A0A087XVH6_POEFO Loading...

Interacts with SUPT6H, CTD assembly factor 1

AlphaFold DB , UniProt , Accession A0A087XVH6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 740 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	34.1	Very low	39.4	Very low	239 Å²	239	151.8 Å²	151.8	100%	1.177	82%	0.821	S	S	*	*				0	66.2	0	-69.1	166.3	175.9	0	0	105.4
2	D	37.4	Very low	39.4	Very low	169 Å²	169	151.8 Å²	151.8	90%	0.904	82%	0.82	S	S	*	*			cis	78.5	129.5	45.1	-161.7	47.7	0	0	0	110.4
3	G	37.2	Very low	39.1	Very low	64 Å²	64	145.2 Å²	145.2	66%	0.66	81%	0.808	S	S	*	*			cis	173	169.8	-1.1	0	0	0	0	0	110.6
4	G	35.2	Very low	38.8	Very low	67 Å²	67	141.1 Å²	141.1	69%	0.691	82%	0.816	S	S	*	*			trans	82.5	130.6	180	0	0	0	0	0	114
5	E	45.3	Very low	38.5	Very low	182 Å²	182	136.1 Å²	136.1	85%	0.85	81%	0.807	S	S	*	*			cis	84.8	137.3	11.4	-42.8	175.1	177.3	0	0	117.2
6	E	42.2	Very low	38.4	Very low	179 Å²	179	136.5 Å²	136.5	84%	0.836	81%	0.811	S	S	*	*			trans	71.5	109	159.1	-43.6	-152	148	0	0	123
7	E	43.9	Very low	39.5	Very low	170 Å²	170	134.8 Å²	134.8	79%	0.794	80%	0.804	S	S	*	*				35.5	145.2	115.4	-121.1	-175.8	154	0	0	125.3
8	F	39.3	Very low	39.4	Very low	164 Å²	164	134.7 Å²	134.7	72%	0.719	80%	0.804	S	S	*	*			trans	68	121.6	141.7	-129.6	-81.5	0	0	0	123	S10	F8-S10 WeakPolarHBondContact CD1-OG 3.38Å; F8-S10 VanDerWaalsContact CE1-OG 3.29Å; F8-S10 WeakPolarHBondContact CE1-OG 3.44Å
9	M	41.3	Very low	39.2	Very low	185 Å²	185	136.4 Å²	136.4	91%	0.911	80%	0.803	S	S	*	*			trans	-173.8	136.4	146	-101.5	174.7	-174.3	0	0	108.2
10	S	41.3	Very low	38.9	Very low	86 Å²	86	135.8 Å²	135.8	60%	0.601	80%	0.796	S	S	*	*			cis	109.3	113.3	13	-68.6	0	0	0	0	114	F8	F8-S10 WeakPolarHBondContact CD1-OG 3.38Å; F8-S10 VanDerWaalsContact CE1-OG 3.29Å; F8-S10 WeakPolarHBondContact CE1-OG 3.44Å
11	D	36.1	Very low	38.7	Very low	165 Å²	165	138.3 Å²	138.3	88%	0.882	80%	0.8	S	S	*	*			trans	-172.9	138.3	165.8	-140.1	-135.6	0	0	0	107.6
12	D	39.2	Very low	39	Very low	152 Å²	152	135.7 Å²	135.7	81%	0.813	79%	0.785	S	S	*	*			cis	-157	156.2	-10.3	177.4	-129.8	0	0	0	111.9
13	G	36.4	Very low	39.8	Very low	65 Å²	65	133 Å²	133	67%	0.67	78%	0.776	S	S	*	*			trans	72.4	146.6	156.3	0	0	0	0	0	120.6
14	G	34.3	Very low	39.6	Very low	88 Å²	88	138.4 Å²	138.4	91%	0.907	79%	0.785	S	S	*	*			cis	118.6	127.5	-5.6	0	0	0	0	0	114.7
15	G	34.6	Very low	39.5	Very low	66 Å²	66	140.1 Å²	140.1	68%	0.68	79%	0.786	S	S	*	*			cis	167.2	157.3	-10.1	0	0	0	0	0	113.7
16	T	37.1	Very low	38.8	Very low	143 Å²	143	139.3 Å²	139.3	88%	0.877	79%	0.787	S	S	*	*			trans	59	170.7	162.7	52.7	0	0	0	0	120.1
17	P	57	Low	38.4	Very low	108 Å²	108	133.7 Å²	133.7	70%	0.701	78%	0.778	S	S	*	*			cis	-142.7	166	-42.4	38.3	-21	0	0	0	118.1
18	V	37.3	Very low	38	Very low	132 Å²	132	134.7 Å²	134.7	80%	0.8	78%	0.782	S	S	*	*			trans	72.3	159	139.2	163.5	0	0	0	0	122.3
19	Q	35.3	Very low	37.8	Very low	168 Å²	168	134 Å²	134	79%	0.785	78%	0.781	S	S	*	*			trans	84.5	151.8	174.6	-56.1	-144	-96.4	0	0	118.4
20	D	33.2	Very low	37.3	Very low	124 Å²	124	131.2 Å²	131.2	66%	0.663	77%	0.768	S	S	*	*			cis	-167	163.4	-32.1	-113.5	-51.1	0	0	0	112.3
21	E	35.6	Very low	36.9	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	78%	0.776	S	S	*	*			trans	51.2	153.5	159.3	-59.9	-159	121.9	0	0	124.9
22	H	39.8	Very low	36.7	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.856	77%	0.768	S	S	*	*			trans	-100.4	165.7	173.1	-84.2	-77.8	0	0	0	112.1
23	P	53.5	Low	36.3	Very low	111 Å²	111	134.5 Å²	134.5	72%	0.721	77%	0.771	S	S	*	*				-155.6	133.3	105.7	35.8	-15.7	0	0	0	119.9
24	Q	33.1	Very low	36.1	Very low	179 Å²	179	135.2 Å²	135.2	84%	0.836	78%	0.778	S	S	*	*				64.6	156.1	127.6	-59.6	-168.7	-75.9	0	0	125.9
25	S	33.6	Very low	36.1	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	77%	0.774	S	S	*	*			trans	73.3	141.3	163.7	66	0	0	0	0	118.3
26	D	31.7	Very low	36.1	Very low	166 Å²	166	145 Å²	145	89%	0.888	78%	0.782	S	S	*	*			cis	-153.8	157.4	-20.8	-94.1	-28.2	0	0	0	107.4
27	G	33.7	Very low	35.9	Very low	61 Å²	61	142 Å²	142	63%	0.629	77%	0.768	S	S	*	*			cis	176.8	176.4	0.1	0	0	0	0	0	111.7
28	E	35.3	Very low	34.8	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	78%	0.776	S	S	*	*			trans	62.3	114.5	171.2	-51.9	-168.4	155	0	0	116.9
29	E	33.9	Very low	34.8	Very low	150 Å²	150	146.9 Å²	146.9	70%	0.701	78%	0.777	S	S	*	*				69.2	137.3	64	-71.7	-128.9	143.4	0	0	114.5
30	M	32	Very low	34.9	Very low	127 Å²	127	146.1 Å²	146.1	63%	0.626	78%	0.779	S	S	*	*			cis	-174.5	168.7	-18.3	-119.7	-151.1	-162.6	0	0	109.2
31	R	32.1	Very low	34.9	Very low	205 Å²	205	143.3 Å²	143.3	77%	0.774	78%	0.779	S	S	*	*			trans	69.8	159.7	160.7	-59.5	134.6	-162	-109.1	6.7	116.9
32	S	31.7	Very low	34.8	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	77%	0.772	S	S	*	*			cis	-166.2	176.5	-26.1	54.6	0	0	0	0	109.9
33	D	32	Very low	34.4	Very low	164 Å²	164	137.1 Å²	137.1	88%	0.877	77%	0.766	S	S	*	*			trans	-34.5	147.8	176	-57	-107.2	0	0	0	118.6
34	G	30.9	Very low	33.6	Very low	80 Å²	80	137.7 Å²	137.7	83%	0.825	76%	0.763	S	S	*	*			trans	-170.5	112.6	165.3	0	0	0	0	0	112.4
35	Q	35	Very low	33.8	Very low	178 Å²	178	137.4 Å²	137.4	83%	0.832	76%	0.762	S	S	*	*			trans	-96.3	174.5	166.4	-57.8	-178.1	-83	0	0	109.9
36	Q	33.8	Very low	33.9	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	77%	0.765	S	S	*	*			trans	71.4	151.6	164.3	-65.3	170.4	-19.9	0	0	115
37	S	33.9	Very low	33.9	Very low	82 Å²	82	135.5 Å²	135.5	57%	0.573	76%	0.756	S	S	*	*			cis	-165.5	176.5	-13	40.7	0	0	0	0	111.1
38	E	32.5	Very low	34.1	Very low	187 Å²	187	137 Å²	137	87%	0.874	76%	0.762	S	S	*	*			trans	82	162.1	150.2	-77.5	148.9	141.9	0	0	121.2
