A0A087XDT4_POEFO Loading...

RUN and FYVE domain containing 1

AlphaFold DB , UniProt , Accession A0A087XDT4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 717 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	36.7	Very low	240 Å²	240	141.8 Å²	141.8	100%	1.182	80%	0.804	S	S	*	*				0	130.3	0	-76.7	177.5	165.1	0	0	106.6
2	A	38.1	Very low	36.7	Very low	90 Å²	90	141.6 Å²	141.6	74%	0.744	81%	0.807	S	S	*	*			trans	55.1	136.2	176.4	0	0	0	0	0	117.1
3	D	39.2	Very low	36.5	Very low	124 Å²	124	144.3 Å²	144.3	66%	0.663	81%	0.809	S	S	*	*			cis	-150.1	133.9	-10.2	-106	-13.3	0	0	0	107.7
4	Q	39.9	Very low	36.3	Very low	157 Å²	157	145.9 Å²	145.9	73%	0.734	82%	0.815	S	S	*	*				63.7	134.9	102.7	-69.4	-175.1	69.5	0	0	115.9
5	T	38.2	Very low	36.1	Very low	114 Å²	114	148.4 Å²	148.4	70%	0.699	82%	0.817	S	S	*	*			cis	177.2	164.8	-33.7	20.9	0	0	0	0	108.3
6	L	38.2	Very low	35.8	Very low	147 Å²	147	147.4 Å²	147.4	77%	0.77	82%	0.816	S	S	*	*			trans	85.1	111.5	174.6	-52.1	165.8	0	0	0	113.8
7	E	36.7	Very low	35.4	Very low	171 Å²	171	149.6 Å²	149.6	80%	0.799	82%	0.819	S	S	*	*			cis	77.3	140.3	43.3	-56.2	-175	152.2	0	0	113.4
8	V	37.3	Very low	35.1	Very low	125 Å²	125	150.1 Å²	150.1	76%	0.758	81%	0.812	S	S	*	*			cis	-136.2	157	15.2	-179.7	0	0	0	0	112.2
9	N	32.3	Very low	35.2	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	81%	0.807	S	S	*	*			trans	-50	155.2	172.6	-38.5	-61.9	0	0	0	117.5
10	T	35.9	Very low	35.1	Very low	151 Å²	151	147.8 Å²	147.8	93%	0.926	80%	0.8	S	S	*	*				-152.8	158	114.6	19.6	0	0	0	0	110.4
11	A	32	Very low	35.8	Very low	97 Å²	97	146 Å²	146	80%	0.802	80%	0.796	S	S	*	*			trans	-126.2	138.2	-177.9	0	0	0	0	0	111.4
12	V	36.4	Very low	35.5	Very low	139 Å²	139	141.3 Å²	141.3	84%	0.842	78%	0.776	S	S	*	*			trans	-140.4	149.3	165.8	-179.7	0	0	0	0	108.7
13	E	34	Very low	35.2	Very low	177 Å²	177	144.6 Å²	144.6	83%	0.827	78%	0.776	S	S	*	*			trans	-53.9	177.3	-165.8	-65.8	161.2	134.3	0	0	120
14	D	33.7	Very low	35	Very low	166 Å²	166	147.7 Å²	147.7	89%	0.888	79%	0.786	S	S	*	*			trans	75.2	153.8	172.2	-72.1	-19.1	0	0	0	119.6
15	H	33	Very low	34.6	Very low	184 Å²	184	143.8 Å²	143.8	85%	0.852	79%	0.788	S	S	*	*			trans	-138.9	148	-140	-132	-62.7	0	0	0	112.5
16	V	32.3	Very low	34.4	Very low	133 Å²	133	145.8 Å²	145.8	81%	0.806	80%	0.799	S	S	*	*			trans	76.8	80.6	172	-164.9	0	0	0	0	115.4
17	E	28.4	Very low	34.1	Very low	185 Å²	185	143.4 Å²	143.4	86%	0.864	80%	0.801	S	S	*	*			trans	-90.4	139.7	144.9	-88	-167	140.7	0	0	110.8
18	K	29.8	Very low	33.9	Very low	157 Å²	157	138.5 Å²	138.5	68%	0.683	80%	0.796	S	S	*	*			trans	-83.4	143.7	143.4	-142.2	-163.7	-178.4	-153.8	0	105.2	E20	K18-E20 IonicContact NZ-OE1 3.86Å; K18-E20 PolarHBondContact NZ-OE1 3.2Å
19	P	36.4	Very low	34.1	Very low	112 Å²	112	139 Å²	139	73%	0.727	80%	0.802	S	S	*	*				-146.9	-159.7	91.1	39.5	-21.7	0	0	0	114.8
20	E	34.6	Very low	34.1	Very low	143 Å²	143	138.4 Å²	138.4	67%	0.668	80%	0.804	S	S	*	*			trans	-102.8	-165.8	-161.8	-45	-174.9	152.1	0	0	109.2	K18	K18-E20 IonicContact NZ-OE1 3.86Å; K18-E20 PolarHBondContact NZ-OE1 3.2Å
21	P	48.6	Very low	33.8	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	80%	0.8	S	S	*	*			cis	-133.5	-164.8	4.9	45.9	-25.8	0	0	0	113.4
22	D	30.2	Very low	33.8	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	80%	0.802	S	S	*	*				-163.2	167.3	79.5	-133.9	-30	0	0	0	115.5
23	E	33.1	Very low	33.5	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	80%	0.802	S	S	*	*			trans	42.9	113	168	-59	-159.8	147.5	0	0	118.3
24	Q	34.1	Very low	33.5	Very low	189 Å²	189	141.8 Å²	141.8	88%	0.883	80%	0.803	S	S	*	*				-160.3	160.2	51	-71.4	177.7	0	0	0	110.5
25	G	30.6	Very low	33.9	Very low	74 Å²	74	139.3 Å²	139.3	76%	0.763	80%	0.796	S	S	*	*			trans	-142.2	166.9	176.8	0	0	0	0	0	114.5
26	V	34.4	Very low	33.8	Very low	156 Å²	156	136.8 Å²	136.8	95%	0.945	79%	0.794	S	S	*	*			trans	-156.4	146.6	139.6	146.8	0	0	0	0	106.6
27	A	31.6	Very low	33.7	Very low	97 Å²	97	134.2 Å²	134.2	80%	0.802	80%	0.795	S	S	*	*			trans	-89.5	150.5	-159.6	0	0	0	0	0	115.6
28	G	32.7	Very low	33.8	Very low	68 Å²	68	129.5 Å²	129.5	70%	0.701	80%	0.795	S	S	*	*			trans	-102.2	169.6	140.7	0	0	0	0	0	109.8
29	P	41.5	Very low	33.9	Very low	136 Å²	136	130.1 Å²	130.1	88%	0.883	80%	0.801	S	S	*	*				-138.1	166.3	125.2	38.2	-28.4	0	0	0	114
30	T	31.8	Very low	33.6	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	81%	0.81	S	S	*	*			trans	-79.9	146.7	175.4	51.3	0	0	0	0	113.4
31	T	30.2	Very low	33.5	Very low	136 Å²	136	134.4 Å²	134.4	83%	0.834	82%	0.816	S	S	*	*			trans	-149.6	160.9	138	29.5	0	0	0	0	110.3
32	N	31.4	Very low	32.6	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	82%	0.823	S	S	*	*			trans	-80.2	151.7	174.8	-43.2	-65.9	0	0	0	110.8
33	D	31.5	Very low	33	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	82%	0.822	S	S	*	*			trans	-138.4	126.8	159	-86.1	-53.4	0	0	0	109.5
34	E	34.3	Very low	33.8	Very low	182 Å²	182	133.5 Å²	133.5	85%	0.85	82%	0.822	S	S	*	*			trans	-82.4	171.7	159	-68.7	-174.2	106.9	0	0	109.6
35	P	41.1	Very low	33.6	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	82%	0.823	S	S	*	*				-143.2	135.2	113.5	34.1	-19.9	0	0	0	116.6
36	T	32.1	Very low	33.6	Very low	131 Å²	131	136.2 Å²	136.2	80%	0.804	82%	0.819	S	S	*	*			trans	60.1	99.8	141.9	60.4	0	0	0	0	119.6
37	G	29.5	Very low	33.4	Very low	80 Å²	80	137.1 Å²	137.1	83%	0.825	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-87	155.5	142.2	0	0	0	0	0	111.5
38	G	30.2	Very low	33.3	Very low	85 Å²	85	140.6 Å²	140.6	88%	0.876	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-89	157.5	-179.6	0	0	0	0	0	114.7
39	E	32.6	Very low	33.8	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.2	150.3	-173.3	-57.4	171.6	92.8	0	0	115.3
40	C	28.9	Very low	33.2	Very low	136 Å²	136	143.3 Å²	143.3	92%	0.919	82%	0.819	S	S	*	*			trans	-151.5	163.8	133.7	-146.2	0	0	0	0	110.1
41	R	33	Very low	33.1	Very low	209 Å²	209	141.5 Å²	141.5	79%	0.789	82%	0.817	S	S	*	*			trans	-115.1	150.9	-157.3	-63.2	178.6	178.9	171.3	-1	116.1
42	D	30.8	Very low	33.1	Very low	161 Å²	161	140.3 Å²	140.3	86%	0.861	82%	0.821	S	S	*	*			trans	-82.2	157.6	166.4	-57.5	-62.8	0	0	0	114
43	P	37.3	Very low	32.8	Very low	114 Å²	114	136.8 Å²	136.8	74%	0.74	82%	0.822	S	S	*	*			trans	-130.2	179.1	156.1	42.8	-30.8	0	0	0	112.1
44	P	50.8	Low	32.5	Very low	117 Å²	117	133 Å²	133	76%	0.76	82%	0.82	S	S	*	*				-133.2	176.3	-60.3	40	-25	0	0	0	112.5
45	E	29.6	Very low	32.1	Very low	190 Å²	190	129.3 Å²	129.3	89%	0.888	82%	0.815	S	S	*	*			trans	-134.2	163.8	165.5	-85.8	-144.9	125.5	0	0	114.8
46	N	31.2	Very low	31.3	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	82%	0.822	S	S	*	*			trans	-70.1	147.4	-159.5	-57.9	-77.7	0	0	0	117.9
47	I	29.2	Very low	31	Very low	175 Å²	175	134.7 Å²	134.7	90%	0.897	83%	0.825	S	S	*	*			trans	-139.5	144.2	137.8	-61.2	-172.4	0	0	0	109.4
48	H	30.4	Very low	31.1	Very low	170 Å²	170	135.2 Å²	135.2	79%	0.787	82%	0.821	S	S	*	*			trans	-93.6	168.9	-176.7	-98	-64.7	0	0	0	114.4
49	P	43	Very low	31.6	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	82%	0.816	S	S	*	*			trans	-97.6	166	-158.5	38.3	-38.8	0	0	0	116.7
50	V	27.9	Very low	31.3	Very low	151 Å²	151	136.2 Å²	136.2	92%	0.915	82%	0.817	S	S	*	*			trans	-133.6	153.3	161.4	179.7	0	0	0	0	108.4
51	A	29.5	Very low	31.1	Very low	92 Å²	92	137.8 Å²	137.8	76%	0.76	82%	0.815	S	S	*	*			trans	-130.9	171.4	-168.1	0	0	0	0	0	114.6
52	A	29.9	Very low	30.8	Very low	111 Å²	111	132.8 Å²	132.8	92%	0.917	81%	0.812	S	S	*	*			trans	75.8	150.8	165.7	0	0	0	0	0	118.7
53	G	25.9	Very low	30.6	Very low	85 Å²	85	133.1 Å²	133.1	88%	0.876	81%	0.813	S	S	*	*			trans	119.9	109.4	177.5	0	0	0	0	0	112.7
54	G	25.5	Very low	30.1	Very low	79 Å²	79	132.4 Å²	132.4	81%	0.814	82%	0.817	S	S	*	*			trans	-146.9	162.4	171.7	0	0	0	0	0	110.9
55	S	25.1	Very low	29	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	83%	0.825	S	S	*	*			trans	165.7	131.2	153.1	-170.7	0	0	0	0	111.1
56	W	24.1	Very low	28.9	Very low	236 Å²	236	139.9 Å²	139.9	89%	0.894	83%	0.827	S	S	*	*			trans	16.4	120.1	144.9	-58.6	67.3	0	0	0	119.6
57	S	27.7	Very low	28.7	Very low	122 Å²	122	138.2 Å²	138.2	85%	0.853	83%	0.831	S	S	*	*				179.1	135.7	111.2	-76.9	0	0	0	0	113
58	A	29.6	Very low	28.7	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	83%	0.831	S	S	*	*			trans	-93.8	168.2	152.7	0	0	0	0	0	108.2
59	P	40.8	Very low	28.6	Very low	119 Å²	119	137.4 Å²	137.4	77%	0.773	84%	0.835	S	S	*	*				-155.7	-168	78.6	34	-9.5	0	0	0	116.4
60	I	26.4	Very low	28	Very low	159 Å²	159	138.9 Å²	138.9	82%	0.815	84%	0.841	S	S	*	*			trans	103.2	96.2	158.1	-51	-174.4	0	0	0	117.3
61	L	25.4	Very low	28.1	Very low	168 Å²	168	140 Å²	140	88%	0.88	84%	0.841	S	S	*	*			trans	-56.9	149.7	162.5	-57.6	139.2	0	0	0	113.7
62	S	27.1	Very low	28	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	84%	0.843	S	S	*	*			trans	-161.3	157.9	130.4	65.7	0	0	0	0	111.8
63	L	27.1	Very low	27.9	Very low	169 Å²	169	142 Å²	142	89%	0.885	84%	0.842	S	S	*	*	S	Bend	trans	61.5	135.1	-171.2	-65.5	94.9	0	0	0	115.2
64	A	26.5	Very low	28.1	Very low	99 Å²	99	141.8 Å²	141.8	82%	0.818	84%	0.84	S	S	*	*			cis	-138.2	141.5	-6.1	0	0	0	0	0	111.2
65	R	27.6	Very low	28.2	Very low	250 Å²	250	146.8 Å²	146.8	94%	0.943	84%	0.844	S	S	*	*			trans	-138.4	84.3	177.3	179.9	-167	-80	167.5	-6.6	109.6
66	K	27.9	Very low	28.3	Very low	213 Å²	213	147.7 Å²	147.7	93%	0.926	85%	0.85	S	S	*	*			trans	-162.8	67.3	174.9	-155.3	175.5	-175.3	179.8	0	115.6
67	A	26.9	Very low	28.7	Very low	95 Å²	95	147.3 Å²	147.3	79%	0.785	85%	0.85	S	S	*	*			trans	-167.6	64.4	165.2	0	0	0	0	0	113.5
68	T	28.6	Very low	28.7	Very low	145 Å²	145	146.6 Å²	146.6	89%	0.89	85%	0.852	S	S	*	*			trans	-152.2	46.1	176.1	-32.5	0	0	0	0	113.9
69	E	29.2	Very low	28.7	Very low	184 Å²	184	147.2 Å²	147.2	86%	0.86	86%	0.857	S	S	*	*			trans	-131.7	158.7	169.7	-68.2	-176.2	143	0	0	109.7
70	T	29.5	Very low	27.9	Very low	140 Å²	140	146 Å²	146	86%	0.859	86%	0.857	S	S	*	*			trans	84.1	41	179.5	-24.8	0	0	0	0	118
71	I	29.5	Very low	28.6	Very low	176 Å²	176	143.9 Å²	143.9	90%	0.903	85%	0.854	S	S	*	*			trans	-135.5	76.2	149.5	-49.2	-180	0	0	0	110.7
72	S	27.3	Very low	28.7	Very low	116 Å²	116	147.3 Å²	147.3	81%	0.811	86%	0.855	S	S	*	*			trans	-167.1	103.4	157	-170.3	0	0	0	0	111.8
73	S	29.4	Very low	28.8	Very low	127 Å²	127	152.8 Å²	152.8	89%	0.888	87%	0.866	S	S	*	*			trans	172	151.6	152.3	35.4	0	0	0	0	111
74	G	28.1	Very low	28.8	Very low	81 Å²	81	149.3 Å²	149.3	84%	0.835	86%	0.861	S	S	*	*			trans	94.2	81.1	159.7	0	0	0	0	0	117.9
75	M	28.4	Very low	29	Very low	185 Å²	185	149.9 Å²	149.9	91%	0.911	86%	0.859	S	S	*	*			trans	-103.2	130	147.3	-80.8	177.1	60.1	0	0	109.1
76	S	26.4	Very low	29	Very low	123 Å²	123	146.5 Å²	146.5	86%	0.86	85%	0.854	S	S	*	*			trans	-165.7	160.3	144.7	-159	0	0	0	0	111.4
77	Y	33.8	Very low	29	Very low	228 Å²	228	143.4 Å²	143.4	89%	0.894	85%	0.848	S	S	*	*			trans	-92.4	139.9	179.5	-77.7	-105.1	0	0	0	112
78	A	26.6	Very low	29.1	Very low	107 Å²	107	143.9 Å²	143.9	88%	0.884	85%	0.846	S	S	*	*			trans	-153.8	165.5	161.2	0	0	0	0	0	110.5
79	A	29.6	Very low	29	Very low	104 Å²	104	141.3 Å²	141.3	86%	0.86	84%	0.839	S	S	*	*			trans	-99.6	174.8	-166	0	0	0	0	0	115.7
80	A	24.5	Very low	29	Very low	92 Å²	92	139.5 Å²	139.5	76%	0.76	84%	0.84	S	S	*	*			trans	-52.2	171.1	174.5	0	0	0	0	0	114.6
81	P	40.7	Very low	28.9	Very low	115 Å²	115	136.6 Å²	136.6	75%	0.747	83%	0.83	S	S	*	*			cis	-150.6	166.7	27	43.5	-22.6	0	0	0	121.3
82	R	28.8	Very low	28.8	Very low	241 Å²	241	133.3 Å²	133.3	91%	0.909	82%	0.823	S	S	*	*			trans	34.3	125.2	144.1	-65.4	179.8	175.3	-176.9	-1.7	120.6
83	K	27.5	Very low	28.9	Very low	219 Å²	219	132.6 Å²	132.6	95%	0.952	82%	0.824	S	S	*	*				-148.3	172.3	118	-124.4	176.2	-177.3	-179.2	0	111.2
84	A	27.6	Very low	28.8	Very low	96 Å²	96	132.4 Å²	132.4	79%	0.793	82%	0.823	S	S	*	*			trans	-139.7	152.2	-163.2	0	0	0	0	0	114.2
85	S	30.2	Very low	28.8	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	83%	0.825	S	S	*	*			trans	-164.3	102.4	162	48.7	0	0	0	0	104.8
86	Q	29.6	Very low	28.7	Very low	178 Å²	178	136.3 Å²	136.3	83%	0.832	82%	0.815	S	S	*	*				67.4	96.8	53.3	-161.6	172.5	-0.5	0	0	111.8
87	D	26.5	Very low	28.8	Very low	148 Å²	148	137.4 Å²	137.4	79%	0.791	81%	0.806	S	S	*	*			trans	171	164.1	139.2	-85.9	-3.9	0	0	0	109.6
88	S	28.6	Very low	28.5	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	80%	0.802	S	S	*	*				-170.4	108.2	-81.4	51.4	0	0	0	0	111.8
89	A	27.8	Very low	28.6	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	80%	0.8	S	S	*	*			trans	-164.5	130.5	161.6	0	0	0	0	0	107.8
90	V	28.3	Very low	28.8	Very low	145 Å²	145	136.1 Å²	136.1	88%	0.879	79%	0.793	S	S	*	*				73.9	122	52	178.1	0	0	0	0	110.4
91	A	27.8	Very low	29.1	Very low	79 Å²	79	138 Å²	138	65%	0.653	79%	0.79	S	S	*	*			cis	-145.7	169	22.3	0	0	0	0	0	116.1
92	S	27.8	Very low	28.7	Very low	107 Å²	107	139 Å²	139	75%	0.748	79%	0.789	S	S	*	*			trans	32.2	123.2	144.7	58.9	0	0	0	0	120.7
93	A	28.5	Very low	28.7	Very low	102 Å²	102	134 Å²	134	84%	0.843	78%	0.78	S	S	*	*			cis	80.9	120.1	40.3	0	0	0	0	0	116.5
94	S	27.7	Very low	28.9	Very low	123 Å²	123	129.4 Å²	129.4	86%	0.86	78%	0.776	S	S	*	*			trans	-157.4	138.6	141.9	53.6	0	0	0	0	109.8
95	E	27.4	Very low	29.2	Very low	186 Å²	186	131 Å²	131	87%	0.869	78%	0.776	S	S	*	*			trans	-99.6	168.2	-178.9	-58.2	150.6	119.7	0	0	110.9
96	K	27.7	Very low	29.4	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	78%	0.779	S	S	*	*			trans	-174.3	144.2	132.9	-105.2	171.6	165.7	-69.3	0	114.4
97	E	27	Very low	29.6	Very low	146 Å²	146	132.2 Å²	132.2	68%	0.682	78%	0.783	S	S	*	*			trans	32.7	112.4	150	-72	120.4	-145.9	0	0	118.6
98	A	29.2	Very low	30.1	Very low	98 Å²	98	135.2 Å²	135.2	81%	0.81	79%	0.789	S	S	*	*			cis	78.2	110.6	19.9	0	0	0	0	0	117.4
99	E	28.8	Very low	30.3	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	79%	0.791	S	S	*	*			trans	-158	126.8	153	-124.2	178.1	-172.7	0	0	110.8
100	N	32.7	Very low	31	Very low	136 Å²	136	139.1 Å²	139.1	73%	0.727	80%	0.795	S	S	*	*			trans	29.1	142.1	140.3	-54.3	-4.6	0	0	0	120
101	D	31.3	Very low	31.6	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	79%	0.789	S	S	*	*			cis	-172.3	-168.5	0.6	-123	-43.9	0	0	0	108
102	L	31.9	Very low	32.5	Very low	137 Å²	137	137.8 Å²	137.8	72%	0.717	79%	0.786	S	S	*	*			cis	-152	135.4	3	-128.5	173.9	0	0	0	109.3
103	N	29.9	Very low	33.2	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	79%	0.789	S	S	*	*			trans	46.9	115.3	150.7	-131.7	-1.5	0	0	0	123
104	S	30.2	Very low	34.1	Very low	122 Å²	122	139.8 Å²	139.8	85%	0.853	79%	0.786	S	S	*	*			trans	-160.6	126.4	134.1	-173	0	0	0	0	110.5
105	T	34.7	Very low	35.7	Very low	129 Å²	129	141.8 Å²	141.8	79%	0.791	78%	0.779	S	S	*	*			trans	-101.3	128.9	-174.7	51.9	0	0	0	0	112.8
106	S	33.6	Very low	38	Very low	123 Å²	123	136.6 Å²	136.6	86%	0.86	76%	0.757	S	S	*	*			trans	-149.3	164	155.6	-162	0	0	0	0	110.7
107	E	34.4	Very low	40.5	Very low	193 Å²	193	133.8 Å²	133.8	90%	0.902	76%	0.755	S	S	*	*			trans	-84.8	160.4	-157	-63.5	-177	108.7	0	0	115.4
108	K	36	Very low	43.3	Very low	211 Å²	211	129.8 Å²	129.8	92%	0.917	74%	0.737	S	S	*	*			trans	-78.6	124.8	-173.8	-68.6	178	178.6	175.5	0	112.7
109	L	34.1	Very low	46.1	Very low	152 Å²	152	126.5 Å²	126.5	80%	0.796	71%	0.71	S	S	*	*			trans	-109.8	145.3	147.4	-81	161.1	0	0	0	108.9	V111	L109-V111 PolarHBondContact O-N 3.13Å
110	P	41.8	Very low	48.9	Very low	126 Å²	126	121.7 Å²	121.7	82%	0.818	69%	0.689	S	S	*	*			trans	-76.9	86.5	-176.6	31.3	-34.5	0	0	0	110.8	A112	P110-A112 PolarHBondContact O-N 2.84Å
111	V	40.3	Very low	51.6	Low	125 Å²	125	120.3 Å²	120.3	76%	0.758	68%	0.678	S	S	*	*			trans	-62.3	125	172	-175.1	0	0	0	0	108.7	L109	L109-V111 PolarHBondContact O-N 3.13Å
112	A	46.8	Very low	54.6	Low	72 Å²	72	115 Å²	115	60%	0.595	65%	0.648	S	S	*	*			trans	-58.2	152.4	174.9	0	0	0	0	0	110.5	P110 T114	P110-A112 PolarHBondContact O-N 2.84Å; A112-T114 PolarHBondContact O-N 3.45Å
113	P	42.9	Very low	57.4	Low	124 Å²	124	111.2 Å²	111.2	81%	0.805	63%	0.634	S	S	*	*			trans	-55.3	115.3	176.8	23.7	-33.9	0	0	0	109.3	K115	P113-K115 PolarHBondContact O-N 2.94Å
114	T	48	Very low	60.3	Low	127 Å²	127	109 Å²	109	78%	0.779	62%	0.622	S	S	*	*			trans	-61.1	102.5	174	46.1	0	0	0	0	107.1	A112 D116	A112-T114 PolarHBondContact O-N 3.45Å; T114-D116 PolarHBondContact O-N 3.38Å
115	K	60	Low	63.3	Low	164 Å²	164	103.7 Å²	103.7	71%	0.713	58%	0.584	S	S	*	*			trans	-50	130.7	173.3	-72.8	-176.6	176.5	-174.8	0	107.7	P113 P117 I120	P113-K115 PolarHBondContact O-N 2.94Å; K115-P117 VanDerWaalsContact O-N 3.17Å; K115-I120 HydrophobicContact CB-CD1 3.95Å; K115-I120 HydrophobicContact CB-CG1 3.84Å; K115-I120 HydrophobicContact CD-CG1 4.44Å
116	D	75.9	Confident	66.1	Low	78 Å²	78	98.1 Å²	98.1	42%	0.417	55%	0.549	S	S	.	.			trans	-45.5	122.2	174.2	161.9	33.1	0	0	0	109.5	T114 M118 A119 I120	T114-D116 PolarHBondContact O-N 3.38Å; D116-M118 PolarHBondContact O-N 3.09Å; D116-M118 VanDerWaalsContact O-N 3.14Å; D116-M118 WeakPolarHBondContact OD1-CB 3.25Å; D116-M118 PolarHBondContact OD1-N 3.39Å; D116-M118 WeakPolarHBondContact OD2-CB 3.29Å; D116-A119 HydrophobicContact CB-CB 4Å; D116-A119 WeakPolarHBondContact O-CB 3.21Å; D116-A119 PolarHBondContact O-N 3.44Å; D116-A119 PolarHBondContact OD2-N 3.47Å; D116-I120 PolarHBondContact O-N 3.21Å
117	P	80.9	Confident	69	Low	102 Å²	102	95.2 Å²	95.2	66%	0.662	53%	0.529	S	S	*	.	H	α-helix	trans	-52.7	-34.4	178.7	-28.3	36	0	0	0	112.7	K115 I120 E121	K115-P117 VanDerWaalsContact O-N 3.17Å; P117-I120 PolarHBondContact O-N 2.94Å; P117-E121 PolarHBondContact O-N 3.42Å
118	M	86.1	Confident	71.7	Confident	63 Å²	63	88.7 Å²	88.7	31%	0.31	50%	0.499	S	S	.	.	H	α-helix	trans	-69.1	-41.9	178.1	-169	174.2	-68	0	0	111.5	D116 I120 E121 R122 H167 G250	D116-M118 PolarHBondContact O-N 3.09Å; D116-M118 VanDerWaalsContact O-N 3.14Å; D116-M118 WeakPolarHBondContact OD1-CB 3.25Å; D116-M118 PolarHBondContact OD1-N 3.39Å; D116-M118 WeakPolarHBondContact OD2-CB 3.29Å; M118-I120 VanDerWaalsContact C-N 3.33Å; M118-I120 PolarHBondContact O-N 3.19Å; M118-E121 PolarHBondContact O-N 3.15Å; M118-R122 WeakPolarHBondContact O-CG 3.47Å; M118-R122 PolarHBondContact O-N 3.46Å; M118-H167 WeakPolarHBondContact CG-CE1 3.42Å; M118-H167 PolarHBondContact O-NE2 3.21Å; M118-G250 WeakPolarHBondContact CG-O 3.28Å; M118-G250 VanDerWaalsContact SD-O 3.34Å
119	A	87.6	Confident	74.5	Confident	29 Å²	29	78.6 Å²	78.6	24%	0.24	46%	0.455	C	S	.	.	H	α-helix	trans	-63.4	-32.8	170.8	0	0	0	0	0	113.8	D116 S123	D116-A119 HydrophobicContact CB-CB 4Å; D116-A119 WeakPolarHBondContact O-CB 3.21Å; D116-A119 PolarHBondContact O-N 3.44Å; D116-A119 PolarHBondContact OD2-N 3.47Å; A119-S123 WeakPolarHBondContact O-CB 3.35Å; A119-S123 PolarHBondContact O-N 3.13Å; A119-S123 VanDerWaalsContact O-N 3.15Å
120	I	87.8	Confident	77.3	Confident	75 Å²	75	75.8 Å²	75.8	39%	0.385	44%	0.437	S	S	.	.	H	α-helix	trans	-65.7	-45.2	170.6	-58.5	173.5	0	0	0	109.9	K115 D116 P117 M118 S123 N124	K115-I120 HydrophobicContact CB-CD1 3.95Å; K115-I120 HydrophobicContact CB-CG1 3.84Å; K115-I120 HydrophobicContact CD-CG1 4.44Å; D116-I120 PolarHBondContact O-N 3.21Å; P117-I120 PolarHBondContact O-N 2.94Å; M118-I120 VanDerWaalsContact C-N 3.33Å; M118-I120 PolarHBondContact O-N 3.19Å; I120-S123 PolarHBondContact O-N 3.37Å; I120-N124 VanDerWaalsContact O-CG 3.27Å; I120-N124 PolarHBondContact O-N 2.72Å; I120-N124 PolarHBondContact O-ND2 2.93Å
121	E	89.1	Confident	79.7	Confident	107 Å²	107	73 Å²	73	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-62.1	-46.1	179.5	-161.7	-176.4	145.4	0	0	111.8	P117 M118 S123 N124 L125 H167	P117-E121 PolarHBondContact O-N 3.42Å; M118-E121 PolarHBondContact O-N 3.15Å; E121-S123 PolarHBondContact O-N 3.24Å; E121-N124 PolarHBondContact O-N 3.45Å; E121-L125 HydrophobicContact CG-CD1 4.2Å; E121-L125 WeakPolarHBondContact O-CB 3.41Å; E121-L125 WeakPolarHBondContact O-CG 3.48Å; E121-L125 PolarHBondContact O-N 3.41Å; E121-H167 IonicContact OE1-CD2 3.74Å; E121-H167 PolarHBondContact OE1-CD2 3.4Å
122	R	93.6	Very high	82.3	Confident	19 Å²	19	67.3 Å²	67.3	7%	0.072	38%	0.38	C	S	.	.	H	α-helix	trans	-54.2	-49.3	171.7	-69.5	-161	-55.8	-97.8	18.7	112.6	M118 N124 L125 L126 H167 G250 L252 E255 E257	M118-R122 WeakPolarHBondContact O-CG 3.47Å; M118-R122 PolarHBondContact O-N 3.46Å; R122-N124 VanDerWaalsContact C-N 3.27Å; R122-N124 PolarHBondContact O-N 3.49Å; R122-L125 PolarHBondContact O-N 2.99Å; R122-L126 WeakPolarHBondContact O-CB 3.42Å; R122-L126 PolarHBondContact O-N 3.25Å; R122-H167 VanDerWaalsContact CG-CE1 3.41Å; R122-H167 WeakPolarHBondContact CG-CE1 3.42Å; R122-G250 WeakPolarHBondContact CD-O 3.11Å; R122-G250 PolarHBondContact NH1-O 2.81Å; R122-L252 HydrophobicContact CG-CB 4.17Å; R122-E255 IonicContact CZ-OE1 3.95Å; R122-E255 IonicContact NH1-OE1 3.23Å; R122-E255 PolarHBondContact NH1-OE1 3.34Å; R122-E255 VanDerWaalsContact NH2-CD 3.3Å; R122-E255 IonicContact NH2-OE1 2.66Å; R122-E255 PolarHBondContact NH2-OE1 3.12Å; R122-E257 HydrophobicContact CB-CB 4.49Å; R122-E257 HydrophobicContact CB-CG 4.1Å; R122-E257 WeakPolarHBondContact CB-OE1 3.49Å; R122-E257 WeakPolarHBondContact CD-OE2 3.3Å; R122-E257 IonicContact CZ-OE1 2.73Å; R122-E257 IonicContact CZ-OE2 2.88Å; R122-E257 IonicContact NE-OE1 3.23Å; R122-E257 PolarHBondContact NE-OE1 2.8Å; R122-E257 IonicContact NE-OE2 3.66Å; R122-E257 PolarHBondContact NE-OE2 2.77Å; R122-E257 IonicContact NH2-OE1 3.59Å; R122-E257 IonicContact NH2-OE2 2.59Å
123	S	91.3	Very high	84.5	Confident	59 Å²	59	64.2 Å²	64.2	41%	0.413	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-35.7	-179.9	-176.9	0	0	0	0	112	A119 I120 E121 S127	A119-S123 WeakPolarHBondContact O-CB 3.35Å; A119-S123 PolarHBondContact O-N 3.13Å; A119-S123 VanDerWaalsContact O-N 3.15Å; I120-S123 PolarHBondContact O-N 3.37Å; E121-S123 PolarHBondContact O-N 3.24Å; S123-S127 WeakPolarHBondContact O-CB 3.49Å; S123-S127 PolarHBondContact O-N 3.47Å; S123-S127 VanDerWaalsContact O-N 3.15Å; S123-S127 PolarHBondContact O-OG 3.05Å
124	N	92.3	Very high	86.8	Confident	90 Å²	90	64.2 Å²	64.2	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-72.6	-45.4	177.1	-70.8	-16.2	0	0	0	111.5	I120 E121 R122 L126 S127 M128	I120-N124 VanDerWaalsContact O-CG 3.27Å; I120-N124 PolarHBondContact O-N 2.72Å; I120-N124 PolarHBondContact O-ND2 2.93Å; E121-N124 PolarHBondContact O-N 3.45Å; R122-N124 VanDerWaalsContact C-N 3.27Å; R122-N124 PolarHBondContact O-N 3.49Å; N124-L126 PolarHBondContact O-N 2.88Å; N124-S127 WeakPolarHBondContact O-CB 3.46Å; N124-S127 PolarHBondContact O-N 2.89Å; N124-S127 VanDerWaalsContact O-N 3.1Å; N124-M128 PolarHBondContact O-N 3.36Å
125	L	92.9	Very high	88.9	Confident	9 Å²	9	60.2 Å²	60.2	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-47	175.2	-76.1	165.5	0	0	0	111.9	E121 R122 S127 M128 M129 H163 H167 L252	E121-L125 HydrophobicContact CG-CD1 4.2Å; E121-L125 WeakPolarHBondContact O-CB 3.41Å; E121-L125 WeakPolarHBondContact O-CG 3.48Å; E121-L125 PolarHBondContact O-N 3.41Å; R122-L125 PolarHBondContact O-N 2.99Å; L125-S127 PolarHBondContact O-N 3.43Å; L125-M128 HydrophobicContact CD2-CE 3.83Å; L125-M128 HydrophobicContact CG-CE 4.42Å; L125-M128 PolarHBondContact O-N 2.83Å; L125-M129 WeakPolarHBondContact O-CB 3.06Å; L125-M129 PolarHBondContact O-N 3.02Å; L125-H163 HydrophobicContact CD2-CB 3.74Å; L125-H167 HydrophobicContact CD1-CB 3.59Å; L125-H167 WeakPolarHBondContact CD1-CD2 3.17Å; L125-L252 HydrophobicContact CB-CD1 3.67Å; L125-L252 HydrophobicContact CD1-CD1 4.16Å
126	L	93.7	Very high	90.4	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-33.7	175.1	-178.8	62.2	0	0	0	112.3	R122 N124 K130 E257 V260 M261 L264	R122-L126 WeakPolarHBondContact O-CB 3.42Å; R122-L126 PolarHBondContact O-N 3.25Å; N124-L126 PolarHBondContact O-N 2.88Å; L126-K130 HydrophobicContact CG-CD 4.2Å; L126-K130 WeakPolarHBondContact O-CB 3.32Å; L126-K130 WeakPolarHBondContact O-CD 3.31Å; L126-K130 VanDerWaalsContact O-CG 3.25Å; L126-K130 WeakPolarHBondContact O-CG 3.2Å; L126-K130 PolarHBondContact O-N 3.05Å; L126-E257 HydrophobicContact CB-CB 4.26Å; L126-E257 HydrophobicContact CB-CG 4.4Å; L126-E257 HydrophobicContact CD2-CB 3.87Å; L126-E257 HydrophobicContact CD2-CG 3.8Å; L126-V260 HydrophobicContact CD1-CB 4.31Å; L126-V260 HydrophobicContact CD1-CG1 4.1Å; L126-V260 HydrophobicContact CD2-CB 4.25Å; L126-V260 HydrophobicContact CD2-CG1 4.16Å; L126-M261 HydrophobicContact CD1-CB 4.32Å; L126-L264 HydrophobicContact CD1-CD1 4.15Å
127	S	92.6	Very high	91.2	Very high	62 Å²	62	50.2 Å²	50.2	43%	0.434	27%	0.27	S	S	.	.	H	α-helix	trans	-70.9	-43.1	177	-60.2	0	0	0	0	111.9	S123 N124 L125 M129 K130 L131	S123-S127 WeakPolarHBondContact O-CB 3.49Å; S123-S127 PolarHBondContact O-N 3.47Å; S123-S127 VanDerWaalsContact O-N 3.15Å; S123-S127 PolarHBondContact O-OG 3.05Å; N124-S127 WeakPolarHBondContact O-CB 3.46Å; N124-S127 PolarHBondContact O-N 2.89Å; N124-S127 VanDerWaalsContact O-N 3.1Å; L125-S127 PolarHBondContact O-N 3.43Å; S127-M129 VanDerWaalsContact C-N 3.34Å; S127-K130 PolarHBondContact O-N 3.13Å; S127-L131 WeakPolarHBondContact O-CB 3.22Å; S127-L131 PolarHBondContact O-N 3.02Å
128	M	91.8	Very high	91.6	Very high	55 Å²	55	50.9 Å²	50.9	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-40.3	172.3	-68	-171.2	-64	0	0	111.5	N124 L125 L131 S132 V160 I289	N124-M128 PolarHBondContact O-N 3.36Å; L125-M128 HydrophobicContact CD2-CE 3.83Å; L125-M128 HydrophobicContact CG-CE 4.42Å; L125-M128 PolarHBondContact O-N 2.83Å; M128-L131 PolarHBondContact O-N 2.92Å; M128-S132 VanDerWaalsContact O-CB 3.26Å; M128-S132 WeakPolarHBondContact O-CB 3.47Å; M128-S132 PolarHBondContact O-N 2.93Å; M128-V160 HydrophobicContact CB-CG1 4Å; M128-V160 HydrophobicContact CB-CG2 4.46Å; M128-I289 HydrophobicContact SD-CD1 4.31Å
129	M	94.7	Very high	91.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-47.1	176.4	178.8	55	78.7	0	0	111.9	L125 S127 L131 S132 I133 F157 V160 L161 C164 M261	L125-M129 WeakPolarHBondContact O-CB 3.06Å; L125-M129 PolarHBondContact O-N 3.02Å; S127-M129 VanDerWaalsContact C-N 3.34Å; M129-L131 VanDerWaalsContact C-N 3.33Å; M129-L131 PolarHBondContact O-N 2.91Å; M129-S132 PolarHBondContact O-N 3.39Å; M129-I133 HydrophobicContact CG-CD1 3.86Å; M129-I133 HydrophobicContact CG-CG1 4.46Å; M129-I133 WeakPolarHBondContact O-CB 3.2Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 3.37Å; M129-I133 HydrophobicContact SD-CD1 3.47Å; M129-I133 WeakPolarHBondContact SD-CD1 3.38Å; M129-I133 HydrophobicContact SD-CG1 3.67Å; M129-F157 HydrophobicContact CE-CE2 4.37Å; M129-F157 HydrophobicContact SD-CD2 4.24Å; M129-F157 HydrophobicContact SD-CE2 3.9Å; M129-V160 HydrophobicContact CB-CG1 4.06Å; M129-V160 HydrophobicContact CE-CG1 4.11Å; M129-V160 HydrophobicContact SD-CG1 4.5Å; M129-L161 VanDerWaalsContact CE-CA 3.45Å; M129-L161 HydrophobicContact CE-CB 3.79Å; M129-L161 HydrophobicContact CE-CD1 3.61Å; M129-L161 HydrophobicContact CE-CG 4.31Å; M129-C164 HydrophobicContact CE-CB 4.39Å; M129-M261 HydrophobicContact CE-CG 4.41Å; M129-M261 HydrophobicContact CE-SD 3.91Å; M129-M261 HydrophobicContact CG-CG 4.02Å; M129-M261 HydrophobicContact CG-SD 4.44Å
130	K	93.5	Very high	91.8	Very high	92 Å²	92	48.9 Å²	48.9	40%	0.4	26%	0.255	S	S	.	.	H	α-helix	trans	-56.3	-45.4	173.8	-78.5	163.9	177.7	168.5	0	112	L126 S127 K134 L264	L126-K130 HydrophobicContact CG-CD 4.2Å; L126-K130 WeakPolarHBondContact O-CB 3.32Å; L126-K130 WeakPolarHBondContact O-CD 3.31Å; L126-K130 VanDerWaalsContact O-CG 3.25Å; L126-K130 WeakPolarHBondContact O-CG 3.2Å; L126-K130 PolarHBondContact O-N 3.05Å; S127-K130 PolarHBondContact O-N 3.13Å; K130-K134 VanDerWaalsContact O-CB 3.25Å; K130-K134 WeakPolarHBondContact O-CB 3.44Å; K130-K134 PolarHBondContact O-N 3Å; K130-K134 VanDerWaalsContact O-N 3.12Å; K130-L264 HydrophobicContact CD-CD1 4.33Å; K130-L264 HydrophobicContact CG-CD1 3.42Å; K130-L264 VanDerWaalsContact CG-CD1 3.42Å; K130-L264 HydrophobicContact CG-CD2 4.5Å
131	L	92.3	Very high	91.8	Very high	69 Å²	69	50.5 Å²	50.5	36%	0.361	26%	0.264	S	S	.	.	H	α-helix	trans	-66.8	-43.9	179.2	-178	59.4	0	0	0	111.8	S127 M128 M129 K134 V135 Y294	S127-L131 WeakPolarHBondContact O-CB 3.22Å; S127-L131 PolarHBondContact O-N 3.02Å; M128-L131 PolarHBondContact O-N 2.92Å; M129-L131 VanDerWaalsContact C-N 3.33Å; M129-L131 PolarHBondContact O-N 2.91Å; L131-K134 PolarHBondContact O-N 3.37Å; L131-V135 HydrophobicContact CD1-CG2 4.29Å; L131-V135 WeakPolarHBondContact O-CB 3.37Å; L131-V135 WeakPolarHBondContact O-CG2 3.46Å; L131-V135 PolarHBondContact O-N 2.79Å; L131-Y294 HydrophobicContact CD1-CD1 4.27Å; L131-Y294 HydrophobicContact CD1-CE1 4.18Å; L131-Y294 HydrophobicContact CD2-CD1 3.76Å; L131-Y294 HydrophobicContact CD2-CD2 4.33Å; L131-Y294 HydrophobicContact CD2-CE1 3.73Å; L131-Y294 HydrophobicContact CD2-CE2 4.33Å; L131-Y294 HydrophobicContact CD2-CG 4.07Å; L131-Y294 HydrophobicContact CG-CD1 4.16Å; L131-Y294 HydrophobicContact CG-CE1 3.78Å
132	S	93.8	Very high	91.7	Very high	4 Å²	4	50 Å²	50	3%	0.028	27%	0.272	C	S	.	.	H	α-helix	trans	-67	-48.2	-179.4	-177.7	0	0	0	0	112.5	M128 M129 K134 V135 L136 F157	M128-S132 VanDerWaalsContact O-CB 3.26Å; M128-S132 WeakPolarHBondContact O-CB 3.47Å; M128-S132 PolarHBondContact O-N 2.93Å; M129-S132 PolarHBondContact O-N 3.39Å; S132-K134 VanDerWaalsContact C-N 3.31Å; S132-K134 PolarHBondContact O-N 3.37Å; S132-V135 PolarHBondContact O-N 3.43Å; S132-L136 VanDerWaalsContact O-CB 3.28Å; S132-L136 WeakPolarHBondContact O-CB 3.32Å; S132-L136 PolarHBondContact O-N 3.32Å; S132-F157 WeakPolarHBondContact OG-CA 3.42Å; S132-F157 PolarHBondContact OG-N 3.32Å
133	I	94.1	Very high	91.4	Very high	8 Å²	8	52.4 Å²	52.4	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-45.2	173.9	-70.1	173.7	0	0	0	110.5	M129 L136 I137 F157 L264 L265 L268	M129-I133 HydrophobicContact CG-CD1 3.86Å; M129-I133 HydrophobicContact CG-CG1 4.46Å; M129-I133 WeakPolarHBondContact O-CB 3.2Å; M129-I133 WeakPolarHBondContact O-CG1 3.5Å; M129-I133 PolarHBondContact O-N 3.37Å; M129-I133 HydrophobicContact SD-CD1 3.47Å; M129-I133 WeakPolarHBondContact SD-CD1 3.38Å; M129-I133 HydrophobicContact SD-CG1 3.67Å; I133-L136 PolarHBondContact O-N 3.44Å; I133-I137 HydrophobicContact CG2-CD1 3.6Å; I133-I137 HydrophobicContact CG2-CG1 4.42Å; I133-I137 WeakPolarHBondContact O-CB 3.49Å; I133-I137 WeakPolarHBondContact O-CG1 3.43Å; I133-I137 PolarHBondContact O-N 2.92Å; I133-F157 HydrophobicContact CD1-CE2 4.41Å; I133-F157 HydrophobicContact CG1-CD2 4.02Å; I133-F157 HydrophobicContact CG1-CE2 3.85Å; I133-L264 HydrophobicContact CD1-CB 3.78Å; I133-L265 HydrophobicContact CD1-CD2 3.96Å; I133-L265 HydrophobicContact CD1-CG 4.35Å; I133-L268 HydrophobicContact CG1-CD2 4.4Å; I133-L268 HydrophobicContact CG2-CD2 4.18Å
134	K	91.8	Very high	90.8	Very high	123 Å²	123	53 Å²	53	54%	0.535	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-50.7	178	177.9	-176.8	173	-172.9	0	111.5	K130 L131 S132 Q138	K130-K134 VanDerWaalsContact O-CB 3.25Å; K130-K134 WeakPolarHBondContact O-CB 3.44Å; K130-K134 PolarHBondContact O-N 3Å; K130-K134 VanDerWaalsContact O-N 3.12Å; L131-K134 PolarHBondContact O-N 3.37Å; S132-K134 VanDerWaalsContact C-N 3.31Å; S132-K134 PolarHBondContact O-N 3.37Å; K134-Q138 HydrophobicContact CG-CG 4.43Å; K134-Q138 WeakPolarHBondContact O-CB 3.46Å; K134-Q138 VanDerWaalsContact O-CG 3.28Å; K134-Q138 WeakPolarHBondContact O-CG 2.98Å; K134-Q138 PolarHBondContact O-N 3.16Å
135	V	90.8	Very high	90.6	Very high	43 Å²	43	55.4 Å²	55.4	26%	0.261	30%	0.304	S	S	.	.	H	α-helix	trans	-67.3	-40.5	-178.3	168.6	0	0	0	0	111.5	L131 S132 S139 Y294	L131-V135 HydrophobicContact CD1-CG2 4.29Å; L131-V135 WeakPolarHBondContact O-CB 3.37Å; L131-V135 WeakPolarHBondContact O-CG2 3.46Å; L131-V135 PolarHBondContact O-N 2.79Å; S132-V135 PolarHBondContact O-N 3.43Å; V135-S139 WeakPolarHBondContact O-CB 2.93Å; V135-S139 PolarHBondContact O-N 3.34Å; V135-Y294 HydrophobicContact CG2-CE1 4.21Å
136	L	92.6	Very high	90.3	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-51.7	175.4	174.5	57.2	0	0	0	111.3	S132 I133 S139 S140 L147 Y151 P153 L154 F157 L268 I271	S132-L136 VanDerWaalsContact O-CB 3.28Å; S132-L136 WeakPolarHBondContact O-CB 3.32Å; S132-L136 PolarHBondContact O-N 3.32Å; I133-L136 PolarHBondContact O-N 3.44Å; L136-S139 PolarHBondContact O-N 2.89Å; L136-S140 VanDerWaalsContact O-CB 3.29Å; L136-S140 WeakPolarHBondContact O-CB 3.19Å; L136-S140 PolarHBondContact O-N 3.21Å; L136-S140 PolarHBondContact O-OG 3.25Å; L136-L147 HydrophobicContact CD1-CD1 3.82Å; L136-Y151 HydrophobicContact CD1-CD1 4.3Å; L136-Y151 HydrophobicContact CD1-CE1 4.04Å; L136-P153 HydrophobicContact CD1-CB 4.14Å; L136-L154 HydrophobicContact CD1-CB 3.99Å; L136-L154 HydrophobicContact CD1-CD1 4.36Å; L136-L154 HydrophobicContact CD2-CD1 3.93Å; L136-F157 HydrophobicContact CD2-CB 3.67Å; L136-F157 HydrophobicContact CD2-CD1 3.94Å; L136-F157 HydrophobicContact CD2-CD2 4.34Å; L136-F157 HydrophobicContact CD2-CG 3.69Å; L136-L268 HydrophobicContact CD2-CD2 3.97Å; L136-I271 HydrophobicContact CD1-CD1 4.31Å; L136-I271 HydrophobicContact CD2-CD1 3.72Å; L136-I271 HydrophobicContact CG-CD1 3.65Å
137	I	91.4	Very high	90.1	Very high	32 Å²	32	57.4 Å²	57.4	16%	0.164	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-44.8	-179.9	-66.5	169.2	0	0	0	111.4	I133 S140 L141 G267 L268 V270 I271	I133-I137 HydrophobicContact CG2-CD1 3.6Å; I133-I137 HydrophobicContact CG2-CG1 4.42Å; I133-I137 WeakPolarHBondContact O-CB 3.49Å; I133-I137 WeakPolarHBondContact O-CG1 3.43Å; I133-I137 PolarHBondContact O-N 2.92Å; I137-S140 PolarHBondContact O-OG 2.89Å; I137-L141 HydrophobicContact CG2-CD1 3.73Å; I137-L141 HydrophobicContact CG2-CG 4.36Å; I137-L141 VanDerWaalsContact O-CB 3.31Å; I137-L141 WeakPolarHBondContact O-CB 2.96Å; I137-L141 WeakPolarHBondContact O-CG 3.06Å; I137-L141 PolarHBondContact O-N 3.28Å; I137-G267 WeakPolarHBondContact CD1-O 3.35Å; I137-L268 HydrophobicContact CD1-CD2 4.3Å; I137-L268 HydrophobicContact CG1-CD2 4.2Å; I137-V270 HydrophobicContact CG2-CG1 4.25Å; I137-I271 HydrophobicContact CG1-CD1 4.23Å
138	Q	90.6	Very high	89.9	Confident	116 Å²	116	56.9 Å²	56.9	54%	0.542	31%	0.309	S	S	.	.	H	α-helix	trans	-64.4	-41.8	178.8	-72.4	-171.4	-61.9	0	0	111.7	K134 S142	K134-Q138 HydrophobicContact CG-CG 4.43Å; K134-Q138 WeakPolarHBondContact O-CB 3.46Å; K134-Q138 VanDerWaalsContact O-CG 3.28Å; K134-Q138 WeakPolarHBondContact O-CG 2.98Å; K134-Q138 PolarHBondContact O-N 3.16Å; Q138-S142 WeakPolarHBondContact O-CB 3.13Å; Q138-S142 PolarHBondContact O-N 2.93Å; Q138-S142 VanDerWaalsContact O-N 3.1Å
139	S	89.1	Confident	89.6	Confident	37 Å²	37	56.5 Å²	56.5	26%	0.259	31%	0.312	S	S	.	.	H	α-helix	trans	-72.1	-41.9	-179.5	-156.9	0	0	0	0	111.4	V135 L136 L141 S142 L143 Y151	V135-S139 WeakPolarHBondContact O-CB 2.93Å; V135-S139 PolarHBondContact O-N 3.34Å; L136-S139 PolarHBondContact O-N 2.89Å; S139-L141 PolarHBondContact O-N 2.9Å; S139-S142 WeakPolarHBondContact CA-OG 3.05Å; S139-S142 PolarHBondContact O-N 3.27Å; S139-S142 VanDerWaalsContact O-N 3.14Å; S139-S142 PolarHBondContact O-OG 3.41Å; S139-L143 WeakPolarHBondContact O-CB 3.01Å; S139-L143 PolarHBondContact O-N 3.05Å; S139-Y151 WeakPolarHBondContact CB-OH 3.24Å; S139-Y151 PolarHBondContact O-OH 2.8Å; S139-Y151 PolarHBondContact OG-OH 3.46Å
140	S	89.3	Confident	89.1	Confident	12 Å²	12	64 Å²	64	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-41.2	177.3	71.7	0	0	0	0	112.5	L136 I137 S142 L143 G144 Y151	L136-S140 VanDerWaalsContact O-CB 3.29Å; L136-S140 WeakPolarHBondContact O-CB 3.19Å; L136-S140 PolarHBondContact O-N 3.21Å; L136-S140 PolarHBondContact O-OG 3.25Å; I137-S140 PolarHBondContact O-OG 2.89Å; S140-S142 VanDerWaalsContact C-N 3.28Å; S140-S142 PolarHBondContact O-N 2.96Å; S140-L143 PolarHBondContact O-N 2.9Å; S140-G144 PolarHBondContact O-N 2.75Å; S140-Y151 PolarHBondContact N-OH 3.39Å
141	L	87.3	Confident	88.9	Confident	110 Å²	110	60.6 Å²	60.6	58%	0.576	33%	0.332	S	S	*	.	H	α-helix	trans	-66.2	-30	174.3	-70.2	173.7	0	0	0	112.4	I137 S139 V270	I137-L141 HydrophobicContact CG2-CD1 3.73Å; I137-L141 HydrophobicContact CG2-CG 4.36Å; I137-L141 VanDerWaalsContact O-CB 3.31Å; I137-L141 WeakPolarHBondContact O-CB 2.96Å; I137-L141 WeakPolarHBondContact O-CG 3.06Å; I137-L141 PolarHBondContact O-N 3.28Å; S139-L141 PolarHBondContact O-N 2.9Å; L141-V270 HydrophobicContact CD2-CG2 4.2Å
142	S	85.6	Confident	88.7	Confident	96 Å²	96	61.1 Å²	61.1	67%	0.671	34%	0.34	S	S	*	.	H	α-helix	trans	-76.1	-27	172.4	76.4	0	0	0	0	113.6	Q138 S139 S140	Q138-S142 WeakPolarHBondContact O-CB 3.13Å; Q138-S142 PolarHBondContact O-N 2.93Å; Q138-S142 VanDerWaalsContact O-N 3.1Å; S139-S142 WeakPolarHBondContact CA-OG 3.05Å; S139-S142 PolarHBondContact O-N 3.27Å; S139-S142 VanDerWaalsContact O-N 3.14Å; S139-S142 PolarHBondContact O-OG 3.41Å; S140-S142 VanDerWaalsContact C-N 3.28Å; S140-S142 PolarHBondContact O-N 2.96Å
143	L	87.5	Confident	88.5	Confident	69 Å²	69	61.9 Å²	61.9	36%	0.361	35%	0.345	S	S	.	.	H	α-helix	trans	-81.6	-30.9	-178.5	-163.9	75.3	0	0	0	112.5	S139 S140 R145 L147 Y151	S139-L143 WeakPolarHBondContact O-CB 3.01Å; S139-L143 PolarHBondContact O-N 3.05Å; S140-L143 PolarHBondContact O-N 2.9Å; L143-R145 HydrophobicContact CD2-CG 3.85Å; L143-R145 HydrophobicContact CG-CG 3.95Å; L143-R145 PolarHBondContact O-N 3.1Å; L143-R145 VanDerWaalsContact O-N 3.12Å; L143-L147 HydrophobicContact CD2-CD2 3.85Å; L143-Y151 HydrophobicContact CD2-CD2 4.15Å; L143-Y151 HydrophobicContact CD2-CE2 3.61Å
144	G	80.1	Confident	88.4	Confident	72 Å²	72	61.7 Å²	61.7	74%	0.742	34%	0.343	S	S	*	.			trans	67.2	11.6	169.7	0	0	0	0	0	116.4	S140	S140-G144 PolarHBondContact O-N 2.75Å
145	R	86.3	Confident	88.2	Confident	140 Å²	140	59 Å²	59	53%	0.528	33%	0.333	S	S	.	.	S	Bend	trans	-130.1	158.9	178.7	74.8	-174.2	-171.3	127.8	18.3	110.8	L143 L147 D148	L143-R145 HydrophobicContact CD2-CG 3.85Å; L143-R145 HydrophobicContact CG-CG 3.95Å; L143-R145 PolarHBondContact O-N 3.1Å; L143-R145 VanDerWaalsContact O-N 3.12Å; R145-L147 PolarHBondContact O-N 3.13Å; R145-D148 IonicContact CZ-OD2 3.5Å; R145-D148 IonicContact NH1-OD2 3.29Å; R145-D148 IonicContact NH2-OD2 2.76Å; R145-D148 PolarHBondContact NH2-OD2 2.84Å
146	T	87.3	Confident	88.2	Confident	62 Å²	62	57.5 Å²	57.5	38%	0.38	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-51	133.2	170.3	-46.9	0	0	0	0	111.1	D272 N274	T146-D272 VanDerWaalsContact CB-OD2 3.28Å; T146-D272 WeakPolarHBondContact CB-OD2 3.44Å; T146-D272 VanDerWaalsContact CG2-OD2 3.28Å; T146-D272 WeakPolarHBondContact CG2-OD2 3.45Å; T146-D272 PolarHBondContact OG1-OD2 3.48Å; T146-N274 HydrophobicContact CG2-CB 3.71Å
147	L	90.3	Very high	88.2	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-79.1	141.3	178.7	-57.4	-172	0	0	0	112	L136 L143 R145 Y151 L154 I271 D272 A273 N274	L136-L147 HydrophobicContact CD1-CD1 3.82Å; L143-L147 HydrophobicContact CD2-CD2 3.85Å; R145-L147 PolarHBondContact O-N 3.13Å; L147-Y151 HydrophobicContact CD1-CD1 3.78Å; L147-Y151 HydrophobicContact CD1-CE1 3.9Å; L147-Y151 HydrophobicContact CD2-CD1 3.72Å; L147-Y151 HydrophobicContact CD2-CE1 3.64Å; L147-Y151 HydrophobicContact CD2-CG 4.16Å; L147-Y151 HydrophobicContact CG-CD1 4.24Å; L147-Y151 HydrophobicContact CG-CE1 4.41Å; L147-L154 HydrophobicContact CB-CD2 4.24Å; L147-L154 HydrophobicContact CD1-CD2 4.36Å; L147-I271 HydrophobicContact CD1-CG2 3.48Å; L147-I271 VanDerWaalsContact CD1-CG2 3.48Å; L147-I271 HydrophobicContact CG-CG2 4.04Å; L147-D272 PolarHBondContact N-O 3.34Å; L147-A273 HydrophobicContact CB-CB 4.18Å; L147-A273 WeakPolarHBondContact O-CA 3.11Å; L147-N274 PolarHBondContact O-N 2.78Å
148	D	88.7	Confident	88.3	Confident	51 Å²	51	56.7 Å²	56.7	27%	0.273	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-99.7	171.2	172.4	52	52.9	0	0	0	111.1	R145 E150 Y151	R145-D148 IonicContact CZ-OD2 3.5Å; R145-D148 IonicContact NH1-OD2 3.29Å; R145-D148 IonicContact NH2-OD2 2.76Å; R145-D148 PolarHBondContact NH2-OD2 2.84Å; D148-E150 PolarHBondContact O-N 3.27Å; D148-E150 PolarHBondContact OD1-N 2.67Å; D148-Y151 PolarHBondContact OD1-N 2.69Å
149	S	84.2	Confident	88.3	Confident	48 Å²	48	51.8 Å²	51.8	34%	0.336	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-10	179.4	47.1	0	0	0	0	114.3	Q155	S149-Q155 PolarHBondContact O-NE2 2.94Å
150	E	84.5	Confident	88.5	Confident	156 Å²	156	50.2 Å²	50.2	73%	0.729	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.6	179.6	-67.2	-177.1	-175.2	0	0	112.3	D148 P152	D148-E150 PolarHBondContact O-N 3.27Å; D148-E150 PolarHBondContact OD1-N 2.67Å; E150-P152 WeakPolarHBondContact O-CD 3.37Å; E150-P152 VanDerWaalsContact O-N 3.16Å
151	Y	89	Confident	88.7	Confident	21 Å²	21	49.6 Å²	49.6	8%	0.082	28%	0.28	C	S	.	.			trans	-60.1	111.2	-177.6	-169.7	-120.6	0	0	0	113.3	L136 S139 S140 L143 L147 D148 P153 L154 Q155	L136-Y151 HydrophobicContact CD1-CD1 4.3Å; L136-Y151 HydrophobicContact CD1-CE1 4.04Å; S139-Y151 WeakPolarHBondContact CB-OH 3.24Å; S139-Y151 PolarHBondContact O-OH 2.8Å; S139-Y151 PolarHBondContact OG-OH 3.46Å; S140-Y151 PolarHBondContact N-OH 3.39Å; L143-Y151 HydrophobicContact CD2-CD2 4.15Å; L143-Y151 HydrophobicContact CD2-CE2 3.61Å; L147-Y151 HydrophobicContact CD1-CD1 3.78Å; L147-Y151 HydrophobicContact CD1-CE1 3.9Å; L147-Y151 HydrophobicContact CD2-CD1 3.72Å; L147-Y151 HydrophobicContact CD2-CE1 3.64Å; L147-Y151 HydrophobicContact CD2-CG 4.16Å; L147-Y151 HydrophobicContact CG-CD1 4.24Å; L147-Y151 HydrophobicContact CG-CE1 4.41Å; D148-Y151 PolarHBondContact OD1-N 2.69Å; Y151-P153 HydrophobicContact CD1-CB 4.21Å; Y151-P153 HydrophobicContact CD1-CG 4.24Å; Y151-P153 HydrophobicContact CE1-CB 3.83Å; Y151-P153 HydrophobicContact CE1-CG 3.78Å; Y151-P153 HydrophobicContact CE2-CG 4.33Å; Y151-L154 HydrophobicContact CD1-CB 3.93Å; Y151-L154 WeakPolarHBondContact O-CB 3.28Å; Y151-L154 PolarHBondContact O-N 3.15Å; Y151-Q155 PolarHBondContact O-N 3.28Å
152	P	88	Confident	88.9	Confident	81 Å²	81	44.7 Å²	44.7	53%	0.526	25%	0.254	S	S	.	.	H	α-helix	trans	-60.6	-38.6	-168.9	-25.6	34.9	0	0	0	115.7	E150 L154 Q155 Q156	E150-P152 WeakPolarHBondContact O-CD 3.37Å; E150-P152 VanDerWaalsContact O-N 3.16Å; P152-L154 PolarHBondContact O-N 2.91Å; P152-Q155 PolarHBondContact O-N 2.83Å; P152-Q156 VanDerWaalsContact O-CB 3.28Å; P152-Q156 WeakPolarHBondContact O-CB 3.39Å; P152-Q156 PolarHBondContact O-N 3.49Å
153	P	90.3	Very high	89.2	Confident	20 Å²	20	43.4 Å²	43.4	13%	0.13	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-28.7	174.3	-25.5	35.8	0	0	0	113.9	L136 Y151 F157	L136-P153 HydrophobicContact CD1-CB 4.14Å; Y151-P153 HydrophobicContact CD1-CB 4.21Å; Y151-P153 HydrophobicContact CD1-CG 4.24Å; Y151-P153 HydrophobicContact CE1-CB 3.83Å; Y151-P153 HydrophobicContact CE1-CG 3.78Å; Y151-P153 HydrophobicContact CE2-CG 4.33Å; P153-F157 WeakPolarHBondContact O-CB 3.29Å; P153-F157 PolarHBondContact O-N 2.7Å; P153-F157 VanDerWaalsContact O-N 3.14Å
154	L	91.1	Very high	89.5	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-80.5	-41.2	178.5	178.1	61	0	0	0	111.7	L136 L147 Y151 P152 Q156 F157 F158 L224 L275	L136-L154 HydrophobicContact CD1-CB 3.99Å; L136-L154 HydrophobicContact CD1-CD1 4.36Å; L136-L154 HydrophobicContact CD2-CD1 3.93Å; L147-L154 HydrophobicContact CB-CD2 4.24Å; L147-L154 HydrophobicContact CD1-CD2 4.36Å; Y151-L154 HydrophobicContact CD1-CB 3.93Å; Y151-L154 WeakPolarHBondContact O-CB 3.28Å; Y151-L154 PolarHBondContact O-N 3.15Å; P152-L154 PolarHBondContact O-N 2.91Å; L154-Q156 VanDerWaalsContact C-N 3.34Å; L154-F157 HydrophobicContact CD1-CD1 4.14Å; L154-F157 WeakPolarHBondContact O-CB 3.03Å; L154-F157 PolarHBondContact O-N 3.24Å; L154-F158 HydrophobicContact CD1-CD2 3.98Å; L154-F158 HydrophobicContact CD1-CE2 3.57Å; L154-F158 HydrophobicContact CD1-CZ 4.21Å; L154-F158 HydrophobicContact CD2-CE2 4.27Å; L154-F158 HydrophobicContact CG-CD2 4.05Å; L154-F158 HydrophobicContact CG-CE2 3.8Å; L154-F158 WeakPolarHBondContact O-CD2 3.39Å; L154-F158 PolarHBondContact O-N 3.37Å; L154-L224 HydrophobicContact CD1-CD2 3.46Å; L154-L224 VanDerWaalsContact CD1-CD2 3.46Å; L154-L275 HydrophobicContact CD2-CD1 4.24Å; L154-L275 HydrophobicContact CD2-CD2 3.69Å
155	Q	89.3	Confident	90.1	Very high	67 Å²	67	36.8 Å²	36.8	31%	0.313	19%	0.186	S	C	.	.	H	α-helix	trans	-59.1	-47.4	171.3	-63.6	-176.9	-11	0	0	110.8	S149 Y151 P152 F157 F158 L159	S149-Q155 PolarHBondContact O-NE2 2.94Å; Y151-Q155 PolarHBondContact O-N 3.28Å; P152-Q155 PolarHBondContact O-N 2.83Å; Q155-F157 VanDerWaalsContact C-N 3.26Å; Q155-F157 PolarHBondContact O-N 3.21Å; Q155-F158 PolarHBondContact O-N 2.06Å; Q155-L159 WeakPolarHBondContact O-CG 3.44Å; Q155-L159 PolarHBondContact O-N 3.26Å
