 PolarHBondContact O-N 3Å; S737-H740 PolarHBondContact OG-ND1 2.77Å; S737-F742 WeakPolarHBondContact O-CB 3.34Å; S737-F742 PolarHBondContact O-N 2.85Å
738	Y	88.5	Confident	91.3	Very high	189 Å²	189	76 Å²	76	74%	0.741	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-52.7	-28.2	172.6	-61	-76.1	0	0	0	113	H740 G741 F742	Y738-H740 VanDerWaalsContact C-N 3.25Å; Y738-H740 PolarHBondContact O-N 2.76Å; Y738-G741 PolarHBondContact O-N 3.17Å; Y738-F742 VanDerWaalsContact CD1-O 3.29Å; Y738-F742 WeakPolarHBondContact CD1-O 3.37Å; Y738-F742 HydrophobicContact CE1-CD1 4.32Å
739	K	88.5	Confident	91.2	Very high	193 Å²	193	75 Å²	75	84%	0.839	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-73.3	-13.1	176.5	-66.5	179.1	-179.9	171.3	0	114.3	S737	S737-K739 PolarHBondContact O-N 2.85Å
740	H	85.6	Confident	91.1	Very high	104 Å²	104	75.1 Å²	75.1	48%	0.481	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-116.1	25.5	177	-61.7	98	0	0	0	111.3	E735 S737 Y738 H756	E735-H740 HydrophobicContact CG-CB 4.04Å; E735-H740 IonicContact OE1-CD2 3.35Å; E735-H740 IonicContact OE1-CE1 3.63Å; E735-H740 PolarHBondContact OE1-CE1 3.36Å; E735-H740 IonicContact OE1-CG 2.7Å; E735-H740 IonicContact OE1-ND1 3.56Å; E735-H740 PolarHBondContact OE1-ND1 3.26Å; E735-H740 IonicContact OE1-NE2 3.77Å; S737-H740 WeakPolarHBondContact CB-ND1 3.35Å; S737-H740 CarbonylContact O-C 3.59Å; S737-H740 WeakPolarHBondContact O-CA 3.28Å; S737-H740 PolarHBondContact O-N 3Å; S737-H740 PolarHBondContact OG-ND1 2.77Å; Y738-H740 VanDerWaalsContact C-N 3.25Å; Y738-H740 PolarHBondContact O-N 2.76Å; H740-H756 PolarHBondContact O-CD2 3.38Å
741	G	86	Confident	91.1	Very high	35 Å²	35	74 Å²	74	36%	0.361	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	7	172.9	0	0	0	0	0	115.9	Y738 R743	Y738-G741 PolarHBondContact O-N 3.17Å; G741-R743 PolarHBondContact O-N 3.1Å
742	F	93.9	Very high	91.2	Very high	20 Å²	20	71.4 Å²	71.4	9%	0.088	33%	0.334	C	S	.	.			trans	-63.9	126.2	173.3	-174.4	-103.1	0	0	0	111.2	E735 Y736 S737 Y738 C744 W754 F755	E735-F742 WeakPolarHBondContact O-CB 3.25Å; Y736-F742 HydrophobicContact CD1-CD2 4.28Å; Y736-F742 HydrophobicContact CD1-CE1 4.26Å; Y736-F742 AromaticContact CD1-CE2 3.7Å; Y736-F742 HydrophobicContact CD1-CE2 3.7Å; Y736-F742 AromaticContact CD1-CZ 3.69Å; Y736-F742 HydrophobicContact CD1-CZ 3.69Å; Y736-F742 HydrophobicContact CE1-CE2 4.17Å; Y736-F742 HydrophobicContact CE1-CZ 4.26Å; S737-F742 WeakPolarHBondContact O-CB 3.34Å; S737-F742 PolarHBondContact O-N 2.85Å; Y738-F742 VanDerWaalsContact CD1-O 3.29Å; Y738-F742 WeakPolarHBondContact CD1-O 3.37Å; Y738-F742 HydrophobicContact CE1-CD1 4.32Å; F742-C744 HydrophobicContact CE1-CB 4.04Å; F742-C744 HydrophobicContact CZ-CB 3.94Å; F742-W754 WeakPolarHBondContact CA-O 3.17Å; F742-F755 HydrophobicContact CD2-CB 3.89Å; F742-F755 HydrophobicContact CE2-CB 4.17Å