39	D	38.7	Very low	34.1	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	76%	0.758	S	S	*	*			trans	-132.4	139.4	-164.2	167.2	-108.2	0	0	0	107.1
40	D	36.5	Very low	34	Very low	151 Å²	151	132.8 Å²	132.8	81%	0.807	76%	0.762	S	S	*	*			trans	-161.7	157.1	163.3	-162.8	-92.8	0	0	0	109.2
41	G	34.3	Very low	34.4	Very low	66 Å²	66	134.6 Å²	134.6	68%	0.68	77%	0.771	S	S	*	*			trans	-165.7	145.8	179	0	0	0	0	0	114.4
42	S	32	Very low	34.4	Very low	103 Å²	103	133 Å²	133	72%	0.72	77%	0.773	S	S	*	*			trans	-164	137.8	171.1	30	0	0	0	0	113
43	N	33.1	Very low	34.6	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	78%	0.776	S	S	*	*				17.2	152.2	118	-69.3	50.3	0	0	0	119.1
44	D	34.9	Very low	34.5	Very low	123 Å²	123	130.1 Å²	130.1	66%	0.658	77%	0.771	S	S	*	*			cis	-164.2	168.1	10.8	-126.6	-33.2	0	0	0	113.9
45	E	39	Very low	34.4	Very low	173 Å²	173	130.1 Å²	130.1	81%	0.808	77%	0.771	S	S	*	*			trans	57.2	165.9	157.9	-59	-174.5	133	0	0	119.3
46	D	34.5	Very low	34.3	Very low	146 Å²	146	126.8 Å²	126.8	78%	0.781	77%	0.774	S	S	*	*			cis	-156	170.3	15.4	-163.7	-0.6	0	0	0	113.2
47	A	32.4	Very low	34.2	Very low	83 Å²	83	122.7 Å²	122.7	69%	0.686	77%	0.771	S	S	*	*			trans	66.7	122.5	166.1	0	0	0	0	0	119.8
48	A	36.7	Very low	34	Very low	93 Å²	93	126.2 Å²	126.2	77%	0.769	78%	0.784	S	S	*	*			cis	79	154.5	17.2	0	0	0	0	0	116.4
49	I	36.3	Very low	33.9	Very low	154 Å²	154	121.5 Å²	121.5	79%	0.79	77%	0.772	S	S	*	*			cis	-152.6	137.2	13.7	-41.8	156.1	0	0	0	111.2
50	A	32.4	Very low	33.8	Very low	96 Å²	96	118.8 Å²	118.8	79%	0.793	77%	0.765	S	S	*	*			trans	171.8	148.8	145.8	0	0	0	0	0	113.1
51	M	40.4	Very low	33.6	Very low	166 Å²	166	118.8 Å²	118.8	82%	0.818	77%	0.765	S	S	*	*			cis	145.4	112.7	-20	-94.4	-91.6	-168	0	0	109.1
52	E	31.6	Very low	33.8	Very low	172 Å²	172	119.3 Å²	119.3	80%	0.804	76%	0.763	S	S	*	*			trans	-175.9	159.3	136.6	-98.8	-110.9	51.6	0	0	114.4
53	T	35.1	Very low	34	Very low	129 Å²	129	121 Å²	121	79%	0.791	76%	0.759	S	S	*	*			trans	-45.3	163.8	-170.5	49.3	0	0	0	0	120.8
54	G	30.9	Very low	34.1	Very low	75 Å²	75	119.9 Å²	119.9	77%	0.773	75%	0.753	S	S	*	*			cis	160	153.6	-8.2	0	0	0	0	0	115.3
55	G	27.7	Very low	34.2	Very low	80 Å²	80	121.4 Å²	121.4	83%	0.825	75%	0.75	S	S	*	*			trans	77.8	127.4	168.1	0	0	0	0	0	117.3
56	A	34	Very low	34	Very low	108 Å²	108	119.6 Å²	119.6	89%	0.893	74%	0.741	S	S	*	*			cis	91.5	109.8	15.3	0	0	0	0	0	118.1
57	A	31.8	Very low	33.9	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	75%	0.746	S	S	*	*			trans	179.2	135.9	143.5	0	0	0	0	0	114.4
58	N	29.1	Very low	34.2	Very low	157 Å²	157	123.1 Å²	123.1	84%	0.84	74%	0.74	S	S	*	*			trans	51.8	150	146.5	-79	35.8	0	0	0	123.4
59	S	30.6	Very low	33.7	Very low	88 Å²	88	125.8 Å²	125.8	62%	0.615	74%	0.742	S	S	*	*			cis	-173.6	160.2	-12.4	48.6	0	0	0	0	112.4
60	S	35.5	Very low	33.8	Very low	98 Å²	98	123.1 Å²	123.1	69%	0.685	74%	0.736	S	S	*	*			trans	32.3	142.8	143.2	59.3	0	0	0	0	121.2
61	D	32.4	Very low	33.8	Very low	150 Å²	150	126 Å²	126	80%	0.802	74%	0.739	S	S	*	*			cis	-153.7	151.5	26.4	-116.8	-170.9	0	0	0	108.3
62	A	38.5	Very low	33.7	Very low	77 Å²	77	122.8 Å²	122.8	64%	0.636	73%	0.733	S	S	*	*				70.2	134.2	57.5	0	0	0	0	0	113.2
63	E	37.7	Very low	33.8	Very low	139 Å²	139	123 Å²	123	65%	0.65	73%	0.734	S	S	*	*			cis	-137.8	-162.1	-14.8	-63.4	-142.5	68.1	0	0	107.6	R65	E63-R65 IonicContact OE1-CZ 3.16Å; E63-R65 IonicContact OE1-NE 3.47Å; E63-R65 PolarHBondContact OE1-NE 2.67Å; E63-R65 IonicContact OE1-NH2 2.8Å; E63-R65 PolarHBondContact OE1-NH2 2.69Å; E63-R65 IonicContact OE2-CZ 3.53Å; E63-R65 IonicContact OE2-NE 3.78Å; E63-R65 IonicContact OE2-NH2 2.72Å; E63-R65 PolarHBondContact OE2-NH2 2.71Å
64	D	34.7	Very low	33.8	Very low	116 Å²	116	123.8 Å²	123.8	62%	0.62	73%	0.733	S	S	*	*			cis	-148.1	144.6	14.4	-152.1	-125.2	0	0	0	108.7
65	R	35.9	Very low	33.8	Very low	154 Å²	154	127.9 Å²	127.9	58%	0.581	73%	0.732	S	S	*	*				52.5	157.9	74.9	-29.5	175.7	-165.4	-178.5	5.5	115.5	E63	E63-R65 IonicContact OE1-CZ 3.16Å; E63-R65 IonicContact OE1-NE 3.47Å; E63-R65 PolarHBondContact OE1-NE 2.67Å; E63-R65 IonicContact OE1-NH2 2.8Å; E63-R65 PolarHBondContact OE1-NH2 2.69Å; E63-R65 IonicContact OE2-CZ 3.53Å; E63-R65 IonicContact OE2-NE 3.78Å; E63-R65 IonicContact OE2-NH2 2.72Å; E63-R65 PolarHBondContact OE2-NH2 2.71Å
66	H	35.7	Very low	34.1	Very low	135 Å²	135	128 Å²	128	63%	0.625	73%	0.725	S	S	*	*			cis	-135.4	158.6	-3.3	-95.6	-67.4	0	0	0	107.8
67	R	32.6	Very low	34.9	Very low	235 Å²	235	128.5 Å²	128.5	89%	0.887	72%	0.719	S	S	*	*				55.6	146.8	64.4	-74.4	-164.2	-176	-170.5	1.9	115.1
68	A	38.6	Very low	34.8	Very low	68 Å²	68	128.1 Å²	128.1	56%	0.562	73%	0.725	S	S	*	*			cis	-168.5	-154.8	-14.5	0	0	0	0	0	109.7
69	D	27.1	Very low	34.9	Very low	150 Å²	150	124 Å²	124	80%	0.802	72%	0.72	S	S	*	*			trans	80.8	155.4	155.8	-44.1	-41.4	0	0	0	119.3
70	S	36.8	Very low	34.9	Very low	97 Å²	97	130.2 Å²	130.2	68%	0.678	73%	0.729	S	S	*	*			cis	-176.9	163.5	-46	-100	0	0	0	0	111.7
71	D	34	Very low	34.8	Very low	157 Å²	157	135 Å²	135	84%	0.84	73%	0.733	S	S	*	*			trans	63.7	154.7	164.7	-67.7	-52.8	0	0	0	118.7
72	S	36.7	Very low	34.7	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	72%	0.72	S	S	*	*			cis	-157.5	-168.4	-9.5	43.1	0	0	0	0	108
73	E	34.8	Very low	34.5	Very low	176 Å²	176	137.4 Å²	137.4	82%	0.822	73%	0.726	S	S	*	*			cis	-151.5	162.7	15.6	-57.6	176.2	134.9	0	0	111.1
74	D	33.8	Very low	34.2	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	73%	0.728	S	S	*	*			trans	24.2	165.3	148.2	-80	-84.4	0	0	0	126.7
75	E	32.1	Very low	34	Very low	162 Å²	162	135.7 Å²	135.7	76%	0.757	73%	0.729	S	S	*	*			cis	-147	-178.2	11.5	-123.7	-81.2	-162.4	0	0	110.4