156	Q	89	Confident	90.3	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.056	17%	0.174	C	C	.	.	H	α-helix	trans	-60	-34.2	176.6	-175.5	55.4	78	0	0	112.5	P152 L154 V160	P152-Q156 VanDerWaalsContact O-CB 3.28Å; P152-Q156 WeakPolarHBondContact O-CB 3.39Å; P152-Q156 PolarHBondContact O-N 3.49Å; L154-Q156 VanDerWaalsContact C-N 3.34Å; Q156-V160 VanDerWaalsContact O-CG2 3.31Å; Q156-V160 WeakPolarHBondContact O-CG2 3.33Å; Q156-V160 PolarHBondContact O-N 2.83Å; Q156-V160 VanDerWaalsContact O-N 3.13Å
157	F	93.9	Very high	90.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-50.6	172.5	164.7	-100.6	0	0	0	112.8	M129 S132 I133 L136 P153 L154 Q155 L159 V160 L161 L265 L268	M129-F157 HydrophobicContact CE-CE2 4.37Å; M129-F157 HydrophobicContact SD-CD2 4.24Å; M129-F157 HydrophobicContact SD-CE2 3.9Å; S132-F157 WeakPolarHBondContact OG-CA 3.42Å; S132-F157 PolarHBondContact OG-N 3.32Å; I133-F157 HydrophobicContact CD1-CE2 4.41Å; I133-F157 HydrophobicContact CG1-CD2 4.02Å; I133-F157 HydrophobicContact CG1-CE2 3.85Å; L136-F157 HydrophobicContact CD2-CB 3.67Å; L136-F157 HydrophobicContact CD2-CD1 3.94Å; L136-F157 HydrophobicContact CD2-CD2 4.34Å; L136-F157 HydrophobicContact CD2-CG 3.69Å; P153-F157 WeakPolarHBondContact O-CB 3.29Å; P153-F157 PolarHBondContact O-N 2.7Å; P153-F157 VanDerWaalsContact O-N 3.14Å; L154-F157 HydrophobicContact CD1-CD1 4.14Å; L154-F157 WeakPolarHBondContact O-CB 3.03Å; L154-F157 PolarHBondContact O-N 3.24Å; Q155-F157 VanDerWaalsContact C-N 3.26Å; Q155-F157 PolarHBondContact O-N 3.21Å; F157-L159 VanDerWaalsContact C-N 3.28Å; F157-L159 PolarHBondContact O-N 3.08Å; F157-V160 PolarHBondContact O-N 2.99Å; F157-L161 HydrophobicContact CE1-CD2 4.13Å; F157-L161 HydrophobicContact CZ-CB 4.44Å; F157-L161 HydrophobicContact CZ-CD2 3.8Å; F157-L161 WeakPolarHBondContact O-CB 3.2Å; F157-L161 PolarHBondContact O-N 3.2Å; F157-L265 HydrophobicContact CE2-CD2 3.77Å; F157-L265 HydrophobicContact CZ-CD2 3.7Å; F157-L268 HydrophobicContact CE1-CD1 3.91Å; F157-L268 HydrophobicContact CE2-CD1 3.69Å; F157-L268 HydrophobicContact CZ-CD1 3.26Å
158	F	92.8	Very high	90.5	Very high	16 Å²	16	31.3 Å²	31.3	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-37.1	178.5	-76.9	-57.2	0	0	0	112.1	L154 Q155 L161 E162 L220 H221 L224 L275	L154-F158 HydrophobicContact CD1-CD2 3.98Å; L154-F158 HydrophobicContact CD1-CE2 3.57Å; L154-F158 HydrophobicContact CD1-CZ 4.21Å; L154-F158 HydrophobicContact CD2-CE2 4.27Å; L154-F158 HydrophobicContact CG-CD2 4.05Å; L154-F158 HydrophobicContact CG-CE2 3.8Å; L154-F158 WeakPolarHBondContact O-CD2 3.39Å; L154-F158 PolarHBondContact O-N 3.37Å; Q155-F158 PolarHBondContact O-N 2.06Å; F158-L161 PolarHBondContact O-N 2.92Å; F158-E162 WeakPolarHBondContact O-CB 3.39Å; F158-E162 PolarHBondContact O-N 2.87Å; F158-L220 HydrophobicContact CD1-CB 4.18Å; F158-L220 HydrophobicContact CE1-CB 3.98Å; F158-L220 WeakPolarHBondContact CE1-O 3.36Å; F158-H221 AromaticContact CD2-CE1 3.52Å; F158-H221 AromaticContact CD2-NE2 3.65Å; F158-H221 AromaticContact CE2-CD2 3.8Å; F158-H221 AromaticContact CE2-CE1 3.69Å; F158-H221 AromaticContact CE2-CG 3.93Å; F158-H221 AromaticContact CE2-ND1 3.87Å; F158-H221 AromaticContact CE2-NE2 3.64Å; F158-H221 AromaticContact CG-CE1 3.8Å; F158-H221 HydrophobicContact CZ-CB 4.43Å; F158-H221 AromaticContact CZ-CG 3.94Å; F158-H221 AromaticContact CZ-ND1 3.87Å; F158-L224 HydrophobicContact CE1-CB 4.49Å; F158-L224 HydrophobicContact CE1-CD2 4.39Å; F158-L224 HydrophobicContact CE2-CD2 4.05Å; F158-L224 HydrophobicContact CZ-CB 3.99Å; F158-L224 HydrophobicContact CZ-CD2 3.54Å; F158-L224 HydrophobicContact CZ-CG 4.41Å; F158-L275 HydrophobicContact CE2-CD1 4.05Å; F158-L275 HydrophobicContact CZ-CD1 4.26Å
159	L	91.1	Very high	90.6	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.068	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-45.9	173.1	-71.3	176.8	0	0	0	112.3	Q155 F157 E162 H163 A287	Q155-L159 WeakPolarHBondContact O-CG 3.44Å; Q155-L159 PolarHBondContact O-N 3.26Å; F157-L159 VanDerWaalsContact C-N 3.28Å; F157-L159 PolarHBondContact O-N 3.08Å; L159-E162 PolarHBondContact O-N 2.84Å; L159-H163 PolarHBondContact O-N 2.82Å; L159-H163 VanDerWaalsContact O-N 3.15Å; L159-H163 PolarHBondContact O-ND1 2.8Å; L159-A287 HydrophobicContact CD2-CB 3.74Å
160	V	92.1	Very high	90.8	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-68.8	-36.1	178.8	172.8	0	0	0	0	111.4	M128 M129 Q156 F157 H163 C164 I289	M128-V160 HydrophobicContact CB-CG1 4Å; M128-V160 HydrophobicContact CB-CG2 4.46Å; M129-V160 HydrophobicContact CB-CG1 4.06Å; M129-V160 HydrophobicContact CE-CG1 4.11Å; M129-V160 HydrophobicContact SD-CG1 4.5Å; Q156-V160 VanDerWaalsContact O-CG2 3.31Å; Q156-V160 WeakPolarHBondContact O-CG2 3.33Å; Q156-V160 PolarHBondContact O-N 2.83Å; Q156-V160 VanDerWaalsContact O-N 3.13Å; F157-V160 PolarHBondContact O-N 2.99Å; V160-H163 PolarHBondContact O-N 2.84Å; V160-C164 PolarHBondContact O-N 2.71Å; V160-C164 PolarHBondContact O-SG 3.4Å; V160-I289 HydrophobicContact CG2-CD1 4.29Å
161	L	93.7	Very high	90.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-43.2	173.4	-173.9	59.9	0	0	0	112.1	M129 F157 F158 H163 C164 L165 L220 V229 L233 M261 L265	M129-L161 VanDerWaalsContact CE-CA 3.45Å; M129-L161 HydrophobicContact CE-CB 3.79Å; M129-L161 HydrophobicContact CE-CD1 3.61Å; M129-L161 HydrophobicContact CE-CG 4.31Å; F157-L161 HydrophobicContact CE1-CD2 4.13Å; F157-L161 HydrophobicContact CZ-CB 4.44Å; F157-L161 HydrophobicContact CZ-CD2 3.8Å; F157-L161 WeakPolarHBondContact O-CB 3.2Å; F157-L161 PolarHBondContact O-N 3.2Å; F158-L161 PolarHBondContact O-N 2.92Å; L161-H163 VanDerWaalsContact C-N 3.3Å; L161-H163 PolarHBondContact O-N 3.21Å; L161-C164 PolarHBondContact O-N 3.21Å; L161-L165 HydrophobicContact CD1-CD1 4.38Å; L161-L165 HydrophobicContact CD1-CG 4.43Å; L161-L165 HydrophobicContact CG-CD1 4.06Å; L161-L165 WeakPolarHBondContact O-CG 3.17Å; L161-L165 PolarHBondContact O-N 3.09Å; L161-L220 HydrophobicContact CD2-CD1 4.38Å; L161-L220 HydrophobicContact CD2-CD2 3.86Å; L161-V229 HydrophobicContact CD2-CG1 4.3Å; L161-L233 HydrophobicContact CD1-CD1 3.99Å; L161-L233 HydrophobicContact CD2-CD1 4.41Å; L161-M261 HydrophobicContact CD1-SD 4.07Å; L161-L265 HydrophobicContact CD1-CD2 4.5Å
162	E	92.6	Very high	88.9	Confident	7 Å²	7	28.8 Å²	28.8	3%	0.033	15%	0.151	C	C	.	.	H	α-helix	trans	-59	-41	175.6	-169.8	-171.4	121.2	0	0	111.7	F158 L159 L165 K166 I182 L213 R217	F158-E162 WeakPolarHBondContact O-CB 3.39Å; F158-E162 PolarHBondContact O-N 2.87Å; L159-E162 PolarHBondContact O-N 2.84Å; E162-L165 PolarHBondContact O-N 2.74Å; E162-K166 HydrophobicContact CG-CD 4.12Å; E162-K166 WeakPolarHBondContact O-CB 3.16Å; E162-K166 VanDerWaalsContact O-CG 3.29Å; E162-K166 WeakPolarHBondContact O-CG 3.32Å; E162-K166 PolarHBondContact O-N 3.32Å; E162-K166 WeakPolarHBondContact OE1-CE 3.27Å; E162-K166 IonicContact OE1-NZ 2.71Å; E162-K166 PolarHBondContact OE1-NZ 2.8Å; E162-I182 HydrophobicContact CG-CD1 4.07Å; E162-L213 HydrophobicContact CG-CD1 4.17Å; E162-R217 IonicContact OE1-NH2 2.58Å; E162-R217 PolarHBondContact OE1-NH2 2.92Å; E162-R217 IonicContact OE2-CZ 3.9Å; E162-R217 VanDerWaalsContact OE2-CZ 3.23Å; E162-R217 IonicContact OE2-NE 3.92Å; E162-R217 PolarHBondContact OE2-NE 2.87Å; E162-R217 IonicContact OE2-NH2 2.69Å; E162-R217 PolarHBondContact OE2-NH2 3.44Å
163	H	91.1	Very high	87.1	Confident	69 Å²	69	34.5 Å²	34.5	32%	0.319	17%	0.168	S	C	.	.	H	α-helix	trans	-67.6	-41.2	175.5	-73.3	83.4	0	0	0	112.4	L125 L159 V160 L161 L165 K166 H167	L125-H163 HydrophobicContact CD2-CB 3.74Å; L159-H163 PolarHBondContact O-N 2.82Å; L159-H163 VanDerWaalsContact O-N 3.15Å; L159-H163 PolarHBondContact O-ND1 2.8Å; V160-H163 PolarHBondContact O-N 2.84Å; L161-H163 VanDerWaalsContact C-N 3.3Å; L161-H163 PolarHBondContact O-N 3.21Å; H163-L165 VanDerWaalsContact C-N 3.3Å; H163-L165 PolarHBondContact O-N 3.1Å; H163-K166 PolarHBondContact O-N 3.28Å; H163-H167 PolarHBondContact O-N 3.05Å
164	C	93.3	Very high	85.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-39	174.8	-64.7	0	0	0	0	112	M129 V160 L161 L252 M261	M129-C164 HydrophobicContact CE-CB 4.39Å; V160-C164 PolarHBondContact O-N 2.71Å; V160-C164 PolarHBondContact O-SG 3.4Å; L161-C164 PolarHBondContact O-N 3.21Å; C164-L252 HydrophobicContact CB-CD1 4.13Å; C164-L252 HydrophobicContact CB-CD2 4.11Å; C164-M261 HydrophobicContact CB-CE 4.47Å; C164-M261 HydrophobicContact CB-SD 3.65Å
165	L	93.1	Very high	83.4	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-75.2	-24.1	175.6	-66.8	170.6	0	0	0	113.2	L161 E162 H163 I182 L220 L233 Y247 M253	L161-L165 HydrophobicContact CD1-CD1 4.38Å; L161-L165 HydrophobicContact CD1-CG 4.43Å; L161-L165 HydrophobicContact CG-CD1 4.06Å; L161-L165 WeakPolarHBondContact O-CG 3.17Å; L161-L165 PolarHBondContact O-N 3.09Å; E162-L165 PolarHBondContact O-N 2.74Å; H163-L165 VanDerWaalsContact C-N 3.3Å; H163-L165 PolarHBondContact O-N 3.1Å; L165-I182 HydrophobicContact CB-CB 4.41Å; L165-I182 HydrophobicContact CB-CD1 4.23Å; L165-I182 HydrophobicContact CB-CG2 3.93Å; L165-I182 HydrophobicContact CD1-CD1 4.19Å; L165-I182 VanDerWaalsContact O-CG2 3.3Å; L165-I182 WeakPolarHBondContact O-CG2 3.38Å; L165-L220 HydrophobicContact CD1-CD1 3.94Å; L165-L220 HydrophobicContact CD1-CD2 4.24Å; L165-L233 HydrophobicContact CD2-CD2 4.14Å; L165-Y247 VanDerWaalsContact O-CE1 3.31Å; L165-Y247 WeakPolarHBondContact O-CE1 3.48Å; L165-Y247 PolarHBondContact O-OH 3.16Å; L165-M253 HydrophobicContact CD2-CE 3.86Å; L165-M253 HydrophobicContact CD2-CG 4.45Å; L165-M253 HydrophobicContact CD2-SD 3.79Å
166	K	91.1	Very high	81.6	Confident	65 Å²	65	52.8 Å²	52.8	28%	0.283	26%	0.261	S	S	.	.	H	α-helix	trans	-84	-22.9	176.8	-80	175.3	173.2	177.2	0	113.8	E162 H163 G168 L169 I182	E162-K166 HydrophobicContact CG-CD 4.12Å; E162-K166 WeakPolarHBondContact O-CB 3.16Å; E162-K166 VanDerWaalsContact O-CG 3.29Å; E162-K166 WeakPolarHBondContact O-CG 3.32Å; E162-K166 PolarHBondContact O-N 3.32Å; E162-K166 WeakPolarHBondContact OE1-CE 3.27Å; E162-K166 IonicContact OE1-NZ 2.71Å; E162-K166 PolarHBondContact OE1-NZ 2.8Å; H163-K166 PolarHBondContact O-N 3.28Å; K166-G168 PolarHBondContact O-N 3.07Å; K166-L169 WeakPolarHBondContact O-CB 3.26Å; K166-L169 PolarHBondContact O-N 3.49Å; K166-L169 VanDerWaalsContact O-N 3.14Å; K166-I182 HydrophobicContact CB-CG2 4.48Å; K166-I182 HydrophobicContact CG-CG2 3.67Å
167	H	92.3	Very high	79.8	Confident	7 Å²	7	54 Å²	54	3%	0.032	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	119.4	-175.1	174.2	-67.6	0	0	0	112.3	M118 E121 R122 L125 H163 L169 G250 A251 L252	M118-H167 WeakPolarHBondContact CG-CE1 3.42Å; M118-H167 PolarHBondContact O-NE2 3.21Å; E121-H167 IonicContact OE1-CD2 3.74Å; E121-H167 PolarHBondContact OE1-CD2 3.4Å; R122-H167 VanDerWaalsContact CG-CE1 3.41Å; R122-H167 WeakPolarHBondContact CG-CE1 3.42Å; L125-H167 HydrophobicContact CD1-CB 3.59Å; L125-H167 WeakPolarHBondContact CD1-CD2 3.17Å; H163-H167 PolarHBondContact O-N 3.05Å; H167-L169 VanDerWaalsContact C-N 3.29Å; H167-L169 PolarHBondContact O-N 2.58Å; H167-G250 PolarHBondContact CE1-O 3.32Å; H167-A251 WeakPolarHBondContact O-CB 3.46Å; H167-L252 HydrophobicContact CB-CB 4.28Å; H167-L252 PolarHBondContact ND1-N 2.81Å; H167-L252 VanDerWaalsContact ND1-N 3.17Å
168	G	88.7	Confident	77.7	Confident	17 Å²	17	61.3 Å²	61.3	18%	0.175	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	18.4	-179.6	0	0	0	0	0	114.5	K166 Y247 D248	K166-G168 PolarHBondContact O-N 3.07Å; G168-Y247 WeakPolarHBondContact O-CA 3.47Å; G168-D248 PolarHBondContact O-N 3.41Å
169	L	90.8	Very high	75.9	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.031	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-74.2	124.5	176.2	-168.8	79.2	0	0	0	111.3	K166 H167 K180 I182 P185 F246 Y247	K166-L169 WeakPolarHBondContact O-CB 3.26Å; K166-L169 PolarHBondContact O-N 3.49Å; K166-L169 VanDerWaalsContact O-N 3.14Å; H167-L169 VanDerWaalsContact C-N 3.29Å; H167-L169 PolarHBondContact O-N 2.58Å; L169-K180 HydrophobicContact CD2-CB 4.25Å; L169-K180 PolarHBondContact O-NZ 2.72Å; L169-I182 HydrophobicContact CD2-CG2 4.03Å; L169-P185 HydrophobicContact CD1-CG 3.88Å; L169-F246 HydrophobicContact CD1-CB 4.26Å; L169-F246 WeakPolarHBondContact CD1-O 3.2Å; L169-Y247 HydrophobicContact CB-CD1 4.37Å; L169-Y247 HydrophobicContact CB-CE1 4.15Å; L169-Y247 HydrophobicContact CD1-CD1 4.08Å; L169-Y247 HydrophobicContact CD1-CD2 4.48Å; L169-Y247 HydrophobicContact CD1-CE1 3.63Å; L169-Y247 HydrophobicContact CD1-CE2 4.07Å; L169-Y247 HydrophobicContact CD1-CG 4.49Å
170	K	88.4	Confident	74.6	Confident	75 Å²	75	70.6 Å²	70.6	33%	0.326	36%	0.355	S	S	.	.			trans	-66.1	134.5	179.6	-73.5	167.4	169.8	156.3	0	111.6	K172 S244 F246 Y247 D248	K170-K172 PolarHBondContact O-N 3.21Å; K170-K172 VanDerWaalsContact O-N 3.16Å; K170-S244 PolarHBondContact NZ-O 2.91Å; K170-F246 WeakPolarHBondContact CB-O 3.43Å; K170-F246 PolarHBondContact N-O 3.13Å; K170-Y247 VanDerWaalsContact CE-C 3.5Å; K170-Y247 WeakPolarHBondContact CE-O 3.34Å; K170-Y247 PolarHBondContact NZ-O 3.45Å; K170-D248 WeakPolarHBondContact CE-OD1 3.35Å; K170-D248 VanDerWaalsContact CG-OD1 3.3Å; K170-D248 WeakPolarHBondContact CG-OD1 3.45Å
171	A	71.6	Confident	74	Confident	38 Å²	38	71.7 Å²	71.7	31%	0.314	36%	0.363	S	S	.	.			trans	-79.7	94.1	172.8	0	0	0	0	0	110.8	K173 K180	A171-K173 PolarHBondContact O-N 3.36Å; A171-K180 HydrophobicContact CB-CG 4.26Å
172	K	61.9	Low	73.7	Confident	104 Å²	104	71.7 Å²	71.7	45%	0.452	36%	0.363	S	S	.	.			trans	-60.8	124.8	168.7	-81.3	-175.8	172.5	176.4	0	109.7	K170 S174 E245	K170-K172 PolarHBondContact O-N 3.21Å; K170-K172 VanDerWaalsContact O-N 3.16Å; K172-S174 PolarHBondContact O-N 2.81Å; K172-E245 WeakPolarHBondContact CE-OE1 3.22Å; K172-E245 IonicContact NZ-OE1 2.92Å; K172-E245 PolarHBondContact NZ-OE1 2.65Å
173	K	51.8	Low	73.7	Confident	201 Å²	201	72.3 Å²	72.3	87%	0.874	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	103.4	176.5	-67.4	-178.4	-179.6	178.8	0	109.5	A171	A171-K173 PolarHBondContact O-N 3.36Å
174	S	51.5	Low	73.5	Confident	79 Å²	79	69.9 Å²	69.9	55%	0.552	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	150.6	165.1	-175.6	0	0	0	0	110.3	K172 I176 G177	K172-S174 PolarHBondContact O-N 2.81Å; S174-I176 PolarHBondContact O-N 3.26Å; S174-I176 VanDerWaalsContact O-N 3.09Å; S174-G177 WeakPolarHBondContact CB-O 2.98Å; S174-G177 PolarHBondContact N-O 3.24Å; S174-G177 PolarHBondContact O-N 2.86Å; S174-G177 VanDerWaalsContact O-N 3.08Å
175	F	51.6	Low	73.3	Confident	222 Å²	222	70 Å²	70	97%	0.974	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.6	178.5	-118.3	-91	0	0	0	113.6
176	I	51.8	Low	73.2	Confident	172 Å²	172	70 Å²	70	88%	0.882	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	12.3	-179	-64.5	171.9	0	0	0	111.3	S174	S174-I176 PolarHBondContact O-N 3.26Å; S174-I176 VanDerWaalsContact O-N 3.09Å
177	G	50.2	Low	73.1	Confident	38 Å²	38	69.7 Å²	69.7	39%	0.392	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.3	176.2	168.4	0	0	0	0	0	115.5	S174	S174-G177 WeakPolarHBondContact CB-O 2.98Å; S174-G177 PolarHBondContact N-O 3.24Å; S174-G177 PolarHBondContact O-N 2.86Å; S174-G177 VanDerWaalsContact O-N 3.08Å
178	Q	50.3	Low	72.9	Confident	153 Å²	153	70.2 Å²	70.2	72%	0.715	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	103.9	175.1	-63.9	-175.3	16.2	0	0	110.2
179	N	54.8	Low	72.9	Confident	104 Å²	104	69.4 Å²	69.4	56%	0.556	35%	0.354	S	S	*	.			trans	-107.5	103.8	174.7	-165.5	-28.2	0	0	0	110.7	S181	N179-S181 PolarHBondContact O-N 3.22Å; N179-S181 PolarHBondContact OD1-N 2.84Å
180	K	63.5	Low	72.8	Confident	120 Å²	120	71.5 Å²	71.5	52%	0.522	36%	0.364	S	S	.	.			trans	-78.1	68.8	172.4	-72.3	-165.5	176.2	-160.4	0	110.8	L169 A171	L169-K180 HydrophobicContact CD2-CB 4.25Å; L169-K180 PolarHBondContact O-NZ 2.72Å; A171-K180 HydrophobicContact CB-CG 4.26Å
181	S	79.7	Confident	72.6	Confident	26 Å²	26	75.5 Å²	75.5	18%	0.182	38%	0.381	C	S	.	.			trans	-91.6	122.9	179.5	-176.2	0	0	0	0	112.3	N179 W183 G212	N179-S181 PolarHBondContact O-N 3.22Å; N179-S181 PolarHBondContact OD1-N 2.84Å; S181-W183 PolarHBondContact O-N 3.4Å; S181-W183 VanDerWaalsContact OG-CB 3.3Å; S181-W183 WeakPolarHBondContact OG-CB 3Å; S181-W183 PolarHBondContact OG-N 2.79Å; S181-G212 VanDerWaalsContact OG-C 3.25Å; S181-G212 PolarHBondContact OG-O 2.88Å
182	I	88.5	Confident	73.3	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-3	170.6	53.5	161.8	0	0	0	113.5	E162 L165 K166 L169 G184 P185 L186 L213 A216	E162-I182 HydrophobicContact CG-CD1 4.07Å; L165-I182 HydrophobicContact CB-CB 4.41Å; L165-I182 HydrophobicContact CB-CD1 4.23Å; L165-I182 HydrophobicContact CB-CG2 3.93Å; L165-I182 HydrophobicContact CD1-CD1 4.19Å; L165-I182 VanDerWaalsContact O-CG2 3.3Å; L165-I182 WeakPolarHBondContact O-CG2 3.38Å; K166-I182 HydrophobicContact CB-CG2 4.48Å; K166-I182 HydrophobicContact CG-CG2 3.67Å; L169-I182 HydrophobicContact CD2-CG2 4.03Å; I182-G184 VanDerWaalsContact C-N 3.34Å; I182-G184 PolarHBondContact O-N 3.31Å; I182-P185 WeakPolarHBondContact O-CD 3.2Å; I182-L186 WeakPolarHBondContact O-CG 3.27Å; I182-L186 PolarHBondContact O-N 3.48Å; I182-L213 HydrophobicContact CD1-CD1 4.18Å; I182-L213 HydrophobicContact CG1-CD1 3.97Å; I182-A216 HydrophobicContact CD1-CB 3.84Å; I182-A216 HydrophobicContact CG1-CB 3.62Å
183	W	90.9	Very high	74.6	Confident	19 Å²	19	72 Å²	72	7%	0.072	36%	0.363	C	S	.	.	H	α-helix	trans	-58.8	-41.7	172.2	-176.1	-107.1	0	0	0	112.9	S181 L186 E187 A203 R215 A216 W219	S181-W183 PolarHBondContact O-N 3.4Å; S181-W183 VanDerWaalsContact OG-CB 3.3Å; S181-W183 WeakPolarHBondContact OG-CB 3Å; S181-W183 PolarHBondContact OG-N 2.79Å; W183-L186 CarbonylContact O-C 3.5Å; W183-L186 PolarHBondContact O-N 3.02Å; W183-E187 PolarHBondContact NE1-OE1 3.03Å; W183-E187 PolarHBondContact NE1-OE2 2.87Å; W183-E187 WeakPolarHBondContact O-CB 3.31Å; W183-E187 PolarHBondContact O-N 2.73Å; W183-A203 HydrophobicContact CH2-CB 4.09Å; W183-A203 HydrophobicContact CZ3-CB 4.14Å; W183-R215 HydrophobicContact CD2-CB 3.95Å; W183-R215 HydrophobicContact CE3-CB 3.56Å; W183-R215 HydrophobicContact CH2-CB 4.33Å; W183-R215 HydrophobicContact CZ3-CB 3.76Å; W183-R215 WeakPolarHBondContact CZ3-O 3.44Å; W183-A216 HydrophobicContact CE3-CB 4.32Å; W183-W219 HydrophobicContact CZ3-CB 3.89Å; W183-W219 HydrophobicContact CZ3-CG 4.25Å
184	G	88.1	Confident	76.1	Confident	19 Å²	19	67.4 Å²	67.4	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-56.2	-50.1	-175.7	0	0	0	0	0	113.7	I182	I182-G184 VanDerWaalsContact C-N 3.34Å; I182-G184 PolarHBondContact O-N 3.31Å
185	P	89.5	Confident	77.6	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.013	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-38.8	170.2	-28.7	35.9	0	0	0	114.8	L169 I182 L188 L236 L243 F246 Y247	L169-P185 HydrophobicContact CD1-CG 3.88Å; I182-P185 WeakPolarHBondContact O-CD 3.2Å; P185-L188 WeakPolarHBondContact O-CB 3.47Å; P185-L188 PolarHBondContact O-N 2.99Å; P185-L236 WeakPolarHBondContact O-CD1 3.47Å; P185-L236 WeakPolarHBondContact O-CD2 3.36Å; P185-L243 HydrophobicContact CB-CD2 4.29Å; P185-F246 HydrophobicContact CG-CB 3.83Å; P185-F246 HydrophobicContact CG-CD1 4.04Å; P185-F246 HydrophobicContact CG-CG 3.97Å; P185-Y247 HydrophobicContact CB-CE2 3.93Å; P185-Y247 HydrophobicContact CG-CE2 3.57Å
186	L	90.6	Very high	79.3	Confident	2 Å²	2	59 Å²	59	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-74.7	-30.4	-178.2	-62	177.1	0	0	0	112.7	I182 W183 L188 V189 A216 W219 L220 L233 L236	I182-L186 WeakPolarHBondContact O-CG 3.27Å; I182-L186 PolarHBondContact O-N 3.48Å; W183-L186 CarbonylContact O-C 3.5Å; W183-L186 PolarHBondContact O-N 3.02Å; L186-L188 PolarHBondContact O-N 3.08Å; L186-V189 VanDerWaalsContact O-CB 3.3Å; L186-V189 WeakPolarHBondContact O-CB 3.44Å; L186-V189 VanDerWaalsContact O-CG2 3.31Å; L186-V189 WeakPolarHBondContact O-CG2 2.93Å; L186-V189 PolarHBondContact O-N 2.96Å; L186-A216 HydrophobicContact CD1-CB 3.79Å; L186-W219 HydrophobicContact CB-CE3 4.43Å; L186-W219 HydrophobicContact CD1-CE3 3.9Å; L186-W219 HydrophobicContact CD1-CZ3 4.36Å; L186-W219 HydrophobicContact CD2-CE3 4.08Å; L186-W219 HydrophobicContact CD2-CH2 4.19Å; L186-W219 HydrophobicContact CD2-CZ3 3.69Å; L186-W219 HydrophobicContact CG-CE3 4.36Å; L186-W219 HydrophobicContact CG-CZ3 4.44Å; L186-L220 HydrophobicContact CD1-CG 4.33Å; L186-L233 HydrophobicContact CD2-CD2 3.74Å; L186-L236 HydrophobicContact CD2-CD1 4.04Å
187	E	88.1	Confident	81	Confident	59 Å²	59	52.3 Å²	52.3	28%	0.276	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-10.6	173.4	-165.6	165.9	-115	0	0	112.6	W183 V189 R204	W183-E187 PolarHBondContact NE1-OE1 3.03Å; W183-E187 PolarHBondContact NE1-OE2 2.87Å; W183-E187 WeakPolarHBondContact O-CB 3.31Å; W183-E187 PolarHBondContact O-N 2.73Å; E187-V189 VanDerWaalsContact C-N 3.34Å; E187-R204 IonicContact OE1-CZ 3.45Å; E187-R204 IonicContact OE1-NE 2.62Å; E187-R204 IonicContact OE1-NH2 2.95Å; E187-R204 PolarHBondContact OE1-NH2 2.7Å
188	L	88.6	Confident	82.7	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.8	164.6	-60.8	177.9	0	0	0	112.5	P185 L186 E190 K191 L192 L236 L242 F246	P185-L188 WeakPolarHBondContact O-CB 3.47Å; P185-L188 PolarHBondContact O-N 2.99Å; L186-L188 PolarHBondContact O-N 3.08Å; L188-E190 VanDerWaalsContact C-N 3.32Å; L188-E190 PolarHBondContact O-N 3.06Å; L188-K191 PolarHBondContact O-N 3.35Å; L188-K191 VanDerWaalsContact O-N 3.08Å; L188-L192 HydrophobicContact CB-CD1 4.45Å; L188-L192 WeakPolarHBondContact O-CG 3.14Å; L188-L192 PolarHBondContact O-N 2.94Å; L188-L192 VanDerWaalsContact O-N 3.12Å; L188-L236 HydrophobicContact CB-CD2 3.78Å; L188-L242 HydrophobicContact CD1-CB 3.95Å; L188-F246 HydrophobicContact CD1-CD2 4.21Å; L188-F246 HydrophobicContact CD1-CE2 3.86Å; L188-F246 HydrophobicContact CD2-CE2 4.33Å; L188-F246 HydrophobicContact CG-CE2 4.29Å
189	V	89.4	Confident	84.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-39.7	178.4	-170.5	0	0	0	0	110.5	L186 E187 K191 L192 C193 S196 W219 Y232 L236	L186-V189 VanDerWaalsContact O-CB 3.3Å; L186-V189 WeakPolarHBondContact O-CB 3.44Å; L186-V189 VanDerWaalsContact O-CG2 3.31Å; L186-V189 WeakPolarHBondContact O-CG2 2.93Å; L186-V189 PolarHBondContact O-N 2.96Å; E187-V189 VanDerWaalsContact C-N 3.34Å; V189-K191 PolarHBondContact O-N 2.85Å; V189-L192 PolarHBondContact O-N 3.15Å; V189-C193 HydrophobicContact CG1-CB 4.02Å; V189-C193 PolarHBondContact O-N 2.84Å; V189-S196 WeakPolarHBondContact CG1-OG 3.13Å; V189-S196 PolarHBondContact O-OG 3.18Å; V189-W219 HydrophobicContact CB-CH2 4.47Å; V189-W219 HydrophobicContact CB-CZ2 3.9Å; V189-W219 HydrophobicContact CG1-CZ2 3.98Å; V189-W219 HydrophobicContact CG2-CH2 3.97Å; V189-W219 HydrophobicContact CG2-CZ2 3.88Å; V189-Y232 HydrophobicContact CG1-CD1 3.84Å; V189-Y232 HydrophobicContact CG1-CG 3.84Å; V189-L236 HydrophobicContact CG2-CD1 3.75Å; V189-L236 HydrophobicContact CG2-CD2 3.7Å; V189-L236 HydrophobicContact CG2-CG 3.66Å
190	E	87.8	Confident	86.2	Confident	50 Å²	50	44.3 Å²	44.3	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-53.4	-30	174.1	-174.5	175.8	-175.9	0	0	112.6	L188 S196 A197 A200 R204	L188-E190 VanDerWaalsContact C-N 3.32Å; L188-E190 PolarHBondContact O-N 3.06Å; E190-S196 PolarHBondContact N-OG 3.22Å; E190-A197 HydrophobicContact CG-CB 4.41Å; E190-A200 HydrophobicContact CB-CB 3.97Å; E190-A200 HydrophobicContact CG-CB 3.95Å; E190-R204 IonicContact OE1-CZ 3.8Å; E190-R204 IonicContact OE1-NH1 3.88Å; E190-R204 PolarHBondContact OE1-NH1 3.08Å; E190-R204 VanDerWaalsContact OE1-NH1 3.08Å; E190-R204 IonicContact OE1-NH2 2.67Å; E190-R204 IonicContact OE2-CZ 3.75Å; E190-R204 IonicContact OE2-NH1 2.7Å; E190-R204 PolarHBondContact OE2-NH1 2.89Å; E190-R204 IonicContact OE2-NH2 3.57Å; E190-R204 PolarHBondContact OE2-NH2 2.86Å
191	K	84.3	Confident	87.5	Confident	159 Å²	159	41.3 Å²	41.3	69%	0.691	22%	0.224	S	C	*	.	H	α-helix	trans	-92.5	-19.1	-179.9	-57.8	176.8	-173.8	172.6	0	113.9	L188 V189	L188-K191 PolarHBondContact O-N 3.35Å; L188-K191 VanDerWaalsContact O-N 3.08Å; V189-K191 PolarHBondContact O-N 2.85Å
192	L	87.4	Confident	88	Confident	45 Å²	45	43 Å²	43	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-103	-28.6	-177.2	-66	170.2	0	0	0	112.6	L188 V189 T235 L236 R239 L242	L188-L192 HydrophobicContact CB-CD1 4.45Å; L188-L192 WeakPolarHBondContact O-CG 3.14Å; L188-L192 PolarHBondContact O-N 2.94Å; L188-L192 VanDerWaalsContact O-N 3.12Å; V189-L192 PolarHBondContact O-N 3.15Å; L192-T235 HydrophobicContact CB-CG2 3.78Å; L192-T235 HydrophobicContact CD1-CG2 4.28Å; L192-L236 HydrophobicContact CD1-CD2 4.11Å; L192-R239 HydrophobicContact CD1-CB 4.32Å; L192-R239 HydrophobicContact CD1-CG 4.08Å; L192-R239 HydrophobicContact CD2-CG 4.21Å; L192-L242 HydrophobicContact CD1-CD1 4.36Å; L192-L242 HydrophobicContact CD2-CD1 4.14Å
193	C	88.1	Confident	87.9	Confident	22 Å²	22	43 Å²	43	15%	0.149	24%	0.237	C	C	.	.			trans	-132.6	92.1	-179.1	-67.2	0	0	0	0	109.5	V189 E195 S196 Y232	V189-C193 HydrophobicContact CG1-CB 4.02Å; V189-C193 PolarHBondContact O-N 2.84Å; C193-E195 PolarHBondContact O-N 2.91Å; C193-S196 PolarHBondContact O-N 3.18Å; C193-S196 PolarHBondContact O-OG 3.12Å; C193-Y232 HydrophobicContact CB-CD1 4.26Å; C193-Y232 HydrophobicContact CB-CE1 4.26Å
194	P	83.1	Confident	87.8	Confident	106 Å²	106	45.5 Å²	45.5	69%	0.688	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-54.8	-26.8	179.6	-28.6	36.6	0	0	0	114.4	S196 A197	P194-S196 PolarHBondContact O-N 3.16Å; P194-A197 VanDerWaalsContact O-CB 3.29Å; P194-A197 WeakPolarHBondContact O-CB 3.17Å; P194-A197 PolarHBondContact O-N 3.25Å; P194-A197 VanDerWaalsContact O-N 3.11Å
195	E	83.3	Confident	87.8	Confident	125 Å²	125	49.8 Å²	49.8	58%	0.584	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-54.7	-30.8	171.7	-62.6	-177.9	177.2	0	0	113.5	C193 A197 K228	C193-E195 PolarHBondContact O-N 2.91Å; E195-A197 VanDerWaalsContact C-N 3.35Å; E195-K228 IonicContact OE2-NZ 2.68Å
196	S	87.6	Confident	87.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-85.2	-3.7	-179.1	84.9	0	0	0	0	113.7	V189 E190 C193 P194 N198 I199 A200	V189-S196 WeakPolarHBondContact CG1-OG 3.13Å; V189-S196 PolarHBondContact O-OG 3.18Å; E190-S196 PolarHBondContact N-OG 3.22Å; C193-S196 PolarHBondContact O-N 3.18Å; C193-S196 PolarHBondContact O-OG 3.12Å; P194-S196 PolarHBondContact O-N 3.16Å; S196-N198 PolarHBondContact O-N 2.11Å; S196-I199 VanDerWaalsContact O-CG1 3.23Å; S196-I199 WeakPolarHBondContact O-CG1 3.2Å; S196-I199 PolarHBondContact O-N 3.01Å; S196-I199 VanDerWaalsContact O-N 3.17Å; S196-A200 WeakPolarHBondContact O-CB 3.22Å; S196-A200 PolarHBondContact O-N 3.2Å
197	A	86.7	Confident	87.3	Confident	30 Å²	30	57 Å²	57	25%	0.248	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-34.4	-178.5	0	0	0	0	0	112.1	E190 P194 E195 A200 T201	E190-A197 HydrophobicContact CG-CB 4.41Å; P194-A197 VanDerWaalsContact O-CB 3.29Å; P194-A197 WeakPolarHBondContact O-CB 3.17Å; P194-A197 PolarHBondContact O-N 3.25Å; P194-A197 VanDerWaalsContact O-N 3.11Å; E195-A197 VanDerWaalsContact C-N 3.35Å; A197-A200 PolarHBondContact O-N 3.42Å; A197-T201 WeakPolarHBondContact O-CB 2.92Å; A197-T201 PolarHBondContact O-N 3.44Å; A197-T201 PolarHBondContact O-OG1 3.32Å
198	N	87	Confident	87	Confident	118 Å²	118	55.7 Å²	55.7	63%	0.631	31%	0.311	S	S	*	.	H	α-helix	trans	-59.4	-50.3	174.3	-66.7	-22	0	0	0	111.5	S196 T201 S202	S196-N198 PolarHBondContact O-N 2.11Å; N198-T201 PolarHBondContact O-N 2.71Å; N198-S202 PolarHBondContact O-N 3.29Å; N198-S202 PolarHBondContact O-OG 3.16Å
199	I	90.3	Very high	86.8	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-75.6	-27	179.9	62.5	160.6	0	0	0	113.5	S196 A203 W219 L222 A223 Q226 Y232	S196-I199 VanDerWaalsContact O-CG1 3.23Å; S196-I199 WeakPolarHBondContact O-CG1 3.2Å; S196-I199 PolarHBondContact O-N 3.01Å; S196-I199 VanDerWaalsContact O-N 3.17Å; I199-A203 WeakPolarHBondContact O-CB 3.48Å; I199-A203 PolarHBondContact O-N 3.12Å; I199-W219 HydrophobicContact CD1-CD2 4.2Å; I199-W219 HydrophobicContact CD1-CG 4.35Å; I199-W219 HydrophobicContact CD1-CZ2 4.03Å; I199-L222 HydrophobicContact CB-CB 3.97Å; I199-L222 HydrophobicContact CB-CD1 4.03Å; I199-L222 HydrophobicContact CG2-CB 3.78Å; I199-L222 HydrophobicContact CG2-CD1 4.25Å; I199-A223 HydrophobicContact CD1-CB 3.91Å; I199-Q226 VanDerWaalsContact CG2-CD 3.48Å; I199-Q226 HydrophobicContact CG2-CG 4.41Å; I199-Y232 HydrophobicContact CD1-CD2 4.15Å; I199-Y232 HydrophobicContact CD1-CE2 3.58Å
200	A	88.3	Confident	86.5	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.008	35%	0.35	C	S	.	.	H	α-helix	trans	-63.4	-44	171	0	0	0	0	0	110.8	E190 S196 A197 R204	E190-A200 HydrophobicContact CB-CB 3.97Å; E190-A200 HydrophobicContact CG-CB 3.95Å; S196-A200 WeakPolarHBondContact O-CB 3.22Å; S196-A200 PolarHBondContact O-N 3.2Å; A197-A200 PolarHBondContact O-N 3.42Å; A200-R204 VanDerWaalsContact O-CB 3.24Å; A200-R204 WeakPolarHBondContact O-CB 3.12Å; A200-R204 PolarHBondContact O-N 2.73Å; A200-R204 VanDerWaalsContact O-N 3.08Å
201	T	89.9	Confident	86.4	Confident	58 Å²	58	66.1 Å²	66.1	36%	0.356	35%	0.354	S	S	.	.	H	α-helix	trans	-66.2	-51.9	174.8	-53.2	0	0	0	0	110.9	A197 N198 A203 R204 D205	A197-T201 WeakPolarHBondContact O-CB 2.92Å; A197-T201 PolarHBondContact O-N 3.44Å; A197-T201 PolarHBondContact O-OG1 3.32Å; N198-T201 PolarHBondContact O-N 2.71Å; T201-A203 VanDerWaalsContact C-N 3.27Å; T201-A203 PolarHBondContact O-N 2.91Å; T201-R204 WeakPolarHBondContact O-CB 3.22Å; T201-R204 PolarHBondContact O-N 3.02Å; T201-D205 VanDerWaalsContact CG2-OD2 3.28Å; T201-D205 WeakPolarHBondContact CG2-OD2 3.26Å; T201-D205 PolarHBondContact O-N 3.27Å
202	S	89.8	Confident	86.4	Confident	62 Å²	62	59.4 Å²	59.4	43%	0.434	33%	0.329	S	S	.	.	H	α-helix	trans	-58.3	-33.7	178.3	-59.7	0	0	0	0	113.8	N198 L206	N198-S202 PolarHBondContact O-N 3.29Å; N198-S202 PolarHBondContact O-OG 3.16Å; S202-L206 WeakPolarHBondContact O-CB 3.42Å; S202-L206 PolarHBondContact O-N 3.33Å
203	A	88.1	Confident	86.4	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-80.4	-22.7	175.5	0	0	0	0	0	113.9	W183 I199 T201 R215 A218 W219 L222	W183-A203 HydrophobicContact CH2-CB 4.09Å; W183-A203 HydrophobicContact CZ3-CB 4.14Å; I199-A203 WeakPolarHBondContact O-CB 3.48Å; I199-A203 PolarHBondContact O-N 3.12Å; T201-A203 VanDerWaalsContact C-N 3.27Å; T201-A203 PolarHBondContact O-N 2.91Å; A203-R215 WeakPolarHBondContact O-CG 3.46Å; A203-A218 HydrophobicContact CB-CB 4.11Å; A203-W219 HydrophobicContact CB-CB 3.77Å; A203-L222 HydrophobicContact CB-CD1 4.33Å
204	R	88.3	Confident	86.5	Confident	71 Å²	71	57.8 Å²	57.8	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-77.7	-38.2	176.2	-178.3	-178.3	-71.4	132.8	0.1	111.6	E187 E190 A200 T201	E187-R204 IonicContact OE1-CZ 3.45Å; E187-R204 IonicContact OE1-NE 2.62Å; E187-R204 IonicContact OE1-NH2 2.95Å; E187-R204 PolarHBondContact OE1-NH2 2.7Å; E190-R204 IonicContact OE1-CZ 3.8Å; E190-R204 IonicContact OE1-NH1 3.88Å; E190-R204 PolarHBondContact OE1-NH1 3.08Å; E190-R204 VanDerWaalsContact OE1-NH1 3.08Å; E190-R204 IonicContact OE1-NH2 2.67Å; E190-R204 IonicContact OE2-CZ 3.75Å; E190-R204 IonicContact OE2-NH1 2.7Å; E190-R204 PolarHBondContact OE2-NH1 2.89Å; E190-R204 IonicContact OE2-NH2 3.57Å; E190-R204 PolarHBondContact OE2-NH2 2.86Å; A200-R204 VanDerWaalsContact O-CB 3.24Å; A200-R204 WeakPolarHBondContact O-CB 3.12Å; A200-R204 PolarHBondContact O-N 2.73Å; A200-R204 VanDerWaalsContact O-N 3.08Å; T201-R204 WeakPolarHBondContact O-CB 3.22Å; T201-R204 PolarHBondContact O-N 3.02Å
205	D	88.3	Confident	86.8	Confident	109 Å²	109	56.6 Å²	56.6	58%	0.583	30%	0.301	S	S	*	.	S	Bend	trans	-102.2	2.3	-170.4	-57.7	-17.4	0	0	0	113.8	T201 P207	T201-D205 VanDerWaalsContact CG2-OD2 3.28Å; T201-D205 WeakPolarHBondContact CG2-OD2 3.26Å; T201-D205 PolarHBondContact O-N 3.27Å; D205-P207 WeakPolarHBondContact O-CD 3.39Å
206	L	86.4	Confident	87.2	Confident	46 Å²	46	50.7 Å²	50.7	24%	0.241	27%	0.273	C	S	.	.			trans	-63.9	122.6	-177.3	-163.1	75.6	0	0	0	111.9	S202 G208 I209 A218 I277	S202-L206 WeakPolarHBondContact O-CB 3.42Å; S202-L206 PolarHBondContact O-N 3.33Å; L206-G208 PolarHBondContact O-N 3.34Å; L206-I209 HydrophobicContact CB-CD1 4.1Å; L206-I209 HydrophobicContact CB-CG1 4.47Å; L206-I209 HydrophobicContact CD2-CD1 3.71Å; L206-I209 HydrophobicContact CD2-CG1 4.26Å; L206-I209 HydrophobicContact CG-CD1 4.48Å; L206-I209 PolarHBondContact O-N 2.82Å; L206-A218 HydrophobicContact CD2-CB 4.46Å; L206-I277 HydrophobicContact CD2-CB 4.24Å; L206-I277 HydrophobicContact CD2-CG2 3.57Å
207	P	83.1	Confident	87.4	Confident	110 Å²	110	51.3 Å²	51.3	71%	0.714	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	132.8	178.2	-25.8	35.3	0	0	0	112.5	D205 G279	D205-P207 WeakPolarHBondContact O-CD 3.39Å; P207-G279 WeakPolarHBondContact O-CA 3.42Å
208	G	81.1	Confident	87.6	Confident	31 Å²	31	50 Å²	50	32%	0.32	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	104	-32.2	179.7	0	0	0	0	0	114.4	L206 R210	L206-G208 PolarHBondContact O-N 3.34Å; G208-R210 PolarHBondContact O-N 2.75Å
209	I	85.3	Confident	87.9	Confident	16 Å²	16	44.4 Å²	44.4	8%	0.082	23%	0.234	C	C	.	.			trans	-76.2	125.1	-176.3	-61.9	-175.6	0	0	0	111.9	L206 T211 R215 A218 G279 L282	L206-I209 HydrophobicContact CB-CD1 4.1Å; L206-I209 HydrophobicContact CB-CG1 4.47Å; L206-I209 HydrophobicContact CD2-CD1 3.71Å; L206-I209 HydrophobicContact CD2-CG1 4.26Å; L206-I209 HydrophobicContact CG-CD1 4.48Å; L206-I209 PolarHBondContact O-N 2.82Å; I209-T211 WeakPolarHBondContact CG2-O 3.23Å; I209-R215 HydrophobicContact CG2-CB 4.45Å; I209-R215 HydrophobicContact CG2-CG 3.58Å; I209-A218 HydrophobicContact CD1-CB 3.65Å; I209-G279 WeakPolarHBondContact CG1-O 3.3Å; I209-L282 HydrophobicContact CD1-CD1 4.05Å
210	R	82.3	Confident	88.1	Confident	220 Å²	220	44.2 Å²	44.2	83%	0.83	23%	0.233	S	C	*	.			trans	-117.1	-25.3	-180	-54.3	178.8	-171.2	-172.4	1.3	112.8	G208 D283	G208-R210 PolarHBondContact O-N 2.75Å; R210-D283 WeakPolarHBondContact CA-OD2 2.98Å; R210-D283 WeakPolarHBondContact CB-OD2 3.42Å; R210-D283 PolarHBondContact N-OD2 3.42Å
211	T	86.4	Confident	88.3	Confident	51 Å²	51	45.1 Å²	45.1	31%	0.313	24%	0.238	S	C	.	.	S	Bend	trans	-99.6	151.7	178.7	83.2	0	0	0	0	113.2	I209 L213 G214 R215 D283	I209-T211 WeakPolarHBondContact CG2-O 3.23Å; T211-L213 PolarHBondContact O-N 2.76Å; T211-L213 PolarHBondContact OG1-N 3.4Å; T211-G214 PolarHBondContact O-N 2.85Å; T211-G214 PolarHBondContact OG1-N 3.43Å; T211-R215 PolarHBondContact O-N 3.23Å; T211-R215 VanDerWaalsContact O-N 3.14Å; T211-D283 WeakPolarHBondContact CA-OD1 3.23Å; T211-D283 VanDerWaalsContact CB-OD1 3.22Å; T211-D283 WeakPolarHBondContact CB-OD1 3.48Å; T211-D283 HydrophobicContact CG2-CB 4.26Å; T211-D283 WeakPolarHBondContact CG2-OD1 3.13Å; T211-D283 PolarHBondContact N-OD1 3.16Å; T211-D283 PolarHBondContact N-OD2 3.41Å; T211-D283 PolarHBondContact OG1-OD1 2.78Å
212	G	84.5	Confident	88.4	Confident	17 Å²	17	44.1 Å²	44.1	18%	0.175	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-23	169.7	0	0	0	0	0	113.6	S181 A216	S181-G212 VanDerWaalsContact OG-C 3.25Å; S181-G212 PolarHBondContact OG-O 2.88Å; G212-A216 WeakPolarHBondContact O-CB 3.47Å; G212-A216 PolarHBondContact O-N 2.7Å
213	L	87.1	Confident	88.6	Confident	33 Å²	33	41.1 Å²	41.1	17%	0.173	21%	0.209	C	C	.	.	H	α-helix	trans	-72.1	-42.4	174.6	-175.7	62	0	0	0	110.9	E162 I182 T211 R215 A216 R217	E162-L213 HydrophobicContact CG-CD1 4.17Å; I182-L213 HydrophobicContact CD1-CD1 4.18Å; I182-L213 HydrophobicContact CG1-CD1 3.97Å; T211-L213 PolarHBondContact O-N 2.76Å; T211-L213 PolarHBondContact OG1-N 3.4Å; L213-R215 PolarHBondContact O-N 3.03Å; L213-A216 PolarHBondContact O-N 2.79Å; L213-R217 WeakPolarHBondContact O-CG 3.46Å; L213-R217 PolarHBondContact O-N 2.8Å
214	G	89.2	Confident	88.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-45.1	171.8	0	0	0	0	0	112	T211 A216 R217 A218 D283	T211-G214 PolarHBondContact O-N 2.85Å; T211-G214 PolarHBondContact OG1-N 3.43Å; G214-A216 VanDerWaalsContact C-N 3.35Å; G214-A216 PolarHBondContact O-N 3.32Å; G214-R217 WeakPolarHBondContact O-CB 3.38Å; G214-R217 PolarHBondContact O-N 3.14Å; G214-A218 PolarHBondContact O-N 2.7Å; G214-D283 WeakPolarHBondContact CA-OD1 3.08Å
215	R	90.6	Very high	89.1	Confident	82 Å²	82	41.1 Å²	41.1	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-58.6	-44.8	175.3	-64.1	-173.2	174.8	158.9	1.5	112.1	W183 A203 I209 T211 L213 R217 A218 W219	W183-R215 HydrophobicContact CD2-CB 3.95Å; W183-R215 HydrophobicContact CE3-CB 3.56Å; W183-R215 HydrophobicContact CH2-CB 4.33Å; W183-R215 HydrophobicContact CZ3-CB 3.76Å; W183-R215 WeakPolarHBondContact CZ3-O 3.44Å; A203-R215 WeakPolarHBondContact O-CG 3.46Å; I209-R215 HydrophobicContact CG2-CB 4.45Å; I209-R215 HydrophobicContact CG2-CG 3.58Å; T211-R215 PolarHBondContact O-N 3.23Å; T211-R215 VanDerWaalsContact O-N 3.14Å; L213-R215 PolarHBondContact O-N 3.03Å; R215-R217 PolarHBondContact O-N 3.44Å; R215-A218 PolarHBondContact O-N 3.31Å; R215-W219 WeakPolarHBondContact O-CB 3.15Å; R215-W219 PolarHBondContact O-N 2.79Å
216	A	90.9	Very high	89.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-40.3	176.3	0	0	0	0	0	112.5	I182 W183 L186 G212 L213 G214 W219 L220	I182-A216 HydrophobicContact CD1-CB 3.84Å; I182-A216 HydrophobicContact CG1-CB 3.62Å; W183-A216 HydrophobicContact CE3-CB 4.32Å; L186-A216 HydrophobicContact CD1-CB 3.79Å; G212-A216 WeakPolarHBondContact O-CB 3.47Å; G212-A216 PolarHBondContact O-N 2.7Å; L213-A216 PolarHBondContact O-N 2.79Å; G214-A216 VanDerWaalsContact C-N 3.35Å; G214-A216 PolarHBondContact O-N 3.32Å; A216-W219 PolarHBondContact O-N 2.69Å; A216-L220 WeakPolarHBondContact O-CB 3.49Å; A216-L220 VanDerWaalsContact O-CG 3.27Å; A216-L220 WeakPolarHBondContact O-CG 3.41Å; A216-L220 PolarHBondContact O-N 3.34Å
217	R	91.5	Very high	89.7	Confident	14 Å²	14	41 Å²	41	5%	0.053	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-49.7	174	-72.3	166.1	171.1	-173.4	-10.8	111.3	E162 L213 G214 R215 W219 L220 H221 L282 Q285	E162-R217 IonicContact OE1-NH2 2.58Å; E162-R217 PolarHBondContact OE1-NH2 2.92Å; E162-R217 IonicContact OE2-CZ 3.9Å; E162-R217 VanDerWaalsContact OE2-CZ 3.23Å; E162-R217 IonicContact OE2-NE 3.92Å; E162-R217 PolarHBondContact OE2-NE 2.87Å; E162-R217 IonicContact OE2-NH2 2.69Å; E162-R217 PolarHBondContact OE2-NH2 3.44Å; L213-R217 WeakPolarHBondContact O-CG 3.46Å; L213-R217 PolarHBondContact O-N 2.8Å; G214-R217 WeakPolarHBondContact O-CB 3.38Å; G214-R217 PolarHBondContact O-N 3.14Å; R215-R217 PolarHBondContact O-N 3.44Å; R217-W219 VanDerWaalsContact C-N 3.34Å; R217-W219 PolarHBondContact O-N 2.91Å; R217-L220 PolarHBondContact O-N 2.91Å; R217-H221 PolarHBondContact O-N 3.38Å; R217-H221 PolarHBondContact O-ND1 3.04Å; R217-L282 HydrophobicContact CB-CB 4.47Å; R217-L282 HydrophobicContact CB-CD1 4.27Å; R217-L282 HydrophobicContact CB-CD2 4.11Å; R217-L282 WeakPolarHBondContact CD-O 3.49Å; R217-L282 PolarHBondContact NH1-O 3.47Å; R217-Q285 PolarHBondContact NH1-O 3.18Å; R217-Q285 PolarHBondContact NH2-O 3.06Å
218	A	91.8	Very high	90.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-45.8	177.5	0	0	0	0	0	111.7	A203 L206 I209 G214 R215 L220 H221 L222 I277 L282	A203-A218 HydrophobicContact CB-CB 4.11Å; L206-A218 HydrophobicContact CD2-CB 4.46Å; I209-A218 HydrophobicContact CD1-CB 3.65Å; G214-A218 PolarHBondContact O-N 2.7Å; R215-A218 PolarHBondContact O-N 3.31Å; A218-L220 PolarHBondContact O-N 3.2Å; A218-H221 PolarHBondContact O-N 2.7Å; A218-L222 WeakPolarHBondContact O-CG 3.27Å; A218-L222 PolarHBondContact O-N 2.84Å; A218-I277 HydrophobicContact CB-CG2 4.23Å; A218-L282 HydrophobicContact CB-CD1 3.69Å
219	W	93.5	Very high	90.8	Very high	1 Å²	1	37 Å²	37	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-41.3	176.8	-174.8	96.3	0	0	0	112.8	W183 L186 V189 I199 A203 R215 A216 R217 H221 L222 A223 Y232	W183-W219 HydrophobicContact CZ3-CB 3.89Å; W183-W219 HydrophobicContact CZ3-CG 4.25Å; L186-W219 HydrophobicContact CB-CE3 4.43Å; L186-W219 HydrophobicContact CD1-CE3 3.9Å; L186-W219 HydrophobicContact CD1-CZ3 4.36Å; L186-W219 HydrophobicContact CD2-CE3 4.08Å; L186-W219 HydrophobicContact CD2-CH2 4.19Å; L186-W219 HydrophobicContact CD2-CZ3 3.69Å; L186-W219 HydrophobicContact CG-CE3 4.36Å; L186-W219 HydrophobicContact CG-CZ3 4.44Å; V189-W219 HydrophobicContact CB-CH2 4.47Å; V189-W219 HydrophobicContact CB-CZ2 3.9Å; V189-W219 HydrophobicContact CG1-CZ2 3.98Å; V189-W219 HydrophobicContact CG2-CH2 3.97Å; V189-W219 HydrophobicContact CG2-CZ2 3.88Å; I199-W219 HydrophobicContact CD1-CD2 4.2Å; I199-W219 HydrophobicContact CD1-CG 4.35Å; I199-W219 HydrophobicContact CD1-CZ2 4.03Å; A203-W219 HydrophobicContact CB-CB 3.77Å; R215-W219 WeakPolarHBondContact O-CB 3.15Å; R215-W219 PolarHBondContact O-N 2.79Å; A216-W219 PolarHBondContact O-N 2.69Å; R217-W219 VanDerWaalsContact C-N 3.34Å; R217-W219 PolarHBondContact O-N 2.91Å; W219-H221 VanDerWaalsContact C-N 3.33Å; W219-H221 PolarHBondContact O-N 2.76Å; W219-L222 PolarHBondContact O-N 3.46Å; W219-A223 HydrophobicContact CE3-CB 4.32Å; W219-A223 HydrophobicContact CH2-CB 4.39Å; W219-A223 HydrophobicContact CZ3-CB 4.16Å; W219-A223 VanDerWaalsContact O-CB 3.26Å; W219-A223 WeakPolarHBondContact O-CB 2.88Å; W219-A223 PolarHBondContact O-N 3.32Å; W219-Y232 AromaticContact CH2-CD2 3.8Å; W219-Y232 HydrophobicContact CH2-CD2 3.8Å; W219-Y232 HydrophobicContact CH2-CG 4.14Å; W219-Y232 AromaticContact CZ2-CD2 3.78Å; W219-Y232 HydrophobicContact CZ2-CD2 3.78Å; W219-Y232 HydrophobicContact CZ2-CG 4.22Å
220	L	93.3	Very high	91.3	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-35.5	175.4	-72.5	169.7	0	0	0	112.4	F158 L161 L165 L186 A216 R217 A218 L224	F158-L220 HydrophobicContact CD1-CB 4.18Å; F158-L220 HydrophobicContact CE1-CB 3.98Å; F158-L220 WeakPolarHBondContact CE1-O 3.36Å; L161-L220 HydrophobicContact CD2-CD1 4.38Å; L161-L220 HydrophobicContact CD2-CD2 3.86Å; L165-L220 HydrophobicContact CD1-CD1 3.94Å; L165-L220 HydrophobicContact CD1-CD2 4.24Å; L186-L220 HydrophobicContact CD1-CG 4.33Å; A216-L220 WeakPolarHBondContact O-CB 3.49Å; A216-L220 VanDerWaalsContact O-CG 3.27Å; A216-L220 WeakPolarHBondContact O-CG 3.41Å; A216-L220 PolarHBondContact O-N 3.34Å; R217-L220 PolarHBondContact O-N 2.91Å; A218-L220 PolarHBondContact O-N 3.2Å; L220-L224 PolarHBondContact O-N 2.74Å; L220-L224 VanDerWaalsContact O-N 3.15Å
221	H	92.8	Very high	91.8	Very high	21 Å²	21	29 Å²	29	10%	0.097	14%	0.143	C	C	.	.	H	α-helix	trans	-67.9	-46.9	174.5	-73	58.8	0	0	0	111.2	F158 R217 A218 W219 A223 L224 M225 L275 I277	F158-H221 AromaticContact CD2-CE1 3.52Å; F158-H221 AromaticContact CD2-NE2 3.65Å; F158-H221 AromaticContact CE2-CD2 3.8Å; F158-H221 AromaticContact CE2-CE1 3.69Å; F158-H221 AromaticContact CE2-CG 3.93Å; F158-H221 AromaticContact CE2-ND1 3.87Å; F158-H221 AromaticContact CE2-NE2 3.64Å; F158-H221 AromaticContact CG-CE1 3.8Å; F158-H221 HydrophobicContact CZ-CB 4.43Å; F158-H221 AromaticContact CZ-CG 3.94Å; F158-H221 AromaticContact CZ-ND1 3.87Å; R217-H221 PolarHBondContact O-N 3.38Å; R217-H221 PolarHBondContact O-ND1 3.04Å; A218-H221 PolarHBondContact O-N 2.7Å; W219-H221 VanDerWaalsContact C-N 3.33Å; W219-H221 PolarHBondContact O-N 2.76Å; H221-A223 PolarHBondContact O-N 2.77Å; H221-L224 PolarHBondContact O-N 2.75Å; H221-M225 WeakPolarHBondContact O-CG 3.15Å; H221-M225 PolarHBondContact O-N 2.71Å; H221-L275 HydrophobicContact CB-CD1 4Å; H221-I277 HydrophobicContact CB-CD1 3.68Å; H221-I277 HydrophobicContact CB-CG1 4.25Å
222	L	93	Very high	92.2	Very high	36 Å²	36	26.9 Å²	26.9	19%	0.188	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-43.8	175.5	-68.9	173.4	0	0	0	112.2	I199 A203 A218 W219 L224 M225 Q226 I277	I199-L222 HydrophobicContact CB-CB 3.97Å; I199-L222 HydrophobicContact CB-CD1 4.03Å; I199-L222 HydrophobicContact CG2-CB 3.78Å; I199-L222 HydrophobicContact CG2-CD1 4.25Å; A203-L222 HydrophobicContact CB-CD1 4.33Å; A218-L222 WeakPolarHBondContact O-CG 3.27Å; A218-L222 PolarHBondContact O-N 2.84Å; W219-L222 PolarHBondContact O-N 3.46Å; L222-L224 PolarHBondContact O-N 2.97Å; L222-M225 PolarHBondContact O-N 3.42Å; L222-Q226 WeakPolarHBondContact O-CG 2.89Å; L222-Q226 PolarHBondContact O-N 2.84Å; L222-I277 HydrophobicContact CD2-CD1 3.65Å; L222-I277 HydrophobicContact CG-CD1 3.64Å
223	A	93.4	Very high	92.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-28.5	176.9	0	0	0	0	0	112.8	I199 W219 H221 K227 K228 V229 Y232	I199-A223 HydrophobicContact CD1-CB 3.91Å; W219-A223 HydrophobicContact CE3-CB 4.32Å; W219-A223 HydrophobicContact CH2-CB 4.39Å; W219-A223 HydrophobicContact CZ3-CB 4.16Å; W219-A223 VanDerWaalsContact O-CB 3.26Å; W219-A223 WeakPolarHBondContact O-CB 2.88Å; W219-A223 PolarHBondContact O-N 3.32Å; H221-A223 PolarHBondContact O-N 2.77Å; A223-K227 PolarHBondContact O-N 2.7Å; A223-K228 PolarHBondContact O-N 3.03Å; A223-V229 VanDerWaalsContact C-CG2 3.47Å; A223-V229 HydrophobicContact CB-CG2 3.89Å; A223-V229 PolarHBondContact O-N 2.73Å; A223-Y232 HydrophobicContact CB-CD2 3.98Å; A223-Y232 HydrophobicContact CB-CE2 4.24Å