743	R	92.3	Very high	91.3	Very high	74 Å²	74	66.2 Å²	66.2	28%	0.279	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	129	178.9	-161.3	178.6	-169.6	179.2	-2.7	109.1	G741 Q745 L753 W754	G741-R743 PolarHBondContact O-N 3.1Å; R743-Q745 HydrophobicContact CG-CG 4.14Å; R743-Q745 VanDerWaalsContact NE-CD 3.27Å; R743-L753 CarbonylContact O-C 3.16Å; R743-L753 WeakPolarHBondContact O-CA 3.25Å; R743-W754 HydrophobicContact CB-CB 3.96Å; R743-W754 HydrophobicContact CB-CD2 4.2Å; R743-W754 HydrophobicContact CB-CE3 4.09Å; R743-W754 HydrophobicContact CB-CG 4.18Å; R743-W754 PolarHBondContact N-O 2.89Å; R743-W754 PolarHBondContact O-N 3.06Å
744	C	93.1	Very high	91.3	Very high	53 Å²	53	62.2 Å²	62.2	36%	0.358	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	99.8	174.8	-177	0	0	0	0	107	F742 Q752 L753	F742-C744 HydrophobicContact CE1-CB 4.04Å; F742-C744 HydrophobicContact CZ-CB 3.94Å; C744-Q752 VanDerWaalsContact CA-O 3.28Å; C744-Q752 WeakPolarHBondContact CA-O 3.39Å; C744-L753 HydrophobicContact CB-CD1 4.06Å
745	Q	92.7	Very high	91.3	Very high	42 Å²	42	61.7 Å²	61.7	20%	0.196	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149.4	-175.2	60.3	169.1	72.8	0	0	112.1	R743 Q752	R743-Q745 HydrophobicContact CG-CG 4.14Å; R743-Q745 VanDerWaalsContact NE-CD 3.27Å; Q745-Q752 HydrophobicContact CG-CB 3.97Å; Q745-Q752 PolarHBondContact N-O 2.7Å; Q745-Q752 PolarHBondContact O-N 3.34Å
746	F	92.5	Very high	91.3	Very high	40 Å²	40	61.5 Å²	61.5	18%	0.175	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.8	166.4	-172.6	-124.3	0	0	0	108.4	Y687 L690 T696 P697 I750 F751	Y687-F746 HydrophobicContact CD2-CE2 4.13Å; L690-F746 HydrophobicContact CD2-CE1 4.17Å; L690-F746 HydrophobicContact CD2-CZ 3.91Å; T696-F746 HydrophobicContact CG2-CB 4.11Å; T696-F746 HydrophobicContact CG2-CD1 4.24Å; P697-F746 HydrophobicContact CG-CD2 3.96Å; P697-F746 HydrophobicContact CG-CE2 3.8Å; P697-F746 HydrophobicContact CG-CG 4.49Å; P697-F746 HydrophobicContact CG-CZ 4.2Å; F746-I750 WeakPolarHBondContact CA-O 3.5Å; F746-F751 HydrophobicContact CB-CD2 4.1Å; F746-F751 HydrophobicContact CD2-CB 4.02Å; F746-F751 HydrophobicContact CD2-CD2 4.28Å
747	Q	89.4	Confident	91.4	Very high	108 Å²	108	55 Å²	55	51%	0.505	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	140	179.9	-69.9	-174.4	-16.8	0	0	109.7	N749 I750	Q747-N749 PolarHBondContact O-N 3.32Å; Q747-I750 PolarHBondContact N-O 3.16Å; Q747-I750 WeakPolarHBondContact O-CA 3.09Å; Q747-I750 WeakPolarHBondContact O-CB 3.1Å; Q747-I750 PolarHBondContact O-N 2.9Å
748	N	86.9	Confident	91.6	Very high	111 Å²	111	57.1 Å²	57.1	59%	0.594	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	40.3	179.3	-51.6	-19.8	0	0	0	113.1	I750	N748-I750 WeakPolarHBondContact O-CG1 3.3Å; N748-I750 PolarHBondContact O-N 3.25Å; N748-I750 VanDerWaalsContact O-N 3.15Å