76	A	33.1	Very low	33.9	Very low	83 Å²	83	130.9 Å²	130.9	69%	0.686	72%	0.719	S	S	*	*			trans	-118.9	-140.2	-177.9	0	0	0	0	0	112.9
77	P	51.9	Low	33.6	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	71%	0.707	S	S	*	*			cis	-142	156.7	1.7	42.4	-22.3	0	0	0	120.3
78	G	30.2	Very low	33.5	Very low	87 Å²	87	119.6 Å²	119.6	90%	0.897	69%	0.686	S	S	*	*			trans	75.6	156.3	145.3	0	0	0	0	0	121.6
79	G	29.6	Very low	33.3	Very low	71 Å²	71	124.5 Å²	124.5	73%	0.732	70%	0.697	S	S	*	*			cis	157.5	157.9	-14.9	0	0	0	0	0	116.2
80	R	31.8	Very low	34.1	Very low	218 Å²	218	122 Å²	122	82%	0.823	69%	0.689	S	S	*	*			trans	83.5	149.3	169.4	-54.3	174.5	-174.3	-102.8	-3.7	117
81	R	32.2	Very low	33.7	Very low	199 Å²	199	125.7 Å²	125.7	75%	0.751	70%	0.695	S	S	*	*			cis	-169.6	156.4	-7.3	-113.4	-177.7	170.4	-166.3	-6.1	114.5
82	D	32	Very low	34	Very low	102 Å²	102	129.1 Å²	129.1	55%	0.545	70%	0.696	S	S	.	*			trans	63.6	118.1	146.2	-74.6	-93.2	0	0	0	126.3
83	K	32.4	Very low	34.1	Very low	175 Å²	175	130.6 Å²	130.6	76%	0.761	70%	0.704	S	S	*	*			trans	78.7	132.7	130.9	-65.7	-171.3	177.6	82.1	0	127.4
84	S	33.3	Very low	33.9	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	70%	0.698	S	S	*	*			trans	69.6	164.1	138.5	-67.7	0	0	0	0	122.3
85	D	29.9	Very low	33.6	Very low	121 Å²	121	125.2 Å²	125.2	65%	0.647	70%	0.697	S	S	*	*			cis	-167.9	-170	-30.9	-94	120.1	0	0	0	107.9	Q409	D85-Q409 PolarHBondContact OD2-NE2 3.27Å
86	S	34.4	Very low	33.4	Very low	52 Å²	52	123.2 Å²	123.2	36%	0.364	70%	0.7	S	S	.	*			cis	-147	-75.5	10.1	82.7	0	0	0	0	120.6	Q409 A410 A411	S86-Q409 WeakPolarHBondContact O-CA 3.41Å; S86-Q409 VanDerWaalsContact O-CB 3.28Å; S86-Q409 WeakPolarHBondContact O-CB 3.38Å; S86-Q409 WeakPolarHBondContact O-CG 3.45Å; S86-Q409 PolarHBondContact O-NE2 3.18Å; S86-A410 VanDerWaalsContact C-N 3.28Å; S86-A410 CarbonylContact C-O 3.38Å; S86-A410 WeakPolarHBondContact CA-O 3.38Å; S86-A410 PolarHBondContact N-O 2.67Å; S86-A410 PolarHBondContact O-N 2.95Å; S86-A411 PolarHBondContact OG-O 3.48Å
87	E	28.7	Very low	33.4	Very low	80 Å²	80	127.1 Å²	127.1	37%	0.374	71%	0.705	S	S	.	*			trans	-108.5	129.6	-160.8	-97.6	-122.5	73.6	0	0	127.9	Q408 Q409 A410 A411	E87-Q408 HydrophobicContact CG-CB 4.14Å; E87-Q408 VanDerWaalsContact OE1-CB 3.31Å; E87-Q408 WeakPolarHBondContact OE1-CB 3.45Å; E87-Q408 WeakPolarHBondContact OE1-CG 3.5Å; E87-Q408 PolarHBondContact OE1-NE2 2.81Å; E87-Q408 PolarHBondContact OE2-NE2 3.22Å; E87-Q409 VanDerWaalsContact C-C 3.47Å; E87-A410 PolarHBondContact N-O 2.84Å; E87-A410 CarbonylContact O-C 3.56Å; E87-A410 VanDerWaalsContact O-C 3.25Å; E87-A410 WeakPolarHBondContact O-CA 3.34Å; E87-A410 WeakPolarHBondContact O-CB 3.48Å; E87-A410 PolarHBondContact O-N 3.12Å; E87-A411 PolarHBondContact O-N 3.32Å
88	A	30.1	Very low	32.4	Very low	54 Å²	54	128.7 Å²	128.7	45%	0.446	71%	0.706	S	S	.	*			trans	85.3	172.7	159.9	0	0	0	0	0	126.8
89	E	34.9	Very low	32.8	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	70%	0.703	S	S	*	*			trans	-141.7	165.4	167.9	-152.8	-150.3	-140.2	0	0	108.2
90	P	42.7	Very low	32.9	Very low	98 Å²	98	135.8 Å²	135.8	64%	0.636	70%	0.701	S	S	*	*				-166.6	175.4	86.4	46.4	-24	0	0	0	121.9
91	H	29.9	Very low	33	Very low	175 Å²	175	130 Å²	130	81%	0.81	69%	0.694	S	S	*	*			trans	76.9	136.9	146.3	-70.7	-52.7	0	0	0	124.9
92	R	38.8	Very low	33.6	Very low	228 Å²	228	126 Å²	126	86%	0.86	70%	0.695	S	S	*	*			trans	-104.1	161.2	152.7	-56.7	-179.5	177.9	-175.9	-1.4	108.9
93	P	39.9	Very low	33.6	Very low	130 Å²	130	125.3 Å²	125.3	84%	0.844	70%	0.703	S	S	*	*				-112.4	-174.1	70.9	-6.2	27.8	0	0	0	112.7
94	G	30.1	Very low	33.7	Very low	68 Å²	68	126.6 Å²	126.6	70%	0.701	71%	0.708	S	S	*	*			cis	121.9	127.8	-0.7	0	0	0	0	0	113.1
95	D	27.3	Very low	33.6	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	72%	0.717	S	S	*	*			trans	78.6	135.8	170.3	-144	69.8	0	0	0	120.5
96	S	28.3	Very low	33.6	Very low	119 Å²	119	136.4 Å²	136.4	83%	0.832	73%	0.729	S	S	*	*			trans	-177.6	79.6	156.2	11.4	0	0	0	0	110
97	E	33.7	Very low	33.4	Very low	166 Å²	166	138.4 Å²	138.4	78%	0.776	75%	0.748	S	S	*	*			trans	-69.7	159.7	142.2	-55.1	-178.7	149.3	0	0	107
98	D	30.7	Very low	33.4	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	77%	0.773	S	S	*	*			cis	-153.1	-165.6	14.3	-153	-28.8	0	0	0	110.4
99	E	37.9	Very low	33.4	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	79%	0.788	S	S	*	*			trans	-79.6	-165.9	-173.4	-86.4	-89.2	142.9	0	0	117.1
100	D	32.2	Very low	33.2	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	78%	0.784	S	S	*	*			trans	86.2	149.3	170.7	-127.5	-113.4	0	0	0	116.3
101	S	33.8	Very low	32.7	Very low	96 Å²	96	140.5 Å²	140.5	67%	0.671	79%	0.786	S	S	*	*			cis	-142.3	161.8	16.8	-55.5	0	0	0	0	114.9
102	P	43.7	Very low	32.8	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	78%	0.784	S	S	*	*			trans	-72.8	145	160.4	31.6	-34.4	0	0	0	112.6
103	A	33.8	Very low	32.6	Very low	87 Å²	87	136.5 Å²	136.5	72%	0.719	78%	0.777	S	S	*	*			trans	-87.2	155.7	-165.8	0	0	0	0	0	116.7
104	K	33.3	Very low	32.3	Very low	202 Å²	202	138.2 Å²	138.2	88%	0.878	77%	0.774	S	S	*	*				-168.1	151	123.3	-100.6	146.2	-167.3	168.2	0	114.7
105	H	31.4	Very low	32.4	Very low	186 Å²	186	142.4 Å²	142.4	86%	0.861	78%	0.775	S	S	*	*			trans	-67.8	155	179.8	-43.9	-98.1	0	0	0	113.6
106	R	30	Very low	32.7	Very low	239 Å²	239	143.9 Å²	143.9	90%	0.902	78%	0.777	S	S	*	*				176.3	124.7	92.7	-178.5	170.7	-177	176.2	0.7	115.2
107	A	29.7	Very low	33.1	Very low	93 Å²	93	143.5 Å²	143.5	77%	0.769	78%	0.775	S	S	*	*			trans	58.2	109.8	154.2	0	0	0	0	0	119.6