224	L	94.1	Very high	92.9	Very high	3 Å²	3	30 Å²	30	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-75.6	-43.3	173.2	-173	67.3	0	0	0	111.8	L154 F158 L220 H221 L222 Q226 K227 V229 L268	L154-L224 HydrophobicContact CD1-CD2 3.46Å; L154-L224 VanDerWaalsContact CD1-CD2 3.46Å; F158-L224 HydrophobicContact CE1-CB 4.49Å; F158-L224 HydrophobicContact CE1-CD2 4.39Å; F158-L224 HydrophobicContact CE2-CD2 4.05Å; F158-L224 HydrophobicContact CZ-CB 3.99Å; F158-L224 HydrophobicContact CZ-CD2 3.54Å; F158-L224 HydrophobicContact CZ-CG 4.41Å; L220-L224 PolarHBondContact O-N 2.74Å; L220-L224 VanDerWaalsContact O-N 3.15Å; H221-L224 PolarHBondContact O-N 2.75Å; L222-L224 PolarHBondContact O-N 2.97Å; L224-Q226 PolarHBondContact O-N 3.28Å; L224-K227 WeakPolarHBondContact O-CA 3.03Å; L224-K227 PolarHBondContact O-N 3.39Å; L224-V229 HydrophobicContact CB-CG2 3.87Å; L224-V229 HydrophobicContact CD1-CG2 4.13Å; L224-L268 HydrophobicContact CD1-CB 4.15Å; L224-L268 HydrophobicContact CD1-CD1 4.44Å
225	M	92.8	Very high	93.1	Very high	68 Å²	68	31.9 Å²	31.9	34%	0.335	15%	0.148	S	C	.	.	H	α-helix	trans	-59.2	-35	173.6	-66.6	172.5	64.9	0	0	111.7	H221 L222 K227 L275	H221-M225 WeakPolarHBondContact O-CG 3.15Å; H221-M225 PolarHBondContact O-N 2.71Å; L222-M225 PolarHBondContact O-N 3.42Å; M225-K227 VanDerWaalsContact C-N 3.28Å; M225-K227 PolarHBondContact O-N 3.38Å; M225-L275 HydrophobicContact CG-CB 4.35Å; M225-L275 HydrophobicContact CG-CD1 4.34Å; M225-L275 HydrophobicContact CG-CG 4.09Å; M225-L275 HydrophobicContact SD-CB 3.78Å; M225-L275 HydrophobicContact SD-CG 4.2Å
226	Q	92.6	Very high	93.2	Very high	79 Å²	79	28.1 Å²	28.1	37%	0.369	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-6.8	172	-72.5	-171.5	-34.6	0	0	114.9	I199 L222 L224 K228 Y232	I199-Q226 VanDerWaalsContact CG2-CD 3.48Å; I199-Q226 HydrophobicContact CG2-CG 4.41Å; L222-Q226 WeakPolarHBondContact O-CG 2.89Å; L222-Q226 PolarHBondContact O-N 2.84Å; L224-Q226 PolarHBondContact O-N 3.28Å; Q226-K228 VanDerWaalsContact C-N 3.26Å; Q226-K228 HydrophobicContact CB-CB 4.11Å; Q226-K228 HydrophobicContact CB-CG 4.11Å; Q226-K228 WeakPolarHBondContact O-CG 3.23Å; Q226-K228 PolarHBondContact O-N 2.69Å; Q226-Y232 PolarHBondContact OE1-OH 2.76Å
227	K	94.5	Very high	93.3	Very high	75 Å²	75	28.5 Å²	28.5	33%	0.326	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	37.3	-171.8	-57.6	166.9	176.3	-69.4	0	113	A223 L224 M225 N269 I271	A223-K227 PolarHBondContact O-N 2.7Å; L224-K227 WeakPolarHBondContact O-CA 3.03Å; L224-K227 PolarHBondContact O-N 3.39Å; M225-K227 VanDerWaalsContact C-N 3.28Å; M225-K227 PolarHBondContact O-N 3.38Å; K227-N269 HydrophobicContact CB-CB 4.47Å; K227-N269 WeakPolarHBondContact CD-O 3.28Å; K227-N269 PolarHBondContact NZ-O 3.36Å; K227-N269 PolarHBondContact O-OD1 3.48Å; K227-I271 PolarHBondContact NZ-O 3.01Å
228	K	94.3	Very high	93.4	Very high	56 Å²	56	33.1 Å²	33.1	24%	0.243	16%	0.162	C	C	.	.			trans	-122.1	-1.2	-171.3	-78	-73.1	-176	168.8	0	115.7	E195 A223 Q226 A230 D231 Y232	E195-K228 IonicContact OE2-NZ 2.68Å; A223-K228 PolarHBondContact O-N 3.03Å; Q226-K228 VanDerWaalsContact C-N 3.26Å; Q226-K228 HydrophobicContact CB-CB 4.11Å; Q226-K228 HydrophobicContact CB-CG 4.11Å; Q226-K228 WeakPolarHBondContact O-CG 3.23Å; Q226-K228 PolarHBondContact O-N 2.69Å; K228-A230 PolarHBondContact O-N 3.22Å; K228-A230 VanDerWaalsContact O-N 3.17Å; K228-D231 HydrophobicContact CD-CB 3.96Å; K228-D231 WeakPolarHBondContact CD-OD2 3.11Å; K228-D231 WeakPolarHBondContact CE-OD2 3.07Å; K228-D231 IonicContact NZ-OD2 3.57Å; K228-D231 PolarHBondContact NZ-OD2 2.7Å; K228-D231 PolarHBondContact O-N 2.88Å; K228-Y232 HydrophobicContact CB-CD2 3.83Å; K228-Y232 HydrophobicContact CB-CE1 4.17Å; K228-Y232 HydrophobicContact CB-CE2 3.4Å; K228-Y232 HydrophobicContact CB-CG 4.38Å; K228-Y232 HydrophobicContact CD-CE1 4.33Å; K228-Y232 HydrophobicContact CG-CE1 4.48Å; K228-Y232 HydrophobicContact CG-CE2 4.27Å; K228-Y232 WeakPolarHBondContact O-CD2 3.38Å; K228-Y232 PolarHBondContact O-N 2.76Å
229	V	93.9	Very high	93.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-49.1	-44.2	177.8	-177.9	0	0	0	0	112.4	L161 A223 L224 L233 L265	L161-V229 HydrophobicContact CD2-CG1 4.3Å; A223-V229 VanDerWaalsContact C-CG2 3.47Å; A223-V229 HydrophobicContact CB-CG2 3.89Å; A223-V229 PolarHBondContact O-N 2.73Å; L224-V229 HydrophobicContact CB-CG2 3.87Å; L224-V229 HydrophobicContact CD1-CG2 4.13Å; V229-L233 HydrophobicContact CG1-CD1 3.83Å; V229-L233 HydrophobicContact CG1-CG 4.39Å; V229-L233 WeakPolarHBondContact O-CB 3.13Å; V229-L233 WeakPolarHBondContact O-CG 3.46Å; V229-L233 PolarHBondContact O-N 3.42Å; V229-L265 HydrophobicContact CG1-CD1 4.41Å; V229-L265 HydrophobicContact CG1-CD2 4.32Å
230	A	94.4	Very high	93.3	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-49.7	-179.3	0	0	0	0	0	112.4	K228 Y232 K234 L265 V266	K228-A230 PolarHBondContact O-N 3.22Å; K228-A230 VanDerWaalsContact O-N 3.17Å; A230-Y232 PolarHBondContact O-N 3.5Å; A230-K234 WeakPolarHBondContact O-CB 3.22Å; A230-K234 PolarHBondContact O-N 2.68Å; A230-L265 HydrophobicContact CB-CB 3.89Å; A230-V266 HydrophobicContact CB-CB 4.35Å; A230-V266 HydrophobicContact CB-CG2 3.83Å
231	D	93.6	Very high	93.2	Very high	66 Å²	66	45.5 Å²	45.5	35%	0.353	22%	0.217	S	C	.	.	H	α-helix	trans	-57.3	-51.2	178.5	-67.9	8.3	0	0	0	110.6	K228 K234 T235	K228-D231 HydrophobicContact CD-CB 3.96Å; K228-D231 WeakPolarHBondContact CD-OD2 3.11Å; K228-D231 WeakPolarHBondContact CE-OD2 3.07Å; K228-D231 IonicContact NZ-OD2 3.57Å; K228-D231 PolarHBondContact NZ-OD2 2.7Å; K228-D231 PolarHBondContact O-N 2.88Å; D231-K234 PolarHBondContact O-N 3.43Å; D231-T235 PolarHBondContact O-N 3.49Å; D231-T235 PolarHBondContact O-OG1 3.31Å
232	Y	94.6	Very high	93.2	Very high	6 Å²	6	47.3 Å²	47.3	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-45.8	-176.7	-63.3	-26	0	0	0	113.2	V189 C193 I199 W219 A223 Q226 K228 A230 K234 T235 L236	V189-Y232 HydrophobicContact CG1-CD1 3.84Å; V189-Y232 HydrophobicContact CG1-CG 3.84Å; C193-Y232 HydrophobicContact CB-CD1 4.26Å; C193-Y232 HydrophobicContact CB-CE1 4.26Å; I199-Y232 HydrophobicContact CD1-CD2 4.15Å; I199-Y232 HydrophobicContact CD1-CE2 3.58Å; W219-Y232 AromaticContact CH2-CD2 3.8Å; W219-Y232 HydrophobicContact CH2-CD2 3.8Å; W219-Y232 HydrophobicContact CH2-CG 4.14Å; W219-Y232 AromaticContact CZ2-CD2 3.78Å; W219-Y232 HydrophobicContact CZ2-CD2 3.78Å; W219-Y232 HydrophobicContact CZ2-CG 4.22Å; A223-Y232 HydrophobicContact CB-CD2 3.98Å; A223-Y232 HydrophobicContact CB-CE2 4.24Å; Q226-Y232 PolarHBondContact OE1-OH 2.76Å; K228-Y232 HydrophobicContact CB-CD2 3.83Å; K228-Y232 HydrophobicContact CB-CE1 4.17Å; K228-Y232 HydrophobicContact CB-CE2 3.4Å; K228-Y232 HydrophobicContact CB-CG 4.38Å; K228-Y232 HydrophobicContact CD-CE1 4.33Å; K228-Y232 HydrophobicContact CG-CE1 4.48Å; K228-Y232 HydrophobicContact CG-CE2 4.27Å; K228-Y232 WeakPolarHBondContact O-CD2 3.38Å; K228-Y232 PolarHBondContact O-N 2.76Å; A230-Y232 PolarHBondContact O-N 3.5Å; Y232-K234 VanDerWaalsContact C-N 3.33Å; Y232-T235 PolarHBondContact O-N 2.6Å; Y232-L236 PolarHBondContact O-N 2.69Å
233	L	93.6	Very high	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70	-31.9	178.1	-68.7	-177.1	0	0	0	111.7	L161 L165 L186 V229 L236 L237 L265	L161-L233 HydrophobicContact CD1-CD1 3.99Å; L161-L233 HydrophobicContact CD2-CD1 4.41Å; L165-L233 HydrophobicContact CD2-CD2 4.14Å; L186-L233 HydrophobicContact CD2-CD2 3.74Å; V229-L233 HydrophobicContact CG1-CD1 3.83Å; V229-L233 HydrophobicContact CG1-CG 4.39Å; V229-L233 WeakPolarHBondContact O-CB 3.13Å; V229-L233 WeakPolarHBondContact O-CG 3.46Å; V229-L233 PolarHBondContact O-N 3.42Å; L233-L236 HydrophobicContact CD2-CD1 4.01Å; L233-L236 PolarHBondContact O-N 3.39Å; L233-L237 WeakPolarHBondContact O-CD1 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.23Å; L233-L237 WeakPolarHBondContact O-CG 3.11Å; L233-L237 PolarHBondContact O-N 3.45Å; L233-L265 HydrophobicContact CB-CD1 4.36Å; L233-L265 HydrophobicContact CD1-CD1 3.75Å
234	K	93.5	Very high	92.9	Very high	114 Å²	114	48.5 Å²	48.5	50%	0.496	24%	0.239	S	C	.	.	H	α-helix	trans	-61	-46.9	169.8	179.7	177.1	174.7	-176.6	0	111.5	A230 D231 Y232 L236 L237 D238	A230-K234 WeakPolarHBondContact O-CB 3.22Å; A230-K234 PolarHBondContact O-N 2.68Å; D231-K234 PolarHBondContact O-N 3.43Å; Y232-K234 VanDerWaalsContact C-N 3.33Å; K234-L236 PolarHBondContact O-N 3.41Å; K234-L237 PolarHBondContact O-N 2.79Å; K234-D238 WeakPolarHBondContact CE-OD2 3.21Å; K234-D238 WeakPolarHBondContact CG-OD2 3.07Å; K234-D238 PolarHBondContact O-N 3.45Å
235	T	92.6	Very high	92.7	Very high	41 Å²	41	53.9 Å²	53.9	25%	0.252	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-29.3	179.2	-53.4	0	0	0	0	112.9	L192 D231 Y232 R239	L192-T235 HydrophobicContact CB-CG2 3.78Å; L192-T235 HydrophobicContact CD1-CG2 4.28Å; D231-T235 PolarHBondContact O-N 3.49Å; D231-T235 PolarHBondContact O-OG1 3.31Å; Y232-T235 PolarHBondContact O-N 2.6Å; T235-R239 WeakPolarHBondContact O-CG 3.45Å
236	L	91.9	Very high	92.6	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-69.3	-50.2	168.1	-66.5	-177.4	0	0	0	112.4	P185 L186 L188 V189 L192 Y232 L233 K234 D238 R239 L243	P185-L236 WeakPolarHBondContact O-CD1 3.47Å; P185-L236 WeakPolarHBondContact O-CD2 3.36Å; L186-L236 HydrophobicContact CD2-CD1 4.04Å; L188-L236 HydrophobicContact CB-CD2 3.78Å; V189-L236 HydrophobicContact CG2-CD1 3.75Å; V189-L236 HydrophobicContact CG2-CD2 3.7Å; V189-L236 HydrophobicContact CG2-CG 3.66Å; L192-L236 HydrophobicContact CD1-CD2 4.11Å; Y232-L236 PolarHBondContact O-N 2.69Å; L233-L236 HydrophobicContact CD2-CD1 4.01Å; L233-L236 PolarHBondContact O-N 3.39Å; K234-L236 PolarHBondContact O-N 3.41Å; L236-D238 VanDerWaalsContact C-N 3.27Å; L236-D238 PolarHBondContact O-N 3.41Å; L236-R239 CarbonylContact O-C 3.58Å; L236-R239 WeakPolarHBondContact O-CA 3.41Å; L236-R239 PolarHBondContact O-N 2.8Å; L236-L243 HydrophobicContact CB-CD1 4.31Å; L236-L243 HydrophobicContact CB-CD2 4.28Å; L236-L243 WeakPolarHBondContact O-CD1 3.38Å
237	L	93.3	Very high	92.6	Very high	9 Å²	9	48.2 Å²	48.2	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-33.5	-177.3	-70.8	162	0	0	0	112.8	L233 K234 R239 K240 M253 G258	L233-L237 WeakPolarHBondContact O-CD1 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.23Å; L233-L237 WeakPolarHBondContact O-CG 3.11Å; L233-L237 PolarHBondContact O-N 3.45Å; K234-L237 PolarHBondContact O-N 2.79Å; L237-R239 PolarHBondContact O-N 3.21Å; L237-K240 VanDerWaalsContact O-CG 3.27Å; L237-K240 WeakPolarHBondContact O-CG 3.47Å; L237-M253 HydrophobicContact CD2-CE 3.65Å; L237-M253 WeakPolarHBondContact CD2-O 3.13Å; L237-M253 HydrophobicContact CD2-SD 3.94Å; L237-M253 HydrophobicContact CG-CE 3.94Å; L237-G258 WeakPolarHBondContact CD1-O 3.14Å
238	D	93.6	Very high	92.5	Very high	110 Å²	110	48 Å²	48	59%	0.588	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-16	173.3	-68	-19.3	0	0	0	112.1	K234 L236	K234-D238 WeakPolarHBondContact CE-OD2 3.21Å; K234-D238 WeakPolarHBondContact CG-OD2 3.07Å; K234-D238 PolarHBondContact O-N 3.45Å; L236-D238 VanDerWaalsContact C-N 3.27Å; L236-D238 PolarHBondContact O-N 3.41Å
239	R	92.4	Very high	92.2	Very high	90 Å²	90	49.5 Å²	49.5	34%	0.34	26%	0.261	S	S	.	.			trans	-110.3	54.4	178.9	-66.2	-57.2	-56.4	-90.9	3.3	112.8	L192 T235 L236 L237 D241 L242 L243	L192-R239 HydrophobicContact CD1-CB 4.32Å; L192-R239 HydrophobicContact CD1-CG 4.08Å; L192-R239 HydrophobicContact CD2-CG 4.21Å; T235-R239 WeakPolarHBondContact O-CG 3.45Å; L236-R239 CarbonylContact O-C 3.58Å; L236-R239 WeakPolarHBondContact O-CA 3.41Å; L236-R239 PolarHBondContact O-N 2.8Å; L237-R239 PolarHBondContact O-N 3.21Å; R239-D241 VanDerWaalsContact C-OD1 3.28Å; R239-D241 WeakPolarHBondContact CA-OD1 3.29Å; R239-D241 IonicContact CZ-OD1 3.82Å; R239-D241 IonicContact CZ-OD2 3.72Å; R239-D241 IonicContact NE-OD1 2.94Å; R239-D241 PolarHBondContact NE-OD1 2.74Å; R239-D241 IonicContact NE-OD2 3.65Å; R239-D241 IonicContact NH2-OD1 2.7Å; R239-D241 IonicContact NH2-OD2 2.72Å; R239-D241 PolarHBondContact NH2-OD2 2.83Å; R239-D241 PolarHBondContact O-N 2.65Å; R239-D241 VanDerWaalsContact O-N 3.12Å; R239-L242 HydrophobicContact CB-CD1 4.38Å; R239-L242 PolarHBondContact O-N 2.82Å; R239-L243 PolarHBondContact O-N 2.77Å
240	K	92.3	Very high	91.9	Very high	90 Å²	90	50.2 Å²	50.2	39%	0.391	27%	0.269	S	S	.	.	H	α-helix	trans	-53.8	-28.8	174.9	-61.3	-165.9	177.2	-168.8	0	113.6	L237 S244 L254	L237-K240 VanDerWaalsContact O-CG 3.27Å; L237-K240 WeakPolarHBondContact O-CG 3.47Å; K240-S244 WeakPolarHBondContact O-CB 3.31Å; K240-S244 PolarHBondContact O-N 3.49Å; K240-L254 HydrophobicContact CB-CD2 4.15Å; K240-L254 WeakPolarHBondContact CD-O 3.25Å; K240-L254 VanDerWaalsContact CE-O 3.27Å; K240-L254 WeakPolarHBondContact CE-O 3.38Å; K240-L254 HydrophobicContact CG-CD2 4.45Å; K240-L254 PolarHBondContact NZ-O 2.72Å
241	D	91.1	Very high	91.9	Very high	87 Å²	87	50.1 Å²	50.1	47%	0.465	27%	0.268	S	S	.	.	H	α-helix	trans	-59.2	-49	174.5	63.7	-49.6	0	0	0	111.8	R239 S244	R239-D241 VanDerWaalsContact C-OD1 3.28Å; R239-D241 WeakPolarHBondContact CA-OD1 3.29Å; R239-D241 IonicContact CZ-OD1 3.82Å; R239-D241 IonicContact CZ-OD2 3.72Å; R239-D241 IonicContact NE-OD1 2.94Å; R239-D241 PolarHBondContact NE-OD1 2.74Å; R239-D241 IonicContact NE-OD2 3.65Å; R239-D241 IonicContact NH2-OD1 2.7Å; R239-D241 IonicContact NH2-OD2 2.72Å; R239-D241 PolarHBondContact NH2-OD2 2.83Å; R239-D241 PolarHBondContact O-N 2.65Å; R239-D241 VanDerWaalsContact O-N 3.12Å; D241-S244 PolarHBondContact O-OG 3.17Å
242	L	91.1	Very high	91.9	Very high	59 Å²	59	47 Å²	47	31%	0.309	25%	0.251	S	S	.	.	H	α-helix	trans	-74.7	-39.1	178	-57.6	-179.7	0	0	0	111.9	L188 L192 R239 S244 E245	L188-L242 HydrophobicContact CD1-CB 3.95Å; L192-L242 HydrophobicContact CD1-CD1 4.36Å; L192-L242 HydrophobicContact CD2-CD1 4.14Å; R239-L242 HydrophobicContact CB-CD1 4.38Å; R239-L242 PolarHBondContact O-N 2.82Å; L242-S244 PolarHBondContact O-N 2.71Å; L242-E245 PolarHBondContact O-N 3.37Å
243	L	90.6	Very high	91.9	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-62.2	-28.2	176.5	-70.9	-178.6	0	0	0	112.7	P185 L236 R239 E245 F246 Y247 M253 L254	P185-L243 HydrophobicContact CB-CD2 4.29Å; L236-L243 HydrophobicContact CB-CD1 4.31Å; L236-L243 HydrophobicContact CB-CD2 4.28Å; L236-L243 WeakPolarHBondContact O-CD1 3.38Å; R239-L243 PolarHBondContact O-N 2.77Å; L243-E245 PolarHBondContact O-N 3.31Å; L243-E245 VanDerWaalsContact O-N 3.14Å; L243-F246 PolarHBondContact O-N 2.73Å; L243-Y247 HydrophobicContact CB-CD2 4.21Å; L243-Y247 HydrophobicContact CD2-CD2 4.2Å; L243-Y247 HydrophobicContact CD2-CE2 3.91Å; L243-Y247 WeakPolarHBondContact O-CD2 3.33Å; L243-Y247 PolarHBondContact O-N 3.03Å; L243-M253 HydrophobicContact CD1-CB 4.36Å; L243-M253 WeakPolarHBondContact CD1-O 2.82Å; L243-L254 HydrophobicContact CB-CD2 3.57Å; L243-L254 HydrophobicContact CD1-CD2 4.48Å
244	S	91	Very high	91.9	Very high	60 Å²	60	47.9 Å²	47.9	42%	0.42	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-20.9	178.4	78.3	0	0	0	0	114.3	K170 K240 D241 L242 F246	K170-S244 PolarHBondContact NZ-O 2.91Å; K240-S244 WeakPolarHBondContact O-CB 3.31Å; K240-S244 PolarHBondContact O-N 3.49Å; D241-S244 PolarHBondContact O-OG 3.17Å; L242-S244 PolarHBondContact O-N 2.71Å; S244-F246 VanDerWaalsContact C-N 3.32Å
245	E	89.9	Confident	91.9	Very high	115 Å²	115	45.4 Å²	45.4	54%	0.537	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-32.8	172.5	-160.1	-154.7	138.9	0	0	111.8	K172 L242 L243	K172-E245 WeakPolarHBondContact CE-OE1 3.22Å; K172-E245 IonicContact NZ-OE1 2.92Å; K172-E245 PolarHBondContact NZ-OE1 2.65Å; L242-E245 PolarHBondContact O-N 3.37Å; L243-E245 PolarHBondContact O-N 3.31Å; L243-E245 VanDerWaalsContact O-N 3.14Å
246	F	90.2	Very high	91.9	Very high	27 Å²	27	51 Å²	51	12%	0.118	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-23.6	-172.2	-62.4	-93.5	0	0	0	113.8	L169 K170 P185 L188 L243 S244	L169-F246 HydrophobicContact CD1-CB 4.26Å; L169-F246 WeakPolarHBondContact CD1-O 3.2Å; K170-F246 WeakPolarHBondContact CB-O 3.43Å; K170-F246 PolarHBondContact N-O 3.13Å; P185-F246 HydrophobicContact CG-CB 3.83Å; P185-F246 HydrophobicContact CG-CD1 4.04Å; P185-F246 HydrophobicContact CG-CG 3.97Å; L188-F246 HydrophobicContact CD1-CD2 4.21Å; L188-F246 HydrophobicContact CD1-CE2 3.86Å; L188-F246 HydrophobicContact CD2-CE2 4.33Å; L188-F246 HydrophobicContact CG-CE2 4.29Å; L243-F246 PolarHBondContact O-N 2.73Å; S244-F246 VanDerWaalsContact C-N 3.32Å
247	Y	92.7	Very high	92	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-120.6	145	-174.3	-68.7	-84.8	0	0	0	113	L165 G168 L169 K170 P185 L243 A251 M253	L165-Y247 VanDerWaalsContact O-CE1 3.31Å; L165-Y247 WeakPolarHBondContact O-CE1 3.48Å; L165-Y247 PolarHBondContact O-OH 3.16Å; G168-Y247 WeakPolarHBondContact O-CA 3.47Å; L169-Y247 HydrophobicContact CB-CD1 4.37Å; L169-Y247 HydrophobicContact CB-CE1 4.15Å; L169-Y247 HydrophobicContact CD1-CD1 4.08Å; L169-Y247 HydrophobicContact CD1-CD2 4.48Å; L169-Y247 HydrophobicContact CD1-CE1 3.63Å; L169-Y247 HydrophobicContact CD1-CE2 4.07Å; L169-Y247 HydrophobicContact CD1-CG 4.49Å; K170-Y247 VanDerWaalsContact CE-C 3.5Å; K170-Y247 WeakPolarHBondContact CE-O 3.34Å; K170-Y247 PolarHBondContact NZ-O 3.45Å; P185-Y247 HydrophobicContact CB-CE2 3.93Å; P185-Y247 HydrophobicContact CG-CE2 3.57Å; L243-Y247 HydrophobicContact CB-CD2 4.21Å; L243-Y247 HydrophobicContact CD2-CD2 4.2Å; L243-Y247 HydrophobicContact CD2-CE2 3.91Å; L243-Y247 WeakPolarHBondContact O-CD2 3.33Å; L243-Y247 PolarHBondContact O-N 3.03Å; Y247-A251 HydrophobicContact CD1-CB 3.73Å; Y247-A251 HydrophobicContact CG-CB 4.09Å; Y247-M253 HydrophobicContact CD1-CB 4.23Å; Y247-M253 HydrophobicContact CD2-CB 4.2Å; Y247-M253 HydrophobicContact CE1-CB 4.04Å; Y247-M253 HydrophobicContact CE1-CG 3.85Å; Y247-M253 HydrophobicContact CE2-CB 4.03Å; Y247-M253 HydrophobicContact CE2-CG 4.22Å; Y247-M253 HydrophobicContact CG-CB 4.3Å
248	D	91.8	Very high	92	Very high	72 Å²	72	52 Å²	52	39%	0.385	27%	0.274	S	S	.	.			trans	-73.4	154.2	168.6	-67.8	-48.4	0	0	0	111.1	G168 K170 G250 A251	G168-D248 PolarHBondContact O-N 3.41Å; K170-D248 WeakPolarHBondContact CE-OD1 3.35Å; K170-D248 VanDerWaalsContact CG-OD1 3.3Å; K170-D248 WeakPolarHBondContact CG-OD1 3.45Å; D248-G250 VanDerWaalsContact C-N 3.31Å; D248-G250 PolarHBondContact O-N 2.8Å; D248-G250 VanDerWaalsContact O-N 3.13Å; D248-A251 WeakPolarHBondContact O-CB 3.49Å; D248-A251 PolarHBondContact O-N 2.78Å
249	A	87.9	Confident	92	Very high	87 Å²	87	49.7 Å²	49.7	72%	0.719	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.1	-164.6	0	0	0	0	0	114.8	A251	A249-A251 VanDerWaalsContact C-N 3.29Å; A249-A251 PolarHBondContact O-N 2.77Å
250	G	88.9	Confident	92.1	Very high	16 Å²	16	48.5 Å²	48.5	17%	0.165	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	14.9	177.1	0	0	0	0	0	115	M118 R122 H167 D248	M118-G250 WeakPolarHBondContact CG-O 3.28Å; M118-G250 VanDerWaalsContact SD-O 3.34Å; R122-G250 WeakPolarHBondContact CD-O 3.11Å; R122-G250 PolarHBondContact NH1-O 2.81Å; H167-G250 PolarHBondContact CE1-O 3.32Å; D248-G250 VanDerWaalsContact C-N 3.31Å; D248-G250 PolarHBondContact O-N 2.8Å; D248-G250 VanDerWaalsContact O-N 3.13Å
251	A	93.2	Very high	92.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.255	C	S	.	.			trans	-68	146.1	179.1	0	0	0	0	0	112.6	H167 Y247 D248 A249 M253 L254 E255	H167-A251 WeakPolarHBondContact O-CB 3.46Å; Y247-A251 HydrophobicContact CD1-CB 3.73Å; Y247-A251 HydrophobicContact CG-CB 4.09Å; D248-A251 WeakPolarHBondContact O-CB 3.49Å; D248-A251 PolarHBondContact O-N 2.78Å; A249-A251 VanDerWaalsContact C-N 3.29Å; A249-A251 PolarHBondContact O-N 2.77Å; A251-M253 PolarHBondContact O-N 3.34Å; A251-M253 VanDerWaalsContact O-N 3.11Å; A251-L254 PolarHBondContact O-N 2.7Å; A251-E255 WeakPolarHBondContact O-CG 3.48Å; A251-E255 PolarHBondContact O-N 3.13Å; A251-E255 VanDerWaalsContact O-N 3.16Å
252	L	94	Very high	92.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-37.6	175.7	-173.1	151	0	0	0	112.4	R122 L125 C164 H167 L254 E257 G258 M261	R122-L252 HydrophobicContact CG-CB 4.17Å; L125-L252 HydrophobicContact CB-CD1 3.67Å; L125-L252 HydrophobicContact CD1-CD1 4.16Å; C164-L252 HydrophobicContact CB-CD1 4.13Å; C164-L252 HydrophobicContact CB-CD2 4.11Å; H167-L252 HydrophobicContact CB-CB 4.28Å; H167-L252 PolarHBondContact ND1-N 2.81Å; H167-L252 VanDerWaalsContact ND1-N 3.17Å; L252-L254 VanDerWaalsContact C-N 3.3Å; L252-L254 PolarHBondContact O-N 3.45Å; L252-E257 HydrophobicContact CG-CB 4.28Å; L252-G258 WeakPolarHBondContact O-CA 3.27Å; L252-G258 PolarHBondContact O-N 2.95Å; L252-M261 HydrophobicContact CD2-CE 3.81Å; L252-M261 HydrophobicContact CD2-SD 4.04Å
253	M	93.9	Very high	92.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-10.3	179.3	-64.7	-59.3	-68.6	0	0	115.2	L165 L237 L243 Y247 A251 M261	L165-M253 HydrophobicContact CD2-CE 3.86Å; L165-M253 HydrophobicContact CD2-CG 4.45Å; L165-M253 HydrophobicContact CD2-SD 3.79Å; L237-M253 HydrophobicContact CD2-CE 3.65Å; L237-M253 WeakPolarHBondContact CD2-O 3.13Å; L237-M253 HydrophobicContact CD2-SD 3.94Å; L237-M253 HydrophobicContact CG-CE 3.94Å; L243-M253 HydrophobicContact CD1-CB 4.36Å; L243-M253 WeakPolarHBondContact CD1-O 2.82Å; Y247-M253 HydrophobicContact CD1-CB 4.23Å; Y247-M253 HydrophobicContact CD2-CB 4.2Å; Y247-M253 HydrophobicContact CE1-CB 4.04Å; Y247-M253 HydrophobicContact CE1-CG 3.85Å; Y247-M253 HydrophobicContact CE2-CB 4.03Å; Y247-M253 HydrophobicContact CE2-CG 4.22Å; Y247-M253 HydrophobicContact CG-CB 4.3Å; A251-M253 PolarHBondContact O-N 3.34Å; A251-M253 VanDerWaalsContact O-N 3.11Å; M253-M261 HydrophobicContact SD-CE 3.57Å; M253-M261 VanDerWaalsContact SD-CE 3.57Å
254	L	93.8	Very high	92.5	Very high	24 Å²	24	42.8 Å²	42.8	13%	0.126	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-15	175.4	-65.1	-176.4	0	0	0	113.2	K240 L243 A251 L252	K240-L254 HydrophobicContact CB-CD2 4.15Å; K240-L254 WeakPolarHBondContact CD-O 3.25Å; K240-L254 VanDerWaalsContact CE-O 3.27Å; K240-L254 WeakPolarHBondContact CE-O 3.38Å; K240-L254 HydrophobicContact CG-CD2 4.45Å; K240-L254 PolarHBondContact NZ-O 2.72Å; L243-L254 HydrophobicContact CB-CD2 3.57Å; L243-L254 HydrophobicContact CD1-CD2 4.48Å; A251-L254 PolarHBondContact O-N 2.7Å; L252-L254 VanDerWaalsContact C-N 3.3Å; L252-L254 PolarHBondContact O-N 3.45Å
255	E	94.2	Very high	92.7	Very high	63 Å²	63	40 Å²	40	29%	0.294	24%	0.24	S	C	.	.	S	Bend	trans	-99.8	-179.6	-172.5	-68.8	-86.7	-134.2	0	0	112.4	R122 A251 E257 G258	R122-E255 IonicContact CZ-OE1 3.95Å; R122-E255 IonicContact NH1-OE1 3.23Å; R122-E255 PolarHBondContact NH1-OE1 3.34Å; R122-E255 VanDerWaalsContact NH2-CD 3.3Å; R122-E255 IonicContact NH2-OE1 2.66Å; R122-E255 PolarHBondContact NH2-OE1 3.12Å; A251-E255 WeakPolarHBondContact O-CG 3.48Å; A251-E255 PolarHBondContact O-N 3.13Å; A251-E255 VanDerWaalsContact O-N 3.16Å; E255-E257 VanDerWaalsContact C-N 3.29Å; E255-E257 VanDerWaalsContact CB-OE2 3.3Å; E255-E257 WeakPolarHBondContact CB-OE2 3.29Å; E255-E257 PolarHBondContact O-N 3.34Å; E255-G258 PolarHBondContact O-N 2.79Å
256	E	92.3	Very high	92.9	Very high	157 Å²	157	38.3 Å²	38.3	73%	0.734	24%	0.238	S	C	*	.	H	α-helix	trans	-65.3	-31.6	180	-65.9	-168.2	165	0	0	112.6	G258 A259 V260	E256-G258 VanDerWaalsContact C-N 3.25Å; E256-G258 PolarHBondContact O-N 2.66Å; E256-A259 PolarHBondContact O-N 2.74Å; E256-A259 VanDerWaalsContact O-N 3.15Å; E256-V260 WeakPolarHBondContact O-CG2 3.44Å; E256-V260 PolarHBondContact O-N 2.87Å
257	E	94.1	Very high	93	Very high	33 Å²	33	38.6 Å²	38.6	15%	0.154	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-34	179.5	-63.5	94.1	151.5	0	0	112.7	R122 L126 L252 E255 V260 M261	R122-E257 HydrophobicContact CB-CB 4.49Å; R122-E257 HydrophobicContact CB-CG 4.1Å; R122-E257 WeakPolarHBondContact CB-OE1 3.49Å; R122-E257 WeakPolarHBondContact CD-OE2 3.3Å; R122-E257 IonicContact CZ-OE1 2.73Å; R122-E257 IonicContact CZ-OE2 2.88Å; R122-E257 IonicContact NE-OE1 3.23Å; R122-E257 PolarHBondContact NE-OE1 2.8Å; R122-E257 IonicContact NE-OE2 3.66Å; R122-E257 PolarHBondContact NE-OE2 2.77Å; R122-E257 IonicContact NH2-OE1 3.59Å; R122-E257 IonicContact NH2-OE2 2.59Å; L126-E257 HydrophobicContact CB-CB 4.26Å; L126-E257 HydrophobicContact CB-CG 4.4Å; L126-E257 HydrophobicContact CD2-CB 3.87Å; L126-E257 HydrophobicContact CD2-CG 3.8Å; L252-E257 HydrophobicContact CG-CB 4.28Å; E255-E257 VanDerWaalsContact C-N 3.29Å; E255-E257 VanDerWaalsContact CB-OE2 3.3Å; E255-E257 WeakPolarHBondContact CB-OE2 3.29Å; E255-E257 PolarHBondContact O-N 3.34Å; E257-V260 PolarHBondContact O-N 3.24Å; E257-M261 WeakPolarHBondContact O-CB 3.16Å; E257-M261 PolarHBondContact O-N 2.97Å
258	G	93.2	Very high	93	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-43.6	174.7	0	0	0	0	0	112.5	L237 L252 E255 E256 V260 M261 G262	L237-G258 WeakPolarHBondContact CD1-O 3.14Å; L252-G258 WeakPolarHBondContact O-CA 3.27Å; L252-G258 PolarHBondContact O-N 2.95Å; E255-G258 PolarHBondContact O-N 2.79Å; E256-G258 VanDerWaalsContact C-N 3.25Å; E256-G258 PolarHBondContact O-N 2.66Å; G258-V260 VanDerWaalsContact C-N 3.33Å; G258-V260 PolarHBondContact O-N 3.11Å; G258-M261 WeakPolarHBondContact O-CB 3.21Å; G258-M261 PolarHBondContact O-N 3.4Å; G258-G262 PolarHBondContact O-N 2.79Å
259	A	93.1	Very high	93	Very high	61 Å²	61	37.8 Å²	37.8	50%	0.504	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-39.9	176	0	0	0	0	0	111.8	E256 G262 G263	E256-A259 PolarHBondContact O-N 2.74Å; E256-A259 VanDerWaalsContact O-N 3.15Å; A259-G262 PolarHBondContact O-N 3.05Å; A259-G263 PolarHBondContact O-N 3.35Å; A259-G263 VanDerWaalsContact O-N 3.1Å
260	V	94.4	Very high	93.2	Very high	66 Å²	66	37.7 Å²	37.7	40%	0.4	24%	0.235	S	C	.	.	H	α-helix	trans	-65.6	-40.4	174	179.2	0	0	0	0	111.3	L126 E256 E257 G258 G263 L264	L126-V260 HydrophobicContact CD1-CB 4.31Å; L126-V260 HydrophobicContact CD1-CG1 4.1Å; L126-V260 HydrophobicContact CD2-CB 4.25Å; L126-V260 HydrophobicContact CD2-CG1 4.16Å; E256-V260 WeakPolarHBondContact O-CG2 3.44Å; E256-V260 PolarHBondContact O-N 2.87Å; E257-V260 PolarHBondContact O-N 3.24Å; G258-V260 VanDerWaalsContact C-N 3.33Å; G258-V260 PolarHBondContact O-N 3.11Å; V260-G263 PolarHBondContact O-N 2.88Å; V260-L264 HydrophobicContact CG1-CD1 4.05Å; V260-L264 WeakPolarHBondContact O-CD1 3.46Å; V260-L264 VanDerWaalsContact O-CG 3.29Å; V260-L264 WeakPolarHBondContact O-CG 3.26Å; V260-L264 PolarHBondContact O-N 3.33Å; V260-L264 VanDerWaalsContact O-N 3.07Å
261	M	95	Very high	93.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-48.7	171.8	175.6	-179.9	74.6	0	0	111.3	L126 M129 L161 C164 L252 M253 E257 G258 G263 L264 L265	L126-M261 HydrophobicContact CD1-CB 4.32Å; M129-M261 HydrophobicContact CE-CG 4.41Å; M129-M261 HydrophobicContact CE-SD 3.91Å; M129-M261 HydrophobicContact CG-CG 4.02Å; M129-M261 HydrophobicContact CG-SD 4.44Å; L161-M261 HydrophobicContact CD1-SD 4.07Å; C164-M261 HydrophobicContact CB-CE 4.47Å; C164-M261 HydrophobicContact CB-SD 3.65Å; L252-M261 HydrophobicContact CD2-CE 3.81Å; L252-M261 HydrophobicContact CD2-SD 4.04Å; M253-M261 HydrophobicContact SD-CE 3.57Å; M253-M261 VanDerWaalsContact SD-CE 3.57Å; E257-M261 WeakPolarHBondContact O-CB 3.16Å; E257-M261 PolarHBondContact O-N 2.97Å; G258-M261 WeakPolarHBondContact O-CB 3.21Å; G258-M261 PolarHBondContact O-N 3.4Å; M261-G263 VanDerWaalsContact C-N 3.29Å; M261-G263 PolarHBondContact O-N 2.67Å; M261-L264 PolarHBondContact O-N 3.49Å; M261-L265 HydrophobicContact CG-CD1 4.01Å; M261-L265 HydrophobicContact CG-CG 4.32Å; M261-L265 VanDerWaalsContact O-CG 3.31Å; M261-L265 WeakPolarHBondContact O-CG 3.3Å; M261-L265 PolarHBondContact O-N 2.69Å
262	G	92	Very high	93.1	Very high	6 Å²	6	41.2 Å²	41.2	6%	0.062	25%	0.25	C	C	.	.	H	α-helix	trans	-53.4	-43.7	176.8	0	0	0	0	0	113	G258 A259	G258-G262 PolarHBondContact O-N 2.79Å; A259-G262 PolarHBondContact O-N 3.05Å
263	G	92.7	Very high	92.9	Very high	52 Å²	52	41.7 Å²	41.7	54%	0.536	25%	0.254	S	S	.	.	H	α-helix	trans	-66.3	-37.4	175.2	0	0	0	0	0	114.4	A259 V260 M261	A259-G263 PolarHBondContact O-N 3.35Å; A259-G263 VanDerWaalsContact O-N 3.1Å; V260-G263 PolarHBondContact O-N 2.88Å; M261-G263 VanDerWaalsContact C-N 3.29Å; M261-G263 PolarHBondContact O-N 2.67Å
264	L	93.8	Very high	92.6	Very high	58 Å²	58	46.6 Å²	46.6	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-69.3	-35.3	178.5	-70.3	163.2	0	0	0	112.6	L126 K130 I133 V260 M261 V266 G267	L126-L264 HydrophobicContact CD1-CD1 4.15Å; K130-L264 HydrophobicContact CD-CD1 4.33Å; K130-L264 HydrophobicContact CG-CD1 3.42Å; K130-L264 VanDerWaalsContact CG-CD1 3.42Å; K130-L264 HydrophobicContact CG-CD2 4.5Å; I133-L264 HydrophobicContact CD1-CB 3.78Å; V260-L264 HydrophobicContact CG1-CD1 4.05Å; V260-L264 WeakPolarHBondContact O-CD1 3.46Å; V260-L264 VanDerWaalsContact O-CG 3.29Å; V260-L264 WeakPolarHBondContact O-CG 3.26Å; V260-L264 PolarHBondContact O-N 3.33Å; V260-L264 VanDerWaalsContact O-N 3.07Å; M261-L264 PolarHBondContact O-N 3.49Å; L264-V266 PolarHBondContact O-N 2.72Å; L264-G267 PolarHBondContact O-N 2.7Å; L264-G267 VanDerWaalsContact O-N 3.14Å
265	L	95.8	Very high	92.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-23.6	-179.9	-70.6	166.8	0	0	0	113	I133 F157 L161 V229 A230 L233 M261 G267 L268	I133-L265 HydrophobicContact CD1-CD2 3.96Å; I133-L265 HydrophobicContact CD1-CG 4.35Å; F157-L265 HydrophobicContact CE2-CD2 3.77Å; F157-L265 HydrophobicContact CZ-CD2 3.7Å; L161-L265 HydrophobicContact CD1-CD2 4.5Å; V229-L265 HydrophobicContact CG1-CD1 4.41Å; V229-L265 HydrophobicContact CG1-CD2 4.32Å; A230-L265 HydrophobicContact CB-CB 3.89Å; L233-L265 HydrophobicContact CB-CD1 4.36Å; L233-L265 HydrophobicContact CD1-CD1 3.75Å; M261-L265 HydrophobicContact CG-CD1 4.01Å; M261-L265 HydrophobicContact CG-CG 4.32Å; M261-L265 VanDerWaalsContact O-CG 3.31Å; M261-L265 WeakPolarHBondContact O-CG 3.3Å; M261-L265 PolarHBondContact O-N 2.69Å; L265-G267 PolarHBondContact O-N 2.59Å; L265-L268 HydrophobicContact CB-CD1 4.43Å; L265-L268 HydrophobicContact CD2-CD1 3.53Å; L265-L268 VanDerWaalsContact O-CB 3.27Å; L265-L268 WeakPolarHBondContact O-CB 3.22Å; L265-L268 WeakPolarHBondContact O-CG 2.9Å; L265-L268 PolarHBondContact O-N 3.11Å
266	V	94.3	Very high	91.6	Very high	81 Å²	81	47.2 Å²	47.2	49%	0.491	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-57.8	-30.2	175.9	-178.2	0	0	0	0	111.8	A230 L264 L268 N269	A230-V266 HydrophobicContact CB-CB 4.35Å; A230-V266 HydrophobicContact CB-CG2 3.83Å; L264-V266 PolarHBondContact O-N 2.72Å; V266-L268 PolarHBondContact O-N 3.12Å; V266-N269 PolarHBondContact O-N 3.07Å
267	G	91.2	Very high	90.9	Very high	33 Å²	33	41.5 Å²	41.5	34%	0.34	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62	-21.5	176	0	0	0	0	0	114	I137 L264 L265 N269 V270	I137-G267 WeakPolarHBondContact CD1-O 3.35Å; L264-G267 PolarHBondContact O-N 2.7Å; L264-G267 VanDerWaalsContact O-N 3.14Å; L265-G267 PolarHBondContact O-N 2.59Å; G267-N269 VanDerWaalsContact C-N 3.26Å; G267-N269 PolarHBondContact O-N 2.97Å; G267-V270 WeakPolarHBondContact O-CG1 3.43Å
268	L	93.3	Very high	89.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-73.4	-15.9	-179.9	-56.1	174.9	0	0	0	113.1	I133 L136 I137 F157 L224 L265 V266 V270 I271	I133-L268 HydrophobicContact CG1-CD2 4.4Å; I133-L268 HydrophobicContact CG2-CD2 4.18Å; L136-L268 HydrophobicContact CD2-CD2 3.97Å; I137-L268 HydrophobicContact CD1-CD2 4.3Å; I137-L268 HydrophobicContact CG1-CD2 4.2Å; F157-L268 HydrophobicContact CE1-CD1 3.91Å; F157-L268 HydrophobicContact CE2-CD1 3.69Å; F157-L268 HydrophobicContact CZ-CD1 3.26Å; L224-L268 HydrophobicContact CD1-CB 4.15Å; L224-L268 HydrophobicContact CD1-CD1 4.44Å; L265-L268 HydrophobicContact CB-CD1 4.43Å; L265-L268 HydrophobicContact CD2-CD1 3.53Å; L265-L268 VanDerWaalsContact O-CB 3.27Å; L265-L268 WeakPolarHBondContact O-CB 3.22Å; L265-L268 WeakPolarHBondContact O-CG 2.9Å; L265-L268 PolarHBondContact O-N 3.11Å; V266-L268 PolarHBondContact O-N 3.12Å; L268-V270 PolarHBondContact O-N 2.84Å; L268-V270 VanDerWaalsContact O-N 3.08Å; L268-I271 HydrophobicContact CB-CD1 4.14Å; L268-I271 HydrophobicContact CD2-CD1 3.52Å; L268-I271 HydrophobicContact CG-CD1 4.43Å; L268-I271 VanDerWaalsContact O-CB 3.26Å; L268-I271 WeakPolarHBondContact O-CB 3.35Å; L268-I271 WeakPolarHBondContact O-CG1 3.11Å; L268-I271 PolarHBondContact O-N 3.34Å
269	N	92.5	Very high	88.4	Confident	54 Å²	54	46.9 Å²	46.9	29%	0.289	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-63.7	-19.2	-178.5	-65.6	6	0	0	0	112.6	K227 V266 G267 I271	K227-N269 HydrophobicContact CB-CB 4.47Å; K227-N269 WeakPolarHBondContact CD-O 3.28Å; K227-N269 PolarHBondContact NZ-O 3.36Å; K227-N269 PolarHBondContact O-OD1 3.48Å; V266-N269 PolarHBondContact O-N 3.07Å; G267-N269 VanDerWaalsContact C-N 3.26Å; G267-N269 PolarHBondContact O-N 2.97Å; N269-I271 VanDerWaalsContact C-N 3.32Å
270	V	91.1	Very high	87	Confident	86 Å²	86	51.4 Å²	51.4	52%	0.521	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-71.3	-24.1	171.8	80.4	0	0	0	0	113.1	I137 L141 G267 L268 D272	I137-V270 HydrophobicContact CG2-CG1 4.25Å; L141-V270 HydrophobicContact CD2-CG2 4.2Å; G267-V270 WeakPolarHBondContact O-CG1 3.43Å; L268-V270 PolarHBondContact O-N 2.84Å; L268-V270 VanDerWaalsContact O-N 3.08Å; V270-D272 PolarHBondContact O-N 3.38Å
271	I	91.1	Very high	85.7	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	31%	0.306	C	S	.	.			trans	-73.2	126.3	-176.2	-58.5	174.1	0	0	0	109.3	L136 I137 L147 K227 L268 N269 A273	L136-I271 HydrophobicContact CD1-CD1 4.31Å; L136-I271 HydrophobicContact CD2-CD1 3.72Å; L136-I271 HydrophobicContact CG-CD1 3.65Å; I137-I271 HydrophobicContact CG1-CD1 4.23Å; L147-I271 HydrophobicContact CD1-CG2 3.48Å; L147-I271 VanDerWaalsContact CD1-CG2 3.48Å; L147-I271 HydrophobicContact CG-CG2 4.04Å; K227-I271 PolarHBondContact NZ-O 3.01Å; L268-I271 HydrophobicContact CB-CD1 4.14Å; L268-I271 HydrophobicContact CD2-CD1 3.52Å; L268-I271 HydrophobicContact CG-CD1 4.43Å; L268-I271 VanDerWaalsContact O-CB 3.26Å; L268-I271 WeakPolarHBondContact O-CB 3.35Å; L268-I271 WeakPolarHBondContact O-CG1 3.11Å; L268-I271 PolarHBondContact O-N 3.34Å; N269-I271 VanDerWaalsContact C-N 3.32Å; I271-A273 HydrophobicContact CG2-CB 4.37Å
272	D	89.1	Confident	85	Confident	86 Å²	86	53.4 Å²	53.4	46%	0.46	31%	0.309	S	S	.	.			trans	-94	129.3	166.1	-173.5	46.3	0	0	0	109.4	T146 L147 V270	T146-D272 VanDerWaalsContact CB-OD2 3.28Å; T146-D272 WeakPolarHBondContact CB-OD2 3.44Å; T146-D272 VanDerWaalsContact CG2-OD2 3.28Å; T146-D272 WeakPolarHBondContact CG2-OD2 3.45Å; T146-D272 PolarHBondContact OG1-OD2 3.48Å; L147-D272 PolarHBondContact N-O 3.34Å; V270-D272 PolarHBondContact O-N 3.38Å
273	A	90	Very high	84.4	Confident	10 Å²	10	55 Å²	55	8%	0.083	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-148.3	133.3	-172.9	0	0	0	0	0	110.5	L147 I271 L275	L147-A273 HydrophobicContact CB-CB 4.18Å; L147-A273 WeakPolarHBondContact O-CA 3.11Å; I271-A273 HydrophobicContact CG2-CB 4.37Å; A273-L275 HydrophobicContact CB-CD2 4.2Å; A273-L275 HydrophobicContact CB-CG 4.29Å
274	N	88.7	Confident	83.3	Confident	103 Å²	103	56.6 Å²	56.6	55%	0.551	32%	0.319	S	S	*	.			trans	-129.2	95.1	176.6	-174.1	15.8	0	0	0	108.5	T146 L147	T146-N274 HydrophobicContact CG2-CB 3.71Å; L147-N274 PolarHBondContact O-N 2.78Å
275	L	86.2	Confident	81.9	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.026	32%	0.32	C	S	.	.			trans	-100.8	113.6	-166.1	-50.4	179.1	0	0	0	109.2	L154 F158 H221 M225 A273 I277	L154-L275 HydrophobicContact CD2-CD1 4.24Å; L154-L275 HydrophobicContact CD2-CD2 3.69Å; F158-L275 HydrophobicContact CE2-CD1 4.05Å; F158-L275 HydrophobicContact CZ-CD1 4.26Å; H221-L275 HydrophobicContact CB-CD1 4Å; M225-L275 HydrophobicContact CG-CB 4.35Å; M225-L275 HydrophobicContact CG-CD1 4.34Å; M225-L275 HydrophobicContact CG-CG 4.09Å; M225-L275 HydrophobicContact SD-CB 3.78Å; M225-L275 HydrophobicContact SD-CG 4.2Å; A273-L275 HydrophobicContact CB-CD2 4.2Å; A273-L275 HydrophobicContact CB-CG 4.29Å; L275-I277 VanDerWaalsContact C-N 3.31Å; L275-I277 WeakPolarHBondContact O-CG1 3.08Å; L275-I277 PolarHBondContact O-N 3.34Å
276	C	79.1	Confident	80.1	Confident	94 Å²	94	62.9 Å²	62.9	64%	0.635	36%	0.355	S	S	*	.			trans	-74	81.8	178	-66.8	0	0	0	0	110.6	K278	C276-K278 PolarHBondContact O-N 2.85Å
277	I	77.5	Confident	78.4	Confident	37 Å²	37	61.2 Å²	61.2	19%	0.19	35%	0.35	C	S	.	.			trans	-70.4	100	-175.3	-42.4	-175.7	0	0	0	110.9	L206 A218 H221 L222 L275 L282	L206-I277 HydrophobicContact CD2-CB 4.24Å; L206-I277 HydrophobicContact CD2-CG2 3.57Å; A218-I277 HydrophobicContact CB-CG2 4.23Å; H221-I277 HydrophobicContact CB-CD1 3.68Å; H221-I277 HydrophobicContact CB-CG1 4.25Å; L222-I277 HydrophobicContact CD2-CD1 3.65Å; L222-I277 HydrophobicContact CG-CD1 3.64Å; L275-I277 VanDerWaalsContact C-N 3.31Å; L275-I277 WeakPolarHBondContact O-CG1 3.08Å; L275-I277 PolarHBondContact O-N 3.34Å; I277-L282 HydrophobicContact CG2-CD1 3.48Å; I277-L282 VanDerWaalsContact CG2-CD1 3.48Å; I277-L282 HydrophobicContact CG2-CG 4.43Å
278	K	73.6	Confident	77.1	Confident	142 Å²	142	64.7 Å²	64.7	62%	0.617	36%	0.364	S	S	*	.			trans	-89.1	132.5	166.1	-61.6	176.6	-173.9	172.7	0	108.9	C276 E280 D281	C276-K278 PolarHBondContact O-N 2.85Å; K278-E280 VanDerWaalsContact C-N 3.34Å; K278-E280 PolarHBondContact O-N 3.32Å; K278-D281 WeakPolarHBondContact CB-OD2 3.26Å
279	G	62.4	Low	76	Confident	5 Å²	5	66.4 Å²	66.4	5%	0.052	37%	0.373	C	S	.	.	H	α-helix	trans	-73.9	-21.3	-174.2	0	0	0	0	0	115.3	P207 I209	P207-G279 WeakPolarHBondContact O-CA 3.42Å; I209-G279 WeakPolarHBondContact CG1-O 3.3Å
280	E	63.7	Low	74.8	Confident	155 Å²	155	67.3 Å²	67.3	72%	0.724	38%	0.378	S	S	*	.	H	α-helix	trans	-74.2	-34.5	-174.9	-55.8	-170.9	144.2	0	0	112.8	K278	K278-E280 VanDerWaalsContact C-N 3.34Å; K278-E280 PolarHBondContact O-N 3.32Å
281	D	67.4	Low	73.8	Confident	95 Å²	95	68.7 Å²	68.7	51%	0.508	38%	0.377	S	S	.	.	H	α-helix	trans	-75	-29.9	-177.8	-59.3	-57.1	0	0	0	112.9	K278 D283 S284 Q285	K278-D281 WeakPolarHBondContact CB-OD2 3.26Å; D281-D283 PolarHBondContact O-N 3.43Å; D281-S284 PolarHBondContact O-N 3.39Å; D281-S284 PolarHBondContact O-OG 3.18Å; D281-Q285 PolarHBondContact O-N 3.27Å
282	L	79.5	Confident	72.6	Confident	14 Å²	14	72.2 Å²	72.2	7%	0.073	40%	0.402	C	S	.	.	H	α-helix	trans	-75.9	-25.8	-169.2	-71.4	-172.6	0	0	0	115	I209 R217 A218 I277	I209-L282 HydrophobicContact CD1-CD1 4.05Å; R217-L282 HydrophobicContact CB-CB 4.47Å; R217-L282 HydrophobicContact CB-CD1 4.27Å; R217-L282 HydrophobicContact CB-CD2 4.11Å; R217-L282 WeakPolarHBondContact CD-O 3.49Å; R217-L282 PolarHBondContact NH1-O 3.47Å; A218-L282 HydrophobicContact CB-CD1 3.69Å; I277-L282 HydrophobicContact CG2-CD1 3.48Å; I277-L282 VanDerWaalsContact CG2-CD1 3.48Å; I277-L282 HydrophobicContact CG2-CG 4.43Å
283	D	79.6	Confident	71.1	Confident	40 Å²	40	72.9 Å²	72.9	21%	0.214	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.7	177.6	-89.9	-13.8	0	0	0	113	R210 T211 G214 D281	R210-D283 WeakPolarHBondContact CA-OD2 2.98Å; R210-D283 WeakPolarHBondContact CB-OD2 3.42Å; R210-D283 PolarHBondContact N-OD2 3.42Å; T211-D283 WeakPolarHBondContact CA-OD1 3.23Å; T211-D283 VanDerWaalsContact CB-OD1 3.22Å; T211-D283 WeakPolarHBondContact CB-OD1 3.48Å; T211-D283 HydrophobicContact CG2-CB 4.26Å; T211-D283 WeakPolarHBondContact CG2-OD1 3.13Å; T211-D283 PolarHBondContact N-OD1 3.16Å; T211-D283 PolarHBondContact N-OD2 3.41Å; T211-D283 PolarHBondContact OG1-OD1 2.78Å; G214-D283 WeakPolarHBondContact CA-OD1 3.08Å; D281-D283 PolarHBondContact O-N 3.43Å
284	S	69.8	Low	69.8	Low	85 Å²	85	75.7 Å²	75.7	59%	0.594	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-12.4	-165.4	61.9	0	0	0	0	114.9	D281 V286	D281-S284 PolarHBondContact O-N 3.39Å; D281-S284 PolarHBondContact O-OG 3.18Å; S284-V286 PolarHBondContact O-N 3.09Å; S284-V286 VanDerWaalsContact O-N 3.13Å
285	Q	65.1	Low	68.3	Low	69 Å²	69	77.1 Å²	77.1	32%	0.322	42%	0.421	S	S	.	.			trans	-52.4	117	-175.3	-165.6	-178.5	33.9	0	0	113.2	R217 D281	R217-Q285 PolarHBondContact NH1-O 3.18Å; R217-Q285 PolarHBondContact NH2-O 3.06Å; D281-Q285 PolarHBondContact O-N 3.27Å
286	V	56.8	Low	66.2	Low	122 Å²	122	86.8 Å²	86.8	74%	0.739	46%	0.463	S	S	*	.			trans	-75.3	123.6	-178	-177.2	0	0	0	0	110.2	S284 V288	S284-V286 PolarHBondContact O-N 3.09Å; S284-V286 VanDerWaalsContact O-N 3.13Å; V286-V288 HydrophobicContact CG1-CG2 4.28Å; V286-V288 PolarHBondContact O-N 2.89Å
287	A	57.8	Low	64.2	Low	46 Å²	46	90.7 Å²	90.7	38%	0.38	48%	0.477	S	S	.	.			trans	-85.8	100.5	-178.1	0	0	0	0	0	111.8	L159	L159-A287 HydrophobicContact CD2-CB 3.74Å
288	V	64	Low	62.2	Low	105 Å²	105	93 Å²	93	64%	0.636	50%	0.502	S	S	*	.			trans	-118.5	130.9	166.5	-177	0	0	0	0	108.4	V286	V286-V288 HydrophobicContact CG1-CG2 4.28Å; V286-V288 PolarHBondContact O-N 2.89Å
289	I	70.6	Confident	60.8	Low	37 Å²	37	92.8 Å²	92.8	19%	0.19	51%	0.513	C	S	.	.			trans	-93.3	117.2	171.8	-64.3	-178.8	0	0	0	107.3	M128 V160 F291	M128-I289 HydrophobicContact SD-CD1 4.31Å; V160-I289 HydrophobicContact CG2-CD1 4.29Å; I289-F291 HydrophobicContact CB-CE2 4.11Å; I289-F291 HydrophobicContact CB-CZ 4.21Å; I289-F291 HydrophobicContact CG2-CD1 4.31Å; I289-F291 HydrophobicContact CG2-CD2 4.26Å; I289-F291 HydrophobicContact CG2-CE1 3.84Å; I289-F291 HydrophobicContact CG2-CE2 3.79Å; I289-F291 HydrophobicContact CG2-CZ 3.56Å; I289-F291 PolarHBondContact O-N 2.89Å
290	D	68.1	Low	59.6	Low	74 Å²	74	98.5 Å²	98.5	40%	0.396	55%	0.552	S	S	.	*			trans	-85	113.2	175.7	-178.1	21.9	0	0	0	110.7	S292	D290-S292 VanDerWaalsContact CG-OG 3.29Å; D290-S292 WeakPolarHBondContact OD1-CB 3.37Å; D290-S292 PolarHBondContact OD1-N 3.4Å; D290-S292 PolarHBondContact OD1-OG 2.82Å; D290-S292 PolarHBondContact OD2-OG 2.81Å
291	F	70.8	Confident	58.6	Low	114 Å²	114	96.9 Å²	96.9	50%	0.5	56%	0.558	S	S	.	*			trans	-85.1	-7.7	175.9	-65	-78.3	0	0	0	113.6	I289 L293 Y294	I289-F291 HydrophobicContact CB-CE2 4.11Å; I289-F291 HydrophobicContact CB-CZ 4.21Å; I289-F291 HydrophobicContact CG2-CD1 4.31Å; I289-F291 HydrophobicContact CG2-CD2 4.26Å; I289-F291 HydrophobicContact CG2-CE1 3.84Å; I289-F291 HydrophobicContact CG2-CE2 3.79Å; I289-F291 HydrophobicContact CG2-CZ 3.56Å; I289-F291 PolarHBondContact O-N 2.89Å; F291-L293 PolarHBondContact O-N 2.73Å; F291-Y294 HydrophobicContact CD1-CD2 4.37Å; F291-Y294 PolarHBondContact O-N 2.98Å; F291-Y294 VanDerWaalsContact O-N 3.09Å
292	S	64.2	Low	57.3	Low	79 Å²	79	101.7 Å²	101.7	55%	0.552	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-62.8	-28.6	-178.7	87.8	0	0	0	0	113	D290 Y294	D290-S292 VanDerWaalsContact CG-OG 3.29Å; D290-S292 WeakPolarHBondContact OD1-CB 3.37Å; D290-S292 PolarHBondContact OD1-N 3.4Å; D290-S292 PolarHBondContact OD1-OG 2.82Å; D290-S292 PolarHBondContact OD2-OG 2.81Å; S292-Y294 PolarHBondContact O-N 3.36Å
293	L	57.9	Low	55.8	Low	100 Å²	100	107.6 Å²	107.6	52%	0.524	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-61.5	-9.3	174.3	-64.7	174.9	0	0	0	114.1	F291	F291-L293 PolarHBondContact O-N 2.73Å
294	Y	62.3	Low	54.5	Low	69 Å²	69	111.9 Å²	111.9	27%	0.271	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-124.8	6.9	-170.9	-46.1	-63	0	0	0	114.9	L131 V135 F291 S292	L131-Y294 HydrophobicContact CD1-CD1 4.27Å; L131-Y294 HydrophobicContact CD1-CE1 4.18Å; L131-Y294 HydrophobicContact CD2-CD1 3.76Å; L131-Y294 HydrophobicContact CD2-CD2 4.33Å; L131-Y294 HydrophobicContact CD2-CE1 3.73Å; L131-Y294 HydrophobicContact CD2-CE2 4.33Å; L131-Y294 HydrophobicContact CD2-CG 4.07Å; L131-Y294 HydrophobicContact CG-CD1 4.16Å; L131-Y294 HydrophobicContact CG-CE1 3.78Å; V135-Y294 HydrophobicContact CG2-CE1 4.21Å; F291-Y294 HydrophobicContact CD1-CD2 4.37Å; F291-Y294 PolarHBondContact O-N 2.98Å; F291-Y294 VanDerWaalsContact O-N 3.09Å; S292-Y294 PolarHBondContact O-N 3.36Å
295	L	58.1	Low	53.3	Low	132 Å²	132	118.3 Å²	118.3	69%	0.691	66%	0.661	S	S	*	*			trans	-140	116.6	-169.5	-63.1	171.8	0	0	0	114.2
296	K	41.6	Very low	52.4	Low	208 Å²	208	122.5 Å²	122.5	90%	0.904	69%	0.686	S	S	*	*			trans	-171	135.6	169.7	-113.7	165.5	-175.8	171.5	0	114.1
297	D	38.3	Very low	51.6	Low	177 Å²	177	124.1 Å²	124.1	95%	0.947	69%	0.69	S	S	*	*			trans	-172.5	-179.7	155.8	-102.3	-27.3	0	0	0	111.9