749	N	89.8	Confident	91.5	Very high	50 Å²	50	55.6 Å²	55.6	27%	0.267	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	8.9	-173.4	-49.1	-28.3	0	0	0	115.5	Y687 P688 Q747	Y687-N749 PolarHBondContact N-O 3.05Å; P688-N749 PolarHBondContact O-ND2 3.28Å; Q747-N749 PolarHBondContact O-N 3.32Å
750	I	91.9	Very high	91.3	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.8	176.4	-40	-177.7	0	0	0	109.8	R613 N684 F686 F746 Q747 N748 Q752	R613-I750 HydrophobicContact CB-CD1 4.49Å; R613-I750 HydrophobicContact CG-CD1 4.29Å; N684-I750 HydrophobicContact CB-CG2 4.14Å; F686-I750 HydrophobicContact CD1-CB 4.37Å; F686-I750 HydrophobicContact CD1-CD1 4.35Å; F686-I750 HydrophobicContact CD1-CG1 3.97Å; F686-I750 HydrophobicContact CD1-CG2 3.88Å; F686-I750 HydrophobicContact CE1-CD1 4.06Å; F686-I750 HydrophobicContact CE1-CG1 4.18Å; F686-I750 HydrophobicContact CE1-CG2 3.89Å; F746-I750 WeakPolarHBondContact CA-O 3.5Å; Q747-I750 PolarHBondContact N-O 3.16Å; Q747-I750 WeakPolarHBondContact O-CA 3.09Å; Q747-I750 WeakPolarHBondContact O-CB 3.1Å; Q747-I750 PolarHBondContact O-N 2.9Å; N748-I750 WeakPolarHBondContact O-CG1 3.3Å; N748-I750 PolarHBondContact O-N 3.25Å; N748-I750 VanDerWaalsContact O-N 3.15Å; I750-Q752 HydrophobicContact CB-CG 4.49Å; I750-Q752 HydrophobicContact CG2-CG 3.9Å
751	F	93.9	Very high	91.2	Very high	7 Å²	7	57.3 Å²	57.3	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	109.7	167.8	-169.8	-108.9	0	0	0	110.1	N684 V685 Y687 P697 Y699 F716 F746 L753	N684-F751 CarbonylContact C-O 3.56Å; N684-F751 WeakPolarHBondContact CA-O 3.45Å; V685-F751 HydrophobicContact CB-CB 4.46Å; V685-F751 PolarHBondContact N-O 2.85Å; V685-F751 PolarHBondContact O-N 2.99Å; Y687-F751 HydrophobicContact CD2-CB 4.09Å; Y687-F751 HydrophobicContact CE2-CB 3.8Å; P697-F751 HydrophobicContact CB-CB 4.43Å; P697-F751 HydrophobicContact CB-CD2 4.04Å; P697-F751 HydrophobicContact CB-CG 4.15Å; P697-F751 HydrophobicContact CG-CB 4.47Å; P697-F751 HydrophobicContact CG-CD2 4.46Å; P697-F751 WeakPolarHBondContact O-CE2 3.2Å; Y699-F751 HydrophobicContact CD1-CE1 4.36Å; Y699-F751 HydrophobicContact CD1-CZ 4.13Å; F716-F751 AromaticContact CD1-CD1 3.8Å; F716-F751 HydrophobicContact CD1-CD1 3.8Å; F716-F751 AromaticContact CD1-CE1 3.71Å; F716-F751 HydrophobicContact CD1-CE1 3.71Å; F716-F751 AromaticContact CE1-CD1 3.88Å; F716-F751 HydrophobicContact CE1-CD1 3.88Å; F716-F751 AromaticContact CE1-CE1 3.71Å; F716-F751 HydrophobicContact CE1-CE1 3.71Å; F746-F751 HydrophobicContact CB-CD2 4.1Å; F746-F751 HydrophobicContact CD2-CB 4.02Å; F746-F751 HydrophobicContact CD2-CD2 4.28Å; F751-L753 HydrophobicContact CD1-CB 4.48Å; F751-L753 HydrophobicContact CE1-CB 3.99Å