108	S	29.3	Very low	33.8	Very low	128 Å²	128	140.7 Å²	140.7	90%	0.895	77%	0.771	S	S	*	*			trans	-81.9	159.6	165.6	-33.3	0	0	0	0	112.7
109	A	29.9	Very low	33.8	Very low	92 Å²	92	139 Å²	139	76%	0.76	77%	0.766	S	S	*	*			trans	-151.2	135.2	147.9	0	0	0	0	0	109
110	S	31.1	Very low	33.5	Very low	100 Å²	100	139 Å²	139	70%	0.699	76%	0.763	S	S	*	*			trans	29.6	144.9	141.9	-68.1	0	0	0	0	122.5
111	D	31.1	Very low	33.3	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	77%	0.771	S	S	*	*			cis	-156.5	154.6	-1.1	-94.2	161.5	0	0	0	109.2
112	E	33.2	Very low	33.3	Very low	167 Å²	167	150 Å²	150	78%	0.78	78%	0.78	S	S	*	*			trans	31.3	156.2	135.7	-50	-173.7	158.7	0	0	123.9
113	E	34.1	Very low	33.5	Very low	151 Å²	151	149.9 Å²	149.9	71%	0.706	78%	0.78	S	S	*	*			trans	73	102.5	162.9	-48.2	-47.9	78	0	0	123.5
114	E	32.9	Very low	33.4	Very low	166 Å²	166	151.5 Å²	151.5	78%	0.776	79%	0.786	S	S	*	*				47	129.1	119	-71.7	-160.2	170.5	0	0	125.1
115	E	33.2	Very low	33.1	Very low	157 Å²	157	145 Å²	145	73%	0.734	78%	0.776	S	S	*	*				88.5	155.8	127.5	-74.6	-63.3	173.2	0	0	126.1
116	E	32.9	Very low	33.2	Very low	171 Å²	171	141.2 Å²	141.2	80%	0.799	77%	0.77	S	S	*	*			trans	1.6	137.9	179.4	-70.6	-164.2	121.5	0	0	123
117	S	36.8	Very low	33.4	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	76%	0.761	S	S	*	*			trans	-82.4	146	155.5	-64.5	0	0	0	0	111.3
118	P	49.4	Very low	33.5	Very low	107 Å²	107	139.5 Å²	139.5	70%	0.695	76%	0.761	S	S	*	*				-157.3	132	107.6	35.5	-15.1	0	0	0	119.2
119	T	29.8	Very low	34	Very low	113 Å²	113	141.3 Å²	141.3	69%	0.693	76%	0.756	S	S	*	*			trans	67.9	128.3	133.2	68.3	0	0	0	0	125.4
120	K	31.3	Very low	34.3	Very low	177 Å²	177	140 Å²	140	77%	0.77	75%	0.745	S	S	*	*				79.6	122.5	126.1	-76.2	170.1	-173.9	163.5	0	123.5
121	R	28.4	Very low	34.4	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.857	75%	0.752	S	S	*	*			trans	109.8	123.7	132.6	-75.9	164.1	171	-171	-3.4	121.9
122	R	33.6	Very low	34.7	Very low	231 Å²	231	140.5 Å²	140.5	87%	0.872	76%	0.758	S	S	*	*			trans	0.5	162.5	138.6	-32.6	177.5	83.4	-177.5	6.9	119.1
123	P	47.9	Very low	35.5	Very low	115 Å²	115	138.1 Å²	138.1	75%	0.747	76%	0.757	S	S	*	*			cis	-150.6	-171	23.3	45.6	-23.7	0	0	0	120
124	S	32	Very low	35.4	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	76%	0.757	S	S	*	*			trans	-27.2	153.2	170.3	55.3	0	0	0	0	126
125	G	26.5	Very low	35.5	Very low	65 Å²	65	138 Å²	138	67%	0.67	76%	0.761	S	S	*	*			trans	155.5	124.5	159.7	0	0	0	0	0	109.3
126	S	33.3	Very low	35.5	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	77%	0.773	S	S	*	*				65.2	134.6	62.5	87.1	0	0	0	0	113.4
127	E	34.1	Very low	35.3	Very low	152 Å²	152	138.6 Å²	138.6	71%	0.71	78%	0.775	S	S	*	*			cis	-158.7	166.7	3.5	51.2	-124.7	57.8	0	0	113
128	D	33.3	Very low	35.1	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	78%	0.781	S	S	*	*			trans	61.5	151.7	160.2	-62.5	-20.2	0	0	0	121.6
129	E	38.3	Very low	34.4	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	78%	0.783	S	S	*	*			cis	-158.2	163.8	-4.8	-126.5	-71.4	78.5	0	0	113.1
130	A	36.9	Very low	34.4	Very low	64 Å²	64	139.8 Å²	139.8	53%	0.529	79%	0.786	S	S	.	*			trans	66.3	103.1	148.7	0	0	0	0	0	123.1
131	S	32.8	Very low	34.4	Very low	123 Å²	123	137 Å²	137	86%	0.86	78%	0.779	S	S	*	*				163.2	140.2	111.5	-72.8	0	0	0	0	115.7
132	S	38.2	Very low	34.6	Very low	115 Å²	115	133.6 Å²	133.6	80%	0.804	77%	0.773	S	S	*	*			trans	-87	-174.8	179.2	-51	0	0	0	0	112.2
133	P	50.3	Low	34.6	Very low	116 Å²	116	130 Å²	130	75%	0.753	77%	0.767	S	S	*	*			cis	-154.2	-178.1	17	36.7	-9.9	0	0	0	121.1
134	V	32.3	Very low	33.9	Very low	115 Å²	115	132.4 Å²	132.4	70%	0.697	77%	0.768	S	S	*	*			trans	94.9	112.7	152	-167.5	0	0	0	0	121.9
135	K	33.8	Very low	34	Very low	201 Å²	201	134 Å²	134	87%	0.874	76%	0.762	S	S	*	*			trans	77.3	150.2	152.3	-76.2	170.1	-175.8	-179.5	0	121.3
136	R	33.6	Very low	34.3	Very low	258 Å²	258	138.8 Å²	138.8	97%	0.974	77%	0.767	S	S	*	*			trans	-144.2	169.1	-169.9	-70.4	-177.2	170.6	-160.5	-1.1	110.4
137	G	28	Very low	34.1	Very low	82 Å²	82	140.2 Å²	140.2	85%	0.845	77%	0.766	S	S	*	*			trans	-174	98.9	158.6	0	0	0	0	0	111.9
138	A	34.1	Very low	34	Very low	110 Å²	110	139.2 Å²	139.2	91%	0.909	77%	0.77	S	S	*	*			trans	-152.6	174.6	177.8	0	0	0	0	0	110.1
139	S	34.1	Very low	34	Very low	107 Å²	107	137.1 Å²	137.1	75%	0.748	77%	0.766	S	S	*	*			trans	-85.9	172.8	-158.3	-150.6	0	0	0	0	117.3
140	D	30.7	Very low	33.6	Very low	140 Å²	140	135 Å²	135	75%	0.749	77%	0.77	S	S	*	*			trans	91.6	123.6	147.6	-84.2	-127.2	0	0	0	124.1
141	N	30.2	Very low	33.9	Very low	118 Å²	118	137.9 Å²	137.9	63%	0.631	78%	0.783	S	S	*	*			trans	64.5	131.2	142.1	-106.5	30	0	0	0	126.7
142	E	32.9	Very low	33.8	Very low	155 Å²	155	135.5 Å²	135.5	72%	0.724	77%	0.771	S	S	*	*			trans	56.8	150.6	145.4	-75.6	152.5	-163.1	0	0	119.8
143	E	33	Very low	33.4	Very low	157 Å²	157	139.2 Å²	139.2	73%	0.734	77%	0.773	S	S	*	*			cis	-155.2	162.5	13.4	-137.3	169.5	-163.4	0	0	111.7
144	E	34.2	Very low	32.5	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	78%	0.778	S	S	*	*			trans	47.4	145	165.6	-38	-164.6	126.9	0	0	120.7
145	E	33.4	Very low	32.4	Very low	155 Å²	155	150.7 Å²	150.7	72%	0.724	79%	0.789	S	S	*	*			cis	-154.3	166.2	33.3	-106.4	-62.4	-155.7	0	0	115.1
146	E	31.9	Very low	32	Very low	165 Å²	165	144.7 Å²	144.7	77%	0.771	78%	0.784	S	S	*	*			trans	47.9	116.7	160.9	-64.1	-153	147.4	0	0	125.2
147	D	29.6	Very low	31.8	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	78%	0.776	S	S	*	*			trans	56.2	115.4	135.5	-129.9	-15.1	0	0	0	123.2
148	V	32.4	Very low	31.8	Very low	132 Å²	132	139 Å²	139	80%	0.8	77%	0.77	S	S	*	*				-165.9	133	97.9	-87.5	0	0	0	0	114.8