298	A	35.1	Very low	50.7	Low	86 Å²	86	124.4 Å²	124.4	71%	0.711	70%	0.698	S	S	*	*			trans	-145.7	175.7	-145.9	0	0	0	0	0	122.4
299	T	43.5	Very low	49.6	Very low	137 Å²	137	130 Å²	130	84%	0.84	71%	0.713	S	S	*	*			trans	75.6	138.6	152.5	53.1	0	0	0	0	126.8
300	S	37.8	Very low	47.6	Very low	124 Å²	124	136.6 Å²	136.6	87%	0.867	75%	0.746	S	S	*	*			trans	154.8	155.9	137.5	53.4	0	0	0	0	117.9
301	S	42.9	Very low	46.5	Very low	122 Å²	122	139.7 Å²	139.7	85%	0.853	77%	0.767	S	S	*	*			trans	-173.6	159.4	165.9	64.8	0	0	0	0	116
302	E	39.9	Very low	45.5	Very low	196 Å²	196	137.6 Å²	137.6	92%	0.916	77%	0.771	S	S	*	*			trans	-162	-178.7	171.2	-84	-142.9	147.8	0	0	115.6
303	T	47.9	Very low	45	Very low	137 Å²	137	140.8 Å²	140.8	84%	0.84	78%	0.781	S	S	*	*			trans	-148.1	168.6	-167.6	60.9	0	0	0	0	118.9
304	P	51.3	Low	44.7	Very low	130 Å²	130	144.5 Å²	144.5	84%	0.844	80%	0.8	S	S	*	*			trans	-130.6	-168.7	-176.7	42.6	-26.1	0	0	0	118.7
305	K	44.6	Very low	44.2	Very low	221 Å²	221	144.4 Å²	144.4	96%	0.961	80%	0.804	S	S	*	*			trans	-150.5	-173.8	-173.8	-129.1	-178	-177	-174.8	0	118.4
306	D	46.2	Very low	43.9	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	80%	0.8	S	S	*	*			trans	-144.6	164.6	-150.9	176.8	49.1	0	0	0	117.8
307	D	40.1	Very low	44.7	Very low	156 Å²	156	141 Å²	141	83%	0.834	79%	0.786	S	S	*	*			trans	-177.8	161.4	164.3	-170.6	52.9	0	0	0	111
308	G	39.8	Very low	45.9	Very low	52 Å²	52	137.9 Å²	137.9	54%	0.536	77%	0.765	S	S	.	*			cis	-179.3	-176.2	6.6	0	0	0	0	0	113.7
309	K	40.9	Very low	47.4	Very low	222 Å²	222	139.8 Å²	139.8	97%	0.965	76%	0.755	S	S	*	*			trans	-158.5	158.7	-177.8	-76.4	-173.8	178.9	178.2	0	116
310	M	29.2	Very low	48.8	Very low	176 Å²	176	137.8 Å²	137.8	87%	0.867	74%	0.738	S	S	*	*			trans	-165.6	85.1	163.3	-173	56.9	156.3	0	0	117.8
311	T	44.3	Very low	50.6	Low	139 Å²	139	136.7 Å²	136.7	85%	0.853	72%	0.719	S	S	*	*			trans	-158.9	96.5	157.6	-22.7	0	0	0	0	112.1
312	A	49.9	Very low	52	Low	70 Å²	70	134 Å²	134	58%	0.579	69%	0.693	S	S	*	*			trans	-128.6	13.3	-150.8	0	0	0	0	0	119.7
313	I	53.4	Low	53.8	Low	146 Å²	146	128.1 Å²	128.1	75%	0.749	67%	0.667	S	S	*	*	S	Bend	trans	-115.1	-44.9	-170.1	-59.7	-178.6	0	0	0	115	D315 Q316	I313-D315 PolarHBondContact O-N 3.23Å; I313-Q316 PolarHBondContact O-N 3.22Å
314	L	51.3	Low	55.2	Low	177 Å²	177	126 Å²	126	93%	0.927	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-22.2	167.6	-79.7	171.1	0	0	0	112	Q316	L314-Q316 VanDerWaalsContact C-N 3.29Å; L314-Q316 PolarHBondContact O-N 3.39Å
315	D	53	Low	56.7	Low	67 Å²	67	127.8 Å²	127.8	36%	0.358	64%	0.641	S	S	.	*	H	α-helix	trans	-65.4	-30.8	175.9	-155.5	20	0	0	0	111.4	I313 K317 H318 Y319	I313-D315 PolarHBondContact O-N 3.23Å; D315-K317 VanDerWaalsContact C-N 3.28Å; D315-K317 CarbonylContact O-C 3.13Å; D315-K317 PolarHBondContact O-N 3.02Å; D315-H318 CarbonylContact O-C 3.35Å; D315-H318 WeakPolarHBondContact O-CA 3.45Å; D315-H318 PolarHBondContact O-N 3.28Å; D315-H318 IonicContact OD1-CD2 2.7Å; D315-Y319 WeakPolarHBondContact O-CB 2.86Å; D315-Y319 PolarHBondContact O-N 3.11Å
316	Q	51.7	Low	58.5	Low	131 Å²	131	123 Å²	123	61%	0.612	62%	0.622	S	S	*	*	H	α-helix	trans	-57.9	-27.9	-159.9	-153.5	173.7	24	0	0	116.4	I313 L314 I320	I313-Q316 PolarHBondContact O-N 3.22Å; L314-Q316 VanDerWaalsContact C-N 3.29Å; L314-Q316 PolarHBondContact O-N 3.39Å; Q316-I320 WeakPolarHBondContact O-CD1 3.15Å; Q316-I320 VanDerWaalsContact O-CG1 3.3Å; Q316-I320 WeakPolarHBondContact O-CG1 3.3Å; Q316-I320 PolarHBondContact O-N 3.43Å
317	K	57.8	Low	60.3	Low	138 Å²	138	120 Å²	120	60%	0.6	61%	0.605	S	S	*	*	H	α-helix	trans	-81.4	-45.7	169	179.9	177	177.6	-71.5	0	112.3	D315 I320 E321	D315-K317 VanDerWaalsContact C-N 3.28Å; D315-K317 CarbonylContact O-C 3.13Å; D315-K317 PolarHBondContact O-N 3.02Å; K317-I320 PolarHBondContact O-N 3.42Å; K317-E321 WeakPolarHBondContact CE-OE1 3.44Å; K317-E321 IonicContact NZ-OE1 3.62Å; K317-E321 PolarHBondContact NZ-OE1 2.84Å; K317-E321 IonicContact NZ-OE2 2.64Å; K317-E321 PolarHBondContact NZ-OE2 2.97Å; K317-E321 PolarHBondContact O-N 3.01Å
318	H	62.9	Low	62.4	Low	112 Å²	112	116.1 Å²	116.1	52%	0.519	59%	0.59	S	S	.	*	H	α-helix	trans	-60.2	-48.5	176.9	-177.3	44.3	0	0	0	110.4	D315 I320 E321 E322	D315-H318 CarbonylContact O-C 3.35Å; D315-H318 WeakPolarHBondContact O-CA 3.45Å; D315-H318 PolarHBondContact O-N 3.28Å; D315-H318 IonicContact OD1-CD2 2.7Å; H318-I320 VanDerWaalsContact C-N 3.29Å; H318-I320 PolarHBondContact O-N 2.91Å; H318-E321 CarbonylContact O-C 3.56Å; H318-E321 PolarHBondContact O-N 2.66Å; H318-E321 VanDerWaalsContact O-N 3.09Å; H318-E322 WeakPolarHBondContact O-CA 3.41Å; H318-E322 WeakPolarHBondContact O-CB 3.24Å; H318-E322 PolarHBondContact O-N 3.27Å
319	Y	66.1	Low	64.7	Low	126 Å²	126	115.1 Å²	115.1	49%	0.494	58%	0.58	S	S	.	*	H	α-helix	trans	-48.8	-38.6	166.6	-178.1	-91.6	0	0	0	113.9	D315 L323	D315-Y319 WeakPolarHBondContact O-CB 2.86Å; D315-Y319 PolarHBondContact O-N 3.11Å; Y319-L323 HydrophobicContact CE1-CD2 4.07Å; Y319-L323 WeakPolarHBondContact O-CA 3.19Å; Y319-L323 WeakPolarHBondContact O-CB 3.38Å; Y319-L323 PolarHBondContact O-N 3.41Å
320	I	73.4	Confident	67	Low	94 Å²	94	107.1 Å²	107.1	48%	0.482	55%	0.55	S	S	.	.	H	α-helix	trans	-75.6	-38.9	175.6	-75	170	0	0	0	111.6	Q316 K317 H318 N324	Q316-I320 WeakPolarHBondContact O-CD1 3.15Å; Q316-I320 VanDerWaalsContact O-CG1 3.3Å; Q316-I320 WeakPolarHBondContact O-CG1 3.3Å; Q316-I320 PolarHBondContact O-N 3.43Å; K317-I320 PolarHBondContact O-N 3.42Å; H318-I320 VanDerWaalsContact C-N 3.29Å; H318-I320 PolarHBondContact O-N 2.91Å; I320-N324 VanDerWaalsContact O-CB 3.29Å; I320-N324 WeakPolarHBondContact O-CB 3.45Å; I320-N324 PolarHBondContact O-N 2.96Å; I320-N324 PolarHBondContact O-ND2 2.95Å
321	E	76	Confident	69.9	Low	102 Å²	102	102.9 Å²	102.9	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-69.7	-36.8	176.5	-70.1	171.3	145.3	0	0	111.6	K317 H318 R325	K317-E321 WeakPolarHBondContact CE-OE1 3.44Å; K317-E321 IonicContact NZ-OE1 3.62Å; K317-E321 PolarHBondContact NZ-OE1 2.84Å; K317-E321 IonicContact NZ-OE2 2.64Å; K317-E321 PolarHBondContact NZ-OE2 2.97Å; K317-E321 PolarHBondContact O-N 3.01Å; H318-E321 CarbonylContact O-C 3.56Å; H318-E321 PolarHBondContact O-N 2.66Å; H318-E321 VanDerWaalsContact O-N 3.09Å; E321-R325 WeakPolarHBondContact O-CB 3.18Å; E321-R325 PolarHBondContact O-N 3.02Å
322	E	72.7	Confident	72.1	Confident	66 Å²	66	100.6 Å²	100.6	31%	0.308	52%	0.52	S	S	.	.	H	α-helix	trans	-78.6	-37.1	177.1	-174.2	63.4	-171.9	0	0	111.8	H318 N324 R325 H326	H318-E322 WeakPolarHBondContact O-CA 3.41Å; H318-E322 WeakPolarHBondContact O-CB 3.24Å; H318-E322 PolarHBondContact O-N 3.27Å; E322-N324 VanDerWaalsContact C-N 3.35Å; E322-R325 VanDerWaalsContact CD-NH2 3.27Å; E322-R325 PolarHBondContact O-N 3.08Å; E322-R325 IonicContact OE1-CZ 2.7Å; E322-R325 IonicContact OE1-NE 3.72Å; E322-R325 IonicContact OE1-NH2 3.6Å; E322-R325 PolarHBondContact OE1-NH2 2.95Å; E322-R325 IonicContact OE2-CZ 3.03Å; E322-R325 VanDerWaalsContact OE2-CZ 3.27Å; E322-R325 IonicContact OE2-NE 3.55Å; E322-R325 PolarHBondContact OE2-NE 3.26Å; E322-R325 IonicContact OE2-NH2 2.72Å; E322-R325 PolarHBondContact OE2-NH2 3Å; E322-H326 WeakPolarHBondContact O-CB 2.93Å; E322-H326 PolarHBondContact O-N 3.26Å
323	L	76.8	Confident	74	Confident	71 Å²	71	101.8 Å²	101.8	37%	0.372	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-40.2	169.3	178.8	63.7	0	0	0	110.1	Y319 H326 L327	Y319-L323 HydrophobicContact CE1-CD2 4.07Å; Y319-L323 WeakPolarHBondContact O-CA 3.19Å; Y319-L323 WeakPolarHBondContact O-CB 3.38Å; Y319-L323 PolarHBondContact O-N 3.41Å; L323-H326 CarbonylContact O-C 3.47Å; L323-H326 PolarHBondContact O-N 2.98Å; L323-L327 HydrophobicContact CD1-CD1 4.14Å; L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.26Å; L323-L327 PolarHBondContact O-N 3.25Å
324	N	78.4	Confident	75.8	Confident	93 Å²	93	99.7 Å²	99.7	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-42.6	171.2	-84	-29.7	0	0	0	111.6	I320 E322 H326 L327 S328	I320-N324 VanDerWaalsContact O-CB 3.29Å; I320-N324 WeakPolarHBondContact O-CB 3.45Å; I320-N324 PolarHBondContact O-N 2.96Å; I320-N324 PolarHBondContact O-ND2 2.95Å; E322-N324 VanDerWaalsContact C-N 3.35Å; N324-H326 VanDerWaalsContact C-N 3.32Å; N324-H326 PolarHBondContact O-N 3.34Å; N324-L327 PolarHBondContact O-N 3.29Å; N324-S328 WeakPolarHBondContact O-CB 3.06Å; N324-S328 PolarHBondContact O-N 3.3Å; N324-S328 PolarHBondContact O-OG 3.36Å
325	R	82.8	Confident	77.8	Confident	167 Å²	167	95.8 Å²	95.8	63%	0.63	48%	0.484	S	S	*	.	H	α-helix	trans	-60.5	-41.7	174.6	-167.4	171.3	75.6	113.8	1.1	111.7	E321 E322 G329	E321-R325 WeakPolarHBondContact O-CB 3.18Å; E321-R325 PolarHBondContact O-N 3.02Å; E322-R325 VanDerWaalsContact CD-NH2 3.27Å; E322-R325 PolarHBondContact O-N 3.08Å; E322-R325 IonicContact OE1-CZ 2.7Å; E322-R325 IonicContact OE1-NE 3.72Å; E322-R325 IonicContact OE1-NH2 3.6Å; E322-R325 PolarHBondContact OE1-NH2 2.95Å; E322-R325 IonicContact OE2-CZ 3.03Å; E322-R325 VanDerWaalsContact OE2-CZ 3.27Å; E322-R325 IonicContact OE2-NE 3.55Å; E322-R325 PolarHBondContact OE2-NE 3.26Å; E322-R325 IonicContact OE2-NH2 2.72Å; E322-R325 PolarHBondContact OE2-NH2 3Å; R325-G329 PolarHBondContact O-N 3.23Å
326	H	81.1	Confident	79.7	Confident	121 Å²	121	95.4 Å²	95.4	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-70.8	-35.5	175.9	-168.7	-69.6	0	0	0	112	E322 L323 N324 T330	E322-H326 WeakPolarHBondContact O-CB 2.93Å; E322-H326 PolarHBondContact O-N 3.26Å; L323-H326 CarbonylContact O-C 3.47Å; L323-H326 PolarHBondContact O-N 2.98Å; N324-H326 VanDerWaalsContact C-N 3.32Å; N324-H326 PolarHBondContact O-N 3.34Å; H326-T330 PolarHBondContact ND1-OG1 3.42Å; H326-T330 VanDerWaalsContact O-CB 3.25Å; H326-T330 WeakPolarHBondContact O-CB 3.4Å; H326-T330 PolarHBondContact O-N 2.94Å; H326-T330 PolarHBondContact O-OG1 3.34Å
327	L	84.9	Confident	81.7	Confident	93 Å²	93	95 Å²	95	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-68.5	-45.6	173.8	-124.2	70.5	0	0	0	110.5	L323 N324 G329 T330 V331	L323-L327 HydrophobicContact CD1-CD1 4.14Å; L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.26Å; L323-L327 PolarHBondContact O-N 3.25Å; N324-L327 PolarHBondContact O-N 3.29Å; L327-G329 VanDerWaalsContact C-N 3.32Å; L327-G329 PolarHBondContact O-N 3.35Å; L327-T330 CarbonylContact O-C 3.55Å; L327-T330 PolarHBondContact O-N 3.09Å; L327-V331 VanDerWaalsContact O-CB 3.31Å; L327-V331 WeakPolarHBondContact O-CB 3.22Å; L327-V331 VanDerWaalsContact O-CG2 3.24Å; L327-V331 WeakPolarHBondContact O-CG2 3.46Å; L327-V331 PolarHBondContact O-N 3.28Å
328	S	84.5	Confident	83.4	Confident	75 Å²	75	92.9 Å²	92.9	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-62.1	-39.4	174.1	-64.8	0	0	0	0	112	N324 T332	N324-S328 WeakPolarHBondContact O-CB 3.06Å; N324-S328 PolarHBondContact O-N 3.3Å; N324-S328 PolarHBondContact O-OG 3.36Å; S328-T332 WeakPolarHBondContact O-CB 3.47Å; S328-T332 PolarHBondContact O-N 3.36Å; S328-T332 PolarHBondContact O-OG1 3.21Å
329	G	88.1	Confident	84.9	Confident	32 Å²	32	90.3 Å²	90.3	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-61.9	-49.8	170.4	0	0	0	0	0	112	R325 L327 V331 T332 D333	R325-G329 PolarHBondContact O-N 3.23Å; L327-G329 VanDerWaalsContact C-N 3.32Å; L327-G329 PolarHBondContact O-N 3.35Å; G329-V331 VanDerWaalsContact C-N 3.32Å; G329-V331 PolarHBondContact O-N 3.42Å; G329-T332 CarbonylContact O-C 3.5Å; G329-T332 WeakPolarHBondContact O-CB 3.2Å; G329-T332 PolarHBondContact O-N 2.95Å; G329-T332 VanDerWaalsContact O-N 3.1Å; G329-D333 WeakPolarHBondContact O-CB 3.32Å; G329-D333 PolarHBondContact O-N 3.18Å
330	T	87.8	Confident	86.2	Confident	53 Å²	53	87.4 Å²	87.4	33%	0.325	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-39.1	177.8	-56.3	0	0	0	0	111.8	H326 L327 D333 L334	H326-T330 PolarHBondContact ND1-OG1 3.42Å; H326-T330 VanDerWaalsContact O-CB 3.25Å; H326-T330 WeakPolarHBondContact O-CB 3.4Å; H326-T330 PolarHBondContact O-N 2.94Å; H326-T330 PolarHBondContact O-OG1 3.34Å; L327-T330 CarbonylContact O-C 3.55Å; L327-T330 PolarHBondContact O-N 3.09Å; T330-D333 PolarHBondContact O-N 3.21Å; T330-L334 HydrophobicContact CG2-CD1 3.95Å; T330-L334 HydrophobicContact CG2-CG 4.36Å; T330-L334 VanDerWaalsContact O-CB 3.24Å; T330-L334 WeakPolarHBondContact O-CB 3.28Å; T330-L334 WeakPolarHBondContact O-CG 3.15Å; T330-L334 PolarHBondContact O-N 3.3Å
331	V	91.3	Very high	87.2	Confident	87 Å²	87	88.5 Å²	88.5	53%	0.527	47%	0.473	S	S	.	.	H	α-helix	trans	-67.6	-38.1	175	166.1	0	0	0	0	110.8	L327 G329 L334 Q335	L327-V331 VanDerWaalsContact O-CB 3.31Å; L327-V331 WeakPolarHBondContact O-CB 3.22Å; L327-V331 VanDerWaalsContact O-CG2 3.24Å; L327-V331 WeakPolarHBondContact O-CG2 3.46Å; L327-V331 PolarHBondContact O-N 3.28Å; G329-V331 VanDerWaalsContact C-N 3.32Å; G329-V331 PolarHBondContact O-N 3.42Å; V331-L334 PolarHBondContact O-N 3.2Å; V331-Q335 VanDerWaalsContact O-CB 3.28Å; V331-Q335 WeakPolarHBondContact O-CB 3.16Å; V331-Q335 PolarHBondContact O-N 3.48Å
332	T	90.3	Very high	88.1	Confident	92 Å²	92	88.9 Å²	88.9	56%	0.564	48%	0.475	S	S	*	.	H	α-helix	trans	-69.2	-41.1	175.6	-57.1	0	0	0	0	111.3	S328 G329 Q335 A336	S328-T332 WeakPolarHBondContact O-CB 3.47Å; S328-T332 PolarHBondContact O-N 3.36Å; S328-T332 PolarHBondContact O-OG1 3.21Å; G329-T332 CarbonylContact O-C 3.5Å; G329-T332 WeakPolarHBondContact O-CB 3.2Å; G329-T332 PolarHBondContact O-N 2.95Å; G329-T332 VanDerWaalsContact O-N 3.1Å; T332-Q335 PolarHBondContact O-N 3.26Å; T332-A336 WeakPolarHBondContact O-CB 3.48Å; T332-A336 PolarHBondContact O-N 3.48Å
333	D	89.7	Confident	89.1	Confident	95 Å²	95	92.4 Å²	92.4	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-39.2	173.7	-82.9	3.6	0	0	0	112.2	G329 T330 K337	G329-D333 WeakPolarHBondContact O-CB 3.32Å; G329-D333 PolarHBondContact O-N 3.18Å; T330-D333 PolarHBondContact O-N 3.21Å; D333-K337 WeakPolarHBondContact O-CB 3.1Å; D333-K337 WeakPolarHBondContact O-CD 3.12Å; D333-K337 WeakPolarHBondContact O-CG 3.43Å; D333-K337 PolarHBondContact O-N 3.2Å
334	L	91.6	Very high	90	Very high	102 Å²	102	92.3 Å²	92.3	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-69.7	-38.1	174.9	-75.6	171.6	0	0	0	111.3	T330 V331 K337 M338	T330-L334 HydrophobicContact CG2-CD1 3.95Å; T330-L334 HydrophobicContact CG2-CG 4.36Å; T330-L334 VanDerWaalsContact O-CB 3.24Å; T330-L334 WeakPolarHBondContact O-CB 3.28Å; T330-L334 WeakPolarHBondContact O-CG 3.15Å; T330-L334 PolarHBondContact O-N 3.3Å; V331-L334 PolarHBondContact O-N 3.2Å; L334-K337 PolarHBondContact O-N 2.97Å; L334-M338 WeakPolarHBondContact O-CB 3.4Å; L334-M338 PolarHBondContact O-N 3.07Å
335	Q	93	Very high	90.7	Very high	95 Å²	95	93.2 Å²	93.2	44%	0.444	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-47.6	172.6	-169.7	63.9	59.8	0	0	110.6	V331 T332 K337 M338 D339	V331-Q335 VanDerWaalsContact O-CB 3.28Å; V331-Q335 WeakPolarHBondContact O-CB 3.16Å; V331-Q335 PolarHBondContact O-N 3.48Å; T332-Q335 PolarHBondContact O-N 3.26Å; Q335-K337 VanDerWaalsContact C-N 3.26Å; Q335-K337 PolarHBondContact O-N 3.42Å; Q335-M338 CarbonylContact O-C 3.44Å; Q335-M338 WeakPolarHBondContact O-CA 3.43Å; Q335-M338 WeakPolarHBondContact O-CB 3.42Å; Q335-M338 PolarHBondContact O-N 3.28Å; Q335-D339 PolarHBondContact NE2-OD1 3.05Å; Q335-D339 WeakPolarHBondContact O-CB 3.42Å; Q335-D339 PolarHBondContact O-N 3.42Å
336	A	92.4	Very high	91.3	Very high	58 Å²	58	88 Å²	88	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-60.2	-35.6	175.9	0	0	0	0	0	112.6	T332 S340	T332-A336 WeakPolarHBondContact O-CB 3.48Å; T332-A336 PolarHBondContact O-N 3.48Å; A336-S340 VanDerWaalsContact O-CB 3.24Å; A336-S340 WeakPolarHBondContact O-CB 3.4Å; A336-S340 PolarHBondContact O-N 3.46Å
337	K	93.4	Very high	92	Very high	123 Å²	123	87.8 Å²	87.8	54%	0.535	48%	0.484	S	S	.	.	H	α-helix	trans	-69.7	-39.6	171.7	-74.6	163.2	-173.6	161.7	0	112.3	D333 L334 Q335 S340 L341	D333-K337 WeakPolarHBondContact O-CB 3.1Å; D333-K337 WeakPolarHBondContact O-CD 3.12Å; D333-K337 WeakPolarHBondContact O-CG 3.43Å; D333-K337 PolarHBondContact O-N 3.2Å; L334-K337 PolarHBondContact O-N 2.97Å; Q335-K337 VanDerWaalsContact C-N 3.26Å; Q335-K337 PolarHBondContact O-N 3.42Å; K337-S340 PolarHBondContact O-N 3.1Å; K337-L341 WeakPolarHBondContact O-CB 3.37Å; K337-L341 VanDerWaalsContact O-CG 3.24Å; K337-L341 WeakPolarHBondContact O-CG 3.37Å; K337-L341 PolarHBondContact O-N 3.35Å
338	M	94.8	Very high	92.5	Very high	94 Å²	94	88.2 Å²	88.2	46%	0.463	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-53.5	174.8	179.5	170	169.6	0	0	110.8	L334 Q335 S340 L341 E342	L334-M338 WeakPolarHBondContact O-CB 3.4Å; L334-M338 PolarHBondContact O-N 3.07Å; Q335-M338 CarbonylContact O-C 3.44Å; Q335-M338 WeakPolarHBondContact O-CA 3.43Å; Q335-M338 WeakPolarHBondContact O-CB 3.42Å; Q335-M338 PolarHBondContact O-N 3.28Å; M338-S340 PolarHBondContact O-N 3.36Å; M338-L341 PolarHBondContact O-N 3.04Å; M338-E342 WeakPolarHBondContact CE-OE1 3.05Å; M338-E342 WeakPolarHBondContact O-CG 3.06Å; M338-E342 PolarHBondContact O-N 3.15Å
339	D	93.9	Very high	93	Very high	58 Å²	58	90 Å²	90	31%	0.31	49%	0.489	S	S	.	.	H	α-helix	trans	-53.8	-38.7	173.9	-71.1	24	0	0	0	112.3	Q335 K343	Q335-D339 PolarHBondContact NE2-OD1 3.05Å; Q335-D339 WeakPolarHBondContact O-CB 3.42Å; Q335-D339 PolarHBondContact O-N 3.42Å; D339-K343 WeakPolarHBondContact O-CB 3.41Å; D339-K343 VanDerWaalsContact O-CD 3.25Å; D339-K343 WeakPolarHBondContact O-CD 3.45Å; D339-K343 WeakPolarHBondContact O-CG 3.33Å; D339-K343 PolarHBondContact O-N 3.3Å
340	S	93.8	Very high	93.4	Very high	65 Å²	65	94 Å²	94	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-71.2	-41.8	176.3	-172.2	0	0	0	0	112	A336 K337 M338 K343 T344	A336-S340 VanDerWaalsContact O-CB 3.24Å; A336-S340 WeakPolarHBondContact O-CB 3.4Å; A336-S340 PolarHBondContact O-N 3.46Å; K337-S340 PolarHBondContact O-N 3.1Å; M338-S340 PolarHBondContact O-N 3.36Å; S340-K343 PolarHBondContact O-N 2.98Å; S340-T344 PolarHBondContact O-N 3.37Å; S340-T344 PolarHBondContact O-OG1 3.05Å
341	L	93.5	Very high	93.7	Very high	116 Å²	116	96.1 Å²	96.1	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-65.8	-43.6	177.9	-77.6	168.1	0	0	0	111	K337 M338 K343 T344 N345	K337-L341 WeakPolarHBondContact O-CB 3.37Å; K337-L341 VanDerWaalsContact O-CG 3.24Å; K337-L341 WeakPolarHBondContact O-CG 3.37Å; K337-L341 PolarHBondContact O-N 3.35Å; M338-L341 PolarHBondContact O-N 3.04Å; L341-K343 PolarHBondContact O-N 3.15Å; L341-T344 WeakPolarHBondContact CA-OG1 3.47Å; L341-T344 PolarHBondContact O-N 3.45Å; L341-T344 PolarHBondContact O-OG1 3.41Å; L341-N345 VanDerWaalsContact O-CB 3.3Å; L341-N345 WeakPolarHBondContact O-CB 3.43Å; L341-N345 PolarHBondContact O-N 3.19Å
342	E	94.4	Very high	93.9	Very high	110 Å²	110	97.3 Å²	97.3	51%	0.514	51%	0.508	S	S	.	.	H	α-helix	trans	-58.8	-45.5	174.2	-72.8	-177.1	174	0	0	111.7	M338 T344 N345 S346	M338-E342 WeakPolarHBondContact CE-OE1 3.05Å; M338-E342 WeakPolarHBondContact O-CG 3.06Å; M338-E342 PolarHBondContact O-N 3.15Å; E342-T344 PolarHBondContact O-N 3.1Å; E342-N345 PolarHBondContact O-N 3.14Å; E342-S346 PolarHBondContact O-N 3.11Å
343	K	95.2	Very high	94.2	Very high	140 Å²	140	96.3 Å²	96.3	61%	0.609	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-42.7	174.5	-73.6	162.9	-168.9	151.1	0	112.3	D339 S340 L341 N345 K347	D339-K343 WeakPolarHBondContact O-CB 3.41Å; D339-K343 VanDerWaalsContact O-CD 3.25Å; D339-K343 WeakPolarHBondContact O-CD 3.45Å; D339-K343 WeakPolarHBondContact O-CG 3.33Å; D339-K343 PolarHBondContact O-N 3.3Å; S340-K343 PolarHBondContact O-N 2.98Å; L341-K343 PolarHBondContact O-N 3.15Å; K343-N345 VanDerWaalsContact C-N 3.33Å; K343-K347 PolarHBondContact O-N 3.3Å; K343-K347 VanDerWaalsContact O-N 3.12Å
344	T	94.4	Very high	94.4	Very high	69 Å²	69	93.6 Å²	93.6	42%	0.423	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-34.8	174.5	52.6	0	0	0	0	112.5	S340 L341 E342 K347 L348	S340-T344 PolarHBondContact O-N 3.37Å; S340-T344 PolarHBondContact O-OG1 3.05Å; L341-T344 WeakPolarHBondContact CA-OG1 3.47Å; L341-T344 PolarHBondContact O-N 3.45Å; L341-T344 PolarHBondContact O-OG1 3.41Å; E342-T344 PolarHBondContact O-N 3.1Å; T344-K347 PolarHBondContact O-N 2.68Å; T344-L348 WeakPolarHBondContact O-CB 3.13Å; T344-L348 VanDerWaalsContact O-CG 3.25Å; T344-L348 WeakPolarHBondContact O-CG 3.45Å; T344-L348 PolarHBondContact O-N 2.9Å
345	N	94.4	Very high	94.6	Very high	112 Å²	112	90.6 Å²	90.6	60%	0.599	48%	0.482	S	S	*	.	H	α-helix	trans	-69.7	-40.8	178.9	-163.2	28.6	0	0	0	111.4	L341 E342 K343 L348 L349	L341-N345 VanDerWaalsContact O-CB 3.3Å; L341-N345 WeakPolarHBondContact O-CB 3.43Å; L341-N345 PolarHBondContact O-N 3.19Å; E342-N345 PolarHBondContact O-N 3.14Å; K343-N345 VanDerWaalsContact C-N 3.33Å; N345-L348 PolarHBondContact O-N 3.4Å; N345-L349 WeakPolarHBondContact O-CB 3.41Å; N345-L349 PolarHBondContact O-N 2.92Å
346	S	95.9	Very high	94.7	Very high	59 Å²	59	89 Å²	89	41%	0.413	48%	0.479	S	S	.	.	H	α-helix	trans	-58.4	-49	170.7	-167.7	0	0	0	0	111.3	E342 L348 L349 E350	E342-S346 PolarHBondContact O-N 3.11Å; S346-L348 VanDerWaalsContact C-N 3.34Å; S346-L348 PolarHBondContact O-N 3.34Å; S346-L349 WeakPolarHBondContact O-CB 3.35Å; S346-L349 PolarHBondContact O-N 2.93Å; S346-L349 VanDerWaalsContact O-N 3.11Å; S346-E350 WeakPolarHBondContact O-CG 3.27Å; S346-E350 PolarHBondContact O-N 3.37Å; S346-E350 PolarHBondContact OG-OE1 3.21Å
347	K	95.3	Very high	94.8	Very high	116 Å²	116	90.8 Å²	90.8	50%	0.504	48%	0.481	S	S	.	.	H	α-helix	trans	-62.9	-38.2	178.8	-174.3	170.9	-179.5	-70.2	0	112.8	K343 T344 E350 E351	K343-K347 PolarHBondContact O-N 3.3Å; K343-K347 VanDerWaalsContact O-N 3.12Å; T344-K347 PolarHBondContact O-N 2.68Å; K347-E350 PolarHBondContact O-N 2.9Å; K347-E351 IonicContact NZ-OE1 3.27Å; K347-E351 PolarHBondContact NZ-OE1 3.36Å; K347-E351 WeakPolarHBondContact O-CB 3.15Å; K347-E351 WeakPolarHBondContact O-CG 3.4Å; K347-E351 PolarHBondContact O-N 3.1Å
348	L	94.9	Very high	95	Very high	102 Å²	102	93.1 Å²	93.1	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-68.7	-33.3	174.2	-73.5	169.6	0	0	0	112.3	T344 N345 S346 L352	T344-L348 WeakPolarHBondContact O-CB 3.13Å; T344-L348 VanDerWaalsContact O-CG 3.25Å; T344-L348 WeakPolarHBondContact O-CG 3.45Å; T344-L348 PolarHBondContact O-N 2.9Å; N345-L348 PolarHBondContact O-N 3.4Å; S346-L348 VanDerWaalsContact C-N 3.34Å; S346-L348 PolarHBondContact O-N 3.34Å; L348-L352 WeakPolarHBondContact O-CB 3.34Å; L348-L352 PolarHBondContact O-N 2.89Å
349	L	95.5	Very high	95	Very high	111 Å²	111	93 Å²	93	58%	0.581	49%	0.486	S	S	*	.	H	α-helix	trans	-67	-42.5	173	-164.1	81	0	0	0	111.5	N345 S346 L352 T353	N345-L349 WeakPolarHBondContact O-CB 3.41Å; N345-L349 PolarHBondContact O-N 2.92Å; S346-L349 WeakPolarHBondContact O-CB 3.35Å; S346-L349 PolarHBondContact O-N 2.93Å; S346-L349 VanDerWaalsContact O-N 3.11Å; L349-L352 PolarHBondContact O-N 2.89Å; L349-T353 WeakPolarHBondContact O-CB 3.48Å; L349-T353 PolarHBondContact O-N 3.06Å; L349-T353 PolarHBondContact O-OG1 2.93Å
350	E	95.6	Very high	95	Very high	118 Å²	118	94.2 Å²	94.2	55%	0.551	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-46.1	174	-70.4	160.8	-137.9	0	0	111.5	S346 K347 T353 A354	S346-E350 WeakPolarHBondContact O-CG 3.27Å; S346-E350 PolarHBondContact O-N 3.37Å; S346-E350 PolarHBondContact OG-OE1 3.21Å; K347-E350 PolarHBondContact O-N 2.9Å; E350-T353 PolarHBondContact O-N 2.67Å; E350-A354 WeakPolarHBondContact O-CB 3.21Å; E350-A354 PolarHBondContact O-N 2.95Å
351	E	95.4	Very high	95.2	Very high	97 Å²	97	94.2 Å²	94.2	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-40	176.2	-76.4	175.4	-179.5	0	0	112.6	K347 A355	K347-E351 IonicContact NZ-OE1 3.27Å; K347-E351 PolarHBondContact NZ-OE1 3.36Å; K347-E351 WeakPolarHBondContact O-CB 3.15Å; K347-E351 WeakPolarHBondContact O-CG 3.4Å; K347-E351 PolarHBondContact O-N 3.1Å; E351-A355 VanDerWaalsContact O-CB 3.25Å; E351-A355 WeakPolarHBondContact O-CB 3.49Å; E351-A355 PolarHBondContact O-N 2.7Å
352	L	93.9	Very high	95.2	Very high	111 Å²	111	93.7 Å²	93.7	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-65.3	-39.8	174.7	179.1	63	0	0	0	111.8	L348 L349 A355 T356	L348-L352 WeakPolarHBondContact O-CB 3.34Å; L348-L352 PolarHBondContact O-N 2.89Å; L349-L352 PolarHBondContact O-N 2.89Å; L352-A355 PolarHBondContact O-N 3.28Å; L352-T356 WeakPolarHBondContact O-CB 3Å; L352-T356 PolarHBondContact O-N 3.34Å; L352-T356 PolarHBondContact O-OG1 2.97Å
353	T	96.3	Very high	95.2	Very high	72 Å²	72	93.8 Å²	93.8	44%	0.442	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-50.9	176.5	-54.5	0	0	0	0	110.1	L349 E350 A355 T356 D357	L349-T353 WeakPolarHBondContact O-CB 3.48Å; L349-T353 PolarHBondContact O-N 3.06Å; L349-T353 PolarHBondContact O-OG1 2.93Å; E350-T353 PolarHBondContact O-N 2.67Å; T353-A355 VanDerWaalsContact C-N 3.27Å; T353-A355 PolarHBondContact O-N 2.86Å; T353-T356 WeakPolarHBondContact O-CA 3.27Å; T353-T356 WeakPolarHBondContact O-CB 3.42Å; T353-T356 PolarHBondContact O-N 2.9Å; T353-D357 PolarHBondContact O-N 3.44Å
354	A	95.8	Very high	95.2	Very high	38 Å²	38	89.2 Å²	89.2	31%	0.314	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-29.4	177.2	0	0	0	0	0	113.4	E350 R358	E350-A354 WeakPolarHBondContact O-CB 3.21Å; E350-A354 PolarHBondContact O-N 2.95Å; A354-R358 WeakPolarHBondContact O-CD 3.41Å; A354-R358 WeakPolarHBondContact O-CG 3.19Å; A354-R358 PolarHBondContact O-N 3.46Å
355	A	93.9	Very high	95.3	Very high	38 Å²	38	90.5 Å²	90.5	31%	0.314	48%	0.484	S	S	.	.	H	α-helix	trans	-71.1	-40.2	170.8	0	0	0	0	0	111.9	E351 L352 T353 R358 I359	E351-A355 VanDerWaalsContact O-CB 3.25Å; E351-A355 WeakPolarHBondContact O-CB 3.49Å; E351-A355 PolarHBondContact O-N 2.7Å; L352-A355 PolarHBondContact O-N 3.28Å; T353-A355 VanDerWaalsContact C-N 3.27Å; T353-A355 PolarHBondContact O-N 2.86Å; A355-R358 PolarHBondContact O-N 3.39Å; A355-I359 VanDerWaalsContact O-CG1 3.32Å; A355-I359 WeakPolarHBondContact O-CG1 3.28Å; A355-I359 PolarHBondContact O-N 3.04Å
356	T	95.3	Very high	95.2	Very high	62 Å²	62	91.8 Å²	91.8	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-44.7	176.8	-56.3	0	0	0	0	111.1	L352 T353 R358 I359 N360	L352-T356 WeakPolarHBondContact O-CB 3Å; L352-T356 PolarHBondContact O-N 3.34Å; L352-T356 PolarHBondContact O-OG1 2.97Å; T353-T356 WeakPolarHBondContact O-CA 3.27Å; T353-T356 WeakPolarHBondContact O-CB 3.42Å; T353-T356 PolarHBondContact O-N 2.9Å; T356-R358 VanDerWaalsContact C-N 3.32Å; T356-R358 PolarHBondContact O-N 3.45Å; T356-I359 PolarHBondContact O-N 3.36Å; T356-I359 VanDerWaalsContact O-N 3.16Å; T356-N360 VanDerWaalsContact O-CG 3.24Å; T356-N360 PolarHBondContact O-N 2.84Å; T356-N360 PolarHBondContact O-ND2 3.16Å
357	D	96.2	Very high	95.2	Very high	96 Å²	96	93 Å²	93	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-38.3	176.7	-67.5	-29.7	0	0	0	112.3	T353 N360 S361	T353-D357 PolarHBondContact O-N 3.44Å; D357-N360 PolarHBondContact O-N 2.93Å; D357-S361 PolarHBondContact O-N 3.36Å
358	R	96.4	Very high	95.2	Very high	172 Å²	172	92.9 Å²	92.9	65%	0.649	49%	0.487	S	S	*	.	H	α-helix	trans	-65.5	-40.9	173.1	-71.9	167.3	-169.1	165.6	5.9	112.3	A354 A355 T356 N360 S361 L362	A354-R358 WeakPolarHBondContact O-CD 3.41Å; A354-R358 WeakPolarHBondContact O-CG 3.19Å; A354-R358 PolarHBondContact O-N 3.46Å; A355-R358 PolarHBondContact O-N 3.39Å; T356-R358 VanDerWaalsContact C-N 3.32Å; T356-R358 PolarHBondContact O-N 3.45Å; R358-N360 VanDerWaalsContact C-N 3.33Å; R358-S361 PolarHBondContact O-N 2.9Å; R358-L362 WeakPolarHBondContact O-CB 3.23Å; R358-L362 VanDerWaalsContact O-CG 3.28Å; R358-L362 WeakPolarHBondContact O-CG 3.18Å; R358-L362 PolarHBondContact O-N 2.93Å
359	I	94.8	Very high	95.2	Very high	90 Å²	90	93.2 Å²	93.2	46%	0.462	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-43.9	175.2	-70.8	163.4	0	0	0	110	A355 T356 L362 Q363	A355-I359 VanDerWaalsContact O-CG1 3.32Å; A355-I359 WeakPolarHBondContact O-CG1 3.28Å; A355-I359 PolarHBondContact O-N 3.04Å; T356-I359 PolarHBondContact O-N 3.36Å; T356-I359 VanDerWaalsContact O-N 3.16Å; I359-L362 PolarHBondContact O-N 2.94Å; I359-Q363 HydrophobicContact CG2-CG 4.48Å; I359-Q363 WeakPolarHBondContact O-CB 3.46Å; I359-Q363 VanDerWaalsContact O-CG 3.3Å; I359-Q363 WeakPolarHBondContact O-CG 3.35Å; I359-Q363 PolarHBondContact O-N 3.39Å
360	N	95.2	Very high	95.1	Very high	85 Å²	85	95.2 Å²	95.2	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-42.2	176.7	-65.1	-26.3	0	0	0	112.1	T356 D357 R358 Q363 G364	T356-N360 VanDerWaalsContact O-CG 3.24Å; T356-N360 PolarHBondContact O-N 2.84Å; T356-N360 PolarHBondContact O-ND2 3.16Å; D357-N360 PolarHBondContact O-N 2.93Å; R358-N360 VanDerWaalsContact C-N 3.33Å; N360-Q363 PolarHBondContact O-N 2.94Å; N360-G364 PolarHBondContact O-N 3.29Å
361	S	96.4	Very high	95.1	Very high	64 Å²	64	95 Å²	95	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-49.7	174.7	-165.2	0	0	0	0	111.6	D357 R358 Q363 G364 E365	D357-S361 PolarHBondContact O-N 3.36Å; R358-S361 PolarHBondContact O-N 2.9Å; S361-Q363 VanDerWaalsContact C-N 3.3Å; S361-Q363 PolarHBondContact O-N 3.28Å; S361-G364 WeakPolarHBondContact O-CA 3.33Å; S361-G364 PolarHBondContact O-N 2.97Å; S361-E365 WeakPolarHBondContact O-CG 3.44Å; S361-E365 PolarHBondContact O-N 2.9Å; S361-E365 PolarHBondContact OG-OE1 2.94Å
362	L	94.6	Very high	95.1	Very high	106 Å²	106	94.6 Å²	94.6	56%	0.555	49%	0.486	S	S	*	.	H	α-helix	trans	-64.7	-31.7	-179.9	-70.6	169.4	0	0	0	112.7	R358 I359 Q366	R358-L362 WeakPolarHBondContact O-CB 3.23Å; R358-L362 VanDerWaalsContact O-CG 3.28Å; R358-L362 WeakPolarHBondContact O-CG 3.18Å; R358-L362 PolarHBondContact O-N 2.93Å; I359-L362 PolarHBondContact O-N 2.94Å; L362-Q366 WeakPolarHBondContact O-CB 3.47Å; L362-Q366 PolarHBondContact O-N 3.47Å
363	Q	94.4	Very high	95	Very high	111 Å²	111	94.2 Å²	94.2	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-39.1	171.3	-76	175.9	-0.6	0	0	112	I359 N360 S361 Q366 E367	I359-Q363 HydrophobicContact CG2-CG 4.48Å; I359-Q363 WeakPolarHBondContact O-CB 3.46Å; I359-Q363 VanDerWaalsContact O-CG 3.3Å; I359-Q363 WeakPolarHBondContact O-CG 3.35Å; I359-Q363 PolarHBondContact O-N 3.39Å; N360-Q363 PolarHBondContact O-N 2.94Å; S361-Q363 VanDerWaalsContact C-N 3.3Å; S361-Q363 PolarHBondContact O-N 3.28Å; Q363-Q366 PolarHBondContact O-N 2.91Å; Q363-E367 WeakPolarHBondContact O-CB 3.35Å; Q363-E367 PolarHBondContact O-N 3.28Å
364	G	95.4	Very high	95	Very high	44 Å²	44	94.8 Å²	94.8	45%	0.454	49%	0.485	S	S	.	.	H	α-helix	trans	-63.3	-46.5	172.8	0	0	0	0	0	112.5	N360 S361 E367 Q368	N360-G364 PolarHBondContact O-N 3.29Å; S361-G364 WeakPolarHBondContact O-CA 3.33Å; S361-G364 PolarHBondContact O-N 2.97Å; G364-E367 PolarHBondContact O-N 3.47Å; G364-Q368 PolarHBondContact O-N 3.36Å
365	E	95.3	Very high	95	Very high	96 Å²	96	96.4 Å²	96.4	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-41.9	174.7	-70.7	164.5	-134	0	0	111.7	S361 E367 Q368 L369	S361-E365 WeakPolarHBondContact O-CG 3.44Å; S361-E365 PolarHBondContact O-N 2.9Å; S361-E365 PolarHBondContact OG-OE1 2.94Å; E365-E367 PolarHBondContact O-N 2.98Å; E365-Q368 PolarHBondContact O-N 3.41Å; E365-L369 WeakPolarHBondContact O-CB 3.45Å; E365-L369 VanDerWaalsContact O-CG 3.26Å; E365-L369 WeakPolarHBondContact O-CG 3.41Å; E365-L369 PolarHBondContact O-N 3.33Å
366	Q	92.6	Very high	95	Very high	139 Å²	139	100 Å²	100	65%	0.65	51%	0.506	S	S	*	.	H	α-helix	trans	-62	-42.9	176.8	-177.6	176.7	26.7	0	0	112.2	L362 Q363 R370	L362-Q366 WeakPolarHBondContact O-CB 3.47Å; L362-Q366 PolarHBondContact O-N 3.47Å; Q363-Q366 PolarHBondContact O-N 2.91Å; Q366-R370 WeakPolarHBondContact O-CB 3.38Å; Q366-R370 PolarHBondContact O-N 2.75Å
367	E	95.6	Very high	94.9	Very high	84 Å²	84	101 Å²	101	39%	0.393	51%	0.509	S	S	.	.	H	α-helix	trans	-72.9	-35.9	178.9	-177.3	55.4	-152.2	0	0	111.9	Q363 G364 E365 R370 Q371	Q363-E367 WeakPolarHBondContact O-CB 3.35Å; Q363-E367 PolarHBondContact O-N 3.28Å; G364-E367 PolarHBondContact O-N 3.47Å; E365-E367 PolarHBondContact O-N 2.98Å; E367-R370 WeakPolarHBondContact O-CB 3.35Å; E367-R370 PolarHBondContact O-N 3.4Å; E367-R370 IonicContact OE2-NH1 2.93Å; E367-Q371 WeakPolarHBondContact O-CG 3.35Å; E367-Q371 PolarHBondContact O-N 2.65Å; E367-Q371 PolarHBondContact OE1-NE2 3.21Å
368	Q	96.2	Very high	94.8	Very high	114 Å²	114	101.1 Å²	101.1	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-62.5	-50.5	170.7	-178.4	-178.9	-25.5	0	0	111.4	G364 E365 R370 Q371 E372	G364-Q368 PolarHBondContact O-N 3.36Å; E365-Q368 PolarHBondContact O-N 3.41Å; Q368-R370 PolarHBondContact O-N 2.94Å; Q368-Q371 PolarHBondContact O-N 2.83Å; Q368-Q371 VanDerWaalsContact O-N 3.11Å; Q368-E372 HydrophobicContact CG-CG 4.5Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.44Å; Q368-E372 PolarHBondContact NE2-OE1 2.91Å; Q368-E372 WeakPolarHBondContact O-CG 3.36Å; Q368-E372 PolarHBondContact O-N 2.76Å
369	L	94.3	Very high	94.8	Very high	109 Å²	109	96 Å²	96	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-60.3	-32.1	178.2	-74.1	170.3	0	0	0	112.1	E365 N373	E365-L369 WeakPolarHBondContact O-CB 3.45Å; E365-L369 VanDerWaalsContact O-CG 3.26Å; E365-L369 WeakPolarHBondContact O-CG 3.41Å; E365-L369 PolarHBondContact O-N 3.33Å; L369-N373 VanDerWaalsContact O-CB 3.25Å; L369-N373 WeakPolarHBondContact O-CB 3.35Å; L369-N373 PolarHBondContact O-N 3.11Å
370	R	93.9	Very high	94.5	Very high	153 Å²	153	94.8 Å²	94.8	58%	0.577	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-50.2	172.3	-174.4	-174.5	-170	164.8	6.2	111.8	Q366 E367 Q368 E372 N373 D374	Q366-R370 WeakPolarHBondContact O-CB 3.38Å; Q366-R370 PolarHBondContact O-N 2.75Å; E367-R370 WeakPolarHBondContact O-CB 3.35Å; E367-R370 PolarHBondContact O-N 3.4Å; E367-R370 IonicContact OE2-NH1 2.93Å; Q368-R370 PolarHBondContact O-N 2.94Å; R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 2.88Å; R370-N373 PolarHBondContact O-N 3.22Å; R370-N373 VanDerWaalsContact O-N 3.15Å; R370-D374 PolarHBondContact O-N 2.98Å
371	Q	95.8	Very high	94.4	Very high	114 Å²	114	94.5 Å²	94.5	53%	0.533	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-35.6	179.1	-68.8	172.7	22.2	0	0	112.2	E367 Q368 S375	E367-Q371 WeakPolarHBondContact O-CG 3.35Å; E367-Q371 PolarHBondContact O-N 2.65Å; E367-Q371 PolarHBondContact OE1-NE2 3.21Å; Q368-Q371 PolarHBondContact O-N 2.83Å; Q368-Q371 VanDerWaalsContact O-N 3.11Å; Q371-S375 VanDerWaalsContact O-CB 3.23Å; Q371-S375 WeakPolarHBondContact O-CB 3.28Å; Q371-S375 PolarHBondContact O-N 3.41Å
372	E	95.1	Very high	94.4	Very high	89 Å²	89	97.8 Å²	97.8	42%	0.416	50%	0.497	S	S	.	.	H	α-helix	trans	-65.7	-42.8	171.5	-72.8	179.4	-162.7	0	0	111.8	Q368 R370 S375 I376	Q368-E372 HydrophobicContact CG-CG 4.5Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.44Å; Q368-E372 PolarHBondContact NE2-OE1 2.91Å; Q368-E372 WeakPolarHBondContact O-CG 3.36Å; Q368-E372 PolarHBondContact O-N 2.76Å; R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 2.88Å; E372-S375 WeakPolarHBondContact O-CB 3.43Å; E372-S375 PolarHBondContact O-N 3.32Å; E372-I376 WeakPolarHBondContact O-CB 3.46Å; E372-I376 WeakPolarHBondContact O-CD1 3.48Å; E372-I376 VanDerWaalsContact O-CG1 3.24Å; E372-I376 WeakPolarHBondContact O-CG1 3.43Å; E372-I376 PolarHBondContact O-N 3.03Å
373	N	92.3	Very high	94.3	Very high	102 Å²	102	99.6 Å²	99.6	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-45.7	176.9	-165.5	-10.5	0	0	0	112	L369 R370 S375 I376 L377	L369-N373 VanDerWaalsContact O-CB 3.25Å; L369-N373 WeakPolarHBondContact O-CB 3.35Å; L369-N373 PolarHBondContact O-N 3.11Å; R370-N373 PolarHBondContact O-N 3.22Å; R370-N373 VanDerWaalsContact O-N 3.15Å; N373-S375 VanDerWaalsContact C-N 3.29Å; N373-S375 PolarHBondContact O-N 2.96Å; N373-I376 PolarHBondContact O-N 3.45Å; N373-L377 WeakPolarHBondContact O-CB 3.24Å; N373-L377 PolarHBondContact O-N 3.05Å
374	D	94.9	Very high	94.2	Very high	85 Å²	85	100.2 Å²	100.2	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-59.8	-39.5	174.4	-70.8	-25.2	0	0	0	111.2	R370 L377 M378	R370-D374 PolarHBondContact O-N 2.98Å; D374-L377 PolarHBondContact O-N 2.91Å; D374-M378 WeakPolarHBondContact O-CB 3.46Å; D374-M378 VanDerWaalsContact O-CG 3.27Å; D374-M378 WeakPolarHBondContact O-CG 3.47Å; D374-M378 PolarHBondContact O-N 3.28Å
375	S	95.9	Very high	94.2	Very high	71 Å²	71	103.5 Å²	103.5	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-42.1	174.7	-174.6	0	0	0	0	112.9	Q371 E372 N373 T379	Q371-S375 VanDerWaalsContact O-CB 3.23Å; Q371-S375 WeakPolarHBondContact O-CB 3.28Å; Q371-S375 PolarHBondContact O-N 3.41Å; E372-S375 WeakPolarHBondContact O-CB 3.43Å; E372-S375 PolarHBondContact O-N 3.32Å; N373-S375 VanDerWaalsContact C-N 3.29Å; N373-S375 PolarHBondContact O-N 2.96Å; S375-T379 VanDerWaalsContact O-CB 3.28Å; S375-T379 WeakPolarHBondContact O-CB 3.49Å; S375-T379 PolarHBondContact O-N 3.42Å; S375-T379 PolarHBondContact O-OG1 3.17Å
376	I	94.4	Very high	94.1	Very high	113 Å²	113	101 Å²	101	58%	0.579	50%	0.503	S	S	*	.	H	α-helix	trans	-63.7	-45	174.4	-72	163.6	0	0	0	110.4	E372 N373 T379 S380	E372-I376 WeakPolarHBondContact O-CB 3.46Å; E372-I376 WeakPolarHBondContact O-CD1 3.48Å; E372-I376 VanDerWaalsContact O-CG1 3.24Å; E372-I376 WeakPolarHBondContact O-CG1 3.43Å; E372-I376 PolarHBondContact O-N 3.03Å; N373-I376 PolarHBondContact O-N 3.45Å; I376-T379 CarbonylContact O-C 3.07Å; I376-T379 PolarHBondContact O-N 3.01Å; I376-S380 WeakPolarHBondContact O-CB 3.4Å; I376-S380 PolarHBondContact O-N 3.4Å
377	L	92.8	Very high	94	Very high	85 Å²	85	97.1 Å²	97.1	45%	0.445	50%	0.495	S	S	.	.	H	α-helix	trans	-60.8	-51.5	178.7	-178.9	63.9	0	0	0	111.4	N373 D374 T379 S380 Q381	N373-L377 WeakPolarHBondContact O-CB 3.24Å; N373-L377 PolarHBondContact O-N 3.05Å; D374-L377 PolarHBondContact O-N 2.91Å; L377-T379 PolarHBondContact O-N 3.37Å; L377-S380 PolarHBondContact O-N 3.34Å; L377-S380 VanDerWaalsContact O-N 3.1Å; L377-Q381 WeakPolarHBondContact O-CG 3.49Å; L377-Q381 PolarHBondContact O-N 2.81Å
378	M	95.5	Very high	94	Very high	97 Å²	97	98.7 Å²	98.7	48%	0.478	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-30.9	176.1	-70.8	-59.5	-52.5	0	0	112.6	D374 K382	D374-M378 WeakPolarHBondContact O-CB 3.46Å; D374-M378 VanDerWaalsContact O-CG 3.27Å; D374-M378 WeakPolarHBondContact O-CG 3.47Å; D374-M378 PolarHBondContact O-N 3.28Å; M378-K382 VanDerWaalsContact O-CG 3.31Å; M378-K382 WeakPolarHBondContact O-CG 2.85Å; M378-K382 PolarHBondContact O-N 3.46Å
379	T	94.7	Very high	93.9	Very high	65 Å²	65	99.6 Å²	99.6	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-76.9	-33.7	175.3	-59.6	0	0	0	0	112	S375 I376 L377 K383	S375-T379 VanDerWaalsContact O-CB 3.28Å; S375-T379 WeakPolarHBondContact O-CB 3.49Å; S375-T379 PolarHBondContact O-N 3.42Å; S375-T379 PolarHBondContact O-OG1 3.17Å; I376-T379 CarbonylContact O-C 3.07Å; I376-T379 PolarHBondContact O-N 3.01Å; L377-T379 PolarHBondContact O-N 3.37Å; T379-K383 WeakPolarHBondContact O-CG 3.44Å; T379-K383 PolarHBondContact O-N 2.97Å
380	S	89.9	Confident	93.9	Very high	65 Å²	65	99.6 Å²	99.6	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-69.6	-48.2	175.7	-163.9	0	0	0	0	110.9	I376 L377 K382 K383 E384	I376-S380 WeakPolarHBondContact O-CB 3.4Å; I376-S380 PolarHBondContact O-N 3.4Å; L377-S380 PolarHBondContact O-N 3.34Å; L377-S380 VanDerWaalsContact O-N 3.1Å; S380-K382 VanDerWaalsContact C-N 3.34Å; S380-K382 PolarHBondContact O-N 3.31Å; S380-K383 WeakPolarHBondContact O-CB 3.48Å; S380-K383 PolarHBondContact O-N 3.16Å; S380-E384 PolarHBondContact O-N 3.18Å
381	Q	93.1	Very high	93.8	Very high	79 Å²	79	95.6 Å²	95.6	37%	0.369	51%	0.506	S	S	.	.	H	α-helix	trans	-56	-46.7	176.5	-73.1	172.3	-15.2	0	0	111.5	L377 K383 E384 E385	L377-Q381 WeakPolarHBondContact O-CG 3.49Å; L377-Q381 PolarHBondContact O-N 2.81Å; Q381-K383 VanDerWaalsContact C-N 3.28Å; Q381-K383 PolarHBondContact O-N 2.83Å; Q381-E384 WeakPolarHBondContact O-CB 3.43Å; Q381-E384 PolarHBondContact O-N 2.62Å; Q381-E384 VanDerWaalsContact O-N 3.15Å; Q381-E385 WeakPolarHBondContact O-CB 3.26Å; Q381-E385 WeakPolarHBondContact O-CG 3.4Å; Q381-E385 PolarHBondContact O-N 3.26Å
382	K	94.8	Very high	93.8	Very high	133 Å²	133	94.6 Å²	94.6	58%	0.578	50%	0.501	S	S	*	.	H	α-helix	trans	-63	-30	176.2	-74.4	173.9	-179.2	176.8	0	114.2	M378 S380 A386	M378-K382 VanDerWaalsContact O-CG 3.31Å; M378-K382 WeakPolarHBondContact O-CG 2.85Å; M378-K382 PolarHBondContact O-N 3.46Å; S380-K382 VanDerWaalsContact C-N 3.34Å; S380-K382 PolarHBondContact O-N 3.31Å; K382-A386 VanDerWaalsContact O-CB 3.3Å; K382-A386 WeakPolarHBondContact O-CB 3.3Å; K382-A386 PolarHBondContact O-N 3.22Å; K382-A386 VanDerWaalsContact O-N 3.09Å
383	K	94.2	Very high	93.8	Very high	144 Å²	144	94.8 Å²	94.8	63%	0.626	51%	0.508	S	S	*	.	H	α-helix	trans	-75.4	-36.6	174.4	-74.1	171.1	179.8	177.7	0	111.7	T379 S380 Q381 A387	T379-K383 WeakPolarHBondContact O-CG 3.44Å; T379-K383 PolarHBondContact O-N 2.97Å; S380-K383 WeakPolarHBondContact O-CB 3.48Å; S380-K383 PolarHBondContact O-N 3.16Å; Q381-K383 VanDerWaalsContact C-N 3.28Å; Q381-K383 PolarHBondContact O-N 2.83Å; K383-A387 WeakPolarHBondContact O-CB 3.39Å; K383-A387 PolarHBondContact O-N 3.43Å
384	E	92.1	Very high	93.8	Very high	124 Å²	124	96.7 Å²	96.7	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-67.2	-47	174.6	-171.9	173.7	-177.1	0	0	111	S380 Q381 A386 A387 L388	S380-E384 PolarHBondContact O-N 3.18Å; Q381-E384 WeakPolarHBondContact O-CB 3.43Å; Q381-E384 PolarHBondContact O-N 2.62Å; Q381-E384 VanDerWaalsContact O-N 3.15Å; E384-A386 VanDerWaalsContact C-N 3.34Å; E384-A386 PolarHBondContact O-N 2.76Å; E384-A387 PolarHBondContact O-N 3.07Å; E384-L388 HydrophobicContact CG-CD1 4.27Å; E384-L388 WeakPolarHBondContact O-CB 3.46Å; E384-L388 VanDerWaalsContact O-CG 3.26Å; E384-L388 WeakPolarHBondContact O-CG 3.45Å; E384-L388 PolarHBondContact O-N 2.9Å
385	E	94.8	Very high	93.7	Very high	113 Å²	113	96.4 Å²	96.4	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-56.6	-44	171.9	-72.9	175	165	0	0	112.2	Q381 Q389	Q381-E385 WeakPolarHBondContact O-CB 3.26Å; Q381-E385 WeakPolarHBondContact O-CG 3.4Å; Q381-E385 PolarHBondContact O-N 3.26Å; E385-Q389 VanDerWaalsContact O-CG 3.32Å; E385-Q389 WeakPolarHBondContact O-CG 3.36Å; E385-Q389 PolarHBondContact O-N 3.44Å
386	A	93.9	Very high	93.7	Very high	43 Å²	43	96.2 Å²	96.2	36%	0.355	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-46.8	176.3	0	0	0	0	0	112	K382 E384 L388 Q389 D390	K382-A386 VanDerWaalsContact O-CB 3.3Å; K382-A386 WeakPolarHBondContact O-CB 3.3Å; K382-A386 PolarHBondContact O-N 3.22Å; K382-A386 VanDerWaalsContact O-N 3.09Å; E384-A386 VanDerWaalsContact C-N 3.34Å; E384-A386 PolarHBondContact O-N 2.76Å; A386-L388 VanDerWaalsContact C-N 3.29Å; A386-L388 PolarHBondContact O-N 2.99Å; A386-Q389 WeakPolarHBondContact O-CB 3.48Å; A386-Q389 PolarHBondContact O-N 3.2Å; A386-Q389 VanDerWaalsContact O-N 3.1Å; A386-D390 PolarHBondContact O-N 2.99Å
387	A	90.4	Very high	93.7	Very high	58 Å²	58	94.5 Å²	94.5	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-34.1	178	0	0	0	0	0	112.8	K383 E384 S391	K383-A387 WeakPolarHBondContact O-CB 3.39Å; K383-A387 PolarHBondContact O-N 3.43Å; E384-A387 PolarHBondContact O-N 3.07Å; A387-S391 VanDerWaalsContact O-CB 3.26Å; A387-S391 WeakPolarHBondContact O-CB 3.4Å; A387-S391 PolarHBondContact O-N 2.95Å
388	L	94.2	Very high	93.7	Very high	117 Å²	117	97.7 Å²	97.7	61%	0.613	51%	0.505	S	S	*	.	H	α-helix	trans	-67.2	-39.6	172	-73.4	167.5	0	0	0	111.8	E384 A386 Q392	E384-L388 HydrophobicContact CG-CD1 4.27Å; E384-L388 WeakPolarHBondContact O-CB 3.46Å; E384-L388 VanDerWaalsContact O-CG 3.26Å; E384-L388 WeakPolarHBondContact O-CG 3.45Å; E384-L388 PolarHBondContact O-N 2.9Å; A386-L388 VanDerWaalsContact C-N 3.29Å; A386-L388 PolarHBondContact O-N 2.99Å; L388-Q392 VanDerWaalsContact O-CB 3.31Å; L388-Q392 WeakPolarHBondContact O-CB 3.47Å; L388-Q392 PolarHBondContact O-N 3.4Å
389	Q	95.4	Very high	93.6	Very high	132 Å²	132	97.6 Å²	97.6	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-66.7	-45.7	174.6	-73.1	173.1	31.5	0	0	111.9	E385 A386 S391 Q392 V393	E385-Q389 VanDerWaalsContact O-CG 3.32Å; E385-Q389 WeakPolarHBondContact O-CG 3.36Å; E385-Q389 PolarHBondContact O-N 3.44Å; A386-Q389 WeakPolarHBondContact O-CB 3.48Å; A386-Q389 PolarHBondContact O-N 3.2Å; A386-Q389 VanDerWaalsContact O-N 3.1Å; Q389-S391 PolarHBondContact O-N 3.17Å; Q389-Q392 PolarHBondContact O-N 2.8Å; Q389-V393 WeakPolarHBondContact O-CG2 3.28Å; Q389-V393 PolarHBondContact O-N 3.32Å
390	D	94.9	Very high	93.6	Very high	110 Å²	110	101 Å²	101	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-59.6	-47.6	176.2	-72.1	-24.4	0	0	0	110.8	A386 Q392 V393 E394	A386-D390 PolarHBondContact O-N 2.99Å; D390-Q392 VanDerWaalsContact C-N 3.32Å; D390-Q392 PolarHBondContact O-N 3.4Å; D390-V393 PolarHBondContact O-N 2.96Å; D390-V393 VanDerWaalsContact O-N 3.11Å; D390-E394 PolarHBondContact O-N 3.33Å