752	Q	93.8	Very high	91.1	Very high	15 Å²	15	63.9 Å²	63.9	7%	0.07	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.2	-178.9	-59.7	-178.3	-17.2	0	0	109.6	F683 C744 Q745 I750	F683-Q752 WeakPolarHBondContact O-CA 3.37Å; C744-Q752 VanDerWaalsContact CA-O 3.28Å; C744-Q752 WeakPolarHBondContact CA-O 3.39Å; Q745-Q752 HydrophobicContact CG-CB 3.97Å; Q745-Q752 PolarHBondContact N-O 2.7Å; Q745-Q752 PolarHBondContact O-N 3.34Å; I750-Q752 HydrophobicContact CB-CG 4.49Å; I750-Q752 HydrophobicContact CG2-CG 3.9Å
753	L	94.6	Very high	90.6	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	98.9	174.2	178.1	61	0	0	0	109.5	F683 Y699 L714 F716 W734 R743 C744 F751 F755	F683-L753 HydrophobicContact CB-CB 4.36Å; F683-L753 PolarHBondContact N-O 3.28Å; F683-L753 PolarHBondContact O-N 2.8Å; Y699-L753 HydrophobicContact CD1-CD2 3.76Å; Y699-L753 HydrophobicContact CD2-CD2 4.11Å; Y699-L753 HydrophobicContact CE1-CD1 3.99Å; Y699-L753 HydrophobicContact CE1-CD2 3.98Å; Y699-L753 HydrophobicContact CE2-CD2 4.31Å; Y699-L753 HydrophobicContact CG-CD2 3.82Å; L714-L753 HydrophobicContact CD1-CD2 4.42Å; L714-L753 HydrophobicContact CD2-CD2 4.11Å; F716-L753 HydrophobicContact CE1-CB 4.14Å; F716-L753 HydrophobicContact CE1-CD2 3.7Å; F716-L753 HydrophobicContact CZ-CD2 4.01Å; W734-L753 HydrophobicContact CH2-CD2 4.43Å; W734-L753 HydrophobicContact CZ3-CD1 4.48Å; R743-L753 CarbonylContact O-C 3.16Å; R743-L753 WeakPolarHBondContact O-CA 3.25Å; C744-L753 HydrophobicContact CB-CD1 4.06Å; F751-L753 HydrophobicContact CD1-CB 4.48Å; F751-L753 HydrophobicContact CE1-CB 3.99Å; L753-F755 HydrophobicContact CD1-CD1 4.46Å; L753-F755 HydrophobicContact CG-CD1 4.2Å; L753-F755 HydrophobicContact CG-CE1 4.45Å
754	W	94.2	Very high	90	Very high	24 Å²	24	81.2 Å²	81.2	9%	0.091	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	129.1	179.9	-51.9	-8.5	0	0	0	109.5	G617 M618 Y681 K682 N684 F742 R743	G617-W754 WeakPolarHBondContact O-CH2 3.28Å; M618-W754 HydrophobicContact CG-CH2 4.34Å; M618-W754 HydrophobicContact CG-CZ2 4.04Å; Y681-W754 WeakPolarHBondContact O-CA 3.46Å; K682-W754 HydrophobicContact CB-CB 4.39Å; K682-W754 HydrophobicContact CB-CG 3.94Å; K682-W754 HydrophobicContact CD-CD2 4.42Å; K682-W754 HydrophobicContact CD-CG 4.48Å; K682-W754 HydrophobicContact CG-CB 4.06Å; K682-W754 HydrophobicContact CG-CD2 4.4Å; K682-W754 HydrophobicContact CG-CG 3.95Å; N684-W754 PolarHBondContact OD1-NE1 3.02Å; F742-W754 WeakPolarHBondContact CA-O 3.17Å; R743-W754 HydrophobicContact CB-CB 3.96Å; R743-W754 HydrophobicContact CB-CD2 4.2Å; R743-W754 HydrophobicContact CB-CE3 4.09Å; R743-W754 HydrophobicContact CB-CG 4.18Å; R743-W754 PolarHBondContact N-O 2.89Å; R743-W754 PolarHBondContact O-N 3.06Å