149	S	32.3	Very low	31.6	Very low	99 Å²	99	138.5 Å²	138.5	69%	0.692	76%	0.76	S	S	*	*			trans	69.7	77	147	-61.9	0	0	0	0	121.7
150	S	31	Very low	31.4	Very low	121 Å²	121	141.7 Å²	141.7	85%	0.846	76%	0.763	S	S	*	*				69.9	148.8	123.7	-62.9	0	0	0	0	123.6
151	P	42.5	Very low	31.6	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	76%	0.762	S	S	*	*			trans	-120.6	-160	-158.8	36.1	-12.5	0	0	0	112
152	A	30.4	Very low	31.8	Very low	73 Å²	73	143.6 Å²	143.6	60%	0.603	77%	0.768	S	S	*	*			cis	-164.7	163.1	16.8	0	0	0	0	0	114.6
153	K	31.2	Very low	31.7	Very low	193 Å²	193	143.3 Å²	143.3	84%	0.839	77%	0.771	S	S	*	*			trans	46	133	137.3	-63.6	165.3	-172.7	176.4	0	120.4
154	R	30.3	Very low	31.7	Very low	226 Å²	226	139.3 Å²	139.3	85%	0.853	77%	0.765	S	S	*	*			cis	86.6	117.7	42.8	-83.3	-171.5	145.1	-147.4	-1.4	116.6
155	R	30.6	Very low	32.2	Very low	246 Å²	246	137.3 Å²	137.3	93%	0.928	77%	0.766	S	S	*	*			trans	66.2	125.9	135	-162.2	-174.2	-160	-125.7	8.8	119.3
156	G	26.6	Very low	32.1	Very low	75 Å²	75	134 Å²	134	77%	0.773	77%	0.774	S	S	*	*			trans	175	163.2	168	0	0	0	0	0	113.6
157	S	28.9	Very low	32	Very low	115 Å²	115	129.9 Å²	129.9	80%	0.804	78%	0.775	S	S	*	*			trans	-127.2	163.4	-178.4	-60.1	0	0	0	0	112.2
158	S	27.9	Very low	31.9	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	79%	0.785	S	S	*	*			trans	60.4	134.2	147.4	54.3	0	0	0	0	122.3
159	S	30.4	Very low	31.7	Very low	100 Å²	100	129.3 Å²	129.3	70%	0.699	79%	0.787	S	S	*	*			trans	61	126.7	155.1	43.6	0	0	0	0	118.8
160	E	29.6	Very low	31.8	Very low	174 Å²	174	129.1 Å²	129.1	81%	0.813	79%	0.791	S	S	*	*				64.3	131.5	80.8	-103	167.8	96.6	0	0	112.7
161	L	33.9	Very low	31.7	Very low	136 Å²	136	134.8 Å²	134.8	71%	0.712	79%	0.794	S	S	*	*			cis	-154.5	-153.9	37.6	-138.1	129.8	0	0	0	112.9
162	E	34.4	Very low	31.2	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.762	79%	0.794	S	S	*	*			trans	73.3	139.6	177.9	-47.8	-63.2	84.6	0	0	116.9
163	D	30.2	Very low	31	Very low	148 Å²	148	138.3 Å²	138.3	79%	0.791	81%	0.805	S	S	*	*			cis	-143.1	175.8	1.1	-176.1	-147.6	0	0	0	111.3
164	A	33.1	Very low	31.3	Very low	74 Å²	74	134.5 Å²	134.5	61%	0.612	80%	0.803	S	S	*	*			trans	-68.4	-174.9	-175.2	0	0	0	0	0	115.2
165	P	45.8	Very low	31.2	Very low	122 Å²	122	131.7 Å²	131.7	79%	0.792	81%	0.805	S	S	*	*			cis	-143.2	151.5	7.6	40.6	-20.5	0	0	0	119.9
166	G	30.3	Very low	31.5	Very low	86 Å²	86	126.3 Å²	126.3	89%	0.887	80%	0.795	S	S	*	*			trans	82	141.1	133	0	0	0	0	0	120.4
167	G	29.6	Very low	32.1	Very low	77 Å²	77	129.9 Å²	129.9	79%	0.794	79%	0.791	S	S	*	*			trans	128.7	121.8	166.1	0	0	0	0	0	114.4
168	D	29.1	Very low	32.4	Very low	177 Å²	177	132.2 Å²	132.2	95%	0.947	79%	0.789	S	S	*	*			trans	-70.7	143.6	179.4	-59.6	-105.6	0	0	0	113.4
169	G	27.8	Very low	32.7	Very low	81 Å²	81	133.7 Å²	133.7	84%	0.835	79%	0.789	S	S	*	*			trans	-165.2	124.9	170.5	0	0	0	0	0	111.3
170	A	33.8	Very low	33.1	Very low	95 Å²	95	136.7 Å²	136.7	79%	0.785	79%	0.789	S	S	*	*			trans	-110.6	134.5	-173.3	0	0	0	0	0	113
171	R	29.6	Very low	34.1	Very low	240 Å²	240	133.9 Å²	133.9	91%	0.906	79%	0.786	S	S	*	*			trans	22.4	127.6	141.5	-50	178.7	-169	-154.9	-0.4	119.1
172	S	31.2	Very low	34.1	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	79%	0.789	S	S	*	*			trans	74	117.1	150.8	-151.8	0	0	0	0	117.8
173	D	27.1	Very low	34.9	Very low	155 Å²	155	129.8 Å²	129.8	83%	0.829	79%	0.79	S	S	*	*			trans	-50.8	134.6	146.2	-60.5	-102.7	0	0	0	110.7
174	S	37.4	Very low	35	Very low	113 Å²	113	126.9 Å²	126.9	79%	0.79	79%	0.786	S	S	*	*				-166.9	123.5	116.8	-169.1	0	0	0	0	108.8
175	D	27.7	Very low	34.9	Very low	167 Å²	167	129 Å²	129	89%	0.893	80%	0.797	S	S	*	*			trans	-155.8	150.9	149.1	-127.5	-34.5	0	0	0	111
176	N	37.1	Very low	34	Very low	134 Å²	134	128.5 Å²	128.5	72%	0.717	80%	0.796	S	S	*	*			trans	-156	125.2	-171.1	170.7	107	0	0	0	111.7
177	E	38.9	Very low	34.9	Very low	150 Å²	150	129.6 Å²	129.6	70%	0.701	79%	0.787	S	S	*	*			trans	-143.1	144.9	166.5	-77.7	-69.5	-175.2	0	0	106.4
178	E	36.4	Very low	34.8	Very low	164 Å²	164	136.3 Å²	136.3	77%	0.766	79%	0.789	S	S	*	*			cis	-133.2	177.5	8	-53.6	167.8	109.4	0	0	107.6
179	D	33.8	Very low	34.9	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	78%	0.78	S	S	*	*			cis	-155	-169.4	7.2	-155.7	-10.1	0	0	0	111.7
180	K	38.8	Very low	35.3	Very low	164 Å²	164	139 Å²	139	71%	0.713	77%	0.773	S	S	*	*			trans	-108.7	-175.1	-163.5	-79.3	165.3	-174.2	119	0	114.1
181	P	50.7	Low	35.2	Very low	114 Å²	114	139.3 Å²	139.3	74%	0.74	77%	0.77	S	S	*	*			cis	-137.3	153.5	-33.8	31.4	-12.9	0	0	0	116.2
182	A	33.9	Very low	35	Very low	94 Å²	94	134.8 Å²	134.8	78%	0.777	76%	0.764	S	S	*	*				45.5	166.1	129	0	0	0	0	0	123.9
183	P	51.1	Low	35	Very low	120 Å²	120	134.1 Å²	134.1	78%	0.779	76%	0.759	S	S	*	*			cis	-133.3	168.5	-26.2	32.4	-13.6	0	0	0	115.6
184	A	31.6	Very low	35.2	Very low	87 Å²	87	132.9 Å²	132.9	72%	0.719	75%	0.753	S	S	*	*				142.2	126.5	116.5	0	0	0	0	0	118.3
185	S	31	Very low	34.9	Very low	119 Å²	119	132.2 Å²	132.2	83%	0.832	75%	0.748	S	S	*	*			trans	65.3	134.5	146	48.4	0	0	0	0	124.2
186	S	27	Very low	35	Very low	111 Å²	111	132 Å²	132	78%	0.776	75%	0.747	S	S	*	*			trans	-78.8	-160.6	163.3	-24.9	0	0	0	0	112
187	P	48.6	Very low	34.8	Very low	108 Å²	108	129.4 Å²	129.4	70%	0.701	74%	0.744	S	S	*	*			cis	-140.6	175.8	-21	37.8	-19.7	0	0	0	116.1
188	R	29.5	Very low	34.5	Very low	218 Å²	218	131.1 Å²	131.1	82%	0.823	75%	0.752	S	S	*	*			trans	66.7	171.7	142.1	-87.3	179.1	171.6	-139.7	-1.1	121.1
189	Q	30.7	Very low	35.6	Very low	162 Å²	162	127.9 Å²	127.9	76%	0.757	75%	0.745	S	S	*	*			trans	81.4	126.1	171.2	-45.6	-163	19.6	0	0	114