391	S	90.8	Very high	93.7	Very high	69 Å²	69	101.9 Å²	101.9	48%	0.483	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-34.9	177.3	-169.3	0	0	0	0	112.9	A387 Q389 E394 L395	A387-S391 VanDerWaalsContact O-CB 3.26Å; A387-S391 WeakPolarHBondContact O-CB 3.4Å; A387-S391 PolarHBondContact O-N 2.95Å; Q389-S391 PolarHBondContact O-N 3.17Å; S391-E394 PolarHBondContact O-N 3.33Å; S391-L395 WeakPolarHBondContact O-CB 3.38Å; S391-L395 PolarHBondContact O-N 3.38Å
392	Q	95.1	Very high	93.7	Very high	93 Å²	93	104.1 Å²	104.1	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-38	172.8	-175.3	62.9	52.3	0	0	111.9	L388 Q389 D390 L395 E396	L388-Q392 VanDerWaalsContact O-CB 3.31Å; L388-Q392 WeakPolarHBondContact O-CB 3.47Å; L388-Q392 PolarHBondContact O-N 3.4Å; Q389-Q392 PolarHBondContact O-N 2.8Å; D390-Q392 VanDerWaalsContact C-N 3.32Å; D390-Q392 PolarHBondContact O-N 3.4Å; Q392-L395 PolarHBondContact O-N 2.86Å; Q392-E396 PolarHBondContact NE2-OE1 2.89Å; Q392-E396 WeakPolarHBondContact O-CG 3.49Å; Q392-E396 PolarHBondContact O-N 3.05Å
393	V	95.6	Very high	93.7	Very high	92 Å²	92	103.2 Å²	103.2	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-68.8	-40.5	175.3	170.6	0	0	0	0	111.5	Q389 D390 L395 E396 T397	Q389-V393 WeakPolarHBondContact O-CG2 3.28Å; Q389-V393 PolarHBondContact O-N 3.32Å; D390-V393 PolarHBondContact O-N 2.96Å; D390-V393 VanDerWaalsContact O-N 3.11Å; V393-L395 VanDerWaalsContact C-N 3.34Å; V393-E396 PolarHBondContact O-N 3.48Å; V393-T397 VanDerWaalsContact O-CB 3.3Å; V393-T397 WeakPolarHBondContact O-CB 3.31Å; V393-T397 PolarHBondContact O-N 2.62Å; V393-T397 PolarHBondContact O-OG1 3.47Å
394	E	92.6	Very high	93.7	Very high	143 Å²	143	98.1 Å²	98.1	67%	0.668	51%	0.507	S	S	*	.	H	α-helix	trans	-59.1	-44.4	170.4	-72.1	-172	157.2	0	0	111.4	D390 S391 T397 Y398	D390-E394 PolarHBondContact O-N 3.33Å; S391-E394 PolarHBondContact O-N 3.33Å; E394-T397 PolarHBondContact O-N 2.93Å; E394-Y398 WeakPolarHBondContact O-CB 3.31Å; E394-Y398 PolarHBondContact O-N 2.84Å
395	L	93.2	Very high	93.8	Very high	78 Å²	78	96.4 Å²	96.4	41%	0.408	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-43.9	178.8	178.3	62.1	0	0	0	112.6	S391 Q392 V393 Y398 K399	S391-L395 WeakPolarHBondContact O-CB 3.38Å; S391-L395 PolarHBondContact O-N 3.38Å; Q392-L395 PolarHBondContact O-N 2.86Å; V393-L395 VanDerWaalsContact C-N 3.34Å; L395-Y398 PolarHBondContact O-N 2.94Å; L395-K399 HydrophobicContact CG-CD 4.47Å; L395-K399 VanDerWaalsContact O-CG 3.31Å; L395-K399 WeakPolarHBondContact O-CG 3.46Å; L395-K399 PolarHBondContact O-N 2.88Å
396	E	94.9	Very high	93.7	Very high	68 Å²	68	94 Å²	94	32%	0.318	49%	0.492	S	S	.	.	H	α-helix	trans	-68.2	-37	175.1	-65.9	-46.6	133.9	0	0	112.2	Q392 V393 Y398 K399 Q400	Q392-E396 PolarHBondContact NE2-OE1 2.89Å; Q392-E396 WeakPolarHBondContact O-CG 3.49Å; Q392-E396 PolarHBondContact O-N 3.05Å; V393-E396 PolarHBondContact O-N 3.48Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 3.06Å; E396-K399 PolarHBondContact O-N 3.21Å; E396-K399 IonicContact OE1-NZ 2.7Å; E396-K399 PolarHBondContact OE1-NZ 2.7Å; E396-K399 VanDerWaalsContact OE2-CD 3.26Å; E396-K399 WeakPolarHBondContact OE2-CD 3.34Å; E396-K399 IonicContact OE2-NZ 3.52Å; E396-Q400 WeakPolarHBondContact O-CB 3.39Å; E396-Q400 WeakPolarHBondContact O-CG 3.34Å; E396-Q400 PolarHBondContact O-N 3.25Å
397	T	94.6	Very high	93.8	Very high	76 Å²	76	97.1 Å²	97.1	47%	0.466	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-40.8	175	-58.2	0	0	0	0	110.9	V393 E394 T401	V393-T397 VanDerWaalsContact O-CB 3.3Å; V393-T397 WeakPolarHBondContact O-CB 3.31Å; V393-T397 PolarHBondContact O-N 2.62Å; V393-T397 PolarHBondContact O-OG1 3.47Å; E394-T397 PolarHBondContact O-N 2.93Å; T397-T401 VanDerWaalsContact O-CB 3.31Å; T397-T401 WeakPolarHBondContact O-CB 3.4Å; T397-T401 PolarHBondContact O-N 2.92Å; T397-T401 PolarHBondContact O-OG1 3.35Å
398	Y	93	Very high	94	Very high	153 Å²	153	99.7 Å²	99.7	60%	0.6	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-47.2	173.5	178.3	-93.1	0	0	0	111.8	E394 L395 E396 Q400 T401 R402	E394-Y398 WeakPolarHBondContact O-CB 3.31Å; E394-Y398 PolarHBondContact O-N 2.84Å; L395-Y398 PolarHBondContact O-N 2.94Å; E396-Y398 VanDerWaalsContact C-N 3.33Å; E396-Y398 PolarHBondContact O-N 3.06Å; Y398-Q400 PolarHBondContact O-N 3.4Å; Y398-T401 PolarHBondContact O-N 2.93Å; Y398-R402 VanDerWaalsContact O-CB 3.29Å; Y398-R402 WeakPolarHBondContact O-CB 3.44Å; Y398-R402 PolarHBondContact O-N 3.24Å
399	K	93.6	Very high	94.1	Very high	95 Å²	95	101.2 Å²	101.2	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-57.6	-48.9	176.2	-74.2	165.9	178.3	176.1	0	112.1	L395 E396 R402 Q403	L395-K399 HydrophobicContact CG-CD 4.47Å; L395-K399 VanDerWaalsContact O-CG 3.31Å; L395-K399 WeakPolarHBondContact O-CG 3.46Å; L395-K399 PolarHBondContact O-N 2.88Å; E396-K399 PolarHBondContact O-N 3.21Å; E396-K399 IonicContact OE1-NZ 2.7Å; E396-K399 PolarHBondContact OE1-NZ 2.7Å; E396-K399 VanDerWaalsContact OE2-CD 3.26Å; E396-K399 WeakPolarHBondContact OE2-CD 3.34Å; E396-K399 IonicContact OE2-NZ 3.52Å; K399-R402 PolarHBondContact O-N 2.71Å; K399-Q403 WeakPolarHBondContact O-CB 3.45Å; K399-Q403 PolarHBondContact O-N 2.92Å
400	Q	94.6	Very high	94.1	Very high	135 Å²	135	99 Å²	99	63%	0.631	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-42.7	178.9	-70.6	178	17.6	0	0	111.7	E396 Y398 R402 Q403 G404	E396-Q400 WeakPolarHBondContact O-CB 3.39Å; E396-Q400 WeakPolarHBondContact O-CG 3.34Å; E396-Q400 PolarHBondContact O-N 3.25Å; Y398-Q400 PolarHBondContact O-N 3.4Å; Q400-R402 VanDerWaalsContact C-N 3.33Å; Q400-R402 PolarHBondContact O-N 2.76Å; Q400-Q403 PolarHBondContact O-N 3.35Å; Q400-G404 PolarHBondContact O-N 2.87Å
401	T	92.9	Very high	94.2	Very high	84 Å²	84	97.6 Å²	97.6	52%	0.515	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.6	-56.6	0	0	0	0	111.2	T397 Y398 G404 L405	T397-T401 VanDerWaalsContact O-CB 3.31Å; T397-T401 WeakPolarHBondContact O-CB 3.4Å; T397-T401 PolarHBondContact O-N 2.92Å; T397-T401 PolarHBondContact O-OG1 3.35Å; Y398-T401 PolarHBondContact O-N 2.93Å; T401-G404 PolarHBondContact O-N 3.47Å; T401-L405 HydrophobicContact CG2-CD1 4.48Å; T401-L405 WeakPolarHBondContact O-CG 2.87Å; T401-L405 PolarHBondContact O-N 2.98Å
402	R	93.2	Very high	94.4	Very high	126 Å²	126	98.2 Å²	98.2	48%	0.475	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-46.5	177.6	-174	52.8	153.7	131.6	-8.3	111.8	Y398 K399 Q400 G404 L405 D406	Y398-R402 VanDerWaalsContact O-CB 3.29Å; Y398-R402 WeakPolarHBondContact O-CB 3.44Å; Y398-R402 PolarHBondContact O-N 3.24Å; K399-R402 PolarHBondContact O-N 2.71Å; Q400-R402 VanDerWaalsContact C-N 3.33Å; Q400-R402 PolarHBondContact O-N 2.76Å; R402-G404 PolarHBondContact O-N 2.93Å; R402-L405 PolarHBondContact O-N 3.11Å; R402-D406 IonicContact CZ-OD1 2.64Å; R402-D406 IonicContact NH1-OD1 3.62Å; R402-D406 PolarHBondContact NH1-OD1 3.06Å; R402-D406 IonicContact NH1-OD2 2.62Å; R402-D406 VanDerWaalsContact O-CG 3.23Å; R402-D406 PolarHBondContact O-N 3.48Å
403	Q	93.5	Very high	94.5	Very high	114 Å²	114	99 Å²	99	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-58.3	-46.1	173.9	-179.1	-178.4	-23.1	0	0	111.4	K399 Q400 L405 D406 E407	K399-Q403 WeakPolarHBondContact O-CB 3.45Å; K399-Q403 PolarHBondContact O-N 2.92Å; Q400-Q403 PolarHBondContact O-N 3.35Å; Q403-L405 VanDerWaalsContact C-N 3.32Å; Q403-L405 PolarHBondContact O-N 3.46Å; Q403-D406 PolarHBondContact O-N 3.12Å; Q403-D406 VanDerWaalsContact O-N 3.13Å; Q403-E407 HydrophobicContact CG-CG 4.4Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.47Å; Q403-E407 PolarHBondContact NE2-OE1 3.27Å; Q403-E407 WeakPolarHBondContact O-CB 3.48Å; Q403-E407 WeakPolarHBondContact O-CG 3.39Å; Q403-E407 PolarHBondContact O-N 2.7Å
404	G	94.5	Very high	94.5	Very high	37 Å²	37	101.9 Å²	101.9	38%	0.381	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-36.7	177.4	0	0	0	0	0	113.5	Q400 T401 R402 M408	Q400-G404 PolarHBondContact O-N 2.87Å; T401-G404 PolarHBondContact O-N 3.47Å; R402-G404 PolarHBondContact O-N 2.93Å; G404-M408 VanDerWaalsContact O-CB 3.28Å; G404-M408 WeakPolarHBondContact O-CB 3.48Å; G404-M408 PolarHBondContact O-N 2.76Å
405	L	93.9	Very high	94.7	Very high	88 Å²	88	100.9 Å²	100.9	46%	0.461	49%	0.489	S	S	.	.	H	α-helix	trans	-67.1	-40.5	172.2	-72.5	171.3	0	0	0	112.2	T401 R402 Q403 M408 Y409	T401-L405 HydrophobicContact CG2-CD1 4.48Å; T401-L405 WeakPolarHBondContact O-CG 2.87Å; T401-L405 PolarHBondContact O-N 2.98Å; R402-L405 PolarHBondContact O-N 3.11Å; Q403-L405 VanDerWaalsContact C-N 3.32Å; Q403-L405 PolarHBondContact O-N 3.46Å; L405-M408 HydrophobicContact CD2-CE 3.79Å; L405-M408 PolarHBondContact O-N 2.83Å; L405-Y409 WeakPolarHBondContact O-CB 3.31Å; L405-Y409 PolarHBondContact O-N 3.26Å
406	D	93.1	Very high	94.9	Very high	64 Å²	64	103 Å²	103	34%	0.342	49%	0.493	S	S	.	.	H	α-helix	trans	-71.7	-35.8	179.5	-64.1	-21.8	0	0	0	111.4	R402 Q403 N410	R402-D406 IonicContact CZ-OD1 2.64Å; R402-D406 IonicContact NH1-OD1 3.62Å; R402-D406 PolarHBondContact NH1-OD1 3.06Å; R402-D406 IonicContact NH1-OD2 2.62Å; R402-D406 VanDerWaalsContact O-CG 3.23Å; R402-D406 PolarHBondContact O-N 3.48Å; Q403-D406 PolarHBondContact O-N 3.12Å; Q403-D406 VanDerWaalsContact O-N 3.13Å; D406-N410 WeakPolarHBondContact O-CB 3.4Å; D406-N410 PolarHBondContact O-N 2.72Å; D406-N410 PolarHBondContact O-ND2 3.07Å
407	E	95.7	Very high	95	Very high	108 Å²	108	105.5 Å²	105.5	51%	0.505	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-47.3	169.8	-75.3	178.4	-162.1	0	0	111.5	Q403 Y409 N410 V411	Q403-E407 HydrophobicContact CG-CG 4.4Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.47Å; Q403-E407 PolarHBondContact NE2-OE1 3.27Å; Q403-E407 WeakPolarHBondContact O-CB 3.48Å; Q403-E407 WeakPolarHBondContact O-CG 3.39Å; Q403-E407 PolarHBondContact O-N 2.7Å; E407-Y409 VanDerWaalsContact C-N 3.34Å; E407-Y409 PolarHBondContact O-N 2.98Å; E407-N410 WeakPolarHBondContact O-CB 3.5Å; E407-N410 PolarHBondContact O-N 2.94Å; E407-V411 WeakPolarHBondContact O-CG2 3.39Å; E407-V411 PolarHBondContact O-N 2.64Å
408	M	95.3	Very high	95.1	Very high	112 Å²	112	105.9 Å²	105.9	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-59	-44.5	174.8	-177.6	-176.9	70.2	0	0	111.5	G404 L405 N410 V411 V412	G404-M408 VanDerWaalsContact O-CB 3.28Å; G404-M408 WeakPolarHBondContact O-CB 3.48Å; G404-M408 PolarHBondContact O-N 2.76Å; L405-M408 HydrophobicContact CD2-CE 3.79Å; L405-M408 PolarHBondContact O-N 2.83Å; M408-N410 VanDerWaalsContact C-N 3.33Å; M408-N410 PolarHBondContact O-N 3.14Å; M408-V411 PolarHBondContact O-N 3.08Å; M408-V412 WeakPolarHBondContact O-CG2 3.32Å; M408-V412 PolarHBondContact O-N 2.87Å
409	Y	95.2	Very high	95.3	Very high	149 Å²	149	104.7 Å²	104.7	58%	0.584	50%	0.499	S	S	*	.	H	α-helix	trans	-60.4	-42.9	175.5	-177.5	-95.8	0	0	0	111.5	L405 E407 V411 V412 W413	L405-Y409 WeakPolarHBondContact O-CB 3.31Å; L405-Y409 PolarHBondContact O-N 3.26Å; E407-Y409 VanDerWaalsContact C-N 3.34Å; E407-Y409 PolarHBondContact O-N 2.98Å; Y409-V411 PolarHBondContact O-N 3.24Å; Y409-V412 PolarHBondContact O-N 2.75Å; Y409-W413 WeakPolarHBondContact O-CB 3.29Å; Y409-W413 PolarHBondContact O-N 3.41Å
410	N	95.8	Very high	95.5	Very high	86 Å²	86	105.1 Å²	105.1	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-35.7	175.4	-83.5	-66.4	0	0	0	113.2	D406 E407 M408 K414	D406-N410 WeakPolarHBondContact O-CB 3.4Å; D406-N410 PolarHBondContact O-N 2.72Å; D406-N410 PolarHBondContact O-ND2 3.07Å; E407-N410 WeakPolarHBondContact O-CB 3.5Å; E407-N410 PolarHBondContact O-N 2.94Å; M408-N410 VanDerWaalsContact C-N 3.33Å; M408-N410 PolarHBondContact O-N 3.14Å; N410-K414 WeakPolarHBondContact O-CB 3.35Å; N410-K414 VanDerWaalsContact O-CG 3.3Å; N410-K414 WeakPolarHBondContact O-CG 3.34Å; N410-K414 PolarHBondContact O-N 3.01Å
411	V	97.1	Very high	95.6	Very high	80 Å²	80	103.7 Å²	103.7	49%	0.485	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-50.3	173.7	171	0	0	0	0	110.8	E407 M408 Y409 W413 K414 Q415	E407-V411 WeakPolarHBondContact O-CG2 3.39Å; E407-V411 PolarHBondContact O-N 2.64Å; M408-V411 PolarHBondContact O-N 3.08Å; Y409-V411 PolarHBondContact O-N 3.24Å; V411-W413 VanDerWaalsContact C-N 3.29Å; V411-W413 PolarHBondContact O-N 3.15Å; V411-K414 PolarHBondContact O-N 3.45Å; V411-Q415 WeakPolarHBondContact O-CG 3.41Å; V411-Q415 PolarHBondContact O-N 3.09Å
412	V	95.7	Very high	95.8	Very high	81 Å²	81	102.6 Å²	102.6	49%	0.491	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-38.6	177.8	172.4	0	0	0	0	111.2	M408 Y409 Q415 Y416	M408-V412 WeakPolarHBondContact O-CG2 3.32Å; M408-V412 PolarHBondContact O-N 2.87Å; Y409-V412 PolarHBondContact O-N 2.75Å; V412-Q415 PolarHBondContact O-N 3.35Å; V412-Y416 WeakPolarHBondContact O-CB 3.37Å; V412-Y416 PolarHBondContact O-N 2.89Å
413	W	96.1	Very high	96	Very high	111 Å²	111	104.1 Å²	104.1	42%	0.42	49%	0.485	S	S	.	.	H	α-helix	trans	-69	-35.3	177.7	-171.6	-132.7	0	0	0	113.1	Y409 V411 Y416 K417	Y409-W413 WeakPolarHBondContact O-CB 3.29Å; Y409-W413 PolarHBondContact O-N 3.41Å; V411-W413 VanDerWaalsContact C-N 3.29Å; V411-W413 PolarHBondContact O-N 3.15Å; W413-Y416 AromaticContact CE3-CD1 3.66Å; W413-Y416 HydrophobicContact CE3-CD1 3.66Å; W413-Y416 HydrophobicContact CE3-CE1 4.37Å; W413-Y416 HydrophobicContact CE3-CG 4.39Å; W413-Y416 HydrophobicContact CH2-CD1 4.28Å; W413-Y416 HydrophobicContact CH2-CE1 4.24Å; W413-Y416 AromaticContact CZ3-CD1 3.42Å; W413-Y416 HydrophobicContact CZ3-CD1 3.42Å; W413-Y416 VanDerWaalsContact CZ3-CD1 3.42Å; W413-Y416 AromaticContact CZ3-CE1 3.67Å; W413-Y416 HydrophobicContact CZ3-CE1 3.67Å; W413-Y416 HydrophobicContact CZ3-CG 4.4Å; W413-K417 WeakPolarHBondContact O-CG 3.45Å; W413-K417 PolarHBondContact O-N 3.44Å; W413-K417 VanDerWaalsContact O-N 3.12Å
414	K	96.9	Very high	96.2	Very high	151 Å²	151	102.7 Å²	102.7	66%	0.657	48%	0.479	S	S	*	.	H	α-helix	trans	-66.1	-46.6	170.4	-76	171.5	-179.2	177.2	0	111.3	N410 V411 K417 E418	N410-K414 WeakPolarHBondContact O-CB 3.35Å; N410-K414 VanDerWaalsContact O-CG 3.3Å; N410-K414 WeakPolarHBondContact O-CG 3.34Å; N410-K414 PolarHBondContact O-N 3.01Å; V411-K414 PolarHBondContact O-N 3.45Å; K414-K417 PolarHBondContact O-N 3.44Å; K414-E418 PolarHBondContact O-N 3.26Å
415	Q	96.3	Very high	96.4	Very high	123 Å²	123	105.7 Å²	105.7	58%	0.575	48%	0.483	S	S	*	.	H	α-helix	trans	-59.4	-47	176.2	-73.2	175.4	-19.1	0	0	111.7	V411 V412 K417 E418 E419	V411-Q415 WeakPolarHBondContact O-CG 3.41Å; V411-Q415 PolarHBondContact O-N 3.09Å; V412-Q415 PolarHBondContact O-N 3.35Å; Q415-K417 VanDerWaalsContact C-N 3.33Å; Q415-K417 PolarHBondContact O-N 3.16Å; Q415-E418 PolarHBondContact O-N 3Å; Q415-E419 WeakPolarHBondContact O-CB 3.48Å; Q415-E419 PolarHBondContact O-N 3.39Å
416	Y	96.8	Very high	96.6	Very high	123 Å²	123	106.9 Å²	106.9	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-41.5	176.3	171.1	-100.3	0	0	0	112.8	V412 W413 K420	V412-Y416 WeakPolarHBondContact O-CB 3.37Å; V412-Y416 PolarHBondContact O-N 2.89Å; W413-Y416 AromaticContact CE3-CD1 3.66Å; W413-Y416 HydrophobicContact CE3-CD1 3.66Å; W413-Y416 HydrophobicContact CE3-CE1 4.37Å; W413-Y416 HydrophobicContact CE3-CG 4.39Å; W413-Y416 HydrophobicContact CH2-CD1 4.28Å; W413-Y416 HydrophobicContact CH2-CE1 4.24Å; W413-Y416 AromaticContact CZ3-CD1 3.42Å; W413-Y416 HydrophobicContact CZ3-CD1 3.42Å; W413-Y416 VanDerWaalsContact CZ3-CD1 3.42Å; W413-Y416 AromaticContact CZ3-CE1 3.67Å; W413-Y416 HydrophobicContact CZ3-CE1 3.67Å; W413-Y416 HydrophobicContact CZ3-CG 4.4Å; Y416-K420 HydrophobicContact CE1-CD 4.46Å; Y416-K420 VanDerWaalsContact O-CB 3.23Å; Y416-K420 WeakPolarHBondContact O-CB 3.25Å; Y416-K420 PolarHBondContact O-N 2.78Å
417	K	97.3	Very high	96.8	Very high	119 Å²	119	107.8 Å²	107.8	52%	0.517	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-42.1	176.5	-78.8	-179.8	175.7	-175.4	0	112.3	W413 K414 Q415 R421	W413-K417 WeakPolarHBondContact O-CG 3.45Å; W413-K417 PolarHBondContact O-N 3.44Å; W413-K417 VanDerWaalsContact O-N 3.12Å; K414-K417 PolarHBondContact O-N 3.44Å; Q415-K417 VanDerWaalsContact C-N 3.33Å; Q415-K417 PolarHBondContact O-N 3.16Å; K417-R421 PolarHBondContact O-N 3.02Å
418	E	97.3	Very high	96.9	Very high	84 Å²	84	109.4 Å²	109.4	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-72.9	-42.5	-179.6	-175.4	55.2	-159.2	0	0	112	K414 Q415 K420 R421 I422	K414-E418 PolarHBondContact O-N 3.26Å; Q415-E418 PolarHBondContact O-N 3Å; E418-K420 VanDerWaalsContact C-N 3.28Å; E418-K420 PolarHBondContact O-N 3.33Å; E418-R421 VanDerWaalsContact CD-NE 3.29Å; E418-R421 WeakPolarHBondContact O-CA 3.4Å; E418-R421 WeakPolarHBondContact O-CB 3.39Å; E418-R421 PolarHBondContact O-N 3.25Å; E418-R421 IonicContact OE1-CZ 2.83Å; E418-R421 VanDerWaalsContact OE1-CZ 3.23Å; E418-R421 IonicContact OE1-NE 2.65Å; E418-R421 PolarHBondContact OE1-NE 2.78Å; E418-R421 IonicContact OE1-NH2 2.62Å; E418-R421 PolarHBondContact OE1-NH2 2.93Å; E418-R421 WeakPolarHBondContact OE2-CD 3.33Å; E418-R421 IonicContact OE2-CZ 3.38Å; E418-R421 IonicContact OE2-NE 2.76Å; E418-R421 PolarHBondContact OE2-NE 3Å; E418-I422 HydrophobicContact CG-CD1 3.96Å; E418-I422 HydrophobicContact CG-CG1 4.49Å; E418-I422 WeakPolarHBondContact O-CG1 3.12Å; E418-I422 PolarHBondContact O-N 2.71Å
419	E	96.1	Very high	97	Very high	129 Å²	129	108.2 Å²	108.2	60%	0.603	49%	0.486	S	S	*	.	H	α-helix	trans	-57.4	-42.6	172.3	-175	63.5	-160	0	0	111.1	Q415 R421 R423	Q415-E419 WeakPolarHBondContact O-CB 3.48Å; Q415-E419 PolarHBondContact O-N 3.39Å; E419-R421 PolarHBondContact O-N 3.34Å; E419-R423 WeakPolarHBondContact O-CB 3.25Å; E419-R423 PolarHBondContact O-N 2.88Å
420	K	97.3	Very high	97.1	Very high	104 Å²	104	106.5 Å²	106.5	45%	0.452	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-37.7	173.5	-176.5	176.6	179.9	177.5	0	112.4	Y416 E418 Q424	Y416-K420 HydrophobicContact CE1-CD 4.46Å; Y416-K420 VanDerWaalsContact O-CB 3.23Å; Y416-K420 WeakPolarHBondContact O-CB 3.25Å; Y416-K420 PolarHBondContact O-N 2.78Å; E418-K420 VanDerWaalsContact C-N 3.28Å; E418-K420 PolarHBondContact O-N 3.33Å; K420-Q424 WeakPolarHBondContact O-CG 3.33Å; K420-Q424 PolarHBondContact O-N 2.9Å; K420-Q424 VanDerWaalsContact O-N 3.09Å
421	R	98.1	Very high	97.1	Very high	105 Å²	105	109.3 Å²	109.3	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-65.6	-51	177.1	-167.7	-161.8	68.8	65.9	10.2	110.9	K417 E418 E419 R423 Q424 E425	K417-R421 PolarHBondContact O-N 3.02Å; E418-R421 VanDerWaalsContact CD-NE 3.29Å; E418-R421 WeakPolarHBondContact O-CA 3.4Å; E418-R421 WeakPolarHBondContact O-CB 3.39Å; E418-R421 PolarHBondContact O-N 3.25Å; E418-R421 IonicContact OE1-CZ 2.83Å; E418-R421 VanDerWaalsContact OE1-CZ 3.23Å; E418-R421 IonicContact OE1-NE 2.65Å; E418-R421 PolarHBondContact OE1-NE 2.78Å; E418-R421 IonicContact OE1-NH2 2.62Å; E418-R421 PolarHBondContact OE1-NH2 2.93Å; E418-R421 WeakPolarHBondContact OE2-CD 3.33Å; E418-R421 IonicContact OE2-CZ 3.38Å; E418-R421 IonicContact OE2-NE 2.76Å; E418-R421 PolarHBondContact OE2-NE 3Å; E419-R421 PolarHBondContact O-N 3.34Å; R421-R423 VanDerWaalsContact C-N 3.33Å; R421-R423 PolarHBondContact O-N 3.32Å; R421-Q424 PolarHBondContact O-N 3.25Å; R421-E425 IonicContact CZ-OE2 2.77Å; R421-E425 IonicContact NH1-OE1 2.71Å; R421-E425 IonicContact NH1-OE2 3.74Å; R421-E425 PolarHBondContact NH1-OE2 3.12Å; R421-E425 IonicContact NH2-OE2 3.76Å; R421-E425 PolarHBondContact NH2-OE2 2.92Å; R421-E425 PolarHBondContact O-N 2.79Å
422	I	97.6	Very high	97.2	Very high	61 Å²	61	110 Å²	110	31%	0.313	50%	0.497	S	S	.	.	H	α-helix	trans	-58.8	-45.1	177.2	-67.6	166.4	0	0	0	110.3	E418 Q424 E425 L426	E418-I422 HydrophobicContact CG-CD1 3.96Å; E418-I422 HydrophobicContact CG-CG1 4.49Å; E418-I422 WeakPolarHBondContact O-CG1 3.12Å; E418-I422 PolarHBondContact O-N 2.71Å; I422-Q424 PolarHBondContact O-N 2.99Å; I422-E425 WeakPolarHBondContact O-CB 3.27Å; I422-E425 PolarHBondContact O-N 3.44Å; I422-E425 VanDerWaalsContact O-N 3.15Å; I422-L426 HydrophobicContact CG2-CD1 3.97Å; I422-L426 HydrophobicContact CG2-CG 4.45Å; I422-L426 WeakPolarHBondContact O-CG 3.47Å; I422-L426 PolarHBondContact O-N 3.41Å
423	R	97.6	Very high	97.2	Very high	157 Å²	157	111 Å²	111	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-59.6	-45.4	177	-179.7	175.1	174.9	127.2	15	112.6	E419 R421 E425 L426 E427	E419-R423 WeakPolarHBondContact O-CB 3.25Å; E419-R423 PolarHBondContact O-N 2.88Å; R421-R423 VanDerWaalsContact C-N 3.33Å; R421-R423 PolarHBondContact O-N 3.32Å; R423-E425 VanDerWaalsContact C-N 3.27Å; R423-E425 PolarHBondContact O-N 3.11Å; R423-L426 PolarHBondContact O-N 2.94Å; R423-E427 HydrophobicContact CG-CG 4.43Å; R423-E427 IonicContact CZ-OE1 3.49Å; R423-E427 VanDerWaalsContact CZ-OE1 3.29Å; R423-E427 IonicContact NE-OE1 2.77Å; R423-E427 PolarHBondContact NE-OE1 3.24Å; R423-E427 IonicContact NH2-OE1 3.08Å; R423-E427 PolarHBondContact NH2-OE1 3.33Å; R423-E427 WeakPolarHBondContact O-CB 3.46Å; R423-E427 VanDerWaalsContact O-CG 3.31Å; R423-E427 WeakPolarHBondContact O-CG 3.37Å; R423-E427 PolarHBondContact O-N 3.13Å
424	Q	97.7	Very high	97.3	Very high	85 Å²	85	108.8 Å²	108.8	40%	0.397	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-29	176.6	-73.5	-179.4	-21	0	0	112.8	K420 R421 I422 R428	K420-Q424 WeakPolarHBondContact O-CG 3.33Å; K420-Q424 PolarHBondContact O-N 2.9Å; K420-Q424 VanDerWaalsContact O-N 3.09Å; R421-Q424 PolarHBondContact O-N 3.25Å; I422-Q424 PolarHBondContact O-N 2.99Å; Q424-R428 WeakPolarHBondContact O-CG 3.46Å; Q424-R428 PolarHBondContact O-N 3.2Å; Q424-R428 PolarHBondContact O-NH1 2.98Å; Q424-R428 VanDerWaalsContact O-NH1 3.08Å
425	E	97.8	Very high	97.3	Very high	99 Å²	99	102.9 Å²	102.9	46%	0.463	48%	0.477	S	S	.	.	H	α-helix	trans	-70.1	-45.8	173.7	-167.5	161.3	-139.3	0	0	111.3	R421 I422 R423 R428 E429	R421-E425 IonicContact CZ-OE2 2.77Å; R421-E425 IonicContact NH1-OE1 2.71Å; R421-E425 IonicContact NH1-OE2 3.74Å; R421-E425 PolarHBondContact NH1-OE2 3.12Å; R421-E425 IonicContact NH2-OE2 3.76Å; R421-E425 PolarHBondContact NH2-OE2 2.92Å; R421-E425 PolarHBondContact O-N 2.79Å; I422-E425 WeakPolarHBondContact O-CB 3.27Å; I422-E425 PolarHBondContact O-N 3.44Å; I422-E425 VanDerWaalsContact O-N 3.15Å; R423-E425 VanDerWaalsContact C-N 3.27Å; R423-E425 PolarHBondContact O-N 3.11Å; E425-R428 PolarHBondContact O-N 3.08Å; E425-E429 PolarHBondContact O-N 2.83Å
426	L	97.2	Very high	97.4	Very high	114 Å²	114	100.9 Å²	100.9	60%	0.597	47%	0.47	S	S	*	.	H	α-helix	trans	-63.2	-38.1	173	-70.7	169.3	0	0	0	113.2	I422 R423 E429 L430	I422-L426 HydrophobicContact CG2-CD1 3.97Å; I422-L426 HydrophobicContact CG2-CG 4.45Å; I422-L426 WeakPolarHBondContact O-CG 3.47Å; I422-L426 PolarHBondContact O-N 3.41Å; R423-L426 PolarHBondContact O-N 2.94Å; L426-E429 PolarHBondContact O-N 2.91Å; L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.27Å; L426-L430 PolarHBondContact O-N 3.16Å
427	E	97.3	Very high	97.4	Very high	82 Å²	82	101.1 Å²	101.1	38%	0.383	47%	0.474	S	S	.	.	H	α-helix	trans	-64.9	-40.4	177.1	-76.4	167.7	171.4	0	0	111	R423 E431	R423-E427 HydrophobicContact CG-CG 4.43Å; R423-E427 IonicContact CZ-OE1 3.49Å; R423-E427 VanDerWaalsContact CZ-OE1 3.29Å; R423-E427 IonicContact NE-OE1 2.77Å; R423-E427 PolarHBondContact NE-OE1 3.24Å; R423-E427 IonicContact NH2-OE1 3.08Å; R423-E427 PolarHBondContact NH2-OE1 3.33Å; R423-E427 WeakPolarHBondContact O-CB 3.46Å; R423-E427 VanDerWaalsContact O-CG 3.31Å; R423-E427 WeakPolarHBondContact O-CG 3.37Å; R423-E427 PolarHBondContact O-N 3.13Å; E427-E431 WeakPolarHBondContact O-CG 3.42Å; E427-E431 PolarHBondContact O-N 3.19Å; E427-E431 VanDerWaalsContact O-N 3.11Å
428	R	97.8	Very high	97.4	Very high	142 Å²	142	101.6 Å²	101.6	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-42	173.3	-69.5	-176.3	-143.8	93.3	1.9	113.5	Q424 E425 L430 E431 L432	Q424-R428 WeakPolarHBondContact O-CG 3.46Å; Q424-R428 PolarHBondContact O-N 3.2Å; Q424-R428 PolarHBondContact O-NH1 2.98Å; Q424-R428 VanDerWaalsContact O-NH1 3.08Å; E425-R428 PolarHBondContact O-N 3.08Å; R428-L430 VanDerWaalsContact C-N 3.3Å; R428-L430 PolarHBondContact O-N 3.45Å; R428-E431 PolarHBondContact O-N 2.98Å; R428-L432 PolarHBondContact O-N 2.87Å
429	E	97.6	Very high	97.4	Very high	88 Å²	88	103.9 Å²	103.9	41%	0.411	49%	0.486	S	S	.	.	H	α-helix	trans	-63.5	-39.2	176.9	-179.6	56.7	-151	0	0	110.6	E425 L426 E431 L432 Q433	E425-E429 PolarHBondContact O-N 2.83Å; L426-E429 PolarHBondContact O-N 2.91Å; E429-E431 PolarHBondContact O-N 3.01Å; E429-L432 PolarHBondContact O-N 2.99Å; E429-Q433 HydrophobicContact CG-CG 4.43Å; E429-Q433 WeakPolarHBondContact O-CB 3.43Å; E429-Q433 VanDerWaalsContact O-CG 3.26Å; E429-Q433 WeakPolarHBondContact O-CG 3.45Å; E429-Q433 PolarHBondContact O-N 2.89Å; E429-Q433 WeakPolarHBondContact OE1-CG 3.43Å; E429-Q433 PolarHBondContact OE1-NE2 2.86Å
430	L	97.1	Very high	97.4	Very high	112 Å²	112	104.2 Å²	104.2	59%	0.586	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-41.1	174	-178.6	61.4	0	0	0	112.2	L426 R428 Q433 V434	L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.27Å; L426-L430 PolarHBondContact O-N 3.16Å; R428-L430 VanDerWaalsContact C-N 3.3Å; R428-L430 PolarHBondContact O-N 3.45Å; L430-Q433 PolarHBondContact O-N 3.5Å; L430-V434 HydrophobicContact CD1-CG2 4.4Å; L430-V434 WeakPolarHBondContact O-CB 3.47Å; L430-V434 VanDerWaalsContact O-CG2 3.26Å; L430-V434 WeakPolarHBondContact O-CG2 3.26Å; L430-V434 PolarHBondContact O-N 3.29Å
431	E	97.4	Very high	97.4	Very high	146 Å²	146	102.7 Å²	102.7	68%	0.682	48%	0.484	S	S	*	.	H	α-helix	trans	-61.6	-42.5	173.6	-74	178.8	159.9	0	0	112	E427 R428 E429 V434 G435	E427-E431 WeakPolarHBondContact O-CG 3.42Å; E427-E431 PolarHBondContact O-N 3.19Å; E427-E431 VanDerWaalsContact O-N 3.11Å; R428-E431 PolarHBondContact O-N 2.98Å; E429-E431 PolarHBondContact O-N 3.01Å; E431-V434 PolarHBondContact O-N 3.48Å; E431-G435 PolarHBondContact O-N 3.01Å
432	L	97.7	Very high	97.4	Very high	95 Å²	95	101.7 Å²	101.7	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-47.4	176	-178.5	62.5	0	0	0	111.9	R428 E429 V434 G435 L436	R428-L432 PolarHBondContact O-N 2.87Å; E429-L432 PolarHBondContact O-N 2.99Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 3.46Å; L432-G435 WeakPolarHBondContact O-CA 3.37Å; L432-G435 PolarHBondContact O-N 3.45Å; L432-L436 HydrophobicContact CD1-CD1 4.46Å; L432-L436 HydrophobicContact CD1-CG 4.48Å; L432-L436 HydrophobicContact CG-CD1 4.15Å; L432-L436 WeakPolarHBondContact O-CG 3.36Å; L432-L436 PolarHBondContact O-N 3.35Å
433	Q	97.1	Very high	97.3	Very high	101 Å²	101	101.4 Å²	101.4	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-38.1	175.8	-68.5	-66.7	-27.6	0	0	112	E429 L430 G435 K437	E429-Q433 HydrophobicContact CG-CG 4.43Å; E429-Q433 WeakPolarHBondContact O-CB 3.43Å; E429-Q433 VanDerWaalsContact O-CG 3.26Å; E429-Q433 WeakPolarHBondContact O-CG 3.45Å; E429-Q433 PolarHBondContact O-N 2.89Å; E429-Q433 WeakPolarHBondContact OE1-CG 3.43Å; E429-Q433 PolarHBondContact OE1-NE2 2.86Å; L430-Q433 PolarHBondContact O-N 3.5Å; Q433-G435 VanDerWaalsContact C-N 3.34Å; Q433-K437 VanDerWaalsContact O-CB 3.24Å; Q433-K437 WeakPolarHBondContact O-CB 3.28Å; Q433-K437 PolarHBondContact O-N 2.85Å
434	V	97.4	Very high	97.3	Very high	64 Å²	64	98.6 Å²	98.6	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-67.9	-33	173.6	166.2	0	0	0	0	111.9	L430 E431 L432 K438	L430-V434 HydrophobicContact CD1-CG2 4.4Å; L430-V434 WeakPolarHBondContact O-CB 3.47Å; L430-V434 VanDerWaalsContact O-CG2 3.26Å; L430-V434 WeakPolarHBondContact O-CG2 3.26Å; L430-V434 PolarHBondContact O-N 3.29Å; E431-V434 PolarHBondContact O-N 3.48Å; L432-V434 VanDerWaalsContact C-N 3.3Å; L432-V434 PolarHBondContact O-N 3.46Å; V434-K438 HydrophobicContact CG1-CD 4.45Å; V434-K438 WeakPolarHBondContact O-CD 3.42Å; V434-K438 VanDerWaalsContact O-CG 3.27Å; V434-K438 WeakPolarHBondContact O-CG 3.31Å; V434-K438 PolarHBondContact O-N 3.28Å
435	G	97.3	Very high	97.2	Very high	28 Å²	28	100 Å²	100	29%	0.289	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-59.8	170.3	0	0	0	0	0	111.9	E431 L432 Q433 K437 K438 E439	E431-G435 PolarHBondContact O-N 3.01Å; L432-G435 WeakPolarHBondContact O-CA 3.37Å; L432-G435 PolarHBondContact O-N 3.45Å; Q433-G435 VanDerWaalsContact C-N 3.34Å; G435-K437 PolarHBondContact O-N 3.08Å; G435-K438 WeakPolarHBondContact O-CB 3.32Å; G435-K438 PolarHBondContact O-N 3.06Å; G435-E439 PolarHBondContact O-N 3.45Å
436	L	97.4	Very high	97.2	Very high	81 Å²	81	100.7 Å²	100.7	42%	0.424	50%	0.502	S	S	.	.	H	α-helix	trans	-54.9	-38.4	179.2	-68.7	169.9	0	0	0	112.4	L432 E439 M440	L432-L436 HydrophobicContact CD1-CD1 4.46Å; L432-L436 HydrophobicContact CD1-CG 4.48Å; L432-L436 HydrophobicContact CG-CD1 4.15Å; L432-L436 WeakPolarHBondContact O-CG 3.36Å; L432-L436 PolarHBondContact O-N 3.35Å; L436-E439 PolarHBondContact O-N 3.44Å; L436-M440 WeakPolarHBondContact O-CB 3.24Å; L436-M440 PolarHBondContact O-N 3.1Å
437	K	97.3	Very high	97.2	Very high	127 Å²	127	100.4 Å²	100.4	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-64.5	-39.1	175.4	-174.9	172.1	-175.9	-69.6	0	112.8	Q433 G435 E441	Q433-K437 VanDerWaalsContact O-CB 3.24Å; Q433-K437 WeakPolarHBondContact O-CB 3.28Å; Q433-K437 PolarHBondContact O-N 2.85Å; G435-K437 PolarHBondContact O-N 3.08Å; K437-E441 IonicContact NZ-OE1 2.66Å; K437-E441 PolarHBondContact NZ-OE1 3.36Å; K437-E441 WeakPolarHBondContact O-CB 3.26Å; K437-E441 WeakPolarHBondContact O-CG 3.45Å; K437-E441 PolarHBondContact O-N 3.09Å
438	K	97.4	Very high	97.1	Very high	130 Å²	130	100.9 Å²	100.9	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-41.9	175.6	-69.7	162.2	-175.2	169.7	0	111.2	V434 G435 E441 V442	V434-K438 HydrophobicContact CG1-CD 4.45Å; V434-K438 WeakPolarHBondContact O-CD 3.42Å; V434-K438 VanDerWaalsContact O-CG 3.27Å; V434-K438 WeakPolarHBondContact O-CG 3.31Å; V434-K438 PolarHBondContact O-N 3.28Å; G435-K438 WeakPolarHBondContact O-CB 3.32Å; G435-K438 PolarHBondContact O-N 3.06Å; K438-E441 PolarHBondContact O-N 3.15Å; K438-V442 WeakPolarHBondContact O-CG2 3.45Å; K438-V442 PolarHBondContact O-N 2.88Å
439	E	97.2	Very high	97.1	Very high	131 Å²	131	99.7 Å²	99.7	61%	0.612	50%	0.501	S	S	*	.	H	α-helix	trans	-62.8	-44.3	175.9	-67.8	179.4	173.5	0	0	111.3	G435 L436 E441 V442 A443	G435-E439 PolarHBondContact O-N 3.45Å; L436-E439 PolarHBondContact O-N 3.44Å; E439-E441 PolarHBondContact O-N 3.34Å; E439-V442 PolarHBondContact O-N 3.01Å; E439-A443 WeakPolarHBondContact O-CB 3.49Å; E439-A443 PolarHBondContact O-N 3.3Å
440	M	96.6	Very high	97.1	Very high	137 Å²	137	98.6 Å²	98.6	68%	0.675	50%	0.498	S	S	*	.	H	α-helix	trans	-60.3	-43.1	173.6	-171.4	65.8	68.1	0	0	112.2	L436 V442 A443 M444	L436-M440 WeakPolarHBondContact O-CB 3.24Å; L436-M440 PolarHBondContact O-N 3.1Å; M440-V442 VanDerWaalsContact C-N 3.32Å; M440-V442 PolarHBondContact O-N 3.2Å; M440-A443 PolarHBondContact O-N 3.43Å; M440-M444 VanDerWaalsContact O-CB 3.28Å; M440-M444 WeakPolarHBondContact O-CB 3.3Å; M440-M444 PolarHBondContact O-N 2.91Å
441	E	96.9	Very high	97	Very high	72 Å²	72	96.9 Å²	96.9	34%	0.336	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-33.1	175.5	-79.1	177.7	-151.7	0	0	113.2	K437 K438 E439 K445	K437-E441 IonicContact NZ-OE1 2.66Å; K437-E441 PolarHBondContact NZ-OE1 3.36Å; K437-E441 WeakPolarHBondContact O-CB 3.26Å; K437-E441 WeakPolarHBondContact O-CG 3.45Å; K437-E441 PolarHBondContact O-N 3.09Å; K438-E441 PolarHBondContact O-N 3.15Å; E439-E441 PolarHBondContact O-N 3.34Å; E441-K445 WeakPolarHBondContact O-CD 3.27Å; E441-K445 VanDerWaalsContact O-CG 3.27Å; E441-K445 WeakPolarHBondContact O-CG 3.44Å; E441-K445 PolarHBondContact O-N 3.05Å
442	V	97.4	Very high	96.9	Very high	84 Å²	84	95.4 Å²	95.4	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-72.7	-46.3	173.9	170.3	0	0	0	0	110.7	K438 E439 M440 M444 K445 L446	K438-V442 WeakPolarHBondContact O-CG2 3.45Å; K438-V442 PolarHBondContact O-N 2.88Å; E439-V442 PolarHBondContact O-N 3.01Å; M440-V442 VanDerWaalsContact C-N 3.32Å; M440-V442 PolarHBondContact O-N 3.2Å; V442-M444 VanDerWaalsContact C-N 3.32Å; V442-M444 PolarHBondContact O-N 3Å; V442-K445 PolarHBondContact O-N 3.03Å; V442-L446 HydrophobicContact CG1-CD1 4.1Å; V442-L446 WeakPolarHBondContact O-CG 3.36Å; V442-L446 PolarHBondContact O-N 3.01Å
443	A	96.6	Very high	96.8	Very high	54 Å²	54	95.2 Å²	95.2	45%	0.446	48%	0.478	S	S	.	.	H	α-helix	trans	-60.2	-41.5	176.6	0	0	0	0	0	111.9	E439 M440 L446 L447	E439-A443 WeakPolarHBondContact O-CB 3.49Å; E439-A443 PolarHBondContact O-N 3.3Å; M440-A443 PolarHBondContact O-N 3.43Å; A443-L446 PolarHBondContact O-N 3.39Å; A443-L447 WeakPolarHBondContact O-CB 3.36Å; A443-L447 PolarHBondContact O-N 3.47Å
444	M	96.9	Very high	96.7	Very high	98 Å²	98	95.7 Å²	95.7	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-47	175.4	-168.3	-178.1	84.1	0	0	111.5	M440 V442 L446 L447 E448	M440-M444 VanDerWaalsContact O-CB 3.28Å; M440-M444 WeakPolarHBondContact O-CB 3.3Å; M440-M444 PolarHBondContact O-N 2.91Å; V442-M444 VanDerWaalsContact C-N 3.32Å; V442-M444 PolarHBondContact O-N 3Å; M444-L446 VanDerWaalsContact C-N 3.32Å; M444-L446 PolarHBondContact O-N 3.01Å; M444-L447 PolarHBondContact O-N 3.06Å; M444-E448 WeakPolarHBondContact O-CB 3.13Å; M444-E448 WeakPolarHBondContact O-CG 2.97Å; M444-E448 PolarHBondContact O-N 3.21Å
445	K	96.8	Very high	96.7	Very high	115 Å²	115	98.1 Å²	98.1	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-63.9	-34.6	177.4	-73.7	164.7	-172.7	157.3	0	113.1	E441 V442 K449	E441-K445 WeakPolarHBondContact O-CD 3.27Å; E441-K445 VanDerWaalsContact O-CG 3.27Å; E441-K445 WeakPolarHBondContact O-CG 3.44Å; E441-K445 PolarHBondContact O-N 3.05Å; V442-K445 PolarHBondContact O-N 3.03Å; K445-K449 WeakPolarHBondContact O-CB 3.3Å; K445-K449 PolarHBondContact O-N 2.88Å
446	L	96.6	Very high	96.6	Very high	113 Å²	113	102.3 Å²	102.3	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-68.5	-39.6	173.7	-70.6	171.2	0	0	0	111.7	V442 A443 M444 K449 D450	V442-L446 HydrophobicContact CG1-CD1 4.1Å; V442-L446 WeakPolarHBondContact O-CG 3.36Å; V442-L446 PolarHBondContact O-N 3.01Å; A443-L446 PolarHBondContact O-N 3.39Å; M444-L446 VanDerWaalsContact C-N 3.32Å; M444-L446 PolarHBondContact O-N 3.01Å; L446-K449 PolarHBondContact O-N 3.02Å; L446-D450 PolarHBondContact O-N 3.02Å
447	L	96.5	Very high	96.5	Very high	109 Å²	109	102.3 Å²	102.3	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-69.1	-43.1	175.5	-173.8	67	0	0	0	112	A443 M444 K449 D450 I451	A443-L447 WeakPolarHBondContact O-CB 3.36Å; A443-L447 PolarHBondContact O-N 3.47Å; M444-L447 PolarHBondContact O-N 3.06Å; L447-K449 VanDerWaalsContact C-N 3.28Å; L447-K449 PolarHBondContact O-N 3.11Å; L447-D450 PolarHBondContact O-N 3.3Å; L447-I451 HydrophobicContact CG-CD1 4.06Å; L447-I451 WeakPolarHBondContact O-CB 3.45Å; L447-I451 VanDerWaalsContact O-CG1 3.25Å; L447-I451 WeakPolarHBondContact O-CG1 3.41Å; L447-I451 PolarHBondContact O-N 3.14Å
448	E	96.7	Very high	96.4	Very high	92 Å²	92	100.2 Å²	100.2	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-55.4	-45.8	171.1	-75.3	173.4	159.1	0	0	110.6	M444 I451 H452	M444-E448 WeakPolarHBondContact O-CB 3.13Å; M444-E448 WeakPolarHBondContact O-CG 2.97Å; M444-E448 PolarHBondContact O-N 3.21Å; E448-I451 PolarHBondContact O-N 2.87Å; E448-H452 PolarHBondContact O-N 3.47Å; E448-H452 PolarHBondContact O-ND1 2.93Å
449	K	96.6	Very high	96.3	Very high	117 Å²	117	96.5 Å²	96.5	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-60.7	-49.4	176.6	-171.6	-162.9	167.7	-146.9	0	111.7	K445 L446 L447 I451 H452 E453	K445-K449 WeakPolarHBondContact O-CB 3.3Å; K445-K449 PolarHBondContact O-N 2.88Å; L446-K449 PolarHBondContact O-N 3.02Å; L447-K449 VanDerWaalsContact C-N 3.28Å; L447-K449 PolarHBondContact O-N 3.11Å; K449-I451 VanDerWaalsContact C-N 3.3Å; K449-I451 PolarHBondContact O-N 3.17Å; K449-H452 PolarHBondContact O-N 3.15Å; K449-H452 VanDerWaalsContact O-N 3.16Å; K449-E453 WeakPolarHBondContact CE-OE1 3.48Å; K449-E453 IonicContact NZ-OE1 3.56Å; K449-E453 PolarHBondContact NZ-OE1 3.49Å; K449-E453 PolarHBondContact O-N 3.47Å
450	D	97.3	Very high	96.2	Very high	64 Å²	64	92.7 Å²	92.7	34%	0.342	48%	0.484	S	S	.	.	H	α-helix	trans	-59.4	-42.8	178.3	-169.1	81.1	0	0	0	111.1	L446 L447 H452 E453 K454	L446-D450 PolarHBondContact O-N 3.02Å; L447-D450 PolarHBondContact O-N 3.3Å; D450-H452 VanDerWaalsContact C-N 3.31Å; D450-H452 PolarHBondContact O-N 3.44Å; D450-E453 PolarHBondContact O-N 3.24Å; D450-E453 VanDerWaalsContact O-N 3.17Å; D450-K454 WeakPolarHBondContact O-CB 3.36Å; D450-K454 VanDerWaalsContact O-CG 3.29Å; D450-K454 WeakPolarHBondContact O-CG 3.34Å; D450-K454 PolarHBondContact O-N 3.04Å; D450-K454 IonicContact OD1-NZ 3.61Å; D450-K454 PolarHBondContact OD1-NZ 3.47Å; D450-K454 WeakPolarHBondContact OD2-CG 3.27Å; D450-K454 IonicContact OD2-NZ 3.39Å; D450-K454 PolarHBondContact OD2-NZ 3.45Å
451	I	96.2	Very high	96	Very high	77 Å²	77	91.3 Å²	91.3	40%	0.395	48%	0.479	S	S	.	.	H	α-helix	trans	-57.6	-41.9	176.1	-72	166	0	0	0	111.6	L447 E448 K449 K454 Q455	L447-I451 HydrophobicContact CG-CD1 4.06Å; L447-I451 WeakPolarHBondContact O-CB 3.45Å; L447-I451 VanDerWaalsContact O-CG1 3.25Å; L447-I451 WeakPolarHBondContact O-CG1 3.41Å; L447-I451 PolarHBondContact O-N 3.14Å; E448-I451 PolarHBondContact O-N 2.87Å; K449-I451 VanDerWaalsContact C-N 3.3Å; K449-I451 PolarHBondContact O-N 3.17Å; I451-K454 PolarHBondContact O-N 3.14Å; I451-Q455 VanDerWaalsContact CG2-NE2 3.32Å; I451-Q455 WeakPolarHBondContact O-CB 3.48Å; I451-Q455 VanDerWaalsContact O-CG 3.25Å; I451-Q455 WeakPolarHBondContact O-CG 3.12Å; I451-Q455 PolarHBondContact O-N 2.83Å
452	H	96	Very high	96	Very high	115 Å²	115	95.9 Å²	95.9	53%	0.532	49%	0.493	S	S	.	.	H	α-helix	trans	-66.2	-46.2	175	-72.2	83.4	0	0	0	111.7	E448 K449 D450 K454 Q455 D456	E448-H452 PolarHBondContact O-N 3.47Å; E448-H452 PolarHBondContact O-ND1 2.93Å; K449-H452 PolarHBondContact O-N 3.15Å; K449-H452 VanDerWaalsContact O-N 3.16Å; D450-H452 VanDerWaalsContact C-N 3.31Å; D450-H452 PolarHBondContact O-N 3.44Å; H452-K454 VanDerWaalsContact C-N 3.28Å; H452-K454 PolarHBondContact O-N 2.92Å; H452-Q455 PolarHBondContact O-N 3.17Å; H452-D456 PolarHBondContact O-N 3.18Å
453	E	95.8	Very high	95.8	Very high	91 Å²	91	96.8 Å²	96.8	43%	0.425	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-35.3	176.4	-69	-178.6	168.4	0	0	112.2	K449 D450 T457	K449-E453 WeakPolarHBondContact CE-OE1 3.48Å; K449-E453 IonicContact NZ-OE1 3.56Å; K449-E453 PolarHBondContact NZ-OE1 3.49Å; K449-E453 PolarHBondContact O-N 3.47Å; D450-E453 PolarHBondContact O-N 3.24Å; D450-E453 VanDerWaalsContact O-N 3.17Å; E453-T457 WeakPolarHBondContact O-CB 3.41Å; E453-T457 WeakPolarHBondContact O-CG2 3.22Å; E453-T457 PolarHBondContact O-N 2.72Å; E453-T457 VanDerWaalsContact O-N 3.11Å; E453-T457 PolarHBondContact O-OG1 3.35Å
454	K	94.9	Very high	95.7	Very high	111 Å²	111	99.7 Å²	99.7	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-70.7	-33.8	171.8	-64.5	-55.6	-179.3	-59.3	0	112.8	D450 I451 H452 T457 L458	D450-K454 WeakPolarHBondContact O-CB 3.36Å; D450-K454 VanDerWaalsContact O-CG 3.29Å; D450-K454 WeakPolarHBondContact O-CG 3.34Å; D450-K454 PolarHBondContact O-N 3.04Å; D450-K454 IonicContact OD1-NZ 3.61Å; D450-K454 PolarHBondContact OD1-NZ 3.47Å; D450-K454 WeakPolarHBondContact OD2-CG 3.27Å; D450-K454 IonicContact OD2-NZ 3.39Å; D450-K454 PolarHBondContact OD2-NZ 3.45Å; I451-K454 PolarHBondContact O-N 3.14Å; H452-K454 VanDerWaalsContact C-N 3.28Å; H452-K454 PolarHBondContact O-N 2.92Å; K454-T457 WeakPolarHBondContact CA-OG1 3.33Å; K454-T457 PolarHBondContact O-OG1 3.08Å; K454-L458 WeakPolarHBondContact O-CB 3.3Å; K454-L458 PolarHBondContact O-N 3.44Å
455	Q	95.7	Very high	95.6	Very high	114 Å²	114	99.7 Å²	99.7	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-70.2	-43.4	174.9	-76.1	175.5	22.4	0	0	111.8	I451 H452 L458 A459	I451-Q455 VanDerWaalsContact CG2-NE2 3.32Å; I451-Q455 WeakPolarHBondContact O-CB 3.48Å; I451-Q455 VanDerWaalsContact O-CG 3.25Å; I451-Q455 WeakPolarHBondContact O-CG 3.12Å; I451-Q455 PolarHBondContact O-N 2.83Å; H452-Q455 PolarHBondContact O-N 3.17Å; Q455-L458 PolarHBondContact O-N 3.02Å; Q455-A459 WeakPolarHBondContact O-CB 3.49Å; Q455-A459 PolarHBondContact O-N 3.2Å
456	D	95.8	Very high	95.4	Very high	117 Å²	117	98.2 Å²	98.2	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-45.9	177.9	-76	-23.3	0	0	0	111.8	H452 L458 A459 A460	H452-D456 PolarHBondContact O-N 3.18Å; D456-L458 VanDerWaalsContact C-N 3.33Å; D456-L458 PolarHBondContact O-N 3.44Å; D456-A459 WeakPolarHBondContact O-CB 3.42Å; D456-A459 PolarHBondContact O-N 2.8Å; D456-A460 PolarHBondContact O-N 2.92Å
457	T	94.8	Very high	95.3	Very high	80 Å²	80	98.3 Å²	98.3	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-37.7	175.2	47.9	0	0	0	0	112.1	E453 K454 A460 L461	E453-T457 WeakPolarHBondContact O-CB 3.41Å; E453-T457 WeakPolarHBondContact O-CG2 3.22Å; E453-T457 PolarHBondContact O-N 2.72Å; E453-T457 VanDerWaalsContact O-N 3.11Å; E453-T457 PolarHBondContact O-OG1 3.35Å; K454-T457 WeakPolarHBondContact CA-OG1 3.33Å; K454-T457 PolarHBondContact O-OG1 3.08Å; T457-A460 PolarHBondContact O-N 2.77Å; T457-L461 WeakPolarHBondContact O-CB 3.36Å; T457-L461 VanDerWaalsContact O-CG 3.31Å; T457-L461 WeakPolarHBondContact O-CG 3.46Å; T457-L461 PolarHBondContact O-N 3.49Å
458	L	95.3	Very high	95.1	Very high	83 Å²	83	96.8 Å²	96.8	44%	0.435	49%	0.491	S	S	.	.	H	α-helix	trans	-69	-33.5	174.3	-173.2	149.5	0	0	0	112.6	K454 Q455 D456 R462	K454-L458 WeakPolarHBondContact O-CB 3.3Å; K454-L458 PolarHBondContact O-N 3.44Å; Q455-L458 PolarHBondContact O-N 3.02Å; D456-L458 VanDerWaalsContact C-N 3.33Å; D456-L458 PolarHBondContact O-N 3.44Å; L458-R462 HydrophobicContact CD2-CG 4.35Å; L458-R462 WeakPolarHBondContact O-CG 3.34Å; L458-R462 PolarHBondContact O-N 3Å
459	A	95.2	Very high	94.9	Very high	52 Å²	52	97.4 Å²	97.4	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-42.9	172.1	0	0	0	0	0	111.7	Q455 D456 R462 L463	Q455-A459 WeakPolarHBondContact O-CB 3.49Å; Q455-A459 PolarHBondContact O-N 3.2Å; D456-A459 WeakPolarHBondContact O-CB 3.42Å; D456-A459 PolarHBondContact O-N 2.8Å; A459-R462 PolarHBondContact O-N 2.7Å; A459-L463 PolarHBondContact O-N 2.94Å
460	A	94.9	Very high	94.8	Very high	51 Å²	51	95.3 Å²	95.3	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-42.7	173.7	0	0	0	0	0	112.2	D456 T457 L463 Q464	D456-A460 PolarHBondContact O-N 2.92Å; T457-A460 PolarHBondContact O-N 2.77Å; A460-L463 PolarHBondContact O-N 3.37Å; A460-Q464 WeakPolarHBondContact O-CG 3.11Å; A460-Q464 PolarHBondContact O-N 3.12Å
461	L	94.1	Very high	94.5	Very high	109 Å²	109	97 Å²	97	57%	0.571	50%	0.497	S	S	*	.	H	α-helix	trans	-65.3	-37.2	175.1	-73.4	169.1	0	0	0	112.6	T457 Q464 L465	T457-L461 WeakPolarHBondContact O-CB 3.36Å; T457-L461 VanDerWaalsContact O-CG 3.31Å; T457-L461 WeakPolarHBondContact O-CG 3.46Å; T457-L461 PolarHBondContact O-N 3.49Å; L461-Q464 PolarHBondContact O-N 2.84Å; L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 PolarHBondContact O-N 3.37Å
462	R	95.3	Very high	94.2	Very high	167 Å²	167	98.3 Å²	98.3	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-44.2	171.7	-78.6	175.1	174.9	168.2	0.9	111.7	L458 A459 L465 D466	L458-R462 HydrophobicContact CD2-CG 4.35Å; L458-R462 WeakPolarHBondContact O-CG 3.34Å; L458-R462 PolarHBondContact O-N 3Å; A459-R462 PolarHBondContact O-N 2.7Å; R462-L465 PolarHBondContact O-N 2.93Å; R462-D466 PolarHBondContact O-N 2.83Å
463	L	94.7	Very high	94	Very high	104 Å²	104	97.8 Å²	97.8	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.9	-179.6	62.5	0	0	0	111.7	A459 A460 D466 Q467	A459-L463 PolarHBondContact O-N 2.94Å; A460-L463 PolarHBondContact O-N 3.37Å; L463-D466 PolarHBondContact O-N 3.38Å; L463-Q467 WeakPolarHBondContact O-CB 3.38Å; L463-Q467 VanDerWaalsContact O-CG 3.28Å; L463-Q467 WeakPolarHBondContact O-CG 3.47Å; L463-Q467 PolarHBondContact O-N 3.28Å
464	Q	94.1	Very high	93.7	Very high	115 Å²	115	99 Å²	99	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-42.4	173.9	-74.4	-179	-12	0	0	112.1	A460 L461 D466 Q467 V468	A460-Q464 WeakPolarHBondContact O-CG 3.11Å; A460-Q464 PolarHBondContact O-N 3.12Å; L461-Q464 PolarHBondContact O-N 2.84Å; Q464-D466 PolarHBondContact O-N 3.22Å; Q464-Q467 PolarHBondContact O-N 2.71Å; Q464-V468 WeakPolarHBondContact O-CG2 3.34Å; Q464-V468 PolarHBondContact O-N 3.31Å