755	F	94.3	Very high	89.9	Confident	1 Å²	1	82.7 Å²	82.7	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	147.4	177.6	61.1	-91	0	0	0	111.7	G680 Y681 F683 L714 I729 W734 F742 L753 F757	G680-F755 CarbonylContact C-O 3.6Å; G680-F755 WeakPolarHBondContact CA-O 3.39Å; Y681-F755 AromaticContact CD2-CE2 3.84Å; Y681-F755 HydrophobicContact CD2-CE2 3.84Å; Y681-F755 AromaticContact CD2-CZ 3.81Å; Y681-F755 HydrophobicContact CD2-CZ 3.81Å; Y681-F755 HydrophobicContact CG-CZ 4.19Å; Y681-F755 PolarHBondContact N-O 2.74Å; Y681-F755 PolarHBondContact O-N 2.75Å; F683-F755 HydrophobicContact CD2-CE1 4.13Å; F683-F755 AromaticContact CE2-CE1 3.91Å; F683-F755 HydrophobicContact CE2-CE1 3.91Å; F683-F755 HydrophobicContact CE2-CZ 4.2Å; L714-F755 HydrophobicContact CD2-CE1 4.23Å; I729-F755 HydrophobicContact CD1-CE2 4.43Å; I729-F755 HydrophobicContact CD1-CZ 3.83Å; W734-F755 HydrophobicContact CB-CB 4.48Å; W734-F755 HydrophobicContact CB-CD2 4.33Å; W734-F755 AromaticContact CD1-CD2 3.63Å; W734-F755 AromaticContact CD1-CE2 3.69Å; W734-F755 HydrophobicContact CD2-CB 4.34Å; W734-F755 HydrophobicContact CD2-CD1 4.17Å; W734-F755 AromaticContact CD2-CD2 3.67Å; W734-F755 HydrophobicContact CD2-CD2 3.67Å; W734-F755 HydrophobicContact CD2-CE1 4.41Å; W734-F755 AromaticContact CD2-CE2 3.94Å; W734-F755 HydrophobicContact CD2-CE2 3.94Å; W734-F755 AromaticContact CD2-CG 3.8Å; W734-F755 HydrophobicContact CD2-CG 3.8Å; W734-F755 HydrophobicContact CD2-CZ 4.3Å; W734-F755 AromaticContact CE2-CD2 3.77Å; W734-F755 AromaticContact CE2-CE2 3.5Å; W734-F755 AromaticContact CE2-CZ 3.64Å; W734-F755 HydrophobicContact CE3-CB 4.26Å; W734-F755 HydrophobicContact CE3-CD1 4.06Å; W734-F755 HydrophobicContact CE3-CD2 4.31Å; W734-F755 HydrophobicContact CE3-CE1 4.49Å; W734-F755 AromaticContact CE3-CG 3.96Å; W734-F755 HydrophobicContact CE3-CG 3.96Å; W734-F755 HydrophobicContact CG-CB 4.43Å; W734-F755 AromaticContact CG-CD2 3.63Å; W734-F755 HydrophobicContact CG-CD2 3.63Å; W734-F755 HydrophobicContact CG-CE2 4.09Å; W734-F755 HydrophobicContact CG-CG 4.1Å; W734-F755 HydrophobicContact CH2-CD1 4.18Å; W734-F755 AromaticContact CH2-CE1 3.88Å; W734-F755 HydrophobicContact CH2-CE1 3.88Å; W734-F755 HydrophobicContact CH2-CZ 4.21Å; W734-F755 HydrophobicContact CZ2-CD1 4.29Å; W734-F755 HydrophobicContact CZ2-CD2 4.48Å; W734-F755 AromaticContact CZ2-CE1 3.78Å; W734-F755 HydrophobicContact CZ2-CE1 3.78Å; W734-F755 AromaticContact CZ2-CE2 4Å; W734-F755 HydrophobicContact CZ2-CE2 4Å; W734-F755 AromaticContact CZ2-CZ 3.61Å; W734-F755 HydrophobicContact CZ2-CZ 3.61Å; W734-F755 HydrophobicContact CZ3-CD1 4.06Å; W734-F755 HydrophobicContact CZ3-CE1 4.24Å; W734-F755 HydrophobicContact CZ3-CG 4.42Å; W734-F755 AromaticContact NE1-CD2 3.74Å; W734-F755 AromaticContact NE1-CE2 3.35Å; W734-F755 VanDerWaalsContact NE1-CE2 3.35Å; W734-F755 AromaticContact NE1-CZ 3.87Å; F742-F755 HydrophobicContact CD2-CB 3.89Å; F742-F755 HydrophobicContact CE2-CB 4.17Å; L753-F755 HydrophobicContact CD1-CD1 4.46Å; L753-F755 HydrophobicContact CG-CD1 4.2Å; L753-F755 HydrophobicContact CG-CE1 4.45Å; F755-F757 HydrophobicContact CD2-CE1 4.44Å; F755-F757 AromaticContact CE2-CE1 3.92Å; F755-F757 HydrophobicContact CE2-CE1 3.92Å; F755-F757 HydrophobicContact CE2-CZ 4.13Å