190	H	35.1	Very low	36.8	Very low	152 Å²	152	127.1 Å²	127.1	70%	0.704	75%	0.748	S	S	*	*			cis	72.2	147.6	42.5	-44.3	-38.4	0	0	0	112
191	S	31.1	Very low	36.4	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	75%	0.751	S	S	*	*			trans	86.4	149.2	-168	74.6	0	0	0	0	116.2
192	D	27.4	Very low	35.5	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	75%	0.751	S	S	*	*			cis	-170.4	169.6	-28.8	-91.9	-34.2	0	0	0	107.3
193	S	31.1	Very low	35.5	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	75%	0.748	S	S	*	*			trans	65.9	162.4	148.2	-78.1	0	0	0	0	119.2
194	D	29.9	Very low	34.5	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	75%	0.754	S	S	*	*			cis	-149.8	164.7	-15.4	-126.9	-56.5	0	0	0	113
195	S	31.7	Very low	34.5	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	75%	0.752	S	S	*	*			trans	-23.4	156.8	163.8	-48.1	0	0	0	0	122.6
196	D	30	Very low	34.6	Very low	164 Å²	164	134.8 Å²	134.8	88%	0.877	75%	0.753	S	S	*	*			trans	89.9	165.2	135.5	-131.8	-26.3	0	0	0	122.3
197	A	32.6	Very low	36.3	Very low	79 Å²	79	135 Å²	135	65%	0.653	75%	0.752	S	S	*	*			trans	83.7	85.3	158.3	0	0	0	0	0	120.9
198	E	32	Very low	35.5	Very low	186 Å²	186	137.8 Å²	137.8	87%	0.869	76%	0.758	S	S	*	*				52.6	161.9	120.2	-84.9	-96.7	103.1	0	0	122.6
199	P	60.8	Low	35.8	Very low	95 Å²	95	133.1 Å²	133.1	62%	0.617	75%	0.749	S	S	*	*			trans	-101.7	-154	-166.2	45.8	-40.6	0	0	0	111.5
200	P	58.6	Low	35.8	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	75%	0.747	S	S	*	*			cis	-140.3	-155.9	-3.5	43.7	-23	0	0	0	115.3
201	A	29.3	Very low	35.8	Very low	95 Å²	95	129.8 Å²	129.8	79%	0.785	75%	0.75	S	S	*	*			trans	102.4	130.1	165.4	0	0	0	0	0	115.7
202	R	32.4	Very low	35.8	Very low	195 Å²	195	133.3 Å²	133.3	74%	0.736	76%	0.755	S	S	*	*			cis	104.8	88.1	12	-165.8	-174.9	-172	-93.3	10	115.9
203	R	34.6	Very low	36.3	Very low	188 Å²	188	135.4 Å²	135.4	71%	0.709	76%	0.76	S	S	*	*			trans	72.1	126.2	149.5	-57.9	172.4	-179.5	-157.2	-2.7	119.5
204	Q	30.7	Very low	36.4	Very low	194 Å²	194	137.8 Å²	137.8	91%	0.907	77%	0.765	S	S	*	*				177.8	178.4	113.5	-93.7	157.1	110.5	0	0	109.1
205	A	30.2	Very low	36.7	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	76%	0.762	S	S	*	*				-179	137.4	-56.6	0	0	0	0	0	109.2
206	A	32.7	Very low	36.8	Very low	103 Å²	103	136.6 Å²	136.6	85%	0.851	76%	0.762	S	S	*	*			trans	73.7	169.1	166	0	0	0	0	0	116.9
207	P	62.8	Low	37	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	75%	0.749	S	S	*	*			trans	-130.7	-146.5	-142.2	45.3	-28.4	0	0	0	115.2
208	M	33.3	Very low	37.1	Very low	165 Å²	165	139 Å²	139	81%	0.813	75%	0.752	S	S	*	*			trans	88.9	141.3	179.3	-52.7	-169.4	73.2	0	0	113.8
209	D	35.1	Very low	37.1	Very low	120 Å²	120	137.8 Å²	137.8	64%	0.642	75%	0.746	S	S	*	*			cis	-162.5	-175.1	-0.4	-155.5	-104.1	0	0	0	112.7
210	S	31.3	Very low	35.9	Very low	101 Å²	101	142.1 Å²	142.1	71%	0.706	76%	0.758	S	S	*	*			trans	78.6	149.7	152.2	-51	0	0	0	0	121
211	D	34.4	Very low	34.7	Very low	144 Å²	144	144.6 Å²	144.6	77%	0.77	76%	0.759	S	S	*	*			cis	-168.6	-174.5	-30.7	-142.4	-45	0	0	0	111.3
212	E	31.6	Very low	34.8	Very low	177 Å²	177	148 Å²	148	83%	0.827	76%	0.759	S	S	*	*			trans	88.1	95.7	164.5	-59.3	-168.7	144.5	0	0	122
213	E	36.4	Very low	34.6	Very low	189 Å²	189	141.4 Å²	141.4	88%	0.883	75%	0.751	S	S	*	*			trans	36.8	155.2	130.7	-54.6	-170.8	157.4	0	0	123.3
214	D	34.2	Very low	34.4	Very low	152 Å²	152	139.5 Å²	139.5	81%	0.813	76%	0.761	S	S	*	*			cis	-148.6	-154.8	26.4	-176.9	20.7	0	0	0	112.9
215	E	35.6	Very low	34.2	Very low	138 Å²	138	133.7 Å²	133.7	65%	0.645	75%	0.752	S	S	*	*			trans	-59.2	155.7	-178.3	-101.1	-154.7	-156.6	0	0	116.2	K217	E215-K217 IonicContact OE1-NZ 3.73Å; E215-K217 PolarHBondContact OE1-NZ 2.88Å; E215-K217 IonicContact OE2-NZ 2.69Å; E215-K217 PolarHBondContact OE2-NZ 2.87Å
216	G	33.4	Very low	34	Very low	65 Å²	65	134 Å²	134	67%	0.67	76%	0.764	S	S	*	*			cis	145.9	-172.9	-5.4	0	0	0	0	0	115.9
217	K	35.2	Very low	33.9	Very low	143 Å²	143	133.1 Å²	133.1	62%	0.622	77%	0.765	S	S	*	*			trans	66.9	141.9	173.5	-62.8	-154.3	172.8	76	0	119.4	E215	E215-K217 IonicContact OE1-NZ 3.73Å; E215-K217 PolarHBondContact OE1-NZ 2.88Å; E215-K217 IonicContact OE2-NZ 2.69Å; E215-K217 PolarHBondContact OE2-NZ 2.87Å
218	Q	34.7	Very low	32.4	Very low	150 Å²	150	136 Å²	136	70%	0.701	77%	0.766	S	S	*	*			cis	164.5	147.5	-21.3	-112	176.3	-34.7	0	0	104.8
219	E	32.1	Very low	32.1	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	77%	0.767	S	S	*	*			cis	-139.4	152.8	6.6	-50.2	179.4	133.4	0	0	105.3
220	E	34.8	Very low	32	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	78%	0.779	S	S	*	*				63	139.8	50.7	-57.5	-163.4	162.1	0	0	113.2
221	E	33.7	Very low	31.8	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	78%	0.78	S	S	*	*			cis	-140	168.6	30.9	-85.3	-169.4	142.8	0	0	115.6
222	E	32.3	Very low	31.6	Very low	166 Å²	166	141 Å²	141	78%	0.776	78%	0.783	S	S	*	*			trans	42.3	151.5	138	-63.7	-71.8	108.1	0	0	122.8
223	G	28.4	Very low	31.5	Very low	56 Å²	56	140.1 Å²	140.1	58%	0.577	78%	0.78	S	S	*	*			cis	165	152.6	-2.8	0	0	0	0	0	113.3
224	V	28.9	Very low	31.1	Very low	149 Å²	149	138.3 Å²	138.3	90%	0.903	77%	0.772	S	S	*	*			trans	50.7	127.8	158	-171	0	0	0	0	120.7
225	G	27.2	Very low	31.3	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	77%	0.77	S	S	*	*			trans	149.7	119.5	148.1	0	0	0	0	0	116.8
226	G	27	Very low	31	Very low	92 Å²	92	137.5 Å²	137.5	95%	0.948	78%	0.781	S	S	*	*			trans	-78.7	141.4	177.8	0	0	0	0	0	114
227	G	29.3	Very low	30.9	Very low	84 Å²	84	138.4 Å²	138.4	87%	0.866	78%	0.777	S	S	*	*			trans	-148.6	138.6	178.3	0	0	0	0	0	112.9
228	K	31.8	Very low	30.7	Very low	177 Å²	177	139.2 Å²	139.2	77%	0.77	78%	0.783	S	S	*	*			trans	-109.7	161.4	176	-167.3	174.1	-176.5	175.6	0	108