465	L	93.8	Very high	93.5	Very high	98 Å²	98	99 Å²	99	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-41.9	177.8	179.9	62.9	0	0	0	111.8	L461 R462 V468 K469	L461-L465 WeakPolarHBondContact O-CB 3.45Å; L461-L465 PolarHBondContact O-N 3.37Å; R462-L465 PolarHBondContact O-N 2.93Å; L465-V468 PolarHBondContact O-N 3.36Å; L465-K469 WeakPolarHBondContact O-CG 3.34Å; L465-K469 PolarHBondContact O-N 3.04Å
466	D	93.4	Very high	93.2	Very high	83 Å²	83	100 Å²	100	44%	0.444	52%	0.517	S	S	.	.	H	α-helix	trans	-70.8	-37.6	176.6	-77.1	-7.6	0	0	0	112.3	R462 L463 Q464 V468 K469 T470	R462-D466 PolarHBondContact O-N 2.83Å; L463-D466 PolarHBondContact O-N 3.38Å; Q464-D466 PolarHBondContact O-N 3.22Å; D466-V468 VanDerWaalsContact C-N 3.31Å; D466-V468 PolarHBondContact O-N 2.88Å; D466-K469 WeakPolarHBondContact O-CB 3.35Å; D466-K469 PolarHBondContact O-N 3.21Å; D466-K469 WeakPolarHBondContact OD1-CD 3.23Å; D466-K469 WeakPolarHBondContact OD1-CE 3.41Å; D466-K469 IonicContact OD1-NZ 3.35Å; D466-K469 PolarHBondContact OD1-NZ 3.06Å; D466-T470 PolarHBondContact O-N 3.03Å; D466-T470 PolarHBondContact O-OG1 3.17Å
467	Q	94.5	Very high	93	Very high	115 Å²	115	99.6 Å²	99.6	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-57.7	-42.8	169.4	-73.7	171	-4	0	0	111.9	L463 Q464 T470 L471	L463-Q467 WeakPolarHBondContact O-CB 3.38Å; L463-Q467 VanDerWaalsContact O-CG 3.28Å; L463-Q467 WeakPolarHBondContact O-CG 3.47Å; L463-Q467 PolarHBondContact O-N 3.28Å; Q464-Q467 PolarHBondContact O-N 2.71Å; Q467-T470 PolarHBondContact O-N 3.07Å; Q467-L471 WeakPolarHBondContact O-CB 3.46Å; Q467-L471 PolarHBondContact O-N 3.07Å
468	V	92.4	Very high	92.8	Very high	78 Å²	78	102.6 Å²	102.6	47%	0.473	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-37.4	176.1	169.8	0	0	0	0	111.9	Q464 L465 D466 L471 N472	Q464-V468 WeakPolarHBondContact O-CG2 3.34Å; Q464-V468 PolarHBondContact O-N 3.31Å; L465-V468 PolarHBondContact O-N 3.36Å; D466-V468 VanDerWaalsContact C-N 3.31Å; D466-V468 PolarHBondContact O-N 2.88Å; V468-L471 PolarHBondContact O-N 3.49Å; V468-N472 WeakPolarHBondContact O-CB 3.34Å; V468-N472 PolarHBondContact O-N 2.99Å
469	K	93	Very high	92.3	Very high	105 Å²	105	101.6 Å²	101.6	46%	0.457	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-47.9	171	-70.3	170.8	-165.9	157.6	0	111.4	L465 D466 L471 N472 L473	L465-K469 WeakPolarHBondContact O-CG 3.34Å; L465-K469 PolarHBondContact O-N 3.04Å; D466-K469 WeakPolarHBondContact O-CB 3.35Å; D466-K469 PolarHBondContact O-N 3.21Å; D466-K469 WeakPolarHBondContact OD1-CD 3.23Å; D466-K469 WeakPolarHBondContact OD1-CE 3.41Å; D466-K469 IonicContact OD1-NZ 3.35Å; D466-K469 PolarHBondContact OD1-NZ 3.06Å; K469-L471 VanDerWaalsContact C-N 3.33Å; K469-L471 PolarHBondContact O-N 2.9Å; K469-N472 PolarHBondContact O-N 2.77Å; K469-L473 WeakPolarHBondContact O-CG 3.47Å; K469-L473 PolarHBondContact O-N 3.15Å
470	T	93.6	Very high	92	Very high	73 Å²	73	103.1 Å²	103.1	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-43.6	177.5	-60.5	0	0	0	0	111.3	D466 Q467 L473 Q474	D466-T470 PolarHBondContact O-N 3.03Å; D466-T470 PolarHBondContact O-OG1 3.17Å; Q467-T470 PolarHBondContact O-N 3.07Å; T470-L473 PolarHBondContact O-N 3.21Å; T470-Q474 VanDerWaalsContact O-CG 3.3Å; T470-Q474 WeakPolarHBondContact O-CG 3.36Å; T470-Q474 PolarHBondContact O-N 2.89Å
471	L	90.8	Very high	91.6	Very high	99 Å²	99	104.9 Å²	104.9	52%	0.518	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-43	176.6	-173.3	66.5	0	0	0	111.9	Q467 V468 K469 Q474 M475	Q467-L471 WeakPolarHBondContact O-CB 3.46Å; Q467-L471 PolarHBondContact O-N 3.07Å; V468-L471 PolarHBondContact O-N 3.49Å; K469-L471 VanDerWaalsContact C-N 3.33Å; K469-L471 PolarHBondContact O-N 2.9Å; L471-Q474 PolarHBondContact O-N 3.17Å; L471-M475 WeakPolarHBondContact O-CB 3.43Å; L471-M475 VanDerWaalsContact O-CG 3.31Å; L471-M475 WeakPolarHBondContact O-CG 3.4Å; L471-M475 PolarHBondContact O-N 3.34Å
472	N	89.9	Confident	91.2	Very high	105 Å²	105	102.8 Å²	102.8	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-40.5	175.6	-88.9	-24.5	0	0	0	112.4	V468 K469 M475 F476	V468-N472 WeakPolarHBondContact O-CB 3.34Å; V468-N472 PolarHBondContact O-N 2.99Å; K469-N472 PolarHBondContact O-N 2.77Å; N472-M475 PolarHBondContact O-N 3.37Å; N472-F476 VanDerWaalsContact O-CB 3.31Å; N472-F476 WeakPolarHBondContact O-CB 3.36Å; N472-F476 PolarHBondContact O-N 2.69Å
473	L	91.4	Very high	90.8	Very high	103 Å²	103	96.4 Å²	96.4	54%	0.539	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-43.2	174.9	-71.9	167.7	0	0	0	111.8	K469 T470 F476 H477	K469-L473 WeakPolarHBondContact O-CG 3.47Å; K469-L473 PolarHBondContact O-N 3.15Å; T470-L473 PolarHBondContact O-N 3.21Å; L473-F476 PolarHBondContact O-N 3.43Å; L473-H477 PolarHBondContact O-N 3.3Å
474	Q	91.1	Very high	90.4	Very high	118 Å²	118	97.2 Å²	97.2	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-62.1	-42.9	174.6	-72.5	172.9	-0.8	0	0	112.1	T470 L471 K478	T470-Q474 VanDerWaalsContact O-CG 3.3Å; T470-Q474 WeakPolarHBondContact O-CG 3.36Å; T470-Q474 PolarHBondContact O-N 2.89Å; L471-Q474 PolarHBondContact O-N 3.17Å; Q474-K478 VanDerWaalsContact O-CB 3.26Å; Q474-K478 WeakPolarHBondContact O-CB 3.35Å; Q474-K478 PolarHBondContact O-N 3.15Å
475	M	89.2	Confident	89.9	Confident	110 Å²	110	97.9 Å²	97.9	54%	0.542	50%	0.501	S	S	.	.	H	α-helix	trans	-66.7	-38.7	176.5	-75.5	-63.5	-64.2	0	0	112.3	L471 N472 K478 A479	L471-M475 WeakPolarHBondContact O-CB 3.43Å; L471-M475 VanDerWaalsContact O-CG 3.31Å; L471-M475 WeakPolarHBondContact O-CG 3.4Å; L471-M475 PolarHBondContact O-N 3.34Å; N472-M475 PolarHBondContact O-N 3.37Å; M475-K478 PolarHBondContact O-N 2.9Å; M475-A479 WeakPolarHBondContact O-CB 3.17Å; M475-A479 PolarHBondContact O-N 3.5Å
476	F	90.8	Very high	89.4	Confident	136 Å²	136	96 Å²	96	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-64.2	-51.3	177.1	-176.7	-93.6	0	0	0	111.6	N472 L473 K478 A479 E480	N472-F476 VanDerWaalsContact O-CB 3.31Å; N472-F476 WeakPolarHBondContact O-CB 3.36Å; N472-F476 PolarHBondContact O-N 2.69Å; L473-F476 PolarHBondContact O-N 3.43Å; F476-K478 VanDerWaalsContact C-N 3.31Å; F476-K478 PolarHBondContact O-N 2.87Å; F476-A479 PolarHBondContact O-N 2.94Å; F476-E480 PolarHBondContact O-N 3.24Å
477	H	90.1	Very high	88.9	Confident	107 Å²	107	98.7 Å²	98.7	50%	0.495	51%	0.51	S	S	.	.	H	α-helix	trans	-57.9	-43.9	175.2	-65.7	167.6	0	0	0	111.7	L473 A479 E480 D481	L473-H477 PolarHBondContact O-N 3.3Å; H477-A479 VanDerWaalsContact C-N 3.32Å; H477-A479 PolarHBondContact O-N 3.15Å; H477-E480 PolarHBondContact O-N 3.47Å; H477-D481 PolarHBondContact O-N 2.99Å
478	K	90.2	Very high	88.4	Confident	144 Å²	144	99.7 Å²	99.7	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-64.8	-34.6	179.1	-171.9	175.6	-178.2	180	0	112.8	Q474 M475 F476 S482	Q474-K478 VanDerWaalsContact O-CB 3.26Å; Q474-K478 WeakPolarHBondContact O-CB 3.35Å; Q474-K478 PolarHBondContact O-N 3.15Å; M475-K478 PolarHBondContact O-N 2.9Å; F476-K478 VanDerWaalsContact C-N 3.31Å; F476-K478 PolarHBondContact O-N 2.87Å; K478-S482 WeakPolarHBondContact O-CB 3.4Å; K478-S482 PolarHBondContact O-N 3.18Å; K478-S482 VanDerWaalsContact O-N 3.14Å; K478-S482 PolarHBondContact O-OG 3.21Å
479	A	85.8	Confident	88	Confident	62 Å²	62	102.3 Å²	102.3	51%	0.512	52%	0.517	S	S	.	.	H	α-helix	trans	-69.6	-41.9	173	0	0	0	0	0	111.6	M475 F476 H477 S482 G483	M475-A479 WeakPolarHBondContact O-CB 3.17Å; M475-A479 PolarHBondContact O-N 3.5Å; F476-A479 PolarHBondContact O-N 2.94Å; H477-A479 VanDerWaalsContact C-N 3.32Å; H477-A479 PolarHBondContact O-N 3.15Å; A479-S482 PolarHBondContact O-N 3.41Å; A479-G483 PolarHBondContact O-N 3.01Å
480	E	88.7	Confident	87.5	Confident	83 Å²	83	103.1 Å²	103.1	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-47.2	176.7	-161.9	-169.7	-177.3	0	0	111.9	F476 H477 S482 G483 R484	F476-E480 PolarHBondContact O-N 3.24Å; H477-E480 PolarHBondContact O-N 3.47Å; E480-S482 VanDerWaalsContact C-N 3.31Å; E480-S482 PolarHBondContact O-N 3.42Å; E480-G483 WeakPolarHBondContact O-CA 3.49Å; E480-G483 PolarHBondContact O-N 3.4Å; E480-G483 VanDerWaalsContact O-N 3.1Å; E480-R484 VanDerWaalsContact CD-CZ 3.44Å; E480-R484 WeakPolarHBondContact O-CG 3.15Å; E480-R484 PolarHBondContact O-N 2.92Å; E480-R484 IonicContact OE1-CZ 3.67Å; E480-R484 IonicContact OE1-NE 3.54Å; E480-R484 IonicContact OE1-NH2 3.67Å; E480-R484 PolarHBondContact OE1-NH2 2.96Å; E480-R484 IonicContact OE2-CZ 2.81Å; E480-R484 IonicContact OE2-NH1 3.34Å; E480-R484 IonicContact OE2-NH2 3.34Å; E480-R484 PolarHBondContact OE2-NH2 3.17Å
481	D	87.1	Confident	87	Confident	88 Å²	88	102.6 Å²	102.6	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-62.8	-36.9	176.3	-75.9	-29.7	0	0	0	112.4	H477 G483 R484 Q485	H477-D481 PolarHBondContact O-N 2.99Å; D481-G483 VanDerWaalsContact C-N 3.34Å; D481-R484 IonicContact OD1-CZ 3.45Å; D481-R484 IonicContact OD1-NH1 2.79Å; D481-R484 PolarHBondContact OD1-NH1 2.92Å; D481-Q485 WeakPolarHBondContact O-CB 3.45Å; D481-Q485 PolarHBondContact O-N 3.03Å
482	S	84.8	Confident	86.7	Confident	66 Å²	66	102.4 Å²	102.4	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-66.2	-37	173.4	-57.4	0	0	0	0	111.8	K478 A479 E480 Q485 A486	K478-S482 WeakPolarHBondContact O-CB 3.4Å; K478-S482 PolarHBondContact O-N 3.18Å; K478-S482 VanDerWaalsContact O-N 3.14Å; K478-S482 PolarHBondContact O-OG 3.21Å; A479-S482 PolarHBondContact O-N 3.41Å; E480-S482 VanDerWaalsContact C-N 3.31Å; E480-S482 PolarHBondContact O-N 3.42Å; S482-Q485 PolarHBondContact O-N 2.89Å; S482-A486 PolarHBondContact O-N 2.97Å
483	G	86.6	Confident	86.1	Confident	32 Å²	32	99.1 Å²	99.1	33%	0.33	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-52.8	174	0	0	0	0	0	112.2	A479 E480 D481 Q485 A486 E487	A479-G483 PolarHBondContact O-N 3.01Å; E480-G483 WeakPolarHBondContact O-CA 3.49Å; E480-G483 PolarHBondContact O-N 3.4Å; E480-G483 VanDerWaalsContact O-N 3.1Å; D481-G483 VanDerWaalsContact C-N 3.34Å; G483-Q485 PolarHBondContact O-N 3.39Å; G483-A486 WeakPolarHBondContact O-CA 3.48Å; G483-A486 WeakPolarHBondContact O-CB 3.1Å; G483-A486 PolarHBondContact O-N 2.8Å; G483-E487 PolarHBondContact O-N 3.44Å
484	R	86.6	Confident	85.7	Confident	122 Å²	122	97.5 Å²	97.5	46%	0.46	50%	0.504	S	S	.	.	H	α-helix	trans	-53.8	-38.4	174.2	-65.9	168.2	-176.4	155	-3.1	111.9	E480 D481 K488	E480-R484 VanDerWaalsContact CD-CZ 3.44Å; E480-R484 WeakPolarHBondContact O-CG 3.15Å; E480-R484 PolarHBondContact O-N 2.92Å; E480-R484 IonicContact OE1-CZ 3.67Å; E480-R484 IonicContact OE1-NE 3.54Å; E480-R484 IonicContact OE1-NH2 3.67Å; E480-R484 PolarHBondContact OE1-NH2 2.96Å; E480-R484 IonicContact OE2-CZ 2.81Å; E480-R484 IonicContact OE2-NH1 3.34Å; E480-R484 IonicContact OE2-NH2 3.34Å; E480-R484 PolarHBondContact OE2-NH2 3.17Å; D481-R484 IonicContact OD1-CZ 3.45Å; D481-R484 IonicContact OD1-NH1 2.79Å; D481-R484 PolarHBondContact OD1-NH1 2.92Å; R484-K488 PolarHBondContact O-N 3.07Å; R484-K488 VanDerWaalsContact O-N 3.15Å
485	Q	84.3	Confident	85.4	Confident	128 Å²	128	98.6 Å²	98.6	60%	0.598	51%	0.509	S	S	*	.	H	α-helix	trans	-71.3	-29.7	177.2	-164.4	177.8	39.9	0	0	113.2	D481 S482 G483 K489	D481-Q485 WeakPolarHBondContact O-CB 3.45Å; D481-Q485 PolarHBondContact O-N 3.03Å; S482-Q485 PolarHBondContact O-N 2.89Å; G483-Q485 PolarHBondContact O-N 3.39Å; Q485-K489 WeakPolarHBondContact O-CG 3.15Å; Q485-K489 PolarHBondContact O-N 3.28Å
486	A	82.6	Confident	84.9	Confident	58 Å²	58	98.5 Å²	98.5	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-74.1	-45.1	173	0	0	0	0	0	111.8	S482 G483 K488 K489 Q490	S482-A486 PolarHBondContact O-N 2.97Å; G483-A486 WeakPolarHBondContact O-CA 3.48Å; G483-A486 WeakPolarHBondContact O-CB 3.1Å; G483-A486 PolarHBondContact O-N 2.8Å; A486-K488 VanDerWaalsContact C-N 3.31Å; A486-K488 PolarHBondContact O-N 3.18Å; A486-K489 PolarHBondContact O-N 3.26Å; A486-K489 VanDerWaalsContact O-N 3.1Å; A486-Q490 PolarHBondContact O-N 2.94Å
487	E	83.8	Confident	84.3	Confident	141 Å²	141	97.4 Å²	97.4	66%	0.659	51%	0.507	S	S	*	.	H	α-helix	trans	-56.1	-44	175.9	-69.7	177.4	155.9	0	0	111.9	G483 K489 Q490 A491	G483-E487 PolarHBondContact O-N 3.44Å; E487-K489 PolarHBondContact O-N 3.06Å; E487-Q490 WeakPolarHBondContact O-CB 3.41Å; E487-Q490 PolarHBondContact O-N 3.39Å; E487-A491 PolarHBondContact O-N 3.08Å
488	K	84.4	Confident	83.9	Confident	136 Å²	136	98.2 Å²	98.2	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-57.7	-45.8	175	178	173.9	169.3	176.2	0	112.3	R484 A486 Q490 A491 E492	R484-K488 PolarHBondContact O-N 3.07Å; R484-K488 VanDerWaalsContact O-N 3.15Å; A486-K488 VanDerWaalsContact C-N 3.31Å; A486-K488 PolarHBondContact O-N 3.18Å; K488-Q490 VanDerWaalsContact C-N 3.31Å; K488-Q490 PolarHBondContact O-N 3.5Å; K488-A491 PolarHBondContact O-N 2.91Å; K488-E492 WeakPolarHBondContact CE-OE1 3.42Å; K488-E492 IonicContact NZ-OE1 3.87Å; K488-E492 WeakPolarHBondContact O-CG 3.23Å; K488-E492 PolarHBondContact O-N 3.41Å
489	K	82.5	Confident	83.5	Confident	132 Å²	132	99.9 Å²	99.9	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-34.2	178.1	-72.5	176.7	177.7	-179.9	0	112.3	Q485 A486 E487 E492 A493	Q485-K489 WeakPolarHBondContact O-CG 3.15Å; Q485-K489 PolarHBondContact O-N 3.28Å; A486-K489 PolarHBondContact O-N 3.26Å; A486-K489 VanDerWaalsContact O-N 3.1Å; E487-K489 PolarHBondContact O-N 3.06Å; K489-E492 PolarHBondContact O-N 2.96Å; K489-A493 PolarHBondContact O-N 3.29Å
490	Q	84.2	Confident	83	Confident	123 Å²	123	101.2 Å²	101.2	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-40.6	175	-171.8	60.7	43.8	0	0	111.5	A486 E487 K488 A493 V494	A486-Q490 PolarHBondContact O-N 2.94Å; E487-Q490 WeakPolarHBondContact O-CB 3.41Å; E487-Q490 PolarHBondContact O-N 3.39Å; K488-Q490 VanDerWaalsContact C-N 3.31Å; K488-Q490 PolarHBondContact O-N 3.5Å; Q490-A493 PolarHBondContact O-N 3.26Å; Q490-V494 WeakPolarHBondContact O-CG2 3.39Å; Q490-V494 PolarHBondContact O-N 2.98Å; Q490-V494 VanDerWaalsContact O-N 3.15Å
491	A	83	Confident	82.5	Confident	62 Å²	62	102 Å²	102	51%	0.512	52%	0.518	S	S	.	.	H	α-helix	trans	-65.6	-37.9	174.7	0	0	0	0	0	112.6	E487 K488 A493 Q495	E487-A491 PolarHBondContact O-N 3.08Å; K488-A491 PolarHBondContact O-N 2.91Å; A491-A493 VanDerWaalsContact C-N 3.34Å; A491-Q495 PolarHBondContact O-N 3.2Å
492	E	83.2	Confident	82.1	Confident	94 Å²	94	104 Å²	104	44%	0.439	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-36.7	173.5	-70.9	168.8	173.6	0	0	111.9	K488 K489	K488-E492 WeakPolarHBondContact CE-OE1 3.42Å; K488-E492 IonicContact NZ-OE1 3.87Å; K488-E492 WeakPolarHBondContact O-CG 3.23Å; K488-E492 PolarHBondContact O-N 3.41Å; K489-E492 PolarHBondContact O-N 2.96Å
493	A	77.3	Confident	81.5	Confident	36 Å²	36	107.3 Å²	107.3	30%	0.298	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-44.8	175.8	0	0	0	0	0	112.9	K489 Q490 A491 Q495 L496 E497	K489-A493 PolarHBondContact O-N 3.29Å; Q490-A493 PolarHBondContact O-N 3.26Å; A491-A493 VanDerWaalsContact C-N 3.34Å; A493-Q495 VanDerWaalsContact C-N 3.27Å; A493-Q495 PolarHBondContact O-N 3.14Å; A493-L496 WeakPolarHBondContact O-CA 3.29Å; A493-L496 WeakPolarHBondContact O-CB 3.5Å; A493-L496 PolarHBondContact O-N 3.26Å; A493-E497 PolarHBondContact O-N 2.92Å; A493-E497 VanDerWaalsContact O-N 3.11Å
494	V	84.3	Confident	81	Confident	70 Å²	70	111.4 Å²	111.4	42%	0.424	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-33.1	179.3	173.5	0	0	0	0	112	Q490 L496 E497 Q498	Q490-V494 WeakPolarHBondContact O-CG2 3.39Å; Q490-V494 PolarHBondContact O-N 2.98Å; Q490-V494 VanDerWaalsContact O-N 3.15Å; V494-L496 VanDerWaalsContact C-N 3.29Å; V494-L496 PolarHBondContact O-N 2.68Å; V494-E497 PolarHBondContact O-N 3.21Å; V494-Q498 PolarHBondContact O-N 3.39Å; V494-Q498 VanDerWaalsContact O-N 3.1Å
495	Q	83.8	Confident	80.6	Confident	141 Å²	141	113.3 Å²	113.3	66%	0.659	56%	0.556	S	S	*	*	H	α-helix	trans	-66.5	-28.2	172.7	-73.6	-168.1	-7.2	0	0	113.5	A491 A493	A491-Q495 PolarHBondContact O-N 3.2Å; A493-Q495 VanDerWaalsContact C-N 3.27Å; A493-Q495 PolarHBondContact O-N 3.14Å
496	L	78.4	Confident	80.1	Confident	108 Å²	108	109.8 Å²	109.8	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-76.9	-41.4	176.1	-65.8	170.1	0	0	0	111.1	A493 V494 Q498 R499 I500	A493-L496 WeakPolarHBondContact O-CA 3.29Å; A493-L496 WeakPolarHBondContact O-CB 3.5Å; A493-L496 PolarHBondContact O-N 3.26Å; V494-L496 VanDerWaalsContact C-N 3.29Å; V494-L496 PolarHBondContact O-N 2.68Å; L496-Q498 VanDerWaalsContact C-N 3.31Å; L496-Q498 PolarHBondContact O-N 3.47Å; L496-R499 PolarHBondContact O-N 3.46Å; L496-I500 WeakPolarHBondContact O-CG1 3.45Å; L496-I500 PolarHBondContact O-N 3.41Å
497	E	79.3	Confident	79.5	Confident	112 Å²	112	112 Å²	112	52%	0.523	55%	0.551	S	S	.	*	H	α-helix	trans	-57.1	-44.1	173	-66.4	176.5	153.2	0	0	111.5	A493 V494 R499 I500 N501	A493-E497 PolarHBondContact O-N 2.92Å; A493-E497 VanDerWaalsContact O-N 3.11Å; V494-E497 PolarHBondContact O-N 3.21Å; E497-R499 VanDerWaalsContact C-N 3.29Å; E497-R499 PolarHBondContact O-N 2.96Å; E497-I500 WeakPolarHBondContact O-CB 3.41Å; E497-I500 PolarHBondContact O-N 2.85Å; E497-I500 VanDerWaalsContact O-N 3.09Å; E497-N501 PolarHBondContact O-N 3.14Å
498	Q	81.1	Confident	79.2	Confident	124 Å²	124	109.7 Å²	109.7	58%	0.579	55%	0.546	S	S	*	.	H	α-helix	trans	-60.7	-36.5	178.8	-169.9	170	1	0	0	112.9	V494 L496 E502	V494-Q498 PolarHBondContact O-N 3.39Å; V494-Q498 VanDerWaalsContact O-N 3.1Å; L496-Q498 VanDerWaalsContact C-N 3.31Å; L496-Q498 PolarHBondContact O-N 3.47Å; Q498-E502 PolarHBondContact O-N 3.17Å
499	R	81.3	Confident	78.6	Confident	179 Å²	179	110.3 Å²	110.3	68%	0.675	55%	0.551	S	S	*	*	H	α-helix	trans	-71.4	-28.6	175.1	-78	-177.8	168.7	179.6	-1.4	113.9	L496 E497 M503	L496-R499 PolarHBondContact O-N 3.46Å; E497-R499 VanDerWaalsContact C-N 3.29Å; E497-R499 PolarHBondContact O-N 2.96Å; R499-M503 PolarHBondContact O-N 3.24Å
500	I	75.7	Confident	77.9	Confident	90 Å²	90	109 Å²	109	46%	0.462	55%	0.549	S	S	.	.	H	α-helix	trans	-66.6	-45.6	176	-68.5	166.8	0	0	0	109.3	L496 E497 E502 M503 E504	L496-I500 WeakPolarHBondContact O-CG1 3.45Å; L496-I500 PolarHBondContact O-N 3.41Å; E497-I500 WeakPolarHBondContact O-CB 3.41Å; E497-I500 PolarHBondContact O-N 2.85Å; E497-I500 VanDerWaalsContact O-N 3.09Å; I500-E502 VanDerWaalsContact C-N 3.31Å; I500-E502 PolarHBondContact O-N 3.44Å; I500-M503 WeakPolarHBondContact O-CA 3.41Å; I500-M503 WeakPolarHBondContact O-CB 3.31Å; I500-M503 PolarHBondContact O-N 2.92Å; I500-E504 PolarHBondContact O-N 3.18Å
501	N	78.2	Confident	76.9	Confident	101 Å²	101	107.2 Å²	107.2	54%	0.54	54%	0.541	S	S	.	.	H	α-helix	trans	-63.9	-32.7	178.9	-60.4	-6.9	0	0	0	113	E497 M503 K505	E497-N501 PolarHBondContact O-N 3.14Å; N501-M503 VanDerWaalsContact C-N 3.3Å; N501-K505 PolarHBondContact O-N 3.19Å
502	E	79.4	Confident	76.1	Confident	130 Å²	130	111.8 Å²	111.8	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-65	-34.8	171.7	-71.7	178	160.2	0	0	112	Q498 I500	Q498-E502 PolarHBondContact O-N 3.17Å; I500-E502 VanDerWaalsContact C-N 3.31Å; I500-E502 PolarHBondContact O-N 3.44Å
503	M	71.6	Confident	75.3	Confident	134 Å²	134	116 Å²	116	66%	0.66	56%	0.564	S	S	*	*	H	α-helix	trans	-79.7	-36.3	-179.2	-170.9	162.5	57	0	0	112.9	R499 I500 N501 K505 A506 M507	R499-M503 PolarHBondContact O-N 3.24Å; I500-M503 WeakPolarHBondContact O-CA 3.41Å; I500-M503 WeakPolarHBondContact O-CB 3.31Å; I500-M503 PolarHBondContact O-N 2.92Å; N501-M503 VanDerWaalsContact C-N 3.3Å; M503-K505 VanDerWaalsContact C-N 3.26Å; M503-K505 PolarHBondContact O-N 3.2Å; M503-A506 PolarHBondContact O-N 2.99Å; M503-M507 PolarHBondContact O-N 2.85Å
504	E	75.5	Confident	74.5	Confident	118 Å²	118	118.8 Å²	118.8	55%	0.551	57%	0.573	S	S	*	*	H	α-helix	trans	-55.5	-42.3	171.2	-72.2	-170.8	138.5	0	0	111.7	I500 A506 M507 V508	I500-E504 PolarHBondContact O-N 3.18Å; E504-A506 VanDerWaalsContact C-N 3.27Å; E504-A506 PolarHBondContact O-N 3.25Å; E504-M507 WeakPolarHBondContact O-CA 3.3Å; E504-M507 VanDerWaalsContact O-CB 3.24Å; E504-M507 WeakPolarHBondContact O-CB 3.49Å; E504-M507 PolarHBondContact O-N 3.43Å; E504-V508 PolarHBondContact O-N 3.39Å
505	K	78.3	Confident	73.6	Confident	163 Å²	163	121.5 Å²	121.5	71%	0.709	58%	0.581	S	S	*	*	H	α-helix	trans	-62.5	-33.2	-179	-167.1	177	-179.8	-176.5	0	113	N501 M503 M507	N501-K505 PolarHBondContact O-N 3.19Å; M503-K505 VanDerWaalsContact C-N 3.26Å; M503-K505 PolarHBondContact O-N 3.2Å; K505-M507 VanDerWaalsContact C-N 3.33Å
506	A	75.3	Confident	72.6	Confident	53 Å²	53	123.6 Å²	123.6	44%	0.438	59%	0.588	S	S	.	*	H	α-helix	trans	-75.7	-20.9	173.8	0	0	0	0	0	113	M503 E504	M503-A506 PolarHBondContact O-N 2.99Å; E504-A506 VanDerWaalsContact C-N 3.27Å; E504-A506 PolarHBondContact O-N 3.25Å
507	M	68.9	Low	71.6	Confident	106 Å²	106	121.9 Å²	121.9	52%	0.522	59%	0.585	S	S	.	*	H	α-helix	trans	-71.7	-40.2	176.9	-157.9	175.6	79.6	0	0	111.6	M503 E504 K505 E509 L510 E511	M503-M507 PolarHBondContact O-N 2.85Å; E504-M507 WeakPolarHBondContact O-CA 3.3Å; E504-M507 VanDerWaalsContact O-CB 3.24Å; E504-M507 WeakPolarHBondContact O-CB 3.49Å; E504-M507 PolarHBondContact O-N 3.43Å; K505-M507 VanDerWaalsContact C-N 3.33Å; M507-E509 VanDerWaalsContact C-N 3.33Å; M507-E509 PolarHBondContact O-N 2.88Å; M507-L510 WeakPolarHBondContact O-CA 3.35Å; M507-L510 WeakPolarHBondContact O-CB 3.31Å; M507-L510 PolarHBondContact O-N 3.35Å; M507-E511 PolarHBondContact O-N 3.28Å
508	V	78.3	Confident	70.6	Confident	91 Å²	91	119.5 Å²	119.5	55%	0.552	57%	0.574	S	S	*	*	H	α-helix	trans	-61.7	-37.5	179.3	-178.7	0	0	0	0	112.4	E504 L510 E511 E512	E504-V508 PolarHBondContact O-N 3.39Å; V508-L510 PolarHBondContact O-N 2.9Å; V508-E511 PolarHBondContact O-N 3.05Å; V508-E512 PolarHBondContact O-N 3.1Å
509	E	72	Confident	69.5	Low	150 Å²	150	121.3 Å²	121.3	70%	0.701	58%	0.582	S	S	*	*	H	α-helix	trans	-68.2	-18.1	174.4	-67.2	-171.4	159.5	0	0	113.4	M507 R513	M507-E509 VanDerWaalsContact C-N 3.33Å; M507-E509 PolarHBondContact O-N 2.88Å; E509-R513 WeakPolarHBondContact O-CD 3.3Å
510	L	66.3	Low	68.3	Low	104 Å²	104	120 Å²	120	55%	0.545	58%	0.584	S	S	.	*	H	α-helix	trans	-87.2	-35.3	171.4	-71.2	164.9	0	0	0	111.9	M507 V508 R513 L514	M507-L510 WeakPolarHBondContact O-CA 3.35Å; M507-L510 WeakPolarHBondContact O-CB 3.31Å; M507-L510 PolarHBondContact O-N 3.35Å; V508-L510 PolarHBondContact O-N 2.9Å; L510-R513 WeakPolarHBondContact O-CB 3.32Å; L510-R513 PolarHBondContact O-N 3.32Å; L510-L514 PolarHBondContact O-N 2.94Å
511	E	64.7	Low	67.3	Low	85 Å²	85	118 Å²	118	40%	0.397	58%	0.578	S	S	.	*	H	α-helix	trans	-63.2	-42.3	178.3	-70.5	176.6	148.8	0	0	112.6	M507 V508 R513 L514 Q515	M507-E511 PolarHBondContact O-N 3.28Å; V508-E511 PolarHBondContact O-N 3.05Å; E511-R513 PolarHBondContact O-N 3.43Å; E511-L514 WeakPolarHBondContact O-CB 3.4Å; E511-L514 PolarHBondContact O-N 3.31Å; E511-Q515 PolarHBondContact O-N 3.41Å
512	E	65	Low	66.4	Low	158 Å²	158	120.7 Å²	120.7	74%	0.738	58%	0.581	S	S	*	*	H	α-helix	trans	-63.6	-29.4	177.1	-165.9	178.8	-133.3	0	0	112.1	V508	V508-E512 PolarHBondContact O-N 3.1Å
513	R	66.1	Low	65.3	Low	184 Å²	184	122.7 Å²	122.7	69%	0.694	59%	0.59	S	S	*	*	H	α-helix	trans	-76.3	-32.9	172.5	-65.2	171.1	58	-172.9	-4.5	112.2	E509 L510 E511	E509-R513 WeakPolarHBondContact O-CD 3.3Å; L510-R513 WeakPolarHBondContact O-CB 3.32Å; L510-R513 PolarHBondContact O-N 3.32Å; E511-R513 PolarHBondContact O-N 3.43Å
514	L	61.2	Low	64.6	Low	94 Å²	94	120.5 Å²	120.5	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-71	-44.5	-179.6	-175.2	62.8	0	0	0	112.2	L510 E511 K516 S517 E518	L510-L514 PolarHBondContact O-N 2.94Å; E511-L514 WeakPolarHBondContact O-CB 3.4Å; E511-L514 PolarHBondContact O-N 3.31Å; L514-K516 PolarHBondContact O-N 2.89Å; L514-K516 VanDerWaalsContact O-N 3.08Å; L514-S517 WeakPolarHBondContact O-CA 3.43Å; L514-S517 WeakPolarHBondContact O-CB 3.3Å; L514-S517 PolarHBondContact O-N 2.84Å; L514-E518 HydrophobicContact CG-CG 4.27Å; L514-E518 PolarHBondContact O-N 3.33Å
515	Q	66.1	Low	63.8	Low	127 Å²	127	118.2 Å²	118.2	59%	0.593	58%	0.576	S	S	*	*	H	α-helix	trans	-54.5	-33.8	-180	-71.4	-175.5	10.2	0	0	113.1	E511 S517 E518 Q519	E511-Q515 PolarHBondContact O-N 3.41Å; Q515-S517 VanDerWaalsContact C-N 3.28Å; Q515-S517 PolarHBondContact O-N 3.24Å; Q515-E518 PolarHBondContact O-N 2.95Å; Q515-Q519 PolarHBondContact O-N 3.25Å
516	K	61.6	Low	62.9	Low	184 Å²	184	115.2 Å²	115.2	80%	0.8	57%	0.565	S	S	*	*	H	α-helix	trans	-71.1	-22	178.1	-141.6	167.4	-169.1	166.8	0	113.4	L514	L514-K516 PolarHBondContact O-N 2.89Å; L514-K516 VanDerWaalsContact O-N 3.08Å
517	S	57.5	Low	62	Low	73 Å²	73	116.3 Å²	116.3	51%	0.51	57%	0.569	S	S	.	*	H	α-helix	trans	-89.6	-36.4	172.8	-165.6	0	0	0	0	111.9	L514 Q515 Q519 Q520 S521	L514-S517 WeakPolarHBondContact O-CA 3.43Å; L514-S517 WeakPolarHBondContact O-CB 3.3Å; L514-S517 PolarHBondContact O-N 2.84Å; Q515-S517 VanDerWaalsContact C-N 3.28Å; Q515-S517 PolarHBondContact O-N 3.24Å; S517-Q519 VanDerWaalsContact C-N 3.26Å; S517-Q519 PolarHBondContact O-N 3.15Å; S517-Q520 PolarHBondContact O-N 3.18Å; S517-Q520 VanDerWaalsContact O-N 3.11Å; S517-S521 PolarHBondContact O-N 2.87Å
518	E	58	Low	61.5	Low	62 Å²	62	115.7 Å²	115.7	29%	0.29	57%	0.568	S	S	.	*	H	α-helix	trans	-59.4	-34.1	178.5	-72.8	-178.2	-158.2	0	0	113.2	L514 Q515 Q520 S521 R522	L514-E518 HydrophobicContact CG-CG 4.27Å; L514-E518 PolarHBondContact O-N 3.33Å; Q515-E518 PolarHBondContact O-N 2.95Å; E518-Q520 PolarHBondContact O-N 3.39Å; E518-S521 WeakPolarHBondContact O-CB 3.38Å; E518-S521 PolarHBondContact O-N 3.42Å; E518-R522 VanDerWaalsContact O-CG 3.28Å; E518-R522 WeakPolarHBondContact O-CG 3.45Å; E518-R522 PolarHBondContact O-N 3.47Å; E518-R522 IonicContact OE2-CZ 2.91Å; E518-R522 IonicContact OE2-NE 3.05Å; E518-R522 IonicContact OE2-NH2 3.85Å; E518-R522 PolarHBondContact OE2-NH2 3.32Å
519	Q	58.8	Low	60.4	Low	161 Å²	161	117.2 Å²	117.2	75%	0.752	57%	0.567	S	S	*	*	H	α-helix	trans	-66.1	-20	179.6	-163.7	167.2	5.7	0	0	113	Q515 S517	Q515-Q519 PolarHBondContact O-N 3.25Å; S517-Q519 VanDerWaalsContact C-N 3.26Å; S517-Q519 PolarHBondContact O-N 3.15Å
520	Q	56.2	Low	59.8	Low	151 Å²	151	115.4 Å²	115.4	71%	0.706	56%	0.562	S	S	*	*	H	α-helix	trans	-82.9	-40.8	165.5	-95.6	177	-40.2	0	0	112.1	S517 E518 R522 Q523	S517-Q520 PolarHBondContact O-N 3.18Å; S517-Q520 VanDerWaalsContact O-N 3.11Å; E518-Q520 PolarHBondContact O-N 3.39Å; Q520-R522 VanDerWaalsContact C-N 3.35Å; Q520-R522 PolarHBondContact O-N 2.88Å; Q520-Q523 PolarHBondContact O-N 3.2Å
521	S	54.9	Low	59.3	Low	50 Å²	50	114.8 Å²	114.8	35%	0.35	56%	0.558	S	S	.	*	H	α-helix	trans	-56.9	-45	177.4	-167.6	0	0	0	0	112.7	S517 E518 Q523 T524 D525	S517-S521 PolarHBondContact O-N 2.87Å; E518-S521 WeakPolarHBondContact O-CB 3.38Å; E518-S521 PolarHBondContact O-N 3.42Å; S521-Q523 PolarHBondContact O-N 3.37Å; S521-T524 CarbonylContact O-C 3.59Å; S521-T524 WeakPolarHBondContact O-CA 3.19Å; S521-T524 WeakPolarHBondContact O-CB 3.32Å; S521-T524 PolarHBondContact O-N 3.01Å; S521-T524 PolarHBondContact O-OG1 2.98Å; S521-D525 WeakPolarHBondContact CB-OD2 3.31Å; S521-D525 PolarHBondContact O-N 3.45Å; S521-D525 PolarHBondContact OG-OD2 2.85Å
522	R	58.4	Low	59.1	Low	157 Å²	157	118.5 Å²	118.5	59%	0.592	57%	0.568	S	S	*	*	H	α-helix	trans	-60.4	-17.5	-174.5	-70	168.4	-167	-167.8	5	114.4	E518 Q520 D525	E518-R522 VanDerWaalsContact O-CG 3.28Å; E518-R522 WeakPolarHBondContact O-CG 3.45Å; E518-R522 PolarHBondContact O-N 3.47Å; E518-R522 IonicContact OE2-CZ 2.91Å; E518-R522 IonicContact OE2-NE 3.05Å; E518-R522 IonicContact OE2-NH2 3.85Å; E518-R522 PolarHBondContact OE2-NH2 3.32Å; Q520-R522 VanDerWaalsContact C-N 3.35Å; Q520-R522 PolarHBondContact O-N 2.88Å; R522-D525 PolarHBondContact N-OD2 3.49Å
523	Q	56.9	Low	59.1	Low	172 Å²	172	115.6 Å²	115.6	80%	0.804	56%	0.561	S	S	*	*	H	α-helix	trans	-84.2	-25.5	174	-142.5	171.1	15.1	0	0	112.4	Q520 S521	Q520-Q523 PolarHBondContact O-N 3.2Å; S521-Q523 PolarHBondContact O-N 3.37Å
524	T	56.8	Low	58.8	Low	88 Å²	88	112 Å²	112	54%	0.54	55%	0.552	S	S	.	*	H	α-helix	trans	-81.4	-44.7	169.5	-0	0	0	0	0	111.6	S521 Q526 S527 D528	S521-T524 CarbonylContact O-C 3.59Å; S521-T524 WeakPolarHBondContact O-CA 3.19Å; S521-T524 WeakPolarHBondContact O-CB 3.32Å; S521-T524 PolarHBondContact O-N 3.01Å; S521-T524 PolarHBondContact O-OG1 2.98Å; T524-Q526 PolarHBondContact O-N 3.39Å; T524-Q526 VanDerWaalsContact O-N 3.09Å; T524-S527 WeakPolarHBondContact O-CA 3.29Å; T524-S527 WeakPolarHBondContact O-CB 3.4Å; T524-S527 PolarHBondContact O-N 3.19Å; T524-D528 PolarHBondContact O-N 2.91Å
525	D	58.9	Low	58.6	Low	69 Å²	69	111.5 Å²	111.5	37%	0.369	55%	0.549	S	S	.	.	H	α-helix	trans	-59.2	-24.5	-177.9	-68.5	-58.7	0	0	0	113.7	S521 R522 K529	S521-D525 WeakPolarHBondContact CB-OD2 3.31Å; S521-D525 PolarHBondContact O-N 3.45Å; S521-D525 PolarHBondContact OG-OD2 2.85Å; R522-D525 PolarHBondContact N-OD2 3.49Å; D525-K529 WeakPolarHBondContact O-CG 3.5Å; D525-K529 PolarHBondContact O-N 2.76Å
526	Q	59.3	Low	58.2	Low	101 Å²	101	110.5 Å²	110.5	47%	0.472	54%	0.544	S	S	.	.	H	α-helix	trans	-77.6	-31.3	174	-172.6	54.4	50.8	0	0	112.6	T524	T524-Q526 PolarHBondContact O-N 3.39Å; T524-Q526 VanDerWaalsContact O-N 3.09Å
527	S	56.9	Low	58.1	Low	75 Å²	75	104.9 Å²	104.9	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-71.4	-36.4	171.3	-169.7	0	0	0	0	111.4	T524 M531	T524-S527 WeakPolarHBondContact O-CA 3.29Å; T524-S527 WeakPolarHBondContact O-CB 3.4Å; T524-S527 PolarHBondContact O-N 3.19Å; S527-M531 PolarHBondContact O-N 3.15Å
528	D	56.9	Low	58.2	Low	94 Å²	94	105.8 Å²	105.8	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-69.4	-31.7	177.2	-103.3	38.3	0	0	0	112.3	T524 M531 R532	T524-D528 PolarHBondContact O-N 2.91Å; D528-M531 CarbonylContact O-C 3.59Å; D528-M531 PolarHBondContact O-N 2.88Å; D528-R532 WeakPolarHBondContact O-CB 3.49Å; D528-R532 PolarHBondContact O-N 2.73Å
529	K	56.2	Low	58.4	Low	123 Å²	123	106.3 Å²	106.3	54%	0.535	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-43.9	176	-82.4	170.5	-175.5	170.7	0	113.5	D525 M531 R532 V533	D525-K529 WeakPolarHBondContact O-CG 3.5Å; D525-K529 PolarHBondContact O-N 2.76Å; K529-M531 VanDerWaalsContact C-N 3.33Å; K529-R532 WeakPolarHBondContact O-CB 3.43Å; K529-R532 PolarHBondContact O-N 2.88Å; K529-R532 VanDerWaalsContact O-N 3.16Å; K529-V533 PolarHBondContact O-N 3.17Å
530	D	58.6	Low	58.6	Low	111 Å²	111	104.4 Å²	104.4	59%	0.594	53%	0.529	S	S	*	.	H	α-helix	trans	-68	-38.7	178.1	-63.8	-19.3	0	0	0	110.2	R532 V533 E534	D530-R532 VanDerWaalsContact C-N 3.29Å; D530-R532 PolarHBondContact O-N 3.41Å; D530-V533 PolarHBondContact O-N 2.91Å; D530-E534 PolarHBondContact O-N 2.62Å
531	M	56.9	Low	58.8	Low	92 Å²	92	99.7 Å²	99.7	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-34.1	171.2	-157	-168.3	-41.1	0	0	112.4	S527 D528 K529 E534 L535	S527-M531 PolarHBondContact O-N 3.15Å; D528-M531 CarbonylContact O-C 3.59Å; D528-M531 PolarHBondContact O-N 2.88Å; K529-M531 VanDerWaalsContact C-N 3.33Å; M531-E534 PolarHBondContact O-N 3.38Å; M531-L535 HydrophobicContact CG-CD1 4.43Å; M531-L535 WeakPolarHBondContact O-CB 3.2Å; M531-L535 PolarHBondContact O-N 3.01Å
532	R	59.3	Low	59	Low	162 Å²	162	102.7 Å²	102.7	61%	0.611	52%	0.523	S	S	*	.	H	α-helix	trans	-70.7	-31.9	-179	-167.1	169	-175.7	-128.6	-4.2	112.8	D528 K529 D530 L535 E536	D528-R532 WeakPolarHBondContact O-CB 3.49Å; D528-R532 PolarHBondContact O-N 2.73Å; K529-R532 WeakPolarHBondContact O-CB 3.43Å; K529-R532 PolarHBondContact O-N 2.88Å; K529-R532 VanDerWaalsContact O-N 3.16Å; D530-R532 VanDerWaalsContact C-N 3.29Å; D530-R532 PolarHBondContact O-N 3.41Å; R532-L535 CarbonylContact O-C 3.57Å; R532-L535 PolarHBondContact O-N 3.39Å; R532-E536 PolarHBondContact O-N 3.03Å
533	V	65.6	Low	59	Low	97 Å²	97	100.6 Å²	100.6	59%	0.588	52%	0.52	S	S	*	.	H	α-helix	trans	-69.7	-39.3	171.5	176.9	0	0	0	0	111	K529 D530 L535 E536 A537	K529-V533 PolarHBondContact O-N 3.17Å; D530-V533 PolarHBondContact O-N 2.91Å; V533-L535 VanDerWaalsContact C-N 3.29Å; V533-L535 PolarHBondContact O-N 3.47Å; V533-E536 PolarHBondContact O-N 3.35Å; V533-A537 PolarHBondContact O-N 2.55Å
534	E	60	Low	59.2	Low	108 Å²	108	99 Å²	99	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-65.4	-34.9	171.8	-158.7	-166.6	142.9	0	0	111.5	D530 M531 K538	D530-E534 PolarHBondContact O-N 2.62Å; M531-E534 PolarHBondContact O-N 3.38Å; E534-K538 WeakPolarHBondContact O-CB 3.43Å; E534-K538 VanDerWaalsContact O-CG 3.27Å; E534-K538 WeakPolarHBondContact O-CG 3.39Å; E534-K538 PolarHBondContact O-N 3.49Å; E534-K538 WeakPolarHBondContact OE1-CE 3.42Å; E534-K538 IonicContact OE1-NZ 2.86Å; E534-K538 PolarHBondContact OE1-NZ 3.02Å
535	L	56.5	Low	59.4	Low	84 Å²	84	99.8 Å²	99.8	44%	0.44	51%	0.508	S	S	.	.	H	α-helix	trans	-71.3	-34.8	173.3	-96.4	155.8	0	0	0	113.2	M531 R532 V533 K538 V539	M531-L535 HydrophobicContact CG-CD1 4.43Å; M531-L535 WeakPolarHBondContact O-CB 3.2Å; M531-L535 PolarHBondContact O-N 3.01Å; R532-L535 CarbonylContact O-C 3.57Å; R532-L535 PolarHBondContact O-N 3.39Å; V533-L535 VanDerWaalsContact C-N 3.29Å; V533-L535 PolarHBondContact O-N 3.47Å; L535-K538 CarbonylContact O-C 3.59Å; L535-K538 PolarHBondContact O-N 3.38Å; L535-V539 WeakPolarHBondContact O-CB 3.4Å; L535-V539 VanDerWaalsContact O-CG2 3.23Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 3.48Å
536	E	57.2	Low	59.3	Low	106 Å²	106	101.2 Å²	101.2	50%	0.495	52%	0.515	S	S	.	.	H	α-helix	trans	-69.1	-41.4	173.2	-81.9	176.7	161.5	0	0	111	R532 V533 K538 V539 D540	R532-E536 PolarHBondContact O-N 3.03Å; V533-E536 PolarHBondContact O-N 3.35Å; E536-K538 VanDerWaalsContact C-N 3.29Å; E536-K538 PolarHBondContact O-N 2.72Å; E536-V539 CarbonylContact O-C 3.57Å; E536-V539 PolarHBondContact O-N 2.88Å; E536-D540 PolarHBondContact O-N 3.42Å
537	A	60.7	Low	59.6	Low	66 Å²	66	100.4 Å²	100.4	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-36.1	170.8	0	0	0	0	0	112.6	V533 A541	V533-A537 PolarHBondContact O-N 2.55Å; A537-A541 WeakPolarHBondContact O-CB 3.33Å; A537-A541 PolarHBondContact O-N 3.24Å; A537-A541 VanDerWaalsContact O-N 3.11Å
538	K	59.3	Low	59.9	Low	93 Å²	93	101 Å²	101	40%	0.404	52%	0.515	S	S	.	.	H	α-helix	trans	-71.9	-33.3	170.7	-75.4	168.1	-175.7	167.9	0	112.6	E534 L535 E536 A541 F542	E534-K538 WeakPolarHBondContact O-CB 3.43Å; E534-K538 VanDerWaalsContact O-CG 3.27Å; E534-K538 WeakPolarHBondContact O-CG 3.39Å; E534-K538 PolarHBondContact O-N 3.49Å; E534-K538 WeakPolarHBondContact OE1-CE 3.42Å; E534-K538 IonicContact OE1-NZ 2.86Å; E534-K538 PolarHBondContact OE1-NZ 3.02Å; L535-K538 CarbonylContact O-C 3.59Å; L535-K538 PolarHBondContact O-N 3.38Å; E536-K538 VanDerWaalsContact C-N 3.29Å; E536-K538 PolarHBondContact O-N 2.72Å; K538-A541 CarbonylContact O-C 3.35Å; K538-A541 PolarHBondContact O-N 3.47Å; K538-F542 HydrophobicContact CB-CD2 4.3Å; K538-F542 HydrophobicContact CB-CE2 4.1Å; K538-F542 WeakPolarHBondContact O-CB 3.47Å; K538-F542 WeakPolarHBondContact O-CD2 3.23Å; K538-F542 WeakPolarHBondContact O-CG 3.38Å; K538-F542 PolarHBondContact O-N 2.81Å
539	V	63	Low	60.2	Low	73 Å²	73	101.1 Å²	101.1	44%	0.442	52%	0.515	S	S	.	.	H	α-helix	trans	-70.4	-40.8	176.8	162.2	0	0	0	0	110.3	L535 E536 A541 F542 Q543	L535-V539 WeakPolarHBondContact O-CB 3.4Å; L535-V539 VanDerWaalsContact O-CG2 3.23Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 3.48Å; E536-V539 CarbonylContact O-C 3.57Å; E536-V539 PolarHBondContact O-N 2.88Å; V539-A541 VanDerWaalsContact C-N 3.33Å; V539-A541 PolarHBondContact O-N 2.95Å; V539-F542 CarbonylContact O-C 3.57Å; V539-F542 WeakPolarHBondContact O-CA 3.4Å; V539-F542 PolarHBondContact O-N 2.78Å; V539-F542 VanDerWaalsContact O-N 3.12Å; V539-Q543 VanDerWaalsContact O-CB 3.28Å; V539-Q543 WeakPolarHBondContact O-CB 3.22Å; V539-Q543 PolarHBondContact O-N 3.38Å
540	D	61.3	Low	60.7	Low	120 Å²	120	98.5 Å²	98.5	64%	0.642	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-38.5	170.8	-83.6	-19.5	0	0	0	111.6	E536 F542 Q543 K544	E536-D540 PolarHBondContact O-N 3.42Å; D540-F542 VanDerWaalsContact C-N 3.32Å; D540-F542 PolarHBondContact O-N 3.13Å; D540-Q543 PolarHBondContact O-N 3.44Å; D540-K544 WeakPolarHBondContact O-CB 3.39Å; D540-K544 PolarHBondContact O-N 3.47Å
541	A	61.9	Low	61.2	Low	53 Å²	53	97.7 Å²	97.7	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-35.4	170.8	0	0	0	0	0	112.4	A537 K538 V539 Q545	A537-A541 WeakPolarHBondContact O-CB 3.33Å; A537-A541 PolarHBondContact O-N 3.24Å; A537-A541 VanDerWaalsContact O-N 3.11Å; K538-A541 CarbonylContact O-C 3.35Å; K538-A541 PolarHBondContact O-N 3.47Å; V539-A541 VanDerWaalsContact C-N 3.33Å; V539-A541 PolarHBondContact O-N 2.95Å; A541-Q545 WeakPolarHBondContact O-CB 3.29Å; A541-Q545 WeakPolarHBondContact O-CG 3.36Å; A541-Q545 PolarHBondContact O-N 3.39Å
542	F	59.1	Low	61.6	Low	112 Å²	112	97.7 Å²	97.7	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-77.9	-26.3	174.4	-71.3	-47.7	0	0	0	113	K538 V539 D540 Q545 L546	K538-F542 HydrophobicContact CB-CD2 4.3Å; K538-F542 HydrophobicContact CB-CE2 4.1Å; K538-F542 WeakPolarHBondContact O-CB 3.47Å; K538-F542 WeakPolarHBondContact O-CD2 3.23Å; K538-F542 WeakPolarHBondContact O-CG 3.38Å; K538-F542 PolarHBondContact O-N 2.81Å; V539-F542 CarbonylContact O-C 3.57Å; V539-F542 WeakPolarHBondContact O-CA 3.4Å; V539-F542 PolarHBondContact O-N 2.78Å; V539-F542 VanDerWaalsContact O-N 3.12Å; D540-F542 VanDerWaalsContact C-N 3.32Å; D540-F542 PolarHBondContact O-N 3.13Å; F542-Q545 CarbonylContact O-C 3.6Å; F542-L546 WeakPolarHBondContact O-CA 3.47Å; F542-L546 WeakPolarHBondContact O-CB 3.37Å; F542-L546 WeakPolarHBondContact O-CD1 3.33Å; F542-L546 WeakPolarHBondContact O-CG 3.33Å; F542-L546 PolarHBondContact O-N 2.94Å
543	Q	57.8	Low	62	Low	113 Å²	113	95.1 Å²	95.1	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-74.9	-36.4	174.2	-157.2	75.5	-8.5	0	0	109.7	V539 D540 L546 T547	V539-Q543 VanDerWaalsContact O-CB 3.28Å; V539-Q543 WeakPolarHBondContact O-CB 3.22Å; V539-Q543 PolarHBondContact O-N 3.38Å; D540-Q543 PolarHBondContact O-N 3.44Å; Q543-L546 PolarHBondContact O-N 2.91Å; Q543-T547 PolarHBondContact O-N 3.38Å; Q543-T547 PolarHBondContact O-OG1 2.88Å
544	K	60.2	Low	62.1	Low	139 Å²	139	93 Å²	93	60%	0.604	49%	0.485	S	S	*	.	H	α-helix	trans	-68.6	-48	167.7	-167.9	172.9	-179.1	-179.8	0	111.4	D540 L546 T547 D548	D540-K544 WeakPolarHBondContact O-CB 3.39Å; D540-K544 PolarHBondContact O-N 3.47Å; K544-L546 PolarHBondContact O-N 2.84Å; K544-T547 WeakPolarHBondContact CA-OG1 3.47Å; K544-T547 PolarHBondContact O-N 3.01Å; K544-T547 VanDerWaalsContact O-N 3.11Å; K544-T547 PolarHBondContact O-OG1 3.12Å; K544-T547 VanDerWaalsContact O-OG1 3.05Å; K544-D548 WeakPolarHBondContact O-CB 3.43Å; K544-D548 VanDerWaalsContact O-CG 3.26Å; K544-D548 PolarHBondContact O-N 3.39Å
545	Q	61	Low	62.6	Low	104 Å²	104	89.1 Å²	89.1	49%	0.486	47%	0.474	S	S	.	.	H	α-helix	trans	-61.9	-26.7	171.2	-76.6	-176.9	-12	0	0	112.6	A541 F542 L549	A541-Q545 WeakPolarHBondContact O-CB 3.29Å; A541-Q545 WeakPolarHBondContact O-CG 3.36Å; A541-Q545 PolarHBondContact O-N 3.39Å; F542-Q545 CarbonylContact O-C 3.6Å; Q545-L549 WeakPolarHBondContact O-CA 3.24Å; Q545-L549 WeakPolarHBondContact O-CB 3.28Å; Q545-L549 WeakPolarHBondContact O-CD1 3.47Å; Q545-L549 WeakPolarHBondContact O-CG 3.39Å; Q545-L549 PolarHBondContact O-N 2.98Å
546	L	58.5	Low	63	Low	100 Å²	100	89.4 Å²	89.4	52%	0.524	48%	0.475	S	S	.	.	H	α-helix	trans	-75.3	-33.4	174.3	-86.5	165.7	0	0	0	112	F542 Q543 K544 L549 D550	F542-L546 WeakPolarHBondContact O-CA 3.47Å; F542-L546 WeakPolarHBondContact O-CB 3.37Å; F542-L546 WeakPolarHBondContact O-CD1 3.33Å; F542-L546 WeakPolarHBondContact O-CG 3.33Å; F542-L546 PolarHBondContact O-N 2.94Å; Q543-L546 PolarHBondContact O-N 2.91Å; K544-L546 PolarHBondContact O-N 2.84Å; L546-L549 CarbonylContact O-C 3.53Å; L546-L549 PolarHBondContact O-N 3.49Å; L546-D550 VanDerWaalsContact O-CB 3.27Å; L546-D550 WeakPolarHBondContact O-CB 3.39Å; L546-D550 PolarHBondContact O-N 2.68Å
547	T	64.4	Low	63.2	Low	84 Å²	84	88.5 Å²	88.5	52%	0.515	47%	0.471	S	S	.	.	H	α-helix	trans	-79.8	-32	172.7	43.3	0	0	0	0	112.3	Q543 K544 L549 D550 T551	Q543-T547 PolarHBondContact O-N 3.38Å; Q543-T547 PolarHBondContact O-OG1 2.88Å; K544-T547 WeakPolarHBondContact CA-OG1 3.47Å; K544-T547 PolarHBondContact O-N 3.01Å; K544-T547 VanDerWaalsContact O-N 3.11Å; K544-T547 PolarHBondContact O-OG1 3.12Å; K544-T547 VanDerWaalsContact O-OG1 3.05Å; T547-L549 VanDerWaalsContact C-N 3.33Å; T547-D550 PolarHBondContact O-N 3.08Å; T547-T551 WeakPolarHBondContact O-CB 3.46Å; T547-T551 WeakPolarHBondContact O-CG2 3.35Å; T547-T551 PolarHBondContact O-N 2.88Å; T547-T551 PolarHBondContact O-OG1 2.83Å
548	D	64.1	Low	63.4	Low	88 Å²	88	89.8 Å²	89.8	47%	0.471	47%	0.469	S	S	.	.	H	α-helix	trans	-65.9	-34.8	164.7	-64.5	-30	0	0	0	110.7	K544 T551 L552	K544-D548 WeakPolarHBondContact O-CB 3.43Å; K544-D548 VanDerWaalsContact O-CG 3.26Å; K544-D548 PolarHBondContact O-N 3.39Å; D548-T551 WeakPolarHBondContact CA-OG1 3.3Å; D548-T551 PolarHBondContact O-OG1 3.43Å; D548-T551 VanDerWaalsContact O-OG1 3.13Å; D548-L552 WeakPolarHBondContact O-CB 3.5Å; D548-L552 PolarHBondContact O-N 3.33Å
549	L	63.2	Low	63.9	Low	96 Å²	96	91.5 Å²	91.5	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-80.2	-19.8	172.6	-77.3	167.5	0	0	0	113.4	Q545 L546 T547 L552 R553	Q545-L549 WeakPolarHBondContact O-CA 3.24Å; Q545-L549 WeakPolarHBondContact O-CB 3.28Å; Q545-L549 WeakPolarHBondContact O-CD1 3.47Å; Q545-L549 WeakPolarHBondContact O-CG 3.39Å; Q545-L549 PolarHBondContact O-N 2.98Å; L546-L549 CarbonylContact O-C 3.53Å; L546-L549 PolarHBondContact O-N 3.49Å; T547-L549 VanDerWaalsContact C-N 3.33Å; L549-L552 HydrophobicContact CD2-CD2 4.18Å; L549-R553 WeakPolarHBondContact O-CA 3.5Å; L549-R553 WeakPolarHBondContact O-CB 3.43Å; L549-R553 PolarHBondContact O-N 3.46Å
550	D	66.9	Low	63.8	Low	68 Å²	68	91.2 Å²	91.2	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-83.7	-36.5	173.3	-155.7	102.6	0	0	0	110.3	L546 T547 R553 T554	L546-D550 VanDerWaalsContact O-CB 3.27Å; L546-D550 WeakPolarHBondContact O-CB 3.39Å; L546-D550 PolarHBondContact O-N 2.68Å; T547-D550 PolarHBondContact O-N 3.08Å; D550-R553 VanDerWaalsContact CG-NH1 3.32Å; D550-R553 VanDerWaalsContact CG-NH2 3.33Å; D550-R553 PolarHBondContact O-N 3.04Å; D550-R553 IonicContact OD1-CZ 3.59Å; D550-R553 IonicContact OD1-NH1 2.7Å; D550-R553 PolarHBondContact OD1-NH1 3.17Å; D550-R553 IonicContact OD1-NH2 3.55Å; D550-R553 PolarHBondContact OD1-NH2 3.13Å; D550-R553 IonicContact OD2-CZ 3.23Å; D550-R553 IonicContact OD2-NH1 3.08Å; D550-R553 IonicContact OD2-NH2 3.7Å; D550-R553 PolarHBondContact OD2-NH2 3.35Å; D550-T554 WeakPolarHBondContact O-CB 3.37Å; D550-T554 WeakPolarHBondContact O-CG2 3.28Å; D550-T554 PolarHBondContact O-N 2.95Å; D550-T554 PolarHBondContact O-OG1 3.22Å
551	T	67.6	Low	64.3	Low	93 Å²	93	92.5 Å²	92.5	57%	0.571	47%	0.47	S	S	*	.	H	α-helix	trans	-71	-34.4	167.2	52.7	0	0	0	0	111.8	T547 D548 T554 G555	T547-T551 WeakPolarHBondContact O-CB 3.46Å; T547-T551 WeakPolarHBondContact O-CG2 3.35Å; T547-T551 PolarHBondContact O-N 2.88Å; T547-T551 PolarHBondContact O-OG1 2.83Å; D548-T551 WeakPolarHBondContact CA-OG1 3.3Å; D548-T551 PolarHBondContact O-OG1 3.43Å; D548-T551 VanDerWaalsContact O-OG1 3.13Å; T551-T554 WeakPolarHBondContact CA-OG1 3.45Å; T551-T554 PolarHBondContact O-OG1 3.22Å; T551-G555 WeakPolarHBondContact O-CA 3.45Å; T551-G555 PolarHBondContact O-N 2.99Å
552	L	67.1	Low	64.7	Low	93 Å²	93	92.2 Å²	92.2	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-73.1	-30.8	167.1	-169.4	68.4	0	0	0	112.2	D548 L549 L556	D548-L552 WeakPolarHBondContact O-CB 3.5Å; D548-L552 PolarHBondContact O-N 3.33Å; L549-L552 HydrophobicContact CD2-CD2 4.18Å; L552-L556 HydrophobicContact CD1-CG 4.49Å; L552-L556 HydrophobicContact CD2-CD1 4.42Å; L552-L556 HydrophobicContact CG-CD1 3.96Å; L552-L556 HydrophobicContact CG-CG 4.28Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 WeakPolarHBondContact O-CG 3.47Å; L552-L556 PolarHBondContact O-N 3.13Å
553	R	67.1	Low	65	Low	108 Å²	108	90 Å²	90	41%	0.408	46%	0.459	S	S	.	.	H	α-helix	trans	-69.7	-49.3	173.3	-171.2	-155.9	65.7	-114.1	-18.7	109.7	L549 D550 G555 L556 E557	L549-R553 WeakPolarHBondContact O-CA 3.5Å; L549-R553 WeakPolarHBondContact O-CB 3.43Å; L549-R553 PolarHBondContact O-N 3.46Å; D550-R553 VanDerWaalsContact CG-NH1 3.32Å; D550-R553 VanDerWaalsContact CG-NH2 3.33Å; D550-R553 PolarHBondContact O-N 3.04Å; D550-R553 IonicContact OD1-CZ 3.59Å; D550-R553 IonicContact OD1-NH1 2.7Å; D550-R553 PolarHBondContact OD1-NH1 3.17Å; D550-R553 IonicContact OD1-NH2 3.55Å; D550-R553 PolarHBondContact OD1-NH2 3.13Å; D550-R553 IonicContact OD2-CZ 3.23Å; D550-R553 IonicContact OD2-NH1 3.08Å; D550-R553 IonicContact OD2-NH2 3.7Å; D550-R553 PolarHBondContact OD2-NH2 3.35Å; R553-G555 VanDerWaalsContact C-N 3.27Å; R553-G555 PolarHBondContact O-N 2.77Å; R553-L556 CarbonylContact O-C 3.59Å; R553-L556 WeakPolarHBondContact O-CA 3.25Å; R553-L556 PolarHBondContact O-N 3.32Å; R553-L556 VanDerWaalsContact O-N 3.13Å; R553-E557 HydrophobicContact CG-CG 4.12Å; R553-E557 IonicContact CZ-OE2 3.45Å; R553-E557 VanDerWaalsContact NE-CD 3.3Å; R553-E557 IonicContact NE-OE1 3.54Å; R553-E557 PolarHBondContact NE-OE1 3.27Å; R553-E557 IonicContact NE-OE2 3.49Å; R553-E557 PolarHBondContact NE-OE2 2.82Å; R553-E557 IonicContact NH2-OE2 3.74Å; R553-E557 VanDerWaalsContact O-CB 3.28Å; R553-E557 WeakPolarHBondContact O-CB 3.4Å; R553-E557 WeakPolarHBondContact O-CG 3.33Å; R553-E557 PolarHBondContact O-N 3.38Å