756	H	94	Very high	89.7	Confident	39 Å²	39	84.8 Å²	84.8	18%	0.181	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	153.5	169.9	-69.4	-85.1	0	0	0	110.5	H655 Q679 E735 H740	H655-H756 AromaticContact CD2-CE1 3.32Å; H655-H756 PolarHBondContact CD2-CE1 2.89Å; H655-H756 AromaticContact CD2-ND1 3.47Å; H655-H756 PolarHBondContact CD2-ND1 3.16Å; H655-H756 AromaticContact CG-CE1 3.63Å; H655-H756 AromaticContact NE2-CE1 3.92Å; Q679-H756 CarbonylContact O-C 3.53Å; Q679-H756 VanDerWaalsContact O-CA 3.31Å; Q679-H756 WeakPolarHBondContact O-CA 3.43Å; Q679-H756 PolarHBondContact O-ND1 2.96Å; E735-H756 PolarHBondContact N-O 2.82Å; H740-H756 PolarHBondContact O-CD2 3.38Å
757	F	94	Very high	89.6	Confident	6 Å²	6	87.3 Å²	87.3	3%	0.026	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-80.2	131.8	175.4	-67.2	-54.1	0	0	0	111.3	V678 Q679 Y681 V730 R732 E733 W734 F755 R759	V678-F757 HydrophobicContact CB-CE2 4.36Å; V678-F757 HydrophobicContact CG1-CD2 4.42Å; V678-F757 HydrophobicContact CG1-CE2 3.81Å; Q679-F757 PolarHBondContact O-N 2.98Å; Y681-F757 HydrophobicContact CD2-CE2 4.21Å; Y681-F757 HydrophobicContact CD2-CZ 4.04Å; Y681-F757 AromaticContact CE2-CE2 3.88Å; Y681-F757 HydrophobicContact CE2-CE2 3.88Å; Y681-F757 AromaticContact CE2-CZ 3.76Å; Y681-F757 HydrophobicContact CE2-CZ 3.76Å; V730-F757 HydrophobicContact CB-CE2 3.98Å; V730-F757 HydrophobicContact CB-CZ 3.93Å; V730-F757 HydrophobicContact CG1-CE2 4.32Å; V730-F757 HydrophobicContact CG1-CZ 4.39Å; V730-F757 WeakPolarHBondContact O-CE1 3.44Å; V730-F757 WeakPolarHBondContact O-CZ 3.49Å; R732-F757 HydrophobicContact CB-CB 4.47Å; R732-F757 HydrophobicContact CB-CD1 3.59Å; R732-F757 HydrophobicContact CB-CE1 3.88Å; R732-F757 HydrophobicContact CB-CG 4Å; R732-F757 HydrophobicContact CB-CZ 4.49Å; R732-F757 WeakPolarHBondContact O-CD1 3.23Å; R732-F757 WeakPolarHBondContact O-CE1 3.28Å; E733-F757 WeakPolarHBondContact O-CA 3.11Å; W734-F757 AromaticContact CD1-CD1 3.93Å; W734-F757 AromaticContact CD1-CE1 3.69Å; W734-F757 AromaticContact NE1-CE1 3.9Å; F755-F757 HydrophobicContact CD2-CE1 4.44Å; F755-F757 AromaticContact CE2-CE1 3.92Å; F755-F757 HydrophobicContact CE2-CE1 3.92Å; F755-F757 HydrophobicContact CE2-CZ 4.13Å; F757-R759 WeakPolarHBondContact O-CG 3.39Å; F757-R759 PolarHBondContact O-N 2.7Å