229	W	27.4	Very low	30.4	Very low	222 Å²	222	138.5 Å²	138.5	84%	0.841	78%	0.784	S	S	*	*			trans	85.5	92.2	169.9	-48.6	98.5	0	0	0	119.5
230	K	32.7	Very low	30.7	Very low	205 Å²	205	139.6 Å²	139.6	89%	0.891	79%	0.789	S	S	*	*				30.6	110.2	112.7	-166.8	-177.8	-174.9	-176.8	0	119.3
231	G	27.3	Very low	30.8	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	79%	0.792	S	S	*	*			trans	161.9	119.1	162.2	0	0	0	0	0	108.5
232	V	30.6	Very low	30.9	Very low	138 Å²	138	139.3 Å²	139.3	84%	0.836	79%	0.793	S	S	*	*			cis	78.4	98.1	42.4	-175.8	0	0	0	0	113.7
233	M	28.1	Very low	31	Very low	157 Å²	157	137.2 Å²	137.2	77%	0.773	78%	0.783	S	S	*	*			trans	-173	123.1	134.1	-98.3	174	164	0	0	108.6
234	Q	28	Very low	31.1	Very low	152 Å²	152	137.3 Å²	137.3	71%	0.71	78%	0.784	S	S	*	*				72.4	128	109.8	-67.7	179	-65.7	0	0	114.8
235	S	39.7	Very low	31.4	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	77%	0.766	S	S	*	*			cis	82.6	112.2	21.5	-48	0	0	0	0	116.4
236	D	29	Very low	31.6	Very low	163 Å²	163	141.3 Å²	141.3	87%	0.872	77%	0.765	S	S	*	*			trans	-151.3	160.8	151.5	-95.4	-41.3	0	0	0	106.6
237	S	30.2	Very low	31.9	Very low	85 Å²	85	145 Å²	145	59%	0.594	76%	0.756	S	S	*	*			cis	-121	-142.6	0.8	-33.7	0	0	0	0	109.5
238	E	30.7	Very low	32	Very low	160 Å²	160	150.1 Å²	150.1	75%	0.748	75%	0.754	S	S	*	*			cis	-163.9	139.5	-8	-117.6	139.9	-113.8	0	0	103.8
239	D	29.8	Very low	31.8	Very low	135 Å²	135	146.1 Å²	146.1	72%	0.722	75%	0.753	S	S	*	*			cis	-154.5	148.9	-14.3	-88.9	164.9	0	0	0	109.5
240	E	38.8	Very low	31.9	Very low	183 Å²	183	140 Å²	140	86%	0.855	75%	0.75	S	S	*	*			trans	43.6	153.1	139.4	-56.2	-148.5	165.6	0	0	123.4
241	E	36.6	Very low	31.7	Very low	199 Å²	199	137.3 Å²	137.3	93%	0.93	75%	0.751	S	S	*	*			cis	-108.8	-172.6	30.4	-55.7	-178.4	92.6	0	0	117.5
242	D	34.3	Very low	31.7	Very low	153 Å²	153	137.3 Å²	137.3	82%	0.818	75%	0.751	S	S	*	*			trans	-109.7	-179.2	-179.5	-150.4	22.9	0	0	0	110.5
243	E	34.7	Very low	31.7	Very low	122 Å²	122	136.5 Å²	136.5	57%	0.57	75%	0.751	S	S	*	*			cis	-144.1	-154.6	10	-154.9	-118.1	-149.7	0	0	109.7	Q245	E243-Q245 PolarHBondContact OE1-NE2 3.01Å; E243-Q245 WeakPolarHBondContact OE2-CG 3.34Å
244	G	31	Very low	31.7	Very low	58 Å²	58	136 Å²	136	60%	0.598	75%	0.752	S	S	*	*			trans	164.6	-45.5	157.8	0	0	0	0	0	116
245	Q	34.7	Very low	31.9	Very low	112 Å²	112	137 Å²	137	52%	0.523	76%	0.756	S	S	.	*			trans	56.5	162.5	176.5	-59.2	-177.2	17.5	0	0	120.8	E243	E243-Q245 PolarHBondContact OE1-NE2 3.01Å; E243-Q245 WeakPolarHBondContact OE2-CG 3.34Å
246	R	31.7	Very low	31.6	Very low	191 Å²	191	138.6 Å²	138.6	72%	0.721	75%	0.752	S	S	*	*			trans	91.2	103.9	152.8	-44.8	-161.2	176.3	177.8	2.8	116.5
247	K	33.3	Very low	31.8	Very low	171 Å²	171	136.4 Å²	136.4	74%	0.743	74%	0.737	S	S	*	*				72.4	134.4	77	-68.6	162.6	-176.4	169	0	112.2
248	K	31.7	Very low	31.7	Very low	191 Å²	191	141.4 Å²	141.4	83%	0.83	74%	0.742	S	S	*	*			cis	-164.6	142	3.3	-126.8	-176.2	-179.8	-169	0	113
249	A	28.3	Very low	31.7	Very low	92 Å²	92	141.4 Å²	141.4	76%	0.76	74%	0.742	S	S	*	*			trans	23.8	124	142.9	0	0	0	0	0	125.1
250	A	28.3	Very low	31.8	Very low	94 Å²	94	142.6 Å²	142.6	78%	0.777	74%	0.744	S	S	*	*				83.2	146.7	120.1	0	0	0	0	0	125.2
251	T	28.9	Very low	31.5	Very low	149 Å²	149	140.3 Å²	140.3	91%	0.914	73%	0.733	S	S	*	*			trans	78.2	142.2	148.3	-155.1	0	0	0	0	123.2
252	G	28	Very low	31.1	Very low	69 Å²	69	138.1 Å²	138.1	71%	0.711	72%	0.72	S	S	*	*			trans	95	128.1	175.3	0	0	0	0	0	114
253	S	30.6	Very low	31	Very low	121 Å²	121	139.4 Å²	139.4	85%	0.846	72%	0.719	S	S	*	*			cis	96.4	104.6	14.3	-161.3	0	0	0	0	116.5
254	D	27.1	Very low	30.9	Very low	147 Å²	147	141.5 Å²	141.5	79%	0.786	73%	0.729	S	S	*	*			trans	-178.6	146.6	159.1	-103.1	10.5	0	0	0	104.7
255	E	32.3	Very low	30.8	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	74%	0.741	S	S	*	*			cis	67	135.5	42.9	-66.7	-168.8	130.9	0	0	113.1
256	E	33	Very low	30.6	Very low	144 Å²	144	153.6 Å²	153.6	67%	0.673	76%	0.759	S	S	*	*			cis	-157.8	164.5	11.5	-135.4	-159.8	150.8	0	0	113.7
257	Q	33.2	Very low	30.4	Very low	117 Å²	117	152.1 Å²	152.1	55%	0.547	77%	0.766	S	S	.	*			trans	67.2	143.3	147.9	-80.2	-177	42.2	0	0	126.5
258	R	29	Very low	30.2	Very low	189 Å²	189	151 Å²	151	71%	0.713	77%	0.768	S	S	*	*			trans	79.4	127	155.6	-67.6	153.2	-163.8	-74.3	-9.4	119.5
259	E	30.6	Very low	30.2	Very low	160 Å²	160	147.8 Å²	147.8	75%	0.748	77%	0.769	S	S	*	*			cis	88.2	133.8	39.4	-72.5	176.2	165.9	0	0	113.7
260	E	32	Very low	30.4	Very low	160 Å²	160	152 Å²	152	75%	0.748	77%	0.773	S	S	*	*			cis	-162.6	-174.1	-9	-146	-159.6	156.1	0	0	111.2
261	E	32.6	Very low	30.6	Very low	136 Å²	136	156 Å²	156	64%	0.636	78%	0.776	S	S	*	*			trans	74.9	146	164.3	-53.2	-144.2	111.9	0	0	119
262	K	29.1	Very low	30.8	Very low	152 Å²	152	157.7 Å²	157.7	66%	0.661	77%	0.773	S	S	*	*			cis	-154.8	139.9	-4.9	-109.6	157.2	173.7	141	0	107.2
263	K	31.5	Very low	31.1	Very low	180 Å²	180	161.7 Å²	161.7	78%	0.783	78%	0.779	S	S	*	*				53.1	131.4	78.4	-81.6	174.4	-176.5	160.7	0	114.3
264	Q	32	Very low	31.3	Very low	167 Å²	167	162.2 Å²	162.2	78%	0.78	77%	0.772	S	S	*	*			cis	-144.1	177.4	1.7	-77.7	147.3	-14.6	0	0	107.5
265	Q	29.6	Very low	31.5	Very low	184 Å²	184	164 Å²	164	86%	0.86	77%	0.773	S	S	*	*			cis	-155.6	166.4	37.7	-63	163.8	-11.8	0	0	107.3
266	R	29.8	Very low	32.6	Very low	240 Å²	240	160.7 Å²	160.7	91%	0.906	77%	0.766	S	S	*	*			cis	103.1	78.5	19.9	-134.8	-167.2	-158.6	-122.6	1.1	117
267	D	27.2	Very low	32.7	Very low	160 Å²	160	159.5 Å²	159.5	86%	0.856	77%	0.768	S	S	*	*			trans	-164.2	136.3	141.2	-100.5	-18.3	0	0	0	104.9