554	T	67.4	Low	65.5	Low	52 Å²	52	92.1 Å²	92.1	32%	0.319	46%	0.462	S	S	.	.	H	α-helix	trans	-65.8	-32.2	175.8	51.1	0	0	0	0	111.9	D550 T551 E557 N558	D550-T554 WeakPolarHBondContact O-CB 3.37Å; D550-T554 WeakPolarHBondContact O-CG2 3.28Å; D550-T554 PolarHBondContact O-N 2.95Å; D550-T554 PolarHBondContact O-OG1 3.22Å; T551-T554 WeakPolarHBondContact CA-OG1 3.45Å; T551-T554 PolarHBondContact O-OG1 3.22Å; T554-E557 PolarHBondContact O-N 3.3Å; T554-N558 WeakPolarHBondContact O-CB 3.27Å; T554-N558 VanDerWaalsContact O-CG 3.25Å; T554-N558 PolarHBondContact O-N 3.49Å; T554-N558 PolarHBondContact O-ND2 3.48Å
555	G	69.6	Low	66	Low	26 Å²	26	91.4 Å²	91.4	27%	0.268	46%	0.461	S	S	.	.	H	α-helix	trans	-56.6	-57.8	164.1	0	0	0	0	0	111.4	T551 R553 E557 N558 E559	T551-G555 WeakPolarHBondContact O-CA 3.45Å; T551-G555 PolarHBondContact O-N 2.99Å; R553-G555 VanDerWaalsContact C-N 3.27Å; R553-G555 PolarHBondContact O-N 2.77Å; G555-E557 VanDerWaalsContact C-N 3.27Å; G555-E557 PolarHBondContact O-N 3.33Å; G555-N558 CarbonylContact O-C 3.49Å; G555-N558 PolarHBondContact O-N 3.45Å; G555-N558 VanDerWaalsContact O-N 3.17Å; G555-E559 WeakPolarHBondContact O-CB 3.48Å; G555-E559 WeakPolarHBondContact O-CG 3.48Å; G555-E559 PolarHBondContact O-N 3.44Å
556	L	65.3	Low	66.2	Low	91 Å²	91	92.1 Å²	92.1	48%	0.476	46%	0.464	S	S	.	.	H	α-helix	trans	-66.2	-19	176.9	-73.7	168.8	0	0	0	114	L552 R553 L560	L552-L556 HydrophobicContact CD1-CG 4.49Å; L552-L556 HydrophobicContact CD2-CD1 4.42Å; L552-L556 HydrophobicContact CG-CD1 3.96Å; L552-L556 HydrophobicContact CG-CG 4.28Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 WeakPolarHBondContact O-CG 3.47Å; L552-L556 PolarHBondContact O-N 3.13Å; R553-L556 CarbonylContact O-C 3.59Å; R553-L556 WeakPolarHBondContact O-CA 3.25Å; R553-L556 PolarHBondContact O-N 3.32Å; R553-L556 VanDerWaalsContact O-N 3.13Å; L556-L560 WeakPolarHBondContact O-CA 3.43Å; L556-L560 WeakPolarHBondContact O-CB 3.33Å; L556-L560 PolarHBondContact O-N 3.27Å
557	E	62.2	Low	66.5	Low	86 Å²	86	94 Å²	94	40%	0.402	46%	0.464	S	S	.	.	H	α-helix	trans	-86.5	-30.4	174.6	-76.9	169.8	136.6	0	0	110.7	R553 T554 G555 R561	R553-E557 HydrophobicContact CG-CG 4.12Å; R553-E557 IonicContact CZ-OE2 3.45Å; R553-E557 VanDerWaalsContact NE-CD 3.3Å; R553-E557 IonicContact NE-OE1 3.54Å; R553-E557 PolarHBondContact NE-OE1 3.27Å; R553-E557 IonicContact NE-OE2 3.49Å; R553-E557 PolarHBondContact NE-OE2 2.82Å; R553-E557 IonicContact NH2-OE2 3.74Å; R553-E557 VanDerWaalsContact O-CB 3.28Å; R553-E557 WeakPolarHBondContact O-CB 3.4Å; R553-E557 WeakPolarHBondContact O-CG 3.33Å; R553-E557 PolarHBondContact O-N 3.38Å; T554-E557 PolarHBondContact O-N 3.3Å; G555-E557 VanDerWaalsContact C-N 3.27Å; G555-E557 PolarHBondContact O-N 3.33Å; E557-R561 VanDerWaalsContact O-CB 3.22Å; E557-R561 WeakPolarHBondContact O-CB 3.26Å; E557-R561 PolarHBondContact O-N 2.77Å
558	N	65.4	Low	66.6	Low	93 Å²	93	95.5 Å²	95.5	50%	0.497	47%	0.465	S	S	.	.	H	α-helix	trans	-78	-35.5	167.8	-71.5	-36.2	0	0	0	111.4	T554 G555 R561 A562	T554-N558 WeakPolarHBondContact O-CB 3.27Å; T554-N558 VanDerWaalsContact O-CG 3.25Å; T554-N558 PolarHBondContact O-N 3.49Å; T554-N558 PolarHBondContact O-ND2 3.48Å; G555-N558 CarbonylContact O-C 3.49Å; G555-N558 PolarHBondContact O-N 3.45Å; G555-N558 VanDerWaalsContact O-N 3.17Å; N558-R561 PolarHBondContact O-N 3.32Å; N558-A562 VanDerWaalsContact O-CB 3.24Å; N558-A562 WeakPolarHBondContact O-CB 3.48Å; N558-A562 PolarHBondContact O-N 2.95Å
559	E	68.2	Low	66.9	Low	129 Å²	129	94.8 Å²	94.8	60%	0.603	47%	0.467	S	S	*	.	H	α-helix	trans	-71.1	-31.5	167.4	-71.4	-178.5	-178.3	0	0	111.4	G555 A562 E563	G555-E559 WeakPolarHBondContact O-CB 3.48Å; G555-E559 WeakPolarHBondContact O-CG 3.48Å; G555-E559 PolarHBondContact O-N 3.44Å; E559-A562 CarbonylContact O-C 3.51Å; E559-E563 WeakPolarHBondContact O-CA 3.43Å; E559-E563 WeakPolarHBondContact O-CB 3.36Å; E559-E563 PolarHBondContact O-N 3.31Å
560	L	62.5	Low	66.9	Low	68 Å²	68	94.8 Å²	94.8	36%	0.356	47%	0.467	S	S	.	.	H	α-helix	trans	-77.5	-24.2	170.9	179.3	63.1	0	0	0	111.7	L556 R564	L556-L560 WeakPolarHBondContact O-CA 3.43Å; L556-L560 WeakPolarHBondContact O-CB 3.33Å; L556-L560 PolarHBondContact O-N 3.27Å; L560-R564 HydrophobicContact CD1-CG 4.43Å; L560-R564 WeakPolarHBondContact O-CB 3.47Å; L560-R564 VanDerWaalsContact O-CD 3.26Å; L560-R564 WeakPolarHBondContact O-CD 3.37Å; L560-R564 WeakPolarHBondContact O-CG 3.49Å; L560-R564 PolarHBondContact O-N 3.5Å
561	R	71.1	Confident	66.9	Low	146 Å²	146	97.1 Å²	97.1	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-71.9	-47.5	167.6	-171.9	-169.7	-52.2	-108.9	-0.5	110	E557 N558 E563 R564 E565	E557-R561 VanDerWaalsContact O-CB 3.22Å; E557-R561 WeakPolarHBondContact O-CB 3.26Å; E557-R561 PolarHBondContact O-N 2.77Å; N558-R561 PolarHBondContact O-N 3.32Å; R561-E563 VanDerWaalsContact C-N 3.33Å; R561-E563 PolarHBondContact O-N 2.83Å; R561-R564 CarbonylContact O-C 3.41Å; R561-R564 PolarHBondContact O-N 3.43Å; R561-E565 WeakPolarHBondContact O-CB 3.35Å; R561-E565 WeakPolarHBondContact O-CG 3.46Å; R561-E565 PolarHBondContact O-N 3.49Å
562	A	69.3	Low	66.9	Low	48 Å²	48	99.1 Å²	99.1	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-36.5	173.1	0	0	0	0	0	111.5	N558 E559 E565 Q566	N558-A562 VanDerWaalsContact O-CB 3.24Å; N558-A562 WeakPolarHBondContact O-CB 3.48Å; N558-A562 PolarHBondContact O-N 2.95Å; E559-A562 CarbonylContact O-C 3.51Å; A562-E565 PolarHBondContact O-N 2.72Å; A562-Q566 WeakPolarHBondContact O-CA 3.45Å; A562-Q566 WeakPolarHBondContact O-CB 3.13Å; A562-Q566 PolarHBondContact O-N 3.03Å
563	E	65.4	Low	67.1	Low	65 Å²	65	96.3 Å²	96.3	30%	0.304	47%	0.467	S	S	.	.	H	α-helix	trans	-70.4	-41.4	172.8	-157.7	-74.6	143	0	0	109.1	E559 R561 E565 Q566 R567	E559-E563 WeakPolarHBondContact O-CA 3.43Å; E559-E563 WeakPolarHBondContact O-CB 3.36Å; E559-E563 PolarHBondContact O-N 3.31Å; R561-E563 VanDerWaalsContact C-N 3.33Å; R561-E563 PolarHBondContact O-N 2.83Å; E563-E565 VanDerWaalsContact C-N 3.32Å; E563-E565 PolarHBondContact O-N 3.35Å; E563-Q566 CarbonylContact O-C 3.52Å; E563-Q566 PolarHBondContact O-N 3.21Å; E563-R567 VanDerWaalsContact O-CA 3.3Å; E563-R567 WeakPolarHBondContact O-CA 3.43Å; E563-R567 WeakPolarHBondContact O-CB 3.39Å; E563-R567 PolarHBondContact O-N 3.45Å; E563-R567 WeakPolarHBondContact OE1-CD 3.27Å; E563-R567 WeakPolarHBondContact OE2-CD 3.38Å; E563-R567 IonicContact OE2-NH1 3.25Å; E563-R567 PolarHBondContact OE2-NH1 2.84Å
564	R	69.3	Low	67.2	Low	157 Å²	157	95.5 Å²	95.5	59%	0.592	47%	0.471	S	S	*	.	H	α-helix	trans	-62	-37.1	172.6	-78.2	163.7	-179.4	168.5	0.6	112.5	L560 R561 R567 Q568	L560-R564 HydrophobicContact CD1-CG 4.43Å; L560-R564 WeakPolarHBondContact O-CB 3.47Å; L560-R564 VanDerWaalsContact O-CD 3.26Å; L560-R564 WeakPolarHBondContact O-CD 3.37Å; L560-R564 WeakPolarHBondContact O-CG 3.49Å; L560-R564 PolarHBondContact O-N 3.5Å; R561-R564 CarbonylContact O-C 3.41Å; R561-R564 PolarHBondContact O-N 3.43Å; R564-R567 PolarHBondContact O-N 2.93Å; R564-Q568 WeakPolarHBondContact O-CB 3.33Å; R564-Q568 WeakPolarHBondContact O-CG 3.45Å; R564-Q568 PolarHBondContact O-N 3.3Å
565	E	70.2	Confident	67.4	Low	125 Å²	125	97.7 Å²	97.7	58%	0.584	48%	0.477	S	S	*	.	H	α-helix	trans	-74.2	-40.9	175.2	-73.7	171.4	-163	0	0	111.5	R561 A562 E563 R567 Q568 S569	R561-E565 WeakPolarHBondContact O-CB 3.35Å; R561-E565 WeakPolarHBondContact O-CG 3.46Å; R561-E565 PolarHBondContact O-N 3.49Å; A562-E565 PolarHBondContact O-N 2.72Å; E563-E565 VanDerWaalsContact C-N 3.32Å; E563-E565 PolarHBondContact O-N 3.35Å; E565-R567 PolarHBondContact O-N 2.95Å; E565-Q568 PolarHBondContact O-N 2.92Å; E565-S569 VanDerWaalsContact O-CB 3.26Å; E565-S569 WeakPolarHBondContact O-CB 3.22Å; E565-S569 PolarHBondContact O-N 2.93Å
566	Q	66.2	Low	67.5	Low	119 Å²	119	104.4 Å²	104.4	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-69.7	-20.5	172.3	-175	176.5	0.2	0	0	111.8	A562 E563 S569 L570	A562-Q566 WeakPolarHBondContact O-CA 3.45Å; A562-Q566 WeakPolarHBondContact O-CB 3.13Å; A562-Q566 PolarHBondContact O-N 3.03Å; E563-Q566 CarbonylContact O-C 3.52Å; E563-Q566 PolarHBondContact O-N 3.21Å; Q566-S569 CarbonylContact O-C 3.34Å; Q566-S569 WeakPolarHBondContact O-CB 3.29Å; Q566-L570 HydrophobicContact CG-CD1 4.15Å; Q566-L570 WeakPolarHBondContact O-CA 3.42Å; Q566-L570 WeakPolarHBondContact O-CB 3.4Å; Q566-L570 WeakPolarHBondContact O-CD1 3.31Å; Q566-L570 WeakPolarHBondContact O-CG 3.45Å; Q566-L570 PolarHBondContact O-N 3.43Å
567	R	63.8	Low	67.7	Low	139 Å²	139	105.3 Å²	105.3	53%	0.525	50%	0.496	S	S	.	.	H	α-helix	trans	-95.3	-25.4	176.7	-175.6	169	174.2	173.3	2.2	112.1	E563 R564 E565 L570 Q571	E563-R567 VanDerWaalsContact O-CA 3.3Å; E563-R567 WeakPolarHBondContact O-CA 3.43Å; E563-R567 WeakPolarHBondContact O-CB 3.39Å; E563-R567 PolarHBondContact O-N 3.45Å; E563-R567 WeakPolarHBondContact OE1-CD 3.27Å; E563-R567 WeakPolarHBondContact OE2-CD 3.38Å; E563-R567 IonicContact OE2-NH1 3.25Å; E563-R567 PolarHBondContact OE2-NH1 2.84Å; R564-R567 PolarHBondContact O-N 2.93Å; E565-R567 PolarHBondContact O-N 2.95Å; R567-L570 CarbonylContact O-C 3.45Å; R567-Q571 WeakPolarHBondContact O-CA 3.37Å; R567-Q571 WeakPolarHBondContact O-CB 3.37Å; R567-Q571 WeakPolarHBondContact O-CG 3.49Å; R567-Q571 PolarHBondContact O-N 2.86Å; R567-Q571 PolarHBondContact O-OE1 2.84Å
568	Q	67.3	Low	68.1	Low	115 Å²	115	106 Å²	106	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-70.6	-35.9	157.3	-76.5	-172.9	8.6	0	0	110.8	R564 E565 Q571 K572	R564-Q568 WeakPolarHBondContact O-CB 3.33Å; R564-Q568 WeakPolarHBondContact O-CG 3.45Å; R564-Q568 PolarHBondContact O-N 3.3Å; E565-Q568 PolarHBondContact O-N 2.92Å; Q568-Q571 PolarHBondContact O-N 2.6Å; Q568-K572 WeakPolarHBondContact O-CB 3.25Å; Q568-K572 VanDerWaalsContact O-CG 3.28Å; Q568-K572 WeakPolarHBondContact O-CG 3.47Å; Q568-K572 PolarHBondContact O-N 3.14Å
569	S	69.5	Low	68.4	Low	74 Å²	74	105.7 Å²	105.7	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-66.5	-46.4	171.8	-168.5	0	0	0	0	110.8	E565 Q566 Q571 K572 A573	E565-S569 VanDerWaalsContact O-CB 3.26Å; E565-S569 WeakPolarHBondContact O-CB 3.22Å; E565-S569 PolarHBondContact O-N 2.93Å; Q566-S569 CarbonylContact O-C 3.34Å; Q566-S569 WeakPolarHBondContact O-CB 3.29Å; S569-Q571 VanDerWaalsContact C-N 3.34Å; S569-Q571 PolarHBondContact O-N 3.15Å; S569-K572 CarbonylContact O-C 3.52Å; S569-K572 PolarHBondContact O-N 2.84Å; S569-A573 WeakPolarHBondContact O-CB 3.46Å; S569-A573 PolarHBondContact O-N 2.94Å
570	L	64.8	Low	68.6	Low	96 Å²	96	103 Å²	103	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-73.4	-19.1	173.7	-74.8	164.4	0	0	0	112.5	Q566 R567 L574	Q566-L570 HydrophobicContact CG-CD1 4.15Å; Q566-L570 WeakPolarHBondContact O-CA 3.42Å; Q566-L570 WeakPolarHBondContact O-CB 3.4Å; Q566-L570 WeakPolarHBondContact O-CD1 3.31Å; Q566-L570 WeakPolarHBondContact O-CG 3.45Å; Q566-L570 PolarHBondContact O-N 3.43Å; R567-L570 CarbonylContact O-C 3.45Å; L570-L574 WeakPolarHBondContact O-CA 3.46Å; L570-L574 WeakPolarHBondContact O-CB 3.45Å; L570-L574 PolarHBondContact O-N 3.26Å
571	Q	65.5	Low	68.7	Low	117 Å²	117	102.6 Å²	102.6	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-78.9	-32.9	166.9	-84.6	175.3	-45	0	0	111.1	R567 Q568 S569 Q575	R567-Q571 WeakPolarHBondContact O-CA 3.37Å; R567-Q571 WeakPolarHBondContact O-CB 3.37Å; R567-Q571 WeakPolarHBondContact O-CG 3.49Å; R567-Q571 PolarHBondContact O-N 2.86Å; R567-Q571 PolarHBondContact O-OE1 2.84Å; Q568-Q571 PolarHBondContact O-N 2.6Å; S569-Q571 VanDerWaalsContact C-N 3.34Å; S569-Q571 PolarHBondContact O-N 3.15Å; Q571-Q575 VanDerWaalsContact O-CB 3.22Å; Q571-Q575 WeakPolarHBondContact O-CB 3.26Å; Q571-Q575 PolarHBondContact O-N 2.9Å
572	K	68.8	Low	68.5	Low	134 Å²	134	98.3 Å²	98.3	58%	0.583	49%	0.486	S	S	*	.	H	α-helix	trans	-71.7	-34.2	169.3	-72.7	166.3	-177.5	171.2	0	111.6	Q568 S569 R576	Q568-K572 WeakPolarHBondContact O-CB 3.25Å; Q568-K572 VanDerWaalsContact O-CG 3.28Å; Q568-K572 WeakPolarHBondContact O-CG 3.47Å; Q568-K572 PolarHBondContact O-N 3.14Å; S569-K572 CarbonylContact O-C 3.52Å; S569-K572 PolarHBondContact O-N 2.84Å; K572-R576 VanDerWaalsContact O-CG 3.26Å; K572-R576 WeakPolarHBondContact O-CG 3.46Å; K572-R576 PolarHBondContact O-N 3.32Å
573	A	70.4	Confident	68.6	Low	35 Å²	35	101.7 Å²	101.7	29%	0.289	49%	0.494	S	S	.	.	H	α-helix	trans	-76.5	-35.3	172.7	0	0	0	0	0	111.7	S569 R576 E577	S569-A573 WeakPolarHBondContact O-CB 3.46Å; S569-A573 PolarHBondContact O-N 2.94Å; A573-R576 CarbonylContact O-C 3.56Å; A573-R576 PolarHBondContact O-N 3.24Å; A573-E577 VanDerWaalsContact O-CB 3.3Å; A573-E577 WeakPolarHBondContact O-CB 3.45Å; A573-E577 VanDerWaalsContact O-CG 3.3Å; A573-E577 WeakPolarHBondContact O-CG 3.33Å; A573-E577 PolarHBondContact O-N 3.17Å
574	L	69.4	Low	68.6	Low	91 Å²	91	103 Å²	103	48%	0.476	50%	0.503	S	S	.	.	H	α-helix	trans	-72.6	-31.8	172.4	179.6	64.4	0	0	0	111.4	L570 E577 Q578	L570-L574 WeakPolarHBondContact O-CA 3.46Å; L570-L574 WeakPolarHBondContact O-CB 3.45Å; L570-L574 PolarHBondContact O-N 3.26Å; L574-E577 CarbonylContact O-C 3.58Å; L574-E577 PolarHBondContact O-N 2.97Å; L574-Q578 HydrophobicContact CD1-CG 4.31Å; L574-Q578 HydrophobicContact CG-CG 4.38Å; L574-Q578 WeakPolarHBondContact O-CB 3.17Å; L574-Q578 WeakPolarHBondContact O-CG 3.28Å; L574-Q578 PolarHBondContact O-N 2.9Å
575	Q	70.4	Confident	68.5	Low	97 Å²	97	98.9 Å²	98.9	45%	0.453	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-50	168.3	-173.6	63.5	62	0	0	109.2	Q571 E577 Q578 D579	Q571-Q575 VanDerWaalsContact O-CB 3.22Å; Q571-Q575 WeakPolarHBondContact O-CB 3.26Å; Q571-Q575 PolarHBondContact O-N 2.9Å; Q575-E577 VanDerWaalsContact C-N 3.26Å; Q575-E577 PolarHBondContact O-N 3.38Å; Q575-Q578 CarbonylContact O-C 2.86Å; Q575-Q578 WeakPolarHBondContact O-CA 3.5Å; Q575-Q578 WeakPolarHBondContact O-CB 3.26Å; Q575-Q578 PolarHBondContact O-N 3.47Å; Q575-D579 PolarHBondContact NE2-OD1 2.88Å; Q575-D579 WeakPolarHBondContact O-CB 3.45Å; Q575-D579 PolarHBondContact O-N 2.88Å
576	R	72.7	Confident	68.2	Low	167 Å²	167	96.6 Å²	96.6	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-58.6	-35.1	172.6	-72.7	168.6	-175.9	160.4	-0.6	113.2	K572 A573 N580	K572-R576 VanDerWaalsContact O-CG 3.26Å; K572-R576 WeakPolarHBondContact O-CG 3.46Å; K572-R576 PolarHBondContact O-N 3.32Å; A573-R576 CarbonylContact O-C 3.56Å; A573-R576 PolarHBondContact O-N 3.24Å; R576-N580 WeakPolarHBondContact O-CA 3.37Å; R576-N580 WeakPolarHBondContact O-CB 3.43Å; R576-N580 PolarHBondContact O-N 2.96Å; R576-N580 PolarHBondContact O-ND2 3.5Å; R576-N580 PolarHBondContact O-OD1 2.94Å
577	E	69.4	Low	68.3	Low	110 Å²	110	94.9 Å²	94.9	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-80.9	-15.4	175.2	-73.7	-59.8	116.7	0	0	112.7	A573 L574 Q575 N580 S581	A573-E577 VanDerWaalsContact O-CB 3.3Å; A573-E577 WeakPolarHBondContact O-CB 3.45Å; A573-E577 VanDerWaalsContact O-CG 3.3Å; A573-E577 WeakPolarHBondContact O-CG 3.33Å; A573-E577 PolarHBondContact O-N 3.17Å; L574-E577 CarbonylContact O-C 3.58Å; L574-E577 PolarHBondContact O-N 2.97Å; Q575-E577 VanDerWaalsContact C-N 3.26Å; Q575-E577 PolarHBondContact O-N 3.38Å; E577-N580 PolarHBondContact OE1-ND2 3.38Å; E577-S581 WeakPolarHBondContact O-CA 3.35Å; E577-S581 WeakPolarHBondContact O-CB 3.31Å; E577-S581 PolarHBondContact O-N 2.94Å
578	Q	70.8	Confident	68.3	Low	101 Å²	101	92.5 Å²	92.5	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-84.4	-33.7	167.8	-79.6	169.7	-3	0	0	110.8	L574 Q575 S581 A582	L574-Q578 HydrophobicContact CD1-CG 4.31Å; L574-Q578 HydrophobicContact CG-CG 4.38Å; L574-Q578 WeakPolarHBondContact O-CB 3.17Å; L574-Q578 WeakPolarHBondContact O-CG 3.28Å; L574-Q578 PolarHBondContact O-N 2.9Å; Q575-Q578 CarbonylContact O-C 2.86Å; Q575-Q578 WeakPolarHBondContact O-CA 3.5Å; Q575-Q578 WeakPolarHBondContact O-CB 3.26Å; Q575-Q578 PolarHBondContact O-N 3.47Å; Q578-S581 CarbonylContact O-C 3.4Å; Q578-S581 PolarHBondContact O-N 3.11Å; Q578-A582 VanDerWaalsContact O-CB 3.29Å; Q578-A582 WeakPolarHBondContact O-CB 3.4Å; Q578-A582 PolarHBondContact O-N 3.24Å
579	D	72.5	Confident	68.3	Low	86 Å²	86	93.8 Å²	93.8	46%	0.46	49%	0.487	S	S	.	.	H	α-helix	trans	-69.2	-50.3	170.7	-53.4	-24.9	0	0	0	108.9	Q575 S581 A582 E583	Q575-D579 PolarHBondContact NE2-OD1 2.88Å; Q575-D579 WeakPolarHBondContact O-CB 3.45Å; Q575-D579 PolarHBondContact O-N 2.88Å; D579-S581 VanDerWaalsContact C-N 3.29Å; D579-S581 PolarHBondContact O-N 3.01Å; D579-A582 WeakPolarHBondContact O-CB 3.31Å; D579-A582 PolarHBondContact O-N 2.64Å; D579-E583 PolarHBondContact O-N 3.39Å
580	N	72.4	Confident	68.1	Low	73 Å²	73	96.3 Å²	96.3	39%	0.39	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-32	171.2	-67.8	-17.7	0	0	0	111.8	R576 E577 E583 L584	R576-N580 WeakPolarHBondContact O-CA 3.37Å; R576-N580 WeakPolarHBondContact O-CB 3.43Å; R576-N580 PolarHBondContact O-N 2.96Å; R576-N580 PolarHBondContact O-ND2 3.5Å; R576-N580 PolarHBondContact O-OD1 2.94Å; E577-N580 PolarHBondContact OE1-ND2 3.38Å; N580-E583 CarbonylContact O-C 3.57Å; N580-L584 VanDerWaalsContact O-CB 3.27Å; N580-L584 WeakPolarHBondContact O-CB 3.39Å; N580-L584 WeakPolarHBondContact O-CD1 3.28Å; N580-L584 PolarHBondContact O-N 2.97Å
581	S	64.4	Low	67.9	Low	59 Å²	59	96.5 Å²	96.5	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-80.8	-24.9	175.5	-177.2	0	0	0	0	112.4	E577 Q578 D579 L584 C585	E577-S581 WeakPolarHBondContact O-CA 3.35Å; E577-S581 WeakPolarHBondContact O-CB 3.31Å; E577-S581 PolarHBondContact O-N 2.94Å; Q578-S581 CarbonylContact O-C 3.4Å; Q578-S581 PolarHBondContact O-N 3.11Å; D579-S581 VanDerWaalsContact C-N 3.29Å; D579-S581 PolarHBondContact O-N 3.01Å; S581-L584 CarbonylContact O-C 3.58Å; S581-C585 WeakPolarHBondContact O-CA 3.34Å; S581-C585 WeakPolarHBondContact O-CB 3.47Å; S581-C585 PolarHBondContact O-N 3.5Å; S581-C585 PolarHBondContact O-SG 2.97Å
582	A	67.1	Low	68	Low	57 Å²	57	96.8 Å²	96.8	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-68.4	-41.2	165.7	0	0	0	0	0	110.1	Q578 D579 C585 T586	Q578-A582 VanDerWaalsContact O-CB 3.29Å; Q578-A582 WeakPolarHBondContact O-CB 3.4Å; Q578-A582 PolarHBondContact O-N 3.24Å; D579-A582 WeakPolarHBondContact O-CB 3.31Å; D579-A582 PolarHBondContact O-N 2.64Å; A582-C585 PolarHBondContact O-N 2.93Å; A582-T586 PolarHBondContact O-N 2.87Å; A582-T586 PolarHBondContact O-OG1 3.1Å
583	E	69.4	Low	68	Low	118 Å²	118	92.1 Å²	92.1	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-68.3	-41.4	173.3	-167.3	161.4	175	0	0	111.9	D579 N580 C585 T586 Q587	D579-E583 PolarHBondContact O-N 3.39Å; N580-E583 CarbonylContact O-C 3.57Å; E583-C585 VanDerWaalsContact C-N 3.34Å; E583-C585 PolarHBondContact O-N 3.48Å; E583-T586 CarbonylContact O-C 3.52Å; E583-T586 WeakPolarHBondContact O-CA 3.21Å; E583-T586 WeakPolarHBondContact O-CB 3.31Å; E583-T586 PolarHBondContact O-N 2.74Å; E583-T586 VanDerWaalsContact O-N 3.14Å; E583-Q587 WeakPolarHBondContact O-CG 3.29Å; E583-Q587 PolarHBondContact O-N 3.44Å
584	L	65.5	Low	67.7	Low	94 Å²	94	95.1 Å²	95.1	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-69	-26.9	171.5	-106.5	77	0	0	0	112.8	N580 S581 Q587 L588	N580-L584 VanDerWaalsContact O-CB 3.27Å; N580-L584 WeakPolarHBondContact O-CB 3.39Å; N580-L584 WeakPolarHBondContact O-CD1 3.28Å; N580-L584 PolarHBondContact O-N 2.97Å; S581-L584 CarbonylContact O-C 3.58Å; L584-Q587 CarbonylContact O-C 3.5Å; L584-L588 WeakPolarHBondContact O-CA 3.28Å; L584-L588 WeakPolarHBondContact O-CB 3.5Å; L584-L588 VanDerWaalsContact O-CG 3.28Å; L584-L588 WeakPolarHBondContact O-CG 3.3Å; L584-L588 PolarHBondContact O-N 3.48Å
585	C	67.3	Low	67.7	Low	69 Å²	69	95.6 Å²	95.6	47%	0.466	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-38.3	169.1	-79	0	0	0	0	110.2	S581 A582 E583 L588 Q589	S581-C585 WeakPolarHBondContact O-CA 3.34Å; S581-C585 WeakPolarHBondContact O-CB 3.47Å; S581-C585 PolarHBondContact O-N 3.5Å; S581-C585 PolarHBondContact O-SG 2.97Å; A582-C585 PolarHBondContact O-N 2.93Å; E583-C585 VanDerWaalsContact C-N 3.34Å; E583-C585 PolarHBondContact O-N 3.48Å; C585-L588 CarbonylContact O-C 3.46Å; C585-L588 PolarHBondContact O-N 2.7Å; C585-Q589 VanDerWaalsContact O-CB 3.31Å; C585-Q589 WeakPolarHBondContact O-CB 3.28Å; C585-Q589 PolarHBondContact O-N 2.87Å
586	T	65.6	Low	67.7	Low	78 Å²	78	94.8 Å²	94.8	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-44	173.8	-50.6	0	0	0	0	110.6	A582 E583 Q589 Q590	A582-T586 PolarHBondContact O-N 2.87Å; A582-T586 PolarHBondContact O-OG1 3.1Å; E583-T586 CarbonylContact O-C 3.52Å; E583-T586 WeakPolarHBondContact O-CA 3.21Å; E583-T586 WeakPolarHBondContact O-CB 3.31Å; E583-T586 PolarHBondContact O-N 2.74Å; E583-T586 VanDerWaalsContact O-N 3.14Å; T586-Q589 PolarHBondContact O-N 3.19Å; T586-Q590 WeakPolarHBondContact O-CG 3.44Å; T586-Q590 PolarHBondContact O-N 3.07Å
587	Q	67.9	Low	67.6	Low	82 Å²	82	92.5 Å²	92.5	38%	0.383	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-32.9	172.9	-65.4	173.9	21.9	0	0	112.3	E583 L584 Q590 L591	E583-Q587 WeakPolarHBondContact O-CG 3.29Å; E583-Q587 PolarHBondContact O-N 3.44Å; L584-Q587 CarbonylContact O-C 3.5Å; Q587-Q590 PolarHBondContact O-N 3.14Å; Q587-L591 VanDerWaalsContact O-CB 3.29Å; Q587-L591 WeakPolarHBondContact O-CB 3.42Å; Q587-L591 VanDerWaalsContact O-CG 3.25Å; Q587-L591 WeakPolarHBondContact O-CG 3.11Å; Q587-L591 PolarHBondContact O-N 3.12Å
588	L	64.1	Low	67.5	Low	89 Å²	89	91.4 Å²	91.4	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-71.3	-31.3	172.9	-89	165.1	0	0	0	111.7	L584 C585 L591 Q592	L584-L588 WeakPolarHBondContact O-CA 3.28Å; L584-L588 WeakPolarHBondContact O-CB 3.5Å; L584-L588 VanDerWaalsContact O-CG 3.28Å; L584-L588 WeakPolarHBondContact O-CG 3.3Å; L584-L588 PolarHBondContact O-N 3.48Å; C585-L588 CarbonylContact O-C 3.46Å; C585-L588 PolarHBondContact O-N 2.7Å; L588-L591 CarbonylContact O-C 3.51Å; L588-L591 PolarHBondContact O-N 3.04Å; L588-Q592 WeakPolarHBondContact O-CB 3.28Å; L588-Q592 WeakPolarHBondContact O-CG 3.43Å; L588-Q592 PolarHBondContact O-N 3.09Å
589	Q	66.1	Low	67.6	Low	142 Å²	142	91.7 Å²	91.7	66%	0.664	49%	0.49	S	S	*	.	H	α-helix	trans	-71.5	-37.5	174	-160.8	168.1	17.2	0	0	110.5	C585 T586 Q592 G593	C585-Q589 VanDerWaalsContact O-CB 3.31Å; C585-Q589 WeakPolarHBondContact O-CB 3.28Å; C585-Q589 PolarHBondContact O-N 2.87Å; T586-Q589 PolarHBondContact O-N 3.19Å; Q589-Q592 PolarHBondContact O-N 2.91Å; Q589-G593 PolarHBondContact O-N 2.65Å
590	Q	64.9	Low	67.6	Low	128 Å²	128	92 Å²	92	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-64.3	-45.2	167.1	-69.5	176.5	-5.6	0	0	112.1	T586 Q587 Q592 G593 L594	T586-Q590 WeakPolarHBondContact O-CG 3.44Å; T586-Q590 PolarHBondContact O-N 3.07Å; Q587-Q590 PolarHBondContact O-N 3.14Å; Q590-Q592 VanDerWaalsContact C-N 3.29Å; Q590-Q592 PolarHBondContact O-N 3.37Å; Q590-G593 PolarHBondContact O-N 3.31Å; Q590-L594 PolarHBondContact O-N 3.48Å
591	L	61.2	Low	67.5	Low	100 Å²	100	93.6 Å²	93.6	52%	0.524	50%	0.499	S	S	.	.	H	α-helix	trans	-69.6	-22.7	176.6	-74.2	167.7	0	0	0	112.9	Q587 L588 L594 H595	Q587-L591 VanDerWaalsContact O-CB 3.29Å; Q587-L591 WeakPolarHBondContact O-CB 3.42Å; Q587-L591 VanDerWaalsContact O-CG 3.25Å; Q587-L591 WeakPolarHBondContact O-CG 3.11Å; Q587-L591 PolarHBondContact O-N 3.12Å; L588-L591 CarbonylContact O-C 3.51Å; L588-L591 PolarHBondContact O-N 3.04Å; L591-L594 HydrophobicContact CD2-CD1 4.14Å; L591-H595 WeakPolarHBondContact O-CA 3.35Å; L591-H595 WeakPolarHBondContact O-CB 3.49Å; L591-H595 PolarHBondContact O-N 3.18Å
592	Q	66.8	Low	67.8	Low	123 Å²	123	96.7 Å²	96.7	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-77.2	-35.4	170	-82.7	176	-8.4	0	0	111.4	L588 Q589 Q590 H595 T596	L588-Q592 WeakPolarHBondContact O-CB 3.28Å; L588-Q592 WeakPolarHBondContact O-CG 3.43Å; L588-Q592 PolarHBondContact O-N 3.09Å; Q589-Q592 PolarHBondContact O-N 2.91Å; Q590-Q592 VanDerWaalsContact C-N 3.29Å; Q590-Q592 PolarHBondContact O-N 3.37Å; Q592-H595 PolarHBondContact O-N 2.82Å; Q592-T596 WeakPolarHBondContact O-CB 3.26Å; Q592-T596 PolarHBondContact O-N 3.28Å; Q592-T596 PolarHBondContact O-OG1 3.28Å
593	G	68.8	Low	68.1	Low	36 Å²	36	97.3 Å²	97.3	37%	0.371	50%	0.503	S	S	.	.	H	α-helix	trans	-56.1	-57.1	164.6	0	0	0	0	0	110.7	Q589 Q590 H595 T596 E597	Q589-G593 PolarHBondContact O-N 2.65Å; Q590-G593 PolarHBondContact O-N 3.31Å; G593-H595 VanDerWaalsContact C-N 3.27Å; G593-H595 PolarHBondContact O-N 2.97Å; G593-T596 WeakPolarHBondContact O-CA 3.26Å; G593-T596 WeakPolarHBondContact O-CB 3.35Å; G593-T596 PolarHBondContact O-N 3.41Å; G593-E597 PolarHBondContact O-N 2.88Å
594	L	65.3	Low	68.2	Low	97 Å²	97	96.8 Å²	96.8	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-31.1	175.3	-71.6	161.6	0	0	0	113.2	Q590 L591 L598	Q590-L594 PolarHBondContact O-N 3.48Å; L591-L594 HydrophobicContact CD2-CD1 4.14Å; L594-L598 WeakPolarHBondContact O-CB 3.46Å; L594-L598 PolarHBondContact O-N 3.1Å
595	H	68.6	Low	68.3	Low	102 Å²	102	98.3 Å²	98.3	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-73.1	-33	175.2	-168.5	83.8	0	0	0	111.8	L591 Q592 G593 L598 Q599	L591-H595 WeakPolarHBondContact O-CA 3.35Å; L591-H595 WeakPolarHBondContact O-CB 3.49Å; L591-H595 PolarHBondContact O-N 3.18Å; Q592-H595 PolarHBondContact O-N 2.82Å; G593-H595 VanDerWaalsContact C-N 3.27Å; G593-H595 PolarHBondContact O-N 2.97Å; H595-L598 PolarHBondContact O-N 3.37Å; H595-Q599 WeakPolarHBondContact O-CB 3.41Å; H595-Q599 PolarHBondContact O-N 2.92Å
596	T	71.3	Confident	68.5	Low	80 Å²	80	101.7 Å²	101.7	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-50.4	173	-51.6	0	0	0	0	109.2	Q592 G593 L598 Q599 D600	Q592-T596 WeakPolarHBondContact O-CB 3.26Å; Q592-T596 PolarHBondContact O-N 3.28Å; Q592-T596 PolarHBondContact O-OG1 3.28Å; G593-T596 WeakPolarHBondContact O-CA 3.26Å; G593-T596 WeakPolarHBondContact O-CB 3.35Å; G593-T596 PolarHBondContact O-N 3.41Å; T596-L598 VanDerWaalsContact C-N 3.3Å; T596-L598 PolarHBondContact O-N 2.92Å; T596-Q599 CarbonylContact O-C 3.19Å; T596-Q599 WeakPolarHBondContact O-CA 3.5Å; T596-Q599 WeakPolarHBondContact O-CB 3.33Å; T596-Q599 PolarHBondContact O-N 2.85Å; T596-D600 PolarHBondContact O-N 2.69Å
597	E	70.3	Confident	68.8	Low	118 Å²	118	104.4 Å²	104.4	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-56.8	-41.4	172.7	-67	-178.6	151.5	0	0	112.3	G593 Q599 D600 L601	G593-E597 PolarHBondContact O-N 2.88Å; E597-Q599 VanDerWaalsContact C-N 3.33Å; E597-D600 PolarHBondContact O-N 3.02Å; E597-L601 VanDerWaalsContact O-CB 3.32Å; E597-L601 WeakPolarHBondContact O-CB 3.16Å; E597-L601 VanDerWaalsContact O-CG 3.26Å; E597-L601 WeakPolarHBondContact O-CG 3.19Å; E597-L601 PolarHBondContact O-N 3.29Å
598	L	67.3	Low	68.7	Low	87 Å²	87	104 Å²	104	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-73.2	-25	177.9	-165.6	151.1	0	0	0	112.3	L594 H595 T596 K602	L594-L598 WeakPolarHBondContact O-CB 3.46Å; L594-L598 PolarHBondContact O-N 3.1Å; H595-L598 PolarHBondContact O-N 3.37Å; T596-L598 VanDerWaalsContact C-N 3.3Å; T596-L598 PolarHBondContact O-N 2.92Å; L598-K602 HydrophobicContact CD2-CD 3.86Å; L598-K602 VanDerWaalsContact CD2-CE 3.44Å; L598-K602 HydrophobicContact CD2-CG 4.3Å; L598-K602 VanDerWaalsContact O-CB 3.23Å; L598-K602 WeakPolarHBondContact O-CB 3.48Å; L598-K602 VanDerWaalsContact O-CG 3.23Å; L598-K602 WeakPolarHBondContact O-CG 3.16Å; L598-K602 PolarHBondContact O-N 3.28Å
599	Q	72.5	Confident	68.8	Low	107 Å²	107	104.1 Å²	104.1	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-76.5	-38.9	171.9	-179	165.7	-43.9	0	0	111.1	H595 T596 E597 K602 T603	H595-Q599 WeakPolarHBondContact O-CB 3.41Å; H595-Q599 PolarHBondContact O-N 2.92Å; T596-Q599 CarbonylContact O-C 3.19Å; T596-Q599 WeakPolarHBondContact O-CA 3.5Å; T596-Q599 WeakPolarHBondContact O-CB 3.33Å; T596-Q599 PolarHBondContact O-N 2.85Å; E597-Q599 VanDerWaalsContact C-N 3.33Å; Q599-K602 CarbonylContact O-C 3.6Å; Q599-K602 WeakPolarHBondContact O-CB 3.48Å; Q599-K602 PolarHBondContact O-N 2.89Å; Q599-T603 WeakPolarHBondContact O-CG2 3.4Å; Q599-T603 PolarHBondContact O-N 3.21Å; Q599-T603 PolarHBondContact O-OG1 3.32Å
600	D	73.6	Confident	69	Low	93 Å²	93	102.3 Å²	102.3	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-50.7	172	-66.9	-25.1	0	0	0	109.9	T596 E597 K602 T603 E604	T596-D600 PolarHBondContact O-N 2.69Å; E597-D600 PolarHBondContact O-N 3.02Å; D600-K602 PolarHBondContact O-N 3.1Å; D600-T603 PolarHBondContact O-N 2.79Å; D600-T603 PolarHBondContact O-OG1 2.82Å; D600-E604 WeakPolarHBondContact O-CB 3.31Å; D600-E604 PolarHBondContact O-N 3.04Å
601	L	69.8	Low	69.3	Low	107 Å²	107	103 Å²	103	56%	0.56	50%	0.504	S	S	*	.	H	α-helix	trans	-58.5	-29.7	171.1	-72.8	165.8	0	0	0	113.1	E597 K605	E597-L601 VanDerWaalsContact O-CB 3.32Å; E597-L601 WeakPolarHBondContact O-CB 3.16Å; E597-L601 VanDerWaalsContact O-CG 3.26Å; E597-L601 WeakPolarHBondContact O-CG 3.19Å; E597-L601 PolarHBondContact O-N 3.29Å; L601-K605 WeakPolarHBondContact O-CB 3.32Å; L601-K605 PolarHBondContact O-N 3.15Å
602	K	70.1	Confident	69.5	Low	123 Å²	123	101.2 Å²	101.2	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-74.2	-36.3	172	-89.8	173.1	178.3	165.5	0	112.7	L598 Q599 D600 K606	L598-K602 HydrophobicContact CD2-CD 3.86Å; L598-K602 VanDerWaalsContact CD2-CE 3.44Å; L598-K602 HydrophobicContact CD2-CG 4.3Å; L598-K602 VanDerWaalsContact O-CB 3.23Å; L598-K602 WeakPolarHBondContact O-CB 3.48Å; L598-K602 VanDerWaalsContact O-CG 3.23Å; L598-K602 WeakPolarHBondContact O-CG 3.16Å; L598-K602 PolarHBondContact O-N 3.28Å; Q599-K602 CarbonylContact O-C 3.6Å; Q599-K602 WeakPolarHBondContact O-CB 3.48Å; Q599-K602 PolarHBondContact O-N 2.89Å; D600-K602 PolarHBondContact O-N 3.1Å; K602-K606 VanDerWaalsContact O-CB 3.27Å; K602-K606 WeakPolarHBondContact O-CB 3.39Å; K602-K606 PolarHBondContact O-N 3.09Å
603	T	73.9	Confident	69.5	Low	70 Å²	70	100 Å²	100	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-73.6	-39.2	175.9	58.5	0	0	0	0	111	Q599 D600 K606 Q607	Q599-T603 WeakPolarHBondContact O-CG2 3.4Å; Q599-T603 PolarHBondContact O-N 3.21Å; Q599-T603 PolarHBondContact O-OG1 3.32Å; D600-T603 PolarHBondContact O-N 2.79Å; D600-T603 PolarHBondContact O-OG1 2.82Å; T603-K606 PolarHBondContact O-N 3.38Å; T603-K606 VanDerWaalsContact O-N 3.16Å; T603-Q607 WeakPolarHBondContact O-CG 3.26Å; T603-Q607 PolarHBondContact O-N 2.96Å
604	E	70.6	Confident	69.4	Low	108 Å²	108	104.2 Å²	104.2	51%	0.505	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-50	168.4	-173.3	178.2	-141.4	0	0	110.9	D600 K606 Q607 L608	D600-E604 WeakPolarHBondContact O-CB 3.31Å; D600-E604 PolarHBondContact O-N 3.04Å; E604-K606 VanDerWaalsContact C-N 3.27Å; E604-K606 PolarHBondContact O-N 3.28Å; E604-Q607 PolarHBondContact O-N 2.84Å; E604-L608 HydrophobicContact CG-CD1 4.21Å; E604-L608 VanDerWaalsContact O-CG 3.32Å; E604-L608 WeakPolarHBondContact O-CG 3.3Å; E604-L608 PolarHBondContact O-N 3.18Å
605	K	68.4	Low	69.1	Low	125 Å²	125	104.7 Å²	104.7	54%	0.543	50%	0.504	S	S	.	.	H	α-helix	trans	-54.2	-43.3	171.6	177.4	179.2	174.5	179.6	0	111.7	L601 L608 Q609	L601-K605 WeakPolarHBondContact O-CB 3.32Å; L601-K605 PolarHBondContact O-N 3.15Å; K605-L608 PolarHBondContact O-N 3.36Å; K605-Q609 VanDerWaalsContact CE-OE1 3.26Å; K605-Q609 WeakPolarHBondContact O-CB 3.5Å; K605-Q609 PolarHBondContact O-N 2.88Å
606	K	70.7	Confident	68.7	Low	141 Å²	141	106.1 Å²	106.1	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-68.2	-37.2	-177.9	-165.6	174.5	-177.2	-177.5	0	111.9	K602 T603 E604 Q609 Q610	K602-K606 VanDerWaalsContact O-CB 3.27Å; K602-K606 WeakPolarHBondContact O-CB 3.39Å; K602-K606 PolarHBondContact O-N 3.09Å; T603-K606 PolarHBondContact O-N 3.38Å; T603-K606 VanDerWaalsContact O-N 3.16Å; E604-K606 VanDerWaalsContact C-N 3.27Å; E604-K606 PolarHBondContact O-N 3.28Å; K606-Q609 PolarHBondContact O-N 3.35Å; K606-Q610 WeakPolarHBondContact O-CG 3.47Å; K606-Q610 PolarHBondContact O-N 2.74Å
607	Q	71.8	Confident	68.3	Low	134 Å²	134	108.7 Å²	108.7	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-64.6	-44.7	171	-69.8	175	11.6	0	0	111.5	T603 E604 Q609 R611	T603-Q607 WeakPolarHBondContact O-CG 3.26Å; T603-Q607 PolarHBondContact O-N 2.96Å; E604-Q607 PolarHBondContact O-N 2.84Å; Q607-Q609 VanDerWaalsContact C-N 3.3Å; Q607-Q609 PolarHBondContact O-N 2.96Å; Q607-R611 WeakPolarHBondContact O-CB 3.45Å; Q607-R611 PolarHBondContact O-N 2.81Å
608	L	66.9	Low	67.8	Low	73 Å²	73	107.4 Å²	107.4	38%	0.382	52%	0.517	S	S	.	.	H	α-helix	trans	-61.1	-38.5	174.1	-69.3	169.5	0	0	0	112	E604 K605 R611 C612	E604-L608 HydrophobicContact CG-CD1 4.21Å; E604-L608 VanDerWaalsContact O-CG 3.32Å; E604-L608 WeakPolarHBondContact O-CG 3.3Å; E604-L608 PolarHBondContact O-N 3.18Å; K605-L608 PolarHBondContact O-N 3.36Å; L608-R611 VanDerWaalsContact CD2-NH2 3.28Å; L608-R611 WeakPolarHBondContact O-CB 3.33Å; L608-R611 PolarHBondContact O-N 3.15Å; L608-C612 PolarHBondContact O-N 2.99Å; L608-C612 PolarHBondContact O-SG 3.03Å
609	Q	65.8	Low	67.3	Low	93 Å²	93	108.4 Å²	108.4	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-74.7	-41.1	-177.5	-166.4	164.9	-16.3	0	0	111.9	K605 K606 Q607 R611 C612 E613	K605-Q609 VanDerWaalsContact CE-OE1 3.26Å; K605-Q609 WeakPolarHBondContact O-CB 3.5Å; K605-Q609 PolarHBondContact O-N 2.88Å; K606-Q609 PolarHBondContact O-N 3.35Å; Q607-Q609 VanDerWaalsContact C-N 3.3Å; Q607-Q609 PolarHBondContact O-N 2.96Å; Q609-R611 VanDerWaalsContact C-N 3.25Å; Q609-R611 PolarHBondContact O-N 3.45Å; Q609-C612 WeakPolarHBondContact O-CB 3.42Å; Q609-C612 PolarHBondContact O-N 2.77Å; Q609-C612 VanDerWaalsContact O-N 3.13Å; Q609-E613 WeakPolarHBondContact O-CG 3.41Å; Q609-E613 PolarHBondContact O-N 3.5Å
610	Q	71.3	Confident	66.5	Low	104 Å²	104	110.8 Å²	110.8	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-60.5	-35.7	168.6	-73.3	-172.6	-71.1	0	0	112.1	K606 C612 E613 Q614	K606-Q610 WeakPolarHBondContact O-CG 3.47Å; K606-Q610 PolarHBondContact O-N 2.74Å; Q610-C612 VanDerWaalsContact C-N 3.34Å; Q610-E613 PolarHBondContact O-N 3.37Å; Q610-Q614 WeakPolarHBondContact O-CB 3.35Å; Q610-Q614 WeakPolarHBondContact O-CG 3.46Å; Q610-Q614 PolarHBondContact O-N 3Å
611	R	69.8	Low	65.7	Low	141 Å²	141	113.5 Å²	113.5	53%	0.532	54%	0.543	S	S	.	.	H	α-helix	trans	-66.6	-35	175.2	-165.6	179.8	70.5	-172.1	2	112.1	Q607 L608 Q609 Q615	Q607-R611 WeakPolarHBondContact O-CB 3.45Å; Q607-R611 PolarHBondContact O-N 2.81Å; L608-R611 VanDerWaalsContact CD2-NH2 3.28Å; L608-R611 WeakPolarHBondContact O-CB 3.33Å; L608-R611 PolarHBondContact O-N 3.15Å; Q609-R611 VanDerWaalsContact C-N 3.25Å; Q609-R611 PolarHBondContact O-N 3.45Å; R611-Q615 WeakPolarHBondContact O-CG 3.25Å; R611-Q615 PolarHBondContact O-N 2.98Å
612	C	66.6	Low	64.9	Low	64 Å²	64	113.4 Å²	113.4	43%	0.432	54%	0.541	S	S	.	.	H	α-helix	trans	-69	-46.1	171	-69	0	0	0	0	112.1	L608 Q609 Q610 Q614 Q615 E616	L608-C612 PolarHBondContact O-N 2.99Å; L608-C612 PolarHBondContact O-SG 3.03Å; Q609-C612 WeakPolarHBondContact O-CB 3.42Å; Q609-C612 PolarHBondContact O-N 2.77Å; Q609-C612 VanDerWaalsContact O-N 3.13Å; Q610-C612 VanDerWaalsContact C-N 3.34Å; C612-Q614 VanDerWaalsContact C-N 3.33Å; C612-Q614 PolarHBondContact O-N 2.88Å; C612-Q615 CarbonylContact O-C 3.11Å; C612-Q615 WeakPolarHBondContact O-CA 3.33Å; C612-Q615 WeakPolarHBondContact O-CB 3.36Å; C612-Q615 PolarHBondContact O-N 3.26Å; C612-E616 PolarHBondContact O-N 2.94Å
613	E	67.3	Low	64	Low	98 Å²	98	110.2 Å²	110.2	46%	0.458	54%	0.544	S	S	.	.	H	α-helix	trans	-60.8	-40.1	-179.7	-71.7	165.8	172.1	0	0	111.8	Q609 Q610 Q615 E616 Q617	Q609-E613 WeakPolarHBondContact O-CG 3.41Å; Q609-E613 PolarHBondContact O-N 3.5Å; Q610-E613 PolarHBondContact O-N 3.37Å; E613-Q615 VanDerWaalsContact C-N 3.34Å; E613-Q615 PolarHBondContact O-N 3.02Å; E613-E616 PolarHBondContact O-N 2.94Å; E613-Q617 PolarHBondContact O-N 3.46Å
614	Q	66.4	Low	63	Low	124 Å²	124	114.1 Å²	114.1	58%	0.579	56%	0.561	S	S	*	*	H	α-helix	trans	-64.7	-35.4	171.9	-72.9	176.7	-10.7	0	0	112.7	Q610 C612 T618	Q610-Q614 WeakPolarHBondContact O-CB 3.35Å; Q610-Q614 WeakPolarHBondContact O-CG 3.46Å; Q610-Q614 PolarHBondContact O-N 3Å; C612-Q614 VanDerWaalsContact C-N 3.33Å; C612-Q614 PolarHBondContact O-N 2.88Å; Q614-T618 WeakPolarHBondContact O-CB 3.34Å; Q614-T618 PolarHBondContact O-N 3.38Å; Q614-T618 VanDerWaalsContact O-N 3.12Å; Q614-T618 PolarHBondContact O-OG1 3.42Å
615	Q	57.5	Low	62	Low	107 Å²	107	117.1 Å²	117.1	50%	0.5	58%	0.575	S	S	.	*	H	α-helix	trans	-71.1	-37.2	175.2	-74.6	171.6	-14.4	0	0	112	R611 C612 E613 T618 L619	R611-Q615 WeakPolarHBondContact O-CG 3.25Å; R611-Q615 PolarHBondContact O-N 2.98Å; C612-Q615 CarbonylContact O-C 3.11Å; C612-Q615 WeakPolarHBondContact O-CA 3.33Å; C612-Q615 WeakPolarHBondContact O-CB 3.36Å; C612-Q615 PolarHBondContact O-N 3.26Å; E613-Q615 VanDerWaalsContact C-N 3.34Å; E613-Q615 PolarHBondContact O-N 3.02Å; Q615-T618 PolarHBondContact O-N 3.11Å; Q615-L619 WeakPolarHBondContact O-CB 3.49Å; Q615-L619 VanDerWaalsContact O-CG 3.29Å; Q615-L619 WeakPolarHBondContact O-CG 3.24Å; Q615-L619 PolarHBondContact O-N 3.42Å
616	E	60.7	Low	60.9	Low	132 Å²	132	117.3 Å²	117.3	62%	0.617	58%	0.581	S	S	*	*	H	α-helix	trans	-66.7	-43	174.5	-74	-171.9	124.6	0	0	112.4	C612 E613 T618 L619 Q620	C612-E616 PolarHBondContact O-N 2.94Å; E613-E616 PolarHBondContact O-N 2.94Å; E616-T618 PolarHBondContact O-N 2.89Å; E616-L619 PolarHBondContact O-N 2.87Å; E616-Q620 PolarHBondContact O-N 2.89Å
617	Q	62.3	Low	60	Low	134 Å²	134	113.2 Å²	113.2	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-59.3	-46	172.6	-73.4	-170.4	-54.6	0	0	111.6	E613 L619 Q620 E621	E613-Q617 PolarHBondContact O-N 3.46Å; Q617-L619 VanDerWaalsContact C-N 3.3Å; Q617-L619 PolarHBondContact O-N 2.94Å; Q617-Q620 PolarHBondContact O-N 2.88Å; Q617-E621 PolarHBondContact O-N 2.98Å; Q617-E621 VanDerWaalsContact O-N 3.13Å
618	T	60.6	Low	58.9	Low	90 Å²	90	116.1 Å²	116.1	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-60.8	-38.7	177.2	-51.7	0	0	0	0	112	Q614 Q615 E616 M622	Q614-T618 WeakPolarHBondContact O-CB 3.34Å; Q614-T618 PolarHBondContact O-N 3.38Å; Q614-T618 VanDerWaalsContact O-N 3.12Å; Q614-T618 PolarHBondContact O-OG1 3.42Å; Q615-T618 PolarHBondContact O-N 3.11Å; E616-T618 PolarHBondContact O-N 2.89Å; T618-M622 VanDerWaalsContact O-CB 3.25Å; T618-M622 WeakPolarHBondContact O-CB 3.48Å; T618-M622 PolarHBondContact O-N 3.16Å; T618-M622 VanDerWaalsContact O-N 3.15Å
619	L	56.2	Low	57.7	Low	109 Å²	109	117.7 Å²	117.7	57%	0.571	60%	0.601	S	S	*	*	H	α-helix	trans	-68	-37.8	176.3	-78.7	164.3	0	0	0	112.6	Q615 E616 Q617 M622 G623	Q615-L619 WeakPolarHBondContact O-CB 3.49Å; Q615-L619 VanDerWaalsContact O-CG 3.29Å; Q615-L619 WeakPolarHBondContact O-CG 3.24Å; Q615-L619 PolarHBondContact O-N 3.42Å; E616-L619 PolarHBondContact O-N 2.87Å; Q617-L619 VanDerWaalsContact C-N 3.3Å; Q617-L619 PolarHBondContact O-N 2.94Å; L619-M622 HydrophobicContact CD2-CE 3.95Å; L619-G623 PolarHBondContact O-N 3.44Å
620	Q	55.4	Low	56.3	Low	157 Å²	157	120.8 Å²	120.8	73%	0.734	61%	0.613	S	S	*	*	H	α-helix	trans	-72.5	-39.1	-177.4	-163.9	168	12.9	0	0	112.3	E616 Q617 G623 L624	E616-Q620 PolarHBondContact O-N 2.89Å; Q617-Q620 PolarHBondContact O-N 2.88Å; Q620-G623 PolarHBondContact O-N 2.91Å; Q620-L624 PolarHBondContact O-N 3.39Å
621	E	56.6	Low	54.6	Low	149 Å²	149	123.6 Å²	123.6	70%	0.696	63%	0.63	S	S	*	*	H	α-helix	trans	-68	-42.1	173.3	-66.8	-174.7	162.5	0	0	111.8	Q617 G623 L624 H625	Q617-E621 PolarHBondContact O-N 2.98Å; Q617-E621 VanDerWaalsContact O-N 3.13Å; E621-G623 VanDerWaalsContact C-N 3.29Å; E621-G623 PolarHBondContact O-N 3.39Å; E621-L624 PolarHBondContact O-N 2.82Å; E621-H625 PolarHBondContact O-N 2.58Å
622	M	54.3	Low	53.2	Low	105 Å²	105	125.9 Å²	125.9	52%	0.517	64%	0.644	S	S	.	*	H	α-helix	trans	-64.2	-32.6	175.9	-173.9	167.4	58.2	0	0	112.4	T618 L619 L624 H625 L626	T618-M622 VanDerWaalsContact O-CB 3.25Å; T618-M622 WeakPolarHBondContact O-CB 3.48Å; T618-M622 PolarHBondContact O-N 3.16Å; T618-M622 VanDerWaalsContact O-N 3.15Å; L619-M622 HydrophobicContact CD2-CE 3.95Å; M622-L624 VanDerWaalsContact C-N 3.33Å; M622-L624 PolarHBondContact O-N 3.36Å; M622-H625 PolarHBondContact O-N 2.91Å; M622-L626 PolarHBondContact O-N 3.35Å; M622-L626 VanDerWaalsContact O-N 3.09Å
623	G	51.9	Low	51.8	Low	57 Å²	57	129.3 Å²	129.3	59%	0.588	66%	0.656	S	S	*	*	H	α-helix	trans	-64.4	-32.9	174.7	0	0	0	0	0	113.9	L619 Q620 E621	L619-G623 PolarHBondContact O-N 3.44Å; Q620-G623 PolarHBondContact O-N 2.91Å; E621-G623 VanDerWaalsContact C-N 3.29Å; E621-G623 PolarHBondContact O-N 3.39Å
624	L	51.9	Low	50.3	Low	151 Å²	151	133.2 Å²	133.2	79%	0.791	67%	0.674	S	S	*	*	H	α-helix	trans	-77.1	-36.6	176.2	-139.7	78.1	0	0	0	112	Q620 E621 M622 L626	Q620-L624 PolarHBondContact O-N 3.39Å; E621-L624 PolarHBondContact O-N 2.82Å; M622-L624 VanDerWaalsContact C-N 3.33Å; M622-L624 PolarHBondContact O-N 3.36Å; L624-L626 VanDerWaalsContact C-N 3.29Å; L624-L626 PolarHBondContact O-N 3.28Å
625	H	50.3	Low	48.5	Very low	171 Å²	171	133.2 Å²	133.2	79%	0.792	68%	0.678	S	S	*	*	H	α-helix	trans	-78.2	-7.5	177.5	-105.9	-81.7	0	0	0	114.3	E621 M622 S627	E621-H625 PolarHBondContact O-N 2.58Å; M622-H625 PolarHBondContact O-N 2.91Å; H625-S627 PolarHBondContact O-N 3.29Å
626	L	44.9	Very low	47.1	Very low	129 Å²	129	135.5 Å²	135.5	68%	0.675	69%	0.686	S	S	*	*	S	Bend	trans	-77.5	50.3	178.4	-138.6	82.6	0	0	0	114.5	M622 L624	M622-L626 PolarHBondContact O-N 3.35Å; M622-L626 VanDerWaalsContact O-N 3.09Å; L624-L626 VanDerWaalsContact C-N 3.29Å; L624-L626 PolarHBondContact O-N 3.28Å
627	S	51.7	Low	45.7	Very low	55 Å²	55	136.6 Å²	136.6	39%	0.385	69%	0.689	S	S	.	*			trans	56.9	96.1	137.8	64.4	0	0	0	0	115.7	H625 S629	H625-S627 PolarHBondContact O-N 3.29Å; S627-S629 VanDerWaalsContact CA-N 3.27Å; S627-S629 PolarHBondContact O-N 3.36Å; S627-S629 VanDerWaalsContact O-N 3.13Å
628	Q	49.3	Very low	44.3	Very low	195 Å²	195	137.6 Å²	137.6	91%	0.911	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	cis	39.7	2.9	46.1	-63.3	-167.9	-2.3	0	0	115.6
629	S	41.4	Very low	42.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.8	23	-178.9	-78.1	0	0	0	0	114.5	S627	S627-S629 VanDerWaalsContact CA-N 3.27Å; S627-S629 PolarHBondContact O-N 3.36Å; S627-S629 VanDerWaalsContact O-N 3.13Å
630	K	35.1	Very low	41.5	Very low	157 Å²	157	140.5 Å²	140.5	68%	0.683	71%	0.71	S	S	*	*			trans	-112.5	32.7	160.1	-148.5	173.9	-176.3	176.6	0	113.8	K632	K630-K632 PolarHBondContact O-N 2.93Å
631	L	36.6	Very low	40.2	Very low	163 Å²	163	142.3 Å²	142.3	85%	0.853	72%	0.716	S	S	*	*			trans	-83.6	29.6	172.2	-136.6	171.8	0	0	0	111.9
632	K	40.9	Very low	38.9	Very low	189 Å²	189	139.1 Å²	139.1	82%	0.822	72%	0.715	S	S	*	*			trans	-151.4	47	-172	-68.1	-167.1	175.8	-177.3	0	112.5	K630	K630-K632 PolarHBondContact O-N 2.93Å
633	M	37.4	Very low	37.9	Very low	137 Å²	137	140.7 Å²	140.7	68%	0.675	73%	0.725	S	S	*	*			trans	-163.8	112.4	160.4	-106.8	176.4	80.2	0	0	109.1
634	E	35.4	Very low	37	Very low	180 Å²	180	147.1 Å²	147.1	84%	0.841	74%	0.737	S	S	*	*			cis	50	71.2	2.1	-65.5	-170	154.9	0	0	113.4
635	D	27.7	Very low	36.4	Very low	124 Å²	124	143.2 Å²	143.2	66%	0.663	73%	0.733	S	S	*	*				-162.8	155.7	60.4	-130.9	-28.2	0	0	0	113.5
636	F	28.3	Very low	36.6	Very low	154 Å²	154	144.5 Å²	144.5	68%	0.675	74%	0.739	S	S	*	*			trans	58	116.5	173.7	-75.1	-113.7	0	0	0	116.1
637	K	31.6	Very low	36.9	Very low	156 Å²	156	142.7 Å²	142.7	68%	0.678	74%	0.742	S	S	*	*				65.8	141	82.3	-70.6	-179.8	177	-175.1	0	113.5
638	E	32.8	Very low	37.7	Very low	155 Å²	155	145.6 Å²	145.6	72%	0.724	75%	0.745	S	S	*	*			cis	-154.1	171.2	21	-150.4	146.9	-135.1	0	0	114.6
639	V	30.5	Very low	38.3	Very low	114 Å²	114	139.9 Å²	139.9	69%	0.691	72%	0.719	S	S	*	*			trans	83.5	132.4	164.7	-175.6	0	0	0	0	118.7
640	N	27.7	Very low	39.1	Very low	145 Å²	145	141.1 Å²	141.1	78%	0.775	71%	0.711	S	S	*	*			trans	50.3	103.3	167.2	-61.9	-12.4	0	0	0	118.5
641	K	28.7	Very low	39.7	Very low	195 Å²	195	137 Å²	137	85%	0.848	70%	0.696	S	S	*	*			cis	66.3	116.2	10.3	-168.3	179	-179	178.2	0	117.1
642	A	29.3	Very low	40.8	Very low	83 Å²	83	135.2 Å²	135.2	69%	0.686	69%	0.688	S	S	*	*			trans	67	156	172.4	0	0	0	0	0	115