758	K	92.6	Very high	89.6	Confident	84 Å²	84	86.1 Å²	86.1	37%	0.365	35%	0.353	S	S	.	.			trans	-56.9	120.2	-175.5	-178.2	177.4	168.2	-173.1	0	111.9	E733 E735 F760	E733-K758 HydrophobicContact CB-CB 4.15Å; E733-K758 HydrophobicContact CB-CD 4.11Å; E733-K758 WeakPolarHBondContact O-CB 3.49Å; E733-K758 PolarHBondContact O-N 3.06Å; E733-K758 VanDerWaalsContact OE2-CD 3.24Å; E733-K758 WeakPolarHBondContact OE2-CD 3.26Å; E733-K758 WeakPolarHBondContact OE2-CE 3.22Å; E733-K758 IonicContact OE2-NZ 2.61Å; E733-K758 PolarHBondContact OE2-NZ 3.27Å; E735-K758 HydrophobicContact CB-CB 4.3Å; K758-F760 HydrophobicContact CD-CZ 4.06Å; K758-F760 HydrophobicContact CG-CE2 4.45Å; K758-F760 HydrophobicContact CG-CZ 4.37Å; K758-F760 WeakPolarHBondContact O-CD2 3.37Å; K758-F760 PolarHBondContact O-N 3.45Å
759	R	88.1	Confident	89.8	Confident	157 Å²	157	84.5 Å²	84.5	59%	0.592	34%	0.338	S	S	*	.			trans	-88.5	89.6	-170.3	-61	-178.8	72.6	-165.8	8.6	112.2	F757 R761	F757-R759 WeakPolarHBondContact O-CG 3.39Å; F757-R759 PolarHBondContact O-N 2.7Å; R759-R761 PolarHBondContact O-N 3.11Å
760	F	83.9	Confident	89.8	Confident	141 Å²	141	86.8 Å²	86.8	62%	0.618	34%	0.342	S	S	*	.			trans	-63.1	97.1	174.1	-65	-80.2	0	0	0	112.5	K758 Y762	K758-F760 HydrophobicContact CD-CZ 4.06Å; K758-F760 HydrophobicContact CG-CE2 4.45Å; K758-F760 HydrophobicContact CG-CZ 4.37Å; K758-F760 WeakPolarHBondContact O-CD2 3.37Å; K758-F760 PolarHBondContact O-N 3.45Å; F760-Y762 PolarHBondContact O-N 2.83Å; F760-Y762 VanDerWaalsContact O-N 3.11Å
761	R	83.6	Confident	89.6	Confident	193 Å²	193	92.7 Å²	92.7	73%	0.728	37%	0.365	S	S	*	.			trans	-80.8	90	175	-163.4	-172.9	81.7	157.3	4.1	111.3	R759 R763	R759-R761 PolarHBondContact O-N 3.11Å; R761-R763 PolarHBondContact O-N 2.96Å
762	Y	83.9	Confident	89.3	Confident	173 Å²	173	99.3 Å²	99.3	68%	0.678	39%	0.391	S	S	*	.			trans	-46.6	136.1	169	176.7	-116	0	0	0	111.7	F760 R764	F760-Y762 PolarHBondContact O-N 2.83Å; F760-Y762 VanDerWaalsContact O-N 3.11Å; Y762-R764 HydrophobicContact CD1-CG 4.45Å; Y762-R764 HydrophobicContact CE1-CG 3.49Å; Y762-R764 VanDerWaalsContact CE1-CG 3.49Å; Y762-R764 WeakPolarHBondContact OH-CG 2.99Å; Y762-R764 PolarHBondContact OH-NE 3.23Å
763	R	83.6	Confident	88.9	Confident	193 Å²	193	106.3 Å²	106.3	73%	0.728	42%	0.418	S	S	*	.			trans	-121.7	136.2	174	-55	-175.7	-170.9	-165.5	4.1	107.3	R761	R761-R763 PolarHBondContact O-N 2.96Å
764	R	80	Confident	88.4	Confident	265 Å²	265	116 Å²	116	100%	1	46%	0.456	S	S	*	.			trans	-98.6	0	162	-71.3	-169	177.3	174.2	5.7	108.7	Y762	Y762-R764 HydrophobicContact CD1-CG 4.45Å; Y762-R764 HydrophobicContact CE1-CG 3.49Å; Y762-R764 VanDerWaalsContact CE1-CG 3.49Å; Y762-R764 WeakPolarHBondContact OH-CG 2.99Å; Y762-R764 PolarHBondContact OH-NE 3.23Å

Retrieved 764 of 764 residues in 1691 ms (Link to these results)

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