643	L	32.1	Very low	41.3	Very low	138 Å²	138	132.3 Å²	132.3	72%	0.723	68%	0.677	S	S	*	*			cis	-128.7	143.3	20	-87.7	81.5	0	0	0	112.3
644	K	32.4	Very low	42.3	Very low	192 Å²	192	126.1 Å²	126.1	84%	0.835	65%	0.648	S	S	*	*				54.7	140.2	98.6	-47.4	-178.1	-168.1	173.2	0	115.9
645	G	39.2	Very low	43.6	Very low	68 Å²	68	118.7 Å²	118.7	70%	0.701	61%	0.614	S	S	*	*			cis	160.2	-179.4	-0.7	0	0	0	0	0	112.2
646	H	55.8	Low	43.7	Very low	199 Å²	199	114.5 Å²	114.5	92%	0.921	59%	0.591	S	S	*	*			trans	-117.5	156.8	166.3	-73.5	65.8	0	0	0	109.2
647	A	51.9	Low	45.4	Very low	90 Å²	90	107.2 Å²	107.2	74%	0.744	56%	0.559	S	S	*	*			trans	-137.1	-177.9	-161.2	0	0	0	0	0	115.2
648	W	68.2	Low	46.3	Very low	117 Å²	117	102.6 Å²	102.6	44%	0.443	54%	0.539	S	S	.	.			trans	-130	138.8	-148.1	-176	-78.6	0	0	0	113.8	H672 C673 R674 Y694	W648-H672 HydrophobicContact CH2-CB 4.39Å; W648-H672 HydrophobicContact CZ2-CB 3.89Å; W648-H672 AromaticContact CZ2-CD2 3.8Å; W648-H672 AromaticContact CZ2-CG 3.63Å; W648-H672 AromaticContact NE1-CE1 3.89Å; W648-C673 VanDerWaalsContact CH2-O 3.22Å; W648-C673 WeakPolarHBondContact CH2-O 3.28Å; W648-R674 HydrophobicContact CH2-CB 4.18Å; W648-R674 HydrophobicContact CH2-CG 3.48Å; W648-R674 VanDerWaalsContact CH2-CG 3.48Å; W648-R674 HydrophobicContact CZ3-CB 4.18Å; W648-R674 HydrophobicContact CZ3-CG 3.8Å; W648-Y694 HydrophobicContact CZ3-CE2 4.49Å; W648-Y694 WeakPolarHBondContact CZ3-OH 3.35Å
649	M	61.2	Low	47.4	Very low	75 Å²	75	100.7 Å²	100.7	37%	0.369	53%	0.53	S	S	.	.			trans	-95.2	-175.1	-178.6	-158.3	-179.1	-74.9	0	0	112.7	H672 G677 D678 I679	M649-H672 WeakPolarHBondContact CB-NE2 3.34Å; M649-H672 PolarHBondContact O-CE1 3.04Å; M649-H672 PolarHBondContact O-NE2 3.39Å; M649-G677 WeakPolarHBondContact CA-O 3.27Å; M649-G677 WeakPolarHBondContact CB-O 3.43Å; M649-G677 PolarHBondContact N-O 3.07Å; M649-D678 HydrophobicContact CE-CB 3.77Å; M649-D678 HydrophobicContact SD-CB 3.93Å; M649-I679 HydrophobicContact SD-CD1 4.46Å; M649-I679 HydrophobicContact SD-CG1 4.26Å
650	K	59.1	Low	48.7	Very low	133 Å²	133	96.3 Å²	96.3	58%	0.578	50%	0.504	S	S	*	.			trans	-120.8	136	-173.7	-68.3	-177.3	178.9	178.9	0	114.8	D652 E653 H672 I679	K650-D652 PolarHBondContact O-N 3.4Å; K650-E653 PolarHBondContact O-N 3.05Å; K650-H672 PolarHBondContact N-CE1 2.8Å; K650-I679 WeakPolarHBondContact O-CD1 3.31Å
651	D	47.8	Very low	49	Very low	69 Å²	69	94.6 Å²	94.6	37%	0.369	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.9	-16.3	171.3	73.9	171.4	0	0	0	115.2	K670 H672 I679	D651-K670 HydrophobicContact CB-CD 3.82Å; D651-K670 HydrophobicContact CB-CG 4.4Å; D651-K670 WeakPolarHBondContact O-CD 3.48Å; D651-K670 WeakPolarHBondContact O-CE 3.21Å; D651-K670 PolarHBondContact O-NZ 2.84Å; D651-H672 PolarHBondContact N-CE1 2.8Å; D651-H672 IonicContact OD1-CG 3.87Å; D651-H672 PolarHBondContact OD1-N 3.24Å; D651-H672 IonicContact OD1-ND1 3.93Å; D651-H672 PolarHBondContact OD1-ND1 2.88Å; D651-H672 IonicContact OD2-CE1 2.64Å; D651-H672 IonicContact OD2-CG 2.83Å; D651-H672 IonicContact OD2-ND1 3.57Å; D651-H672 PolarHBondContact OD2-ND1 3.36Å; D651-I679 HydrophobicContact CB-CB 4.45Å; D651-I679 HydrophobicContact CB-CD1 4.17Å; D651-I679 HydrophobicContact CB-CG1 4.09Å; D651-I679 HydrophobicContact CB-CG2 3.5Å; D651-I679 VanDerWaalsContact CB-CG2 3.5Å; D651-I679 WeakPolarHBondContact OD1-CG2 3.26Å
652	D	59.8	Low	49.8	Very low	127 Å²	127	90.2 Å²	90.2	68%	0.679	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-31.1	-174.5	-55.2	-57.5	0	0	0	114.4	K650 K670	K650-D652 PolarHBondContact O-N 3.4Å; D652-K670 PolarHBondContact O-NZ 3.41Å
653	E	50.3	Low	50.9	Low	127 Å²	127	90.6 Å²	90.6	59%	0.593	46%	0.46	S	S	*	.	S	Bend	trans	-99.8	-41	-151.6	-63.9	-173.7	-170.5	0	0	118.2	K650 Q661 I679	K650-E653 PolarHBondContact O-N 3.05Å; E653-Q661 PolarHBondContact O-NE2 3.44Å; E653-I679 HydrophobicContact CB-CD1 4.23Å
654	A	59	Low	51.9	Low	8 Å²	8	90.6 Å²	90.6	7%	0.066	45%	0.454	C	S	.	.			trans	-112.9	135.3	-171.8	0	0	0	0	0	112.8	C657 K658 K670 I679	A654-C657 VanDerWaalsContact C-SG 3.5Å; A654-C657 PolarHBondContact O-SG 2.87Å; A654-K658 HydrophobicContact CB-CB 3.31Å; A654-K670 VanDerWaalsContact O-CD 3.31Å; A654-K670 WeakPolarHBondContact O-CD 3.36Å; A654-K670 WeakPolarHBondContact O-CE 3.42Å; A654-K670 WeakPolarHBondContact O-CG 3.44Å; A654-K670 PolarHBondContact O-NZ 3.43Å; A654-I679 HydrophobicContact CB-CB 4.37Å; A654-I679 HydrophobicContact CB-CD1 3.8Å
655	T	61.5	Low	52.3	Low	23 Å²	23	84.6 Å²	84.6	14%	0.141	44%	0.437	C	S	.	.	S	Bend	trans	-150.6	20.9	-155.2	-31	0	0	0	0	117.8	K662 E663 R669 K670	T655-K662 VanDerWaalsContact C-N 3.26Å; T655-K662 CarbonylContact O-C 3.5Å; T655-K662 WeakPolarHBondContact O-CA 3.46Å; T655-K662 PolarHBondContact O-N 3.47Å; T655-E663 PolarHBondContact O-N 2.9Å; T655-R669 HydrophobicContact CG2-CB 3.92Å; T655-R669 HydrophobicContact CG2-CG 3.77Å; T655-R669 WeakPolarHBondContact O-CA 3.49Å; T655-K670 HydrophobicContact CG2-CB 4.2Å; T655-K670 VanDerWaalsContact CG2-CE 3.41Å; T655-K670 VanDerWaalsContact OG1-CE 3.22Å; T655-K670 WeakPolarHBondContact OG1-CE 3.48Å; T655-K670 PolarHBondContact OG1-NZ 2.97Å
656	Q	29.5	Very low	52.6	Low	37 Å²	37	87.8 Å²	87.8	17%	0.173	44%	0.436	C	S	.	.	S	Bend	trans	-117.1	-1.2	144.6	86.5	139.5	94.1	0	0	117.6	C660 Q661 K662 S667 R669 C681	Q656-C660 CarbonylContact C-O 3.57Å; Q656-C660 WeakPolarHBondContact CA-O 3.28Å; Q656-C660 VanDerWaalsContact CG-CA 3.46Å; Q656-C660 HydrophobicContact CG-CB 3.76Å; Q656-C660 PolarHBondContact N-O 3.11Å; Q656-C660 PolarHBondContact NE2-SG 2.92Å; Q656-C660 PolarHBondContact O-SG 3.12Å; Q656-Q661 WeakPolarHBondContact CG-O 3.35Å; Q656-Q661 VanDerWaalsContact N-CA 3.25Å; Q656-K662 HydrophobicContact CB-CB 3.86Å; Q656-K662 VanDerWaalsContact CB-N 3.27Å; Q656-K662 HydrophobicContact CG-CB 4.38Å; Q656-K662 VanDerWaalsContact N-N 3.16Å; Q656-S667 WeakPolarHBondContact CB-O 3.2Å; Q656-S667 VanDerWaalsContact CD-CA 3.5Å; Q656-S667 WeakPolarHBondContact CG-O 3.47Å; Q656-S667 PolarHBondContact OE1-O 2.72Å; Q656-R669 CarbonylContact C-O 3.57Å; Q656-C681 VanDerWaalsContact C-CB 3.48Å; Q656-C681 WeakPolarHBondContact O-CB 3.21Å; Q656-C681 PolarHBondContact O-SG 2.82Å
657	C	65.3	Low	52.5	Low	0 Å²	0	80.2 Å²	80.2	0%	0	41%	0.406	C	S	.	.			cis	-147.4	142.9	11	162.8	0	0	0	0	113.5	A654 C660 R669 K670 I679 Y680 C681	A654-C657 VanDerWaalsContact C-SG 3.5Å; A654-C657 PolarHBondContact O-SG 2.87Å; C657-C660 VanDerWaalsContact C-CB 3.45Å; C657-C660 CarbonylContact C-O 3.6Å; C657-C660 WeakPolarHBondContact CA-O 3.41Å; C657-C660 PolarHBondContact N-O 2.73Å; C657-C660 VanDerWaalsContact N-O 3.16Å; C657-C660 PolarHBondContact N-SG 2.91Å; C657-C660 VanDerWaalsContact O-CB 3.27Å; C657-C660 WeakPolarHBondContact O-CB 3.44Å; C657-R669 WeakPolarHBondContact CB-O 3.32Å; C657-R669 PolarHBondContact N-O 3.38Å; C657-R669 VanDerWaalsContact N-O 3.15Å; C657-K670 VanDerWaalsContact CB-CA 3.4Å; C657-K670 HydrophobicContact CB-CB 3.87Å; C657-K670 HydrophobicContact CB-CG 4.33Å; C657-K670 VanDerWaalsContact SG-CG 3.58Å; C657-I679 CarbonylContact C-O 3.53Å; C657-I679 VanDerWaalsContact SG-CB 3.59Å; C657-I679 VanDerWaalsContact SG-CG2 3.52Å; C657-I679 PolarHBondContact SG-O 2.7Å; C657-Y680 CarbonylContact O-C 3.43Å; C657-Y680 VanDerWaalsContact O-CA 3.27Å; C657-Y680 WeakPolarHBondContact O-CA 3.36Å; C657-Y680 WeakPolarHBondContact SG-CA 3.24Å; C657-Y680 PolarHBondContact SG-N 2.75Å; C657-C681 HydrophobicContact CB-CB 4.31Å; C657-C681 PolarHBondContact N-SG 3.02Å; C657-C681 PolarHBondContact O-N 3.43Å; C657-C681 PolarHBondContact O-SG 3.4Å
658	K	50.9	Low	52.6	Low	59 Å²	59	79.8 Å²	79.8	26%	0.257	39%	0.385	S	S	.	.	S	Bend	trans	100.7	-140.3	-167.5	140.1	56.4	-179.7	158.2	0	110.8	A654 C660 D678 I679 Y680	A654-K658 HydrophobicContact CB-CB 3.31Å; K658-C660 PolarHBondContact N-O 3.3Å; K658-C660 VanDerWaalsContact N-O 3.12Å; K658-C660 CarbonylContact O-C 3.52Å; K658-C660 PolarHBondContact O-N 3.48Å; K658-D678 HydrophobicContact CD-CB 4.23Å; K658-D678 VanDerWaalsContact CE-CB 3.48Å; K658-D678 WeakPolarHBondContact CE-OD1 3.41Å; K658-D678 HydrophobicContact CG-CB 3.64Å; K658-D678 IonicContact NZ-OD1 2.78Å; K658-I679 WeakPolarHBondContact CA-O 3.35Å; K658-I679 WeakPolarHBondContact CB-O 3.5Å; K658-I679 WeakPolarHBondContact CG-O 3.19Å; K658-I679 PolarHBondContact N-O 3.4Å; K658-I679 VanDerWaalsContact N-O 3.1Å; K658-Y680 HydrophobicContact CD-CE1 4.32Å; K658-Y680 WeakPolarHBondContact CE-OH 3.25Å; K658-Y680 HydrophobicContact CG-CE2 4.49Å; K658-Y680 PolarHBondContact NZ-OH 2.66Å; K658-Y680 VanDerWaalsContact NZ-OH 3.07Å
659	Q	55.5	Low	52.4	Low	116 Å²	116	79.1 Å²	79.1	54%	0.542	38%	0.382	S	S	.	.	S	Bend		58.8	-26.1	80.3	-145.7	77.6	12.5	0	0	113.9	Y680 C684	Q659-Y680 HydrophobicContact CB-CD1 4.41Å; Q659-Y680 HydrophobicContact CB-CE1 4.48Å; Q659-C684 HydrophobicContact CB-CB 4.31Å; Q659-C684 HydrophobicContact CG-CB 3.79Å; Q659-C684 VanDerWaalsContact CG-SG 3.59Å
660	C	57.5	Low	52.4	Low	21 Å²	21	77.7 Å²	77.7	14%	0.142	37%	0.374	C	S	.	.			trans	172.4	105	-134.4	-153.6	0	0	0	0	104.4	Q656 C657 K658 C681	Q656-C660 CarbonylContact C-O 3.57Å; Q656-C660 WeakPolarHBondContact CA-O 3.28Å; Q656-C660 VanDerWaalsContact CG-CA 3.46Å; Q656-C660 HydrophobicContact CG-CB 3.76Å; Q656-C660 PolarHBondContact N-O 3.11Å; Q656-C660 PolarHBondContact NE2-SG 2.92Å; Q656-C660 PolarHBondContact O-SG 3.12Å; C657-C660 VanDerWaalsContact C-CB 3.45Å; C657-C660 CarbonylContact C-O 3.6Å; C657-C660 WeakPolarHBondContact CA-O 3.41Å; C657-C660 PolarHBondContact N-O 2.73Å; C657-C660 VanDerWaalsContact N-O 3.16Å; C657-C660 PolarHBondContact N-SG 2.91Å; C657-C660 VanDerWaalsContact O-CB 3.27Å; C657-C660 WeakPolarHBondContact O-CB 3.44Å; K658-C660 PolarHBondContact N-O 3.3Å; K658-C660 VanDerWaalsContact N-O 3.12Å; K658-C660 CarbonylContact O-C 3.52Å; K658-C660 PolarHBondContact O-N 3.48Å; C660-C681 WeakPolarHBondContact CB-SG 3.2Å; C660-C681 WeakPolarHBondContact SG-CB 3.48Å; C660-C681 CovalentContact SG-SG 2.11Å; C660-C681 PolarHBondContact SG-SG 3.48Å
661	Q	35.1	Very low	53.3	Low	109 Å²	109	74.8 Å²	74.8	51%	0.509	36%	0.362	S	S	.	.			trans	-119.1	132.2	171.6	-81.5	-75.1	27.4	0	0	116.2	E653 Q656	E653-Q661 PolarHBondContact O-NE2 3.44Å; Q656-Q661 WeakPolarHBondContact CG-O 3.35Å; Q656-Q661 VanDerWaalsContact N-CA 3.25Å
662	K	44.3	Very low	54.5	Low	104 Å²	104	71.5 Å²	71.5	45%	0.452	35%	0.345	S	S	.	.	S	Bend	trans	157.6	-117.7	179.4	-174.5	-177.2	-48.4	75.1	0	119	T655 Q656 R668 R669	T655-K662 VanDerWaalsContact C-N 3.26Å; T655-K662 CarbonylContact O-C 3.5Å; T655-K662 WeakPolarHBondContact O-CA 3.46Å; T655-K662 PolarHBondContact O-N 3.47Å; Q656-K662 HydrophobicContact CB-CB 3.86Å; Q656-K662 VanDerWaalsContact CB-N 3.27Å; Q656-K662 HydrophobicContact CG-CB 4.38Å; Q656-K662 VanDerWaalsContact N-N 3.16Å; K662-R668 HydrophobicContact CD-CG 4.06Å; K662-R668 HydrophobicContact CG-CG 3.94Å; K662-R669 PolarHBondContact O-NE 3.02Å; K662-R669 VanDerWaalsContact O-NE 3.08Å; K662-R669 PolarHBondContact O-NH2 3.03Å
663	E	52.9	Low	55.5	Low	91 Å²	91	65.4 Å²	65.4	43%	0.425	31%	0.312	S	S	.	.	S	Bend	trans	-162	53.1	-141.1	-163.3	-124.5	146.9	0	0	122.9	T655 R668	T655-E663 PolarHBondContact O-N 2.9Å; E663-R668 HydrophobicContact CB-CG 3.97Å; E663-R668 WeakPolarHBondContact O-CD 3.23Å; E663-R668 WeakPolarHBondContact O-CG 3.35Å; E663-R668 PolarHBondContact O-NE 2.9Å; E663-R668 PolarHBondContact O-NH1 2.92Å; E663-R668 IonicContact OE1-CZ 3.81Å; E663-R668 IonicContact OE1-NH2 3.2Å; E663-R668 PolarHBondContact OE1-NH2 2.93Å; E663-R668 IonicContact OE2-CZ 2.75Å; E663-R668 VanDerWaalsContact OE2-CZ 3.23Å; E663-R668 IonicContact OE2-NE 3.59Å; E663-R668 PolarHBondContact OE2-NE 2.95Å; E663-R668 VanDerWaalsContact OE2-NE 3.08Å; E663-R668 IonicContact OE2-NH2 3.17Å; E663-R668 PolarHBondContact OE2-NH2 3.34Å
664	F	52.5	Low	56.7	Low	137 Å²	137	62.5 Å²	62.5	60%	0.601	30%	0.296	S	S	*	.	S	Bend	trans	55.8	97.9	179.6	-101.8	-52.5	0	0	0	123.4	R668 R669	F664-R668 VanDerWaalsContact CA-C 3.45Å; F664-R668 VanDerWaalsContact N-C 3.33Å; F664-R668 WeakPolarHBondContact O-CD 3.35Å; F664-R668 PolarHBondContact O-NH1 3.28Å; F664-R669 HydrophobicContact CB-CG 3.92Å; F664-R669 HydrophobicContact CD1-CB 4.29Å; F664-R669 HydrophobicContact CD2-CB 3.81Å; F664-R669 HydrophobicContact CD2-CG 3.56Å; F664-R669 HydrophobicContact CE1-CB 4.4Å; F664-R669 HydrophobicContact CE2-CB 3.93Å; F664-R669 HydrophobicContact CE2-CG 4.15Å; F664-R669 HydrophobicContact CG-CB 3.97Å; F664-R669 HydrophobicContact CG-CG 3.77Å; F664-R669 HydrophobicContact CZ-CB 4.22Å
665	S	41.6	Very low	57.4	Low	66 Å²	66	65.4 Å²	65.4	46%	0.462	31%	0.31	S	S	.	.	S	Bend	trans	139.3	-110.6	-175.3	75.8	0	0	0	0	115.1	R668	S665-R668 CarbonylContact C-O 3.51Å; S665-R668 WeakPolarHBondContact CA-O 3.25Å; S665-R668 PolarHBondContact N-O 2.91Å; S665-R668 WeakPolarHBondContact OG-CD 3.42Å
666	I	44.2	Very low	57.9	Low	136 Å²	136	66.5 Å²	66.5	70%	0.697	32%	0.318	S	S	*	.	S	Bend	trans	-90.5	-49.3	-150.5	-101.9	61	0	0	0	119.2
667	S	54.3	Low	60.3	Low	40 Å²	40	64.9 Å²	64.9	28%	0.28	31%	0.312	S	S	.	.	S	Bend	cis	84.7	-20	9.9	77.4	0	0	0	0	119.7	Q656	Q656-S667 WeakPolarHBondContact CB-O 3.2Å; Q656-S667 VanDerWaalsContact CD-CA 3.5Å; Q656-S667 WeakPolarHBondContact CG-O 3.47Å; Q656-S667 PolarHBondContact OE1-O 2.72Å
668	R	53.4	Low	60.1	Low	80 Å²	80	66.5 Å²	66.5	30%	0.302	32%	0.32	S	S	.	.			trans	-179.3	137.9	-150.2	-91	-176.4	140.3	-147.8	7	111.8	K662 E663 F664 S665	K662-R668 HydrophobicContact CD-CG 4.06Å; K662-R668 HydrophobicContact CG-CG 3.94Å; E663-R668 HydrophobicContact CB-CG 3.97Å; E663-R668 WeakPolarHBondContact O-CD 3.23Å; E663-R668 WeakPolarHBondContact O-CG 3.35Å; E663-R668 PolarHBondContact O-NE 2.9Å; E663-R668 PolarHBondContact O-NH1 2.92Å; E663-R668 IonicContact OE1-CZ 3.81Å; E663-R668 IonicContact OE1-NH2 3.2Å; E663-R668 PolarHBondContact OE1-NH2 2.93Å; E663-R668 IonicContact OE2-CZ 2.75Å; E663-R668 VanDerWaalsContact OE2-CZ 3.23Å; E663-R668 IonicContact OE2-NE 3.59Å; E663-R668 PolarHBondContact OE2-NE 2.95Å; E663-R668 VanDerWaalsContact OE2-NE 3.08Å; E663-R668 IonicContact OE2-NH2 3.17Å; E663-R668 PolarHBondContact OE2-NH2 3.34Å; F664-R668 VanDerWaalsContact CA-C 3.45Å; F664-R668 VanDerWaalsContact N-C 3.33Å; F664-R668 WeakPolarHBondContact O-CD 3.35Å; F664-R668 PolarHBondContact O-NH1 3.28Å; S665-R668 CarbonylContact C-O 3.51Å; S665-R668 WeakPolarHBondContact CA-O 3.25Å; S665-R668 PolarHBondContact N-O 2.91Å; S665-R668 WeakPolarHBondContact OG-CD 3.42Å
669	R	64.8	Low	61.5	Low	104 Å²	104	63.7 Å²	63.7	39%	0.392	31%	0.308	S	S	.	.			cis	-107.9	-122.1	-30.8	-64.8	-148.3	134.5	133.8	3.9	113.3	T655 Q656 C657 K662 F664 C681	T655-R669 HydrophobicContact CG2-CB 3.92Å; T655-R669 HydrophobicContact CG2-CG 3.77Å; T655-R669 WeakPolarHBondContact O-CA 3.49Å; Q656-R669 CarbonylContact C-O 3.57Å; C657-R669 WeakPolarHBondContact CB-O 3.32Å; C657-R669 PolarHBondContact N-O 3.38Å; C657-R669 VanDerWaalsContact N-O 3.15Å; K662-R669 PolarHBondContact O-NE 3.02Å; K662-R669 VanDerWaalsContact O-NE 3.08Å; K662-R669 PolarHBondContact O-NH2 3.03Å; F664-R669 HydrophobicContact CB-CG 3.92Å; F664-R669 HydrophobicContact CD1-CB 4.29Å; F664-R669 HydrophobicContact CD2-CB 3.81Å; F664-R669 HydrophobicContact CD2-CG 3.56Å; F664-R669 HydrophobicContact CE1-CB 4.4Å; F664-R669 HydrophobicContact CE2-CB 3.93Å; F664-R669 HydrophobicContact CE2-CG 4.15Å; F664-R669 HydrophobicContact CG-CB 3.97Å; F664-R669 HydrophobicContact CG-CG 3.77Å; F664-R669 HydrophobicContact CZ-CB 4.22Å; R669-C681 WeakPolarHBondContact O-CA 3.3Å
670	K	60.8	Low	62.4	Low	44 Å²	44	58.3 Å²	58.3	19%	0.191	28%	0.283	C	S	.	.			trans	-144.3	135.9	-134.4	177.7	-170.4	-41.9	-143.5	0	120.8	D651 D652 A654 T655 C657 I679 Y680	D651-K670 HydrophobicContact CB-CD 3.82Å; D651-K670 HydrophobicContact CB-CG 4.4Å; D651-K670 WeakPolarHBondContact O-CD 3.48Å; D651-K670 WeakPolarHBondContact O-CE 3.21Å; D651-K670 PolarHBondContact O-NZ 2.84Å; D652-K670 PolarHBondContact O-NZ 3.41Å; A654-K670 VanDerWaalsContact O-CD 3.31Å; A654-K670 WeakPolarHBondContact O-CD 3.36Å; A654-K670 WeakPolarHBondContact O-CE 3.42Å; A654-K670 WeakPolarHBondContact O-CG 3.44Å; A654-K670 PolarHBondContact O-NZ 3.43Å; T655-K670 HydrophobicContact CG2-CB 4.2Å; T655-K670 VanDerWaalsContact CG2-CE 3.41Å; T655-K670 VanDerWaalsContact OG1-CE 3.22Å; T655-K670 WeakPolarHBondContact OG1-CE 3.48Å; T655-K670 PolarHBondContact OG1-NZ 2.97Å; C657-K670 VanDerWaalsContact CB-CA 3.4Å; C657-K670 HydrophobicContact CB-CB 3.87Å; C657-K670 HydrophobicContact CB-CG 4.33Å; C657-K670 VanDerWaalsContact SG-CG 3.58Å; K670-I679 HydrophobicContact CD-CG2 4.01Å; K670-I679 HydrophobicContact CG-CG2 3.46Å; K670-I679 VanDerWaalsContact CG-CG2 3.46Å; K670-Y680 CarbonylContact C-O 3.57Å
671	H	78.3	Confident	62.3	Low	72 Å²	72	57.3 Å²	57.3	33%	0.333	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	145.5	157.9	-45.6	-87.7	0	0	0	116.8	Y680 R699	H671-Y680 PolarHBondContact N-O 3.27Å; H671-Y680 WeakPolarHBondContact O-CA 3.24Å; H671-Y680 PolarHBondContact O-N 3.43Å; H671-R699 VanDerWaalsContact CB-CZ 3.4Å; H671-R699 VanDerWaalsContact CB-NE 3.3Å; H671-R699 VanDerWaalsContact CD2-CZ 3.47Å; H671-R699 PolarHBondContact CD2-NH1 3.44Å; H671-R699 VanDerWaalsContact CD2-NH1 3.32Å; H671-R699 VanDerWaalsContact CG-CZ 3.43Å
672	H	72.6	Confident	63.7	Low	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	154.6	-177.7	-106.1	114.6	0	0	0	123.6	W648 M649 K650 D651 R674 G677 D678 R699	W648-H672 HydrophobicContact CH2-CB 4.39Å; W648-H672 HydrophobicContact CZ2-CB 3.89Å; W648-H672 AromaticContact CZ2-CD2 3.8Å; W648-H672 AromaticContact CZ2-CG 3.63Å; W648-H672 AromaticContact NE1-CE1 3.89Å; M649-H672 WeakPolarHBondContact CB-NE2 3.34Å; M649-H672 PolarHBondContact O-CE1 3.04Å; M649-H672 PolarHBondContact O-NE2 3.39Å; K650-H672 PolarHBondContact N-CE1 2.8Å; D651-H672 PolarHBondContact N-CE1 2.8Å; D651-H672 IonicContact OD1-CG 3.87Å; D651-H672 PolarHBondContact OD1-N 3.24Å; D651-H672 IonicContact OD1-ND1 3.93Å; D651-H672 PolarHBondContact OD1-ND1 2.88Å; D651-H672 IonicContact OD2-CE1 2.64Å; D651-H672 IonicContact OD2-CG 2.83Å; D651-H672 IonicContact OD2-ND1 3.57Å; D651-H672 PolarHBondContact OD2-ND1 3.36Å; H672-R674 PolarHBondContact O-NH1 3.19Å; H672-G677 PolarHBondContact CD2-O 3.22Å; H672-G677 PolarHBondContact NE2-O 2.8Å; H672-D678 CarbonylContact C-O 3.5Å; H672-D678 PolarHBondContact CD2-O 2.82Å; H672-R699 WeakPolarHBondContact O-CB 3.4Å; H672-R699 WeakPolarHBondContact O-CD 2.89Å; H672-R699 WeakPolarHBondContact O-CG 3.11Å
673	C	80.6	Confident	64.4	Low	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.			trans	-91.3	132	165.1	172.5	0	0	0	0	113.1	W648 C676 G677 D678 Y680 R699 C701	W648-C673 VanDerWaalsContact CH2-O 3.22Å; W648-C673 WeakPolarHBondContact CH2-O 3.28Å; C673-C676 WeakPolarHBondContact CB-SG 3.4Å; C673-C676 WeakPolarHBondContact SG-CB 3.4Å; C673-C676 PolarHBondContact SG-N 2.89Å; C673-C676 CovalentContact SG-SG 2.06Å; C673-C676 PolarHBondContact SG-SG 3.48Å; C673-G677 VanDerWaalsContact O-CA 3.24Å; C673-G677 WeakPolarHBondContact O-CA 3.36Å; C673-G677 PolarHBondContact O-N 3.04Å; C673-D678 WeakPolarHBondContact CB-O 3.16Å; C673-D678 PolarHBondContact N-O 3.18Å; C673-Y680 HydrophobicContact CB-CD2 3.93Å; C673-Y680 HydrophobicContact CB-CE2 3.67Å; C673-R699 CarbonylContact C-O 3.58Å; C673-R699 WeakPolarHBondContact CA-O 3.25Å; C673-C701 HydrophobicContact CB-CB 3.93Å
674	R	76.1	Confident	64.5	Low	66 Å²	66	54 Å²	54	25%	0.249	28%	0.276	C	S	.	.	S	Bend	trans	-94.8	-11.2	-175	-90.2	77.1	-167.8	166.1	5.8	117.1	W648 H672 L691 Y694 V698 R699 V700	W648-R674 HydrophobicContact CH2-CB 4.18Å; W648-R674 HydrophobicContact CH2-CG 3.48Å; W648-R674 VanDerWaalsContact CH2-CG 3.48Å; W648-R674 HydrophobicContact CZ3-CB 4.18Å; W648-R674 HydrophobicContact CZ3-CG 3.8Å; H672-R674 PolarHBondContact O-NH1 3.19Å; R674-L691 HydrophobicContact CB-CD1 3.79Å; R674-L691 WeakPolarHBondContact O-CD1 3.39Å; R674-Y694 HydrophobicContact CB-CD2 4.29Å; R674-Y694 HydrophobicContact CB-CE2 3.97Å; R674-Y694 HydrophobicContact CG-CD2 4.46Å; R674-Y694 HydrophobicContact CG-CE1 4.34Å; R674-Y694 HydrophobicContact CG-CE2 4Å; R674-Y694 WeakPolarHBondContact O-CE2 3.35Å; R674-V698 HydrophobicContact CB-CB 3.83Å; R674-V698 HydrophobicContact CB-CG2 3.58Å; R674-V698 HydrophobicContact CG-CB 3.71Å; R674-V698 HydrophobicContact CG-CG1 4.44Å; R674-V698 HydrophobicContact CG-CG2 3.95Å; R674-R699 WeakPolarHBondContact CD-O 3.41Å; R674-R699 PolarHBondContact N-O 3.22Å; R674-V700 HydrophobicContact CB-CG1 4.3Å
675	N	73	Confident	65	Low	68 Å²	68	47.5 Å²	47.5	36%	0.364	25%	0.247	S	C	.	.	S	Bend	trans	-101.6	-51	178.8	-173.2	47	0	0	0	111.1	L691 V700 C704 L708	N675-L691 HydrophobicContact CB-CD1 3.79Å; N675-L691 HydrophobicContact CB-CD2 3.88Å; N675-L691 HydrophobicContact CB-CG 4.4Å; N675-L691 WeakPolarHBondContact OD1-CD2 3.5Å; N675-V700 HydrophobicContact CB-CG1 3.56Å; N675-C704 HydrophobicContact CB-CB 3.82Å; N675-C704 PolarHBondContact ND2-SG 3.24Å; N675-L708 HydrophobicContact CB-CD1 4.22Å
676	C	72.9	Confident	67.2	Low	46 Å²	46	46.3 Å²	46.3	31%	0.311	24%	0.238	S	C	.	.	S	Bend	trans	-87	-34.5	178.8	58.9	0	0	0	0	115.1	C673 D678 C701 C704	C673-C676 WeakPolarHBondContact CB-SG 3.4Å; C673-C676 WeakPolarHBondContact SG-CB 3.4Å; C673-C676 PolarHBondContact SG-N 2.89Å; C673-C676 CovalentContact SG-SG 2.06Å; C673-C676 PolarHBondContact SG-SG 3.48Å; C676-D678 PolarHBondContact SG-OD2 3.03Å; C676-C701 PolarHBondContact SG-SG 3.29Å; C676-C704 WeakPolarHBondContact CB-SG 3.48Å; C676-C704 VanDerWaalsContact SG-SG 3.65Å
677	G	79.9	Confident	67.8	Low	4 Å²	4	42.7 Å²	42.7	4%	0.041	22%	0.221	C	C	.	.			trans	97.3	0.5	175	0	0	0	0	0	118.2	M649 H672 C673	M649-G677 WeakPolarHBondContact CA-O 3.27Å; M649-G677 WeakPolarHBondContact CB-O 3.43Å; M649-G677 PolarHBondContact N-O 3.07Å; H672-G677 PolarHBondContact CD2-O 3.22Å; H672-G677 PolarHBondContact NE2-O 2.8Å; C673-G677 VanDerWaalsContact O-CA 3.24Å; C673-G677 WeakPolarHBondContact O-CA 3.36Å; C673-G677 PolarHBondContact O-N 3.04Å
678	D	61.5	Low	67.8	Low	33 Å²	33	46.2 Å²	46.2	18%	0.176	23%	0.232	C	C	.	.			trans	-91.1	173.3	175.1	5.1	-141.3	0	0	0	114.9	M649 K658 H672 C673 C676 Y680	M649-D678 HydrophobicContact CE-CB 3.77Å; M649-D678 HydrophobicContact SD-CB 3.93Å; K658-D678 HydrophobicContact CD-CB 4.23Å; K658-D678 VanDerWaalsContact CE-CB 3.48Å; K658-D678 WeakPolarHBondContact CE-OD1 3.41Å; K658-D678 HydrophobicContact CG-CB 3.64Å; K658-D678 IonicContact NZ-OD1 2.78Å; H672-D678 CarbonylContact C-O 3.5Å; H672-D678 PolarHBondContact CD2-O 2.82Å; C673-D678 WeakPolarHBondContact CB-O 3.16Å; C673-D678 PolarHBondContact N-O 3.18Å; C676-D678 PolarHBondContact SG-OD2 3.03Å; D678-Y680 VanDerWaalsContact C-CD2 3.49Å; D678-Y680 HydrophobicContact CB-CD2 4.47Å; D678-Y680 HydrophobicContact CB-CE2 3.59Å; D678-Y680 VanDerWaalsContact CG-OH 3.26Å; D678-Y680 WeakPolarHBondContact O-CD2 3.3Å; D678-Y680 VanDerWaalsContact O-CE2 3.22Å; D678-Y680 WeakPolarHBondContact O-CE2 3.43Å; D678-Y680 WeakPolarHBondContact OD2-CE2 3.4Å; D678-Y680 VanDerWaalsContact OD2-CZ 3.26Å; D678-Y680 PolarHBondContact OD2-OH 2.72Å
679	I	80.4	Confident	68.1	Low	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138.6	-174.1	-25.6	151.2	0	0	0	113.2	M649 K650 D651 E653 A654 C657 K658 K670	M649-I679 HydrophobicContact SD-CD1 4.46Å; M649-I679 HydrophobicContact SD-CG1 4.26Å; K650-I679 WeakPolarHBondContact O-CD1 3.31Å; D651-I679 HydrophobicContact CB-CB 4.45Å; D651-I679 HydrophobicContact CB-CD1 4.17Å; D651-I679 HydrophobicContact CB-CG1 4.09Å; D651-I679 HydrophobicContact CB-CG2 3.5Å; D651-I679 VanDerWaalsContact CB-CG2 3.5Å; D651-I679 WeakPolarHBondContact OD1-CG2 3.26Å; E653-I679 HydrophobicContact CB-CD1 4.23Å; A654-I679 HydrophobicContact CB-CB 4.37Å; A654-I679 HydrophobicContact CB-CD1 3.8Å; C657-I679 CarbonylContact C-O 3.53Å; C657-I679 VanDerWaalsContact SG-CB 3.59Å; C657-I679 VanDerWaalsContact SG-CG2 3.52Å; C657-I679 PolarHBondContact SG-O 2.7Å; K658-I679 WeakPolarHBondContact CA-O 3.35Å; K658-I679 WeakPolarHBondContact CB-O 3.5Å; K658-I679 WeakPolarHBondContact CG-O 3.19Å; K658-I679 PolarHBondContact N-O 3.4Å; K658-I679 VanDerWaalsContact N-O 3.1Å; K670-I679 HydrophobicContact CD-CG2 4.01Å; K670-I679 HydrophobicContact CG-CG2 3.46Å; K670-I679 VanDerWaalsContact CG-CG2 3.46Å
680	Y	73.3	Confident	67.9	Low	3 Å²	3	41.6 Å²	41.6	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.9	-167.5	-71.4	-93	0	0	0	117.9	C657 K658 Q659 K670 H671 C673 D678 C684 S685 C701	C657-Y680 CarbonylContact O-C 3.43Å; C657-Y680 VanDerWaalsContact O-CA 3.27Å; C657-Y680 WeakPolarHBondContact O-CA 3.36Å; C657-Y680 WeakPolarHBondContact SG-CA 3.24Å; C657-Y680 PolarHBondContact SG-N 2.75Å; K658-Y680 HydrophobicContact CD-CE1 4.32Å; K658-Y680 WeakPolarHBondContact CE-OH 3.25Å; K658-Y680 HydrophobicContact CG-CE2 4.49Å; K658-Y680 PolarHBondContact NZ-OH 2.66Å; K658-Y680 VanDerWaalsContact NZ-OH 3.07Å; Q659-Y680 HydrophobicContact CB-CD1 4.41Å; Q659-Y680 HydrophobicContact CB-CE1 4.48Å; K670-Y680 CarbonylContact C-O 3.57Å; H671-Y680 PolarHBondContact N-O 3.27Å; H671-Y680 WeakPolarHBondContact O-CA 3.24Å; H671-Y680 PolarHBondContact O-N 3.43Å; C673-Y680 HydrophobicContact CB-CD2 3.93Å; C673-Y680 HydrophobicContact CB-CE2 3.67Å; D678-Y680 VanDerWaalsContact C-CD2 3.49Å; D678-Y680 HydrophobicContact CB-CD2 4.47Å; D678-Y680 HydrophobicContact CB-CE2 3.59Å; D678-Y680 VanDerWaalsContact CG-OH 3.26Å; D678-Y680 WeakPolarHBondContact O-CD2 3.3Å; D678-Y680 VanDerWaalsContact O-CE2 3.22Å; D678-Y680 WeakPolarHBondContact O-CE2 3.43Å; D678-Y680 WeakPolarHBondContact OD2-CE2 3.4Å; D678-Y680 VanDerWaalsContact OD2-CZ 3.26Å; D678-Y680 PolarHBondContact OD2-OH 2.72Å; Y680-C684 HydrophobicContact CD1-CB 3.82Å; Y680-C684 WeakPolarHBondContact CD1-O 3.45Å; Y680-S685 WeakPolarHBondContact CB-OG 3.34Å; Y680-C701 HydrophobicContact CD1-CB 3.56Å; Y680-C701 HydrophobicContact CD2-CB 3.27Å; Y680-C701 HydrophobicContact CE1-CB 3.51Å; Y680-C701 HydrophobicContact CE2-CB 3.23Å; Y680-C701 VanDerWaalsContact CE2-SG 3.59Å; Y680-C701 HydrophobicContact CG-CB 3.42Å; Y680-C701 VanDerWaalsContact CG-CB 3.42Å; Y680-C701 PolarHBondContact OH-SG 2.77Å; Y680-C701 VanDerWaalsContact OH-SG 3.4Å
681	C	55.9	Low	68.1	Low	1 Å²	1	39.9 Å²	39.9	1%	0.007	22%	0.223	C	C	.	.			trans	-69.4	164.5	172.5	19.4	0	0	0	0	111.6	Q656 C657 C660 R669 T683 C684 S685	Q656-C681 VanDerWaalsContact C-CB 3.48Å; Q656-C681 WeakPolarHBondContact O-CB 3.21Å; Q656-C681 PolarHBondContact O-SG 2.82Å; C657-C681 HydrophobicContact CB-CB 4.31Å; C657-C681 PolarHBondContact N-SG 3.02Å; C657-C681 PolarHBondContact O-N 3.43Å; C657-C681 PolarHBondContact O-SG 3.4Å; C660-C681 WeakPolarHBondContact CB-SG 3.2Å; C660-C681 WeakPolarHBondContact SG-CB 3.48Å; C660-C681 CovalentContact SG-SG 2.11Å; C660-C681 PolarHBondContact SG-SG 3.48Å; R669-C681 WeakPolarHBondContact O-CA 3.3Å; C681-T683 PolarHBondContact O-N 3.24Å; C681-T683 VanDerWaalsContact O-N 3.12Å; C681-C684 CarbonylContact O-C 3.59Å; C681-C684 PolarHBondContact O-N 2.81Å; C681-C684 VanDerWaalsContact SG-CB 3.51Å; C681-C684 PolarHBondContact SG-SG 2.88Å; C681-S685 CarbonylContact O-C 3.6Å; C681-S685 PolarHBondContact O-N 3.38Å; C681-S685 PolarHBondContact O-OG 2.74Å
682	N	65.1	Low	67.3	Low	116 Å²	116	42.9 Å²	42.9	62%	0.62	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.2	167.4	-145.4	82.5	0	0	0	113	S685	N682-S685 CarbonylContact C-O 3.55Å; N682-S685 VanDerWaalsContact CA-O 3.23Å; N682-S685 WeakPolarHBondContact CA-O 3.25Å
683	T	59.2	Low	66.9	Low	91 Å²	91	47.6 Å²	47.6	56%	0.558	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.8	173.7	-13.6	0	0	0	0	114.1	C681	C681-T683 PolarHBondContact O-N 3.24Å; C681-T683 VanDerWaalsContact O-N 3.12Å
684	C	53.4	Low	65.7	Low	28 Å²	28	51.5 Å²	51.5	19%	0.189	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.2	-2.6	-178.4	-59.1	0	0	0	0	114.5	Q659 Y680 C681 C701 D702	Q659-C684 HydrophobicContact CB-CB 4.31Å; Q659-C684 HydrophobicContact CG-CB 3.79Å; Q659-C684 VanDerWaalsContact CG-SG 3.59Å; Y680-C684 HydrophobicContact CD1-CB 3.82Å; Y680-C684 WeakPolarHBondContact CD1-O 3.45Å; C681-C684 CarbonylContact O-C 3.59Å; C681-C684 PolarHBondContact O-N 2.81Å; C681-C684 VanDerWaalsContact SG-CB 3.51Å; C681-C684 PolarHBondContact SG-SG 2.88Å; C684-C701 WeakPolarHBondContact O-CB 3.42Å; C684-D702 VanDerWaalsContact C-CG 3.42Å; C684-D702 WeakPolarHBondContact CA-OD2 3.17Å; C684-D702 PolarHBondContact O-N 3.1Å; C684-D702 VanDerWaalsContact O-N 3.16Å
685	S	64.7	Low	64.9	Low	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157.2	153.4	66.2	0	0	0	0	107.9	Y680 C681 N682 R699 D702	Y680-S685 WeakPolarHBondContact CB-OG 3.34Å; C681-S685 CarbonylContact O-C 3.6Å; C681-S685 PolarHBondContact O-N 3.38Å; C681-S685 PolarHBondContact O-OG 2.74Å; N682-S685 CarbonylContact C-O 3.55Å; N682-S685 VanDerWaalsContact CA-O 3.23Å; N682-S685 WeakPolarHBondContact CA-O 3.25Å; S685-R699 PolarHBondContact OG-NH1 2.7Å; S685-D702 VanDerWaalsContact CA-OD1 3.26Å; S685-D702 WeakPolarHBondContact CA-OD1 3.24Å; S685-D702 PolarHBondContact N-OD2 3.47Å
686	S	86.3	Confident	64.5	Low	40 Å²	40	61 Å²	61	28%	0.28	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)		-148	-75.7	115.4	43.3	0	0	0	0	107.6	R699 V700 D702	S686-R699 WeakPolarHBondContact O-CG 3.5Å; S686-V700 VanDerWaalsContact O-O 3.05Å; S686-D702 PolarHBondContact N-OD1 2.91Å
687	N	57.9	Low	64.3	Low	61 Å²	61	62.3 Å²	62.3	33%	0.326	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53	71.1	145.2	-83.9	-25.9	0	0	0	114.4	V700 D702 H705	N687-V700 WeakPolarHBondContact CB-O 3.36Å; N687-V700 WeakPolarHBondContact O-CG2 3.3Å; N687-V700 PolarHBondContact O-N 2.74Å; N687-V700 VanDerWaalsContact O-O 3.08Å; N687-D702 PolarHBondContact ND2-OD1 2.83Å; N687-H705 HydrophobicContact CB-CB 3.76Å; N687-H705 WeakPolarHBondContact CB-CD2 3.44Å; N687-H705 PolarHBondContact O-CD2 3.47Å
688	E	53	Low	63.8	Low	113 Å²	113	63 Å²	63	53%	0.528	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	119.1	174.2	-58.6	-135.8	103.8	0	0	111.1	P697 V698 R699	E688-P697 HydrophobicContact CB-CB 4.14Å; E688-P697 WeakPolarHBondContact O-CB 3.28Å; E688-V698 WeakPolarHBondContact CA-O 3.43Å; E688-V698 WeakPolarHBondContact OE1-CA 3.45Å; E688-R699 HydrophobicContact CG-CB 3.96Å; E688-R699 WeakPolarHBondContact OE1-CA 3.34Å; E688-R699 VanDerWaalsContact OE1-CB 3.28Å; E688-R699 WeakPolarHBondContact OE1-CB 3.17Å; E688-R699 PolarHBondContact OE1-N 3.33Å
689	L	60.1	Low	64.6	Low	23 Å²	23	63.4 Å²	63.4	12%	0.12	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.6	-178.1	-157	154.7	0	0	0	112.3	L691 P697 V698 V700 H705 L708 L709	L689-L691 PolarHBondContact O-N 3.38Å; L689-P697 VanDerWaalsContact C-CA 3.43Å; L689-V698 VanDerWaalsContact N-N 3.2Å; L689-V698 PolarHBondContact N-O 2.67Å; L689-V698 VanDerWaalsContact O-CG2 3.31Å; L689-V698 WeakPolarHBondContact O-CG2 3.48Å; L689-V698 PolarHBondContact O-N 2.83Å; L689-V700 HydrophobicContact CB-CG2 3.64Å; L689-H705 WeakPolarHBondContact CD1-O 3.15Å; L689-L708 HydrophobicContact CB-CD1 4.35Å; L689-L708 HydrophobicContact CD1-CB 3.68Å; L689-L708 HydrophobicContact CD1-CD1 4.23Å; L689-L708 HydrophobicContact CD2-CB 3.51Å; L689-L708 HydrophobicContact CD2-CD1 3.87Å; L689-L708 HydrophobicContact CD2-CG 4.3Å; L689-L708 HydrophobicContact CG-CB 4.24Å; L689-L708 HydrophobicContact CG-CD1 4.38Å; L689-L709 HydrophobicContact CD1-CD1 4.23Å; L689-L709 HydrophobicContact CD1-CG 3.96Å
690	A	61.4	Low	63.6	Low	64 Å²	64	63.4 Å²	63.4	53%	0.529	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	89.8	-178.4	0	0	0	0	0	111.8	P697	A690-P697 HydrophobicContact CB-CG 4.34Å
691	L	65.7	Low	63	Low	9 Å²	9	63.3 Å²	63.3	5%	0.047	36%	0.356	C	S	.	.			trans	-78.1	144.4	173.5	-82.1	165.5	0	0	0	111.4	R674 N675 L689 S693 Y694 V698 V700 L708	R674-L691 HydrophobicContact CB-CD1 3.79Å; R674-L691 WeakPolarHBondContact O-CD1 3.39Å; N675-L691 HydrophobicContact CB-CD1 3.79Å; N675-L691 HydrophobicContact CB-CD2 3.88Å; N675-L691 HydrophobicContact CB-CG 4.4Å; N675-L691 WeakPolarHBondContact OD1-CD2 3.5Å; L689-L691 PolarHBondContact O-N 3.38Å; L691-S693 PolarHBondContact O-N 2.74Å; L691-Y694 HydrophobicContact CB-CD2 4.05Å; L691-Y694 HydrophobicContact CD1-CD2 4.04Å; L691-Y694 HydrophobicContact CD1-CE2 4.43Å; L691-Y694 CarbonylContact O-C 3.48Å; L691-Y694 PolarHBondContact O-N 2.79Å; L691-V698 HydrophobicContact CB-CG2 4.19Å; L691-V698 HydrophobicContact CD1-CG2 3.88Å; L691-V698 HydrophobicContact CG-CG2 4.35Å; L691-V700 HydrophobicContact CD1-CG1 3.86Å; L691-L708 HydrophobicContact CD2-CD1 3.49Å; L691-L708 VanDerWaalsContact CD2-CD1 3.49Å; L691-L708 HydrophobicContact CD2-CD2 3.7Å; L691-L708 HydrophobicContact CD2-CG 4.27Å; L691-L708 HydrophobicContact CG-CD1 3.99Å
692	P	60.8	Low	63.2	Low	134 Å²	134	65.9 Å²	65.9	87%	0.87	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.7	172	-26.8	35.5	0	0	0	114	Y694	P692-Y694 VanDerWaalsContact C-N 3.29Å; P692-Y694 PolarHBondContact O-N 2.82Å
693	S	63.1	Low	62.9	Low	100 Å²	100	64.3 Å²	64.3	70%	0.699	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-5.1	176.5	-50.3	0	0	0	0	114.8	L691	L691-S693 PolarHBondContact O-N 2.74Å
694	Y	56.3	Low	62.8	Low	82 Å²	82	60.2 Å²	60.2	32%	0.322	34%	0.339	S	S	.	.	S	Bend	trans	-141.9	123.3	-173.5	-70.6	-84.3	0	0	0	111.8	W648 R674 L691 P692 R696 V698	W648-Y694 HydrophobicContact CZ3-CE2 4.49Å; W648-Y694 WeakPolarHBondContact CZ3-OH 3.35Å; R674-Y694 HydrophobicContact CB-CD2 4.29Å; R674-Y694 HydrophobicContact CB-CE2 3.97Å; R674-Y694 HydrophobicContact CG-CD2 4.46Å; R674-Y694 HydrophobicContact CG-CE1 4.34Å; R674-Y694 HydrophobicContact CG-CE2 4Å; R674-Y694 WeakPolarHBondContact O-CE2 3.35Å; L691-Y694 HydrophobicContact CB-CD2 4.05Å; L691-Y694 HydrophobicContact CD1-CD2 4.04Å; L691-Y694 HydrophobicContact CD1-CE2 4.43Å; L691-Y694 CarbonylContact O-C 3.48Å; L691-Y694 PolarHBondContact O-N 2.79Å; P692-Y694 VanDerWaalsContact C-N 3.29Å; P692-Y694 PolarHBondContact O-N 2.82Å; Y694-R696 PolarHBondContact O-N 2.78Å; Y694-V698 HydrophobicContact CD1-CG1 3.94Å; Y694-V698 HydrophobicContact CD1-CG2 4.39Å; Y694-V698 HydrophobicContact CD2-CG2 3.71Å; Y694-V698 HydrophobicContact CG-CB 4.28Å; Y694-V698 HydrophobicContact CG-CG1 3.9Å; Y694-V698 HydrophobicContact CG-CG2 3.62Å
695	P	59.1	Low	63.3	Low	136 Å²	136	60.8 Å²	60.8	88%	0.883	34%	0.339	S	S	*	.	S	Bend	trans	-74.7	15.8	-171.4	31.9	-38	0	0	0	115.1
696	R	64	Low	63.1	Low	198 Å²	198	64.4 Å²	64.4	75%	0.747	36%	0.364	S	S	*	.	S	Bend	trans	-150.6	162.8	177.2	-66.2	-171.7	-177.1	173.9	1.4	108.5	Y694 V698	Y694-R696 PolarHBondContact O-N 2.78Å; R696-V698 PolarHBondContact O-N 2.92Å
697	P	69.8	Low	62.3	Low	73 Å²	73	67.8 Å²	67.8	47%	0.474	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	135.9	164.5	-21	32.5	0	0	0	111.1	E688 L689 A690	E688-P697 HydrophobicContact CB-CB 4.14Å; E688-P697 WeakPolarHBondContact O-CB 3.28Å; L689-P697 VanDerWaalsContact C-CA 3.43Å; A690-P697 HydrophobicContact CB-CG 4.34Å
698	V	68.5	Low	62.7	Low	19 Å²	19	66.2 Å²	66.2	12%	0.115	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	138.3	-174.4	-78.7	0	0	0	0	113.1	R674 E688 L689 L691 Y694 R696 V700	R674-V698 HydrophobicContact CB-CB 3.83Å; R674-V698 HydrophobicContact CB-CG2 3.58Å; R674-V698 HydrophobicContact CG-CB 3.71Å; R674-V698 HydrophobicContact CG-CG1 4.44Å; R674-V698 HydrophobicContact CG-CG2 3.95Å; E688-V698 WeakPolarHBondContact CA-O 3.43Å; E688-V698 WeakPolarHBondContact OE1-CA 3.45Å; L689-V698 VanDerWaalsContact N-N 3.2Å; L689-V698 PolarHBondContact N-O 2.67Å; L689-V698 VanDerWaalsContact O-CG2 3.31Å; L689-V698 WeakPolarHBondContact O-CG2 3.48Å; L689-V698 PolarHBondContact O-N 2.83Å; L691-V698 HydrophobicContact CB-CG2 4.19Å; L691-V698 HydrophobicContact CD1-CG2 3.88Å; L691-V698 HydrophobicContact CG-CG2 4.35Å; Y694-V698 HydrophobicContact CD1-CG1 3.94Å; Y694-V698 HydrophobicContact CD1-CG2 4.39Å; Y694-V698 HydrophobicContact CD2-CG2 3.71Å; Y694-V698 HydrophobicContact CG-CB 4.28Å; Y694-V698 HydrophobicContact CG-CG1 3.9Å; Y694-V698 HydrophobicContact CG-CG2 3.62Å; R696-V698 PolarHBondContact O-N 2.92Å; V698-V700 PolarHBondContact O-N 3.09Å
699	R	78.3	Confident	63.3	Low	41 Å²	41	65 Å²	65	16%	0.155	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	99.5	-169.8	-169.6	-172.9	-88	-92.4	-3.4	111.9	H671 H672 C673 R674 S685 S686 E688	H671-R699 VanDerWaalsContact CB-CZ 3.4Å; H671-R699 VanDerWaalsContact CB-NE 3.3Å; H671-R699 VanDerWaalsContact CD2-CZ 3.47Å; H671-R699 PolarHBondContact CD2-NH1 3.44Å; H671-R699 VanDerWaalsContact CD2-NH1 3.32Å; H671-R699 VanDerWaalsContact CG-CZ 3.43Å; H672-R699 WeakPolarHBondContact O-CB 3.4Å; H672-R699 WeakPolarHBondContact O-CD 2.89Å; H672-R699 WeakPolarHBondContact O-CG 3.11Å; C673-R699 CarbonylContact C-O 3.58Å; C673-R699 WeakPolarHBondContact CA-O 3.25Å; R674-R699 WeakPolarHBondContact CD-O 3.41Å; R674-R699 PolarHBondContact N-O 3.22Å; S685-R699 PolarHBondContact OG-NH1 2.7Å; S686-R699 WeakPolarHBondContact O-CG 3.5Å; E688-R699 HydrophobicContact CG-CB 3.96Å; E688-R699 WeakPolarHBondContact OE1-CA 3.34Å; E688-R699 VanDerWaalsContact OE1-CB 3.28Å; E688-R699 WeakPolarHBondContact OE1-CB 3.17Å; E688-R699 PolarHBondContact OE1-N 3.33Å
700	V	60.2	Low	63.1	Low	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	143.5	167.6	-78.8	0	0	0	0	108.1	R674 N675 S686 N687 L689 L691 V698 C704 H705 L708	R674-V700 HydrophobicContact CB-CG1 4.3Å; N675-V700 HydrophobicContact CB-CG1 3.56Å; S686-V700 VanDerWaalsContact O-O 3.05Å; N687-V700 WeakPolarHBondContact CB-O 3.36Å; N687-V700 WeakPolarHBondContact O-CG2 3.3Å; N687-V700 PolarHBondContact O-N 2.74Å; N687-V700 VanDerWaalsContact O-O 3.08Å; L689-V700 HydrophobicContact CB-CG2 3.64Å; L691-V700 HydrophobicContact CD1-CG1 3.86Å; V698-V700 PolarHBondContact O-N 3.09Å; V700-C704 HydrophobicContact CB-CB 3.75Å; V700-C704 HydrophobicContact CG1-CB 4.03Å; V700-H705 HydrophobicContact CG2-CB 3.79Å; V700-L708 HydrophobicContact CG1-CD1 4.17Å; V700-L708 HydrophobicContact CG2-CD1 4.48Å
701	C	60.8	Low	63.1	Low	0 Å²	0	79 Å²	79	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	174.7	171.2	69.5	0	0	0	0	111.5	C673 C676 Y680 C684 V703 C704 H705	C673-C701 HydrophobicContact CB-CB 3.93Å; C676-C701 PolarHBondContact SG-SG 3.29Å; Y680-C701 HydrophobicContact CD1-CB 3.56Å; Y680-C701 HydrophobicContact CD2-CB 3.27Å; Y680-C701 HydrophobicContact CE1-CB 3.51Å; Y680-C701 HydrophobicContact CE2-CB 3.23Å; Y680-C701 VanDerWaalsContact CE2-SG 3.59Å; Y680-C701 HydrophobicContact CG-CB 3.42Å; Y680-C701 VanDerWaalsContact CG-CB 3.42Å; Y680-C701 PolarHBondContact OH-SG 2.77Å; Y680-C701 VanDerWaalsContact OH-SG 3.4Å; C684-C701 WeakPolarHBondContact O-CB 3.42Å; C701-V703 PolarHBondContact O-N 2.91Å; C701-V703 VanDerWaalsContact SG-CB 3.52Å; C701-C704 CarbonylContact O-C 3.53Å; C701-C704 WeakPolarHBondContact O-CA 3.24Å; C701-C704 PolarHBondContact O-N 2.72Å; C701-H705 PolarHBondContact O-N 2.87Å
702	D	59.5	Low	62.7	Low	55 Å²	55	81.9 Å²	81.9	29%	0.294	43%	0.432	S	S	.	.	H	α-helix	trans	-72.1	-20.4	-174.5	-51.7	-25.5	0	0	0	111.4	C684 S685 S686 N687 C704 S706	C684-D702 VanDerWaalsContact C-CG 3.42Å; C684-D702 WeakPolarHBondContact CA-OD2 3.17Å; C684-D702 PolarHBondContact O-N 3.1Å; C684-D702 VanDerWaalsContact O-N 3.16Å; S685-D702 VanDerWaalsContact CA-OD1 3.26Å; S685-D702 WeakPolarHBondContact CA-OD1 3.24Å; S685-D702 PolarHBondContact N-OD2 3.47Å; S686-D702 PolarHBondContact N-OD1 2.91Å; N687-D702 PolarHBondContact ND2-OD1 2.83Å; D702-C704 PolarHBondContact O-N 3.28Å; D702-S706 PolarHBondContact O-OG 2.8Å
703	V	58.7	Low	62.1	Low	83 Å²	83	80.3 Å²	80.3	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-63.8	-24.2	166.3	-168.9	0	0	0	0	111.9	C701 L707	C701-V703 PolarHBondContact O-N 2.91Å; C701-V703 VanDerWaalsContact SG-CB 3.52Å; V703-L707 VanDerWaalsContact O-CD1 3.3Å; V703-L707 WeakPolarHBondContact O-CD1 3.3Å
704	C	58.1	Low	61.6	Low	5 Å²	5	80.4 Å²	80.4	3%	0.034	43%	0.425	C	S	.	.	H	α-helix	trans	-119.9	-21	-170.5	-87.4	0	0	0	0	116.5	N675 C676 V700 C701 D702 L708	N675-C704 HydrophobicContact CB-CB 3.82Å; N675-C704 PolarHBondContact ND2-SG 3.24Å; C676-C704 WeakPolarHBondContact CB-SG 3.48Å; C676-C704 VanDerWaalsContact SG-SG 3.65Å; V700-C704 HydrophobicContact CB-CB 3.75Å; V700-C704 HydrophobicContact CG1-CB 4.03Å; C701-C704 CarbonylContact O-C 3.53Å; C701-C704 WeakPolarHBondContact O-CA 3.24Å; C701-C704 PolarHBondContact O-N 2.72Å; D702-C704 PolarHBondContact O-N 3.28Å; C704-L708 WeakPolarHBondContact O-CD1 3.31Å; C704-L708 WeakPolarHBondContact O-CG 3.29Å
705	H	62.9	Low	60.9	Low	40 Å²	40	82 Å²	82	19%	0.185	44%	0.443	C	S	.	.	H	α-helix	trans	-62.4	-49.8	172.5	-163.6	-102.9	0	0	0	110.9	N687 L689 V700 C701 L707 L708	N687-H705 HydrophobicContact CB-CB 3.76Å; N687-H705 WeakPolarHBondContact CB-CD2 3.44Å; N687-H705 PolarHBondContact O-CD2 3.47Å; L689-H705 WeakPolarHBondContact CD1-O 3.15Å; V700-H705 HydrophobicContact CG2-CB 3.79Å; C701-H705 PolarHBondContact O-N 2.87Å; H705-L707 PolarHBondContact O-N 3.15Å; H705-L708 PolarHBondContact O-N 3.29Å
706	S	60.6	Low	59.9	Low	77 Å²	77	79.6 Å²	79.6	54%	0.538	44%	0.435	S	S	.	.	H	α-helix	trans	-59.2	-42.3	-177.5	-45.5	0	0	0	0	112.8	D702 L708	D702-S706 PolarHBondContact O-OG 2.8Å; S706-L708 PolarHBondContact O-N 3.39Å
707	L	70.3	Confident	58.1	Low	110 Å²	110	79.2 Å²	79.2	58%	0.576	46%	0.463	S	S	*	.	H	α-helix	trans	-62.7	-23.3	-178.9	-79.2	175.4	0	0	0	114.4	V703 H705	V703-L707 VanDerWaalsContact O-CD1 3.3Å; V703-L707 WeakPolarHBondContact O-CD1 3.3Å; H705-L707 PolarHBondContact O-N 3.15Å
708	L	66.6	Low	57.5	Low	28 Å²	28	79.6 Å²	79.6	15%	0.147	46%	0.463	C	S	.	.	H	α-helix	trans	-95.8	-34.7	-172.3	-62.2	163.4	0	0	0	111.8	N675 L689 L691 V700 C704 H705 S706 R711 S712	N675-L708 HydrophobicContact CB-CD1 4.22Å; L689-L708 HydrophobicContact CB-CD1 4.35Å; L689-L708 HydrophobicContact CD1-CB 3.68Å; L689-L708 HydrophobicContact CD1-CD1 4.23Å; L689-L708 HydrophobicContact CD2-CB 3.51Å; L689-L708 HydrophobicContact CD2-CD1 3.87Å; L689-L708 HydrophobicContact CD2-CG 4.3Å; L689-L708 HydrophobicContact CG-CB 4.24Å; L689-L708 HydrophobicContact CG-CD1 4.38Å; L691-L708 HydrophobicContact CD2-CD1 3.49Å; L691-L708 VanDerWaalsContact CD2-CD1 3.49Å; L691-L708 HydrophobicContact CD2-CD2 3.7Å; L691-L708 HydrophobicContact CD2-CG 4.27Å; L691-L708 HydrophobicContact CG-CD1 3.99Å; V700-L708 HydrophobicContact CG1-CD1 4.17Å; V700-L708 HydrophobicContact CG2-CD1 4.48Å; C704-L708 WeakPolarHBondContact O-CD1 3.31Å; C704-L708 WeakPolarHBondContact O-CG 3.29Å; H705-L708 PolarHBondContact O-N 3.29Å; S706-L708 PolarHBondContact O-N 3.39Å; L708-R711 WeakPolarHBondContact O-CB 3.47Å; L708-R711 PolarHBondContact O-N 2.99Å; L708-R711 VanDerWaalsContact O-N 3.08Å; L708-S712 PolarHBondContact O-N 3.36Å
709	L	64.3	Low	56.9	Low	88 Å²	88	82.7 Å²	82.7	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-67	-39.1	-178.8	-93.4	162	0	0	0	113.9	L689 R711 S712	L689-L709 HydrophobicContact CD1-CD1 4.23Å; L689-L709 HydrophobicContact CD1-CG 3.96Å; L709-R711 PolarHBondContact O-N 3.06Å; L709-S712 PolarHBondContact O-N 2.7Å; L709-S712 PolarHBondContact O-OG 2.64Å
710	Q	57.2	Low	55.7	Low	167 Å²	167	85.1 Å²	85.1	78%	0.78	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.8	172.3	-78.3	-170.6	-56.9	0	0	112.5
711	R	60.5	Low	55.5	Low	214 Å²	214	90.1 Å²	90.1	81%	0.808	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.7	-177.5	-137.9	176.2	-173.7	-172	1.1	113.6	L708 L709	L708-R711 WeakPolarHBondContact O-CB 3.47Å; L708-R711 PolarHBondContact O-N 2.99Å; L708-R711 VanDerWaalsContact O-N 3.08Å; L709-R711 PolarHBondContact O-N 3.06Å
712	S	57.9	Low	55.1	Low	70 Å²	70	95.7 Å²	95.7	49%	0.49	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.4	-17.2	-175.6	47.4	0	0	0	0	115.6	L708 L709	L708-S712 PolarHBondContact O-N 3.36Å; L709-S712 PolarHBondContact O-N 2.7Å; L709-S712 PolarHBondContact O-OG 2.64Å
713	S	47.3	Very low	54.8	Low	101 Å²	101	98.4 Å²	98.4	71%	0.706	58%	0.579	S	S	*	*	S	Bend	trans	-85.5	-16	-176.3	-54.6	0	0	0	0	114.6
714	S	53.2	Low	54.6	Low	101 Å²	101	99.5 Å²	99.5	71%	0.706	59%	0.585	S	S	*	*	S	Bend	trans	-96	5.9	-170.7	-54.8	0	0	0	0	114.8
715	T	41.3	Very low	54.3	Low	115 Å²	115	106.8 Å²	106.8	71%	0.706	63%	0.627	S	S	*	*			trans	-139.1	56	174.7	59.2	0	0	0	0	110.9
716	A	37.5	Very low	53.6	Low	87 Å²	87	112.3 Å²	112.3	72%	0.719	66%	0.664	S	S	*	*				-109.4	142.6	120.3	0	0	0	0	0	106.6
717	S	26.1	Very low	52.9	Low	190 Å²	190	115.5 Å²	115.5	100%	1.329	68%	0.675	S	S	*	*			cis	-85.3	0	-1.4	-59.2	0	0	0	0	113.7

Retrieved 717 of 717 residues in 525.3 ms (Link to these results)

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