268	D	30.3	Very low	32.9	Very low	148 Å²	148	162.5 Å²	162.5	79%	0.791	78%	0.78	S	S	*	*			cis	96.1	89.4	25.5	-147	-10.5	0	0	0	114.4
269	S	31.9	Very low	33.2	Very low	123 Å²	123	164.3 Å²	164.3	86%	0.86	79%	0.786	S	S	*	*			trans	-171.5	153.4	161	-78.6	0	0	0	0	111.7
270	E	31.8	Very low	33.5	Very low	180 Å²	180	167.1 Å²	167.1	84%	0.841	80%	0.796	S	S	*	*			trans	-66.6	144.6	-169.6	-69.1	162	162.4	0	0	114
271	E	32.8	Very low	33.8	Very low	179 Å²	179	169.2 Å²	169.2	84%	0.836	80%	0.803	S	S	*	*				63.6	131.4	72.5	-159.7	164.8	-127.7	0	0	112.3
272	E	33.2	Very low	33.7	Very low	183 Å²	183	167.1 Å²	167.1	86%	0.855	81%	0.808	S	S	*	*			cis	-139.2	169.3	22.2	-159.3	175.3	-157	0	0	112.2
273	D	34.1	Very low	33.8	Very low	154 Å²	154	166.5 Å²	166.5	82%	0.824	81%	0.811	S	S	*	*			trans	-140.6	149.5	-177.3	-156.3	0	0	0	0	115.6
274	D	34	Very low	33.7	Very low	131 Å²	131	165.5 Å²	165.5	70%	0.701	81%	0.813	S	S	*	*			trans	68	177.5	159.5	-136.2	-8.9	0	0	0	123.3
275	K	32.9	Very low	33.5	Very low	186 Å²	186	161.4 Å²	161.4	81%	0.809	80%	0.803	S	S	*	*			trans	-119.5	-125.7	-142.3	-63.4	160.7	-175.7	160.7	0	116
276	P	53.6	Low	33.3	Very low	102 Å²	102	159.9 Å²	159.9	66%	0.662	80%	0.801	S	S	*	*				-137.1	165.4	-109.3	43	-24.8	0	0	0	120.1
277	V	36.1	Very low	33.3	Very low	118 Å²	118	153 Å²	153	72%	0.715	79%	0.79	S	S	*	*			trans	48.5	138.4	151.1	-63.3	0	0	0	0	123.3
278	K	37	Very low	33.4	Very low	181 Å²	181	153.7 Å²	153.7	79%	0.787	79%	0.788	S	S	*	*				171.6	117.9	109.4	-90.6	149.9	-170.9	164	0	117
279	R	35.6	Very low	33.2	Very low	227 Å²	227	154.1 Å²	154.1	86%	0.857	79%	0.79	S	S	*	*				44.3	133.4	128.4	-50.8	170.4	79.6	164.6	6.5	121.9
280	K	36.7	Very low	33.6	Very low	219 Å²	219	156.8 Å²	156.8	95%	0.952	79%	0.789	S	S	*	*				-172.8	166.5	111.5	-101.6	168.1	-176.2	-179.7	0	115
281	K	39.1	Very low	33.4	Very low	204 Å²	204	156.2 Å²	156.2	89%	0.887	79%	0.792	S	S	*	*			trans	-80.6	167.3	-164.8	-59.4	177.5	170.3	-174.1	0	115.9
282	A	30.7	Very low	34	Very low	91 Å²	91	155.6 Å²	155.6	75%	0.752	79%	0.789	S	S	*	*				131.1	151.6	122.9	0	0	0	0	0	114.9
283	I	29.6	Very low	33.9	Very low	140 Å²	140	156.5 Å²	156.5	72%	0.718	79%	0.793	S	S	*	*			cis	-166	141.7	-18.3	-107.4	164	0	0	0	106.3
284	L	30.7	Very low	34.2	Very low	158 Å²	158	157.7 Å²	157.7	83%	0.827	79%	0.791	S	S	*	*			trans	63.4	174.3	170.2	-77	171.2	0	0	0	115.8
285	S	26.6	Very low	34.1	Very low	82 Å²	82	161.1 Å²	161.1	57%	0.573	80%	0.803	S	S	*	*			cis	-166.2	168.7	-2.1	-106.8	0	0	0	0	108
286	D	26.1	Very low	34.1	Very low	151 Å²	151	158.2 Å²	158.2	81%	0.807	80%	0.796	S	S	*	*			cis	-146.1	-94.5	-10.8	-85.2	-33.1	0	0	0	112.6
287	S	29.2	Very low	33.3	Very low	97 Å²	97	161.2 Å²	161.2	68%	0.678	80%	0.799	S	S	*	*			trans	-124.4	163.6	-161.8	-110	0	0	0	0	116.4
288	E	28.8	Very low	33.9	Very low	173 Å²	173	161.6 Å²	161.6	81%	0.808	80%	0.803	S	S	*	*			trans	26.8	139	143.7	-66.7	145.1	134.9	0	0	120.6
289	D	26.4	Very low	33.8	Very low	158 Å²	158	157.7 Å²	157.7	85%	0.845	81%	0.805	S	S	*	*				-154.3	176.5	77.2	-136.7	-50.7	0	0	0	114.8
290	E	40.1	Very low	33.5	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	80%	0.796	S	S	*	*			trans	-105.8	167.5	177.3	-62.5	-167.3	130.3	0	0	113.1
291	D	29	Very low	33.8	Very low	168 Å²	168	149.3 Å²	149.3	90%	0.898	79%	0.79	S	S	*	*			trans	-157.6	119.6	160.3	-113	-33.9	0	0	0	110
292	E	44	Very low	33.6	Very low	166 Å²	166	150.3 Å²	150.3	78%	0.776	79%	0.788	S	S	*	*			trans	-97.4	140.5	168.8	-78.8	-155.6	144.9	0	0	110.4
293	E	31.9	Very low	33.9	Very low	203 Å²	203	151.3 Å²	151.3	95%	0.949	79%	0.789	S	S	*	*			trans	-130.8	144.4	154.9	-92.8	-156.5	156.2	0	0	112.4
294	K	39.9	Very low	33.9	Very low	179 Å²	179	156.8 Å²	156.8	78%	0.778	80%	0.801	S	S	*	*			trans	-153.5	116.5	-171.6	-153.6	-171.8	-154	160.4	0	109.6
295	E	31.7	Very low	34.1	Very low	203 Å²	203	153.6 Å²	153.6	95%	0.949	80%	0.797	S	S	*	*			trans	-144.3	167.1	165.9	-85.1	-130.6	137.2	0	0	111.5
296	D	34	Very low	34.3	Very low	124 Å²	124	155.9 Å²	155.9	66%	0.663	81%	0.808	S	S	*	*			trans	-151.9	127.4	-138.9	-168.7	26.4	0	0	0	116
297	K	37.2	Very low	34.9	Very low	166 Å²	166	153.8 Å²	153.8	72%	0.722	81%	0.805	S	S	*	*			trans	67.1	173.3	168.4	-36.8	-171.4	168.2	53	0	117
298	P	48.6	Very low	35	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	81%	0.809	S	S	*	*				-148.7	155.6	65.6	38.8	-17.5	0	0	0	120.2
299	A	33.4	Very low	35.4	Very low	100 Å²	100	154.7 Å²	154.7	83%	0.826	81%	0.807	S	S	*	*			trans	71.1	159.3	150.8	0	0	0	0	0	120.7
300	A	30.5	Very low	35.8	Very low	79 Å²	79	153.1 Å²	153.1	65%	0.653	80%	0.799	S	S	*	*			cis	-162.6	158.4	9.6	0	0	0	0	0	117.3
301	K	43	Very low	35.7	Very low	190 Å²	190	151.8 Å²	151.8	83%	0.826	79%	0.793	S	S	*	*			trans	85.8	110.1	139.4	-73.6	163.1	-174.6	169.8	0	125.9
302	R	33.8	Very low	35.8	Very low	225 Å²	225	150 Å²	150	85%	0.849	78%	0.784	S	S	*	*				95.1	112	125.1	-65.2	179.2	90.5	-176.6	9	125.5
303	S	37.5	Very low	35.3	Very low	112 Å²	112	147.1 Å²	147.1	78%	0.783	78%	0.782	S	S	*	*			trans	60.8	134.7	133.8	64.6	0	0	0	0	122.3
304	R	29.9	Very low	35.1	Very low	255 Å²	255	141.2 Å²	141.2	96%	0.962	78%	0.775	S	S	*	*				-173.7	163.2	55.1	-176.6	169.8	179.9	142.9	2.1	111.9
305	A	33.7	Very low	34.7	Very low	91 Å²	91	138.2 Å²	138.2	75%	0.752	78%	0.776	S	S	*	*			trans	-104.6	167.7	-160.8	0	0	0	0	0	119.5
306	V	32.5	Very low	34.7	Very low	131 Å²	131	134 Å²	134	79%	0.794	77%	0.77	S	S	*	*			trans	-163.4	125.3	137.7	-92.3	0	0	0	0	107.4
307	S	37.1	Very low	34.6	Very low	106 Å²	106	135.6 Å²	135.6	74%	0.741	78%	0.778	S	S	*	*				75	125.8	78.7	-61.7	0	0	0	0	112.2
308	D	32.1	Very low	34.2	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	78%	0.78	S	S	*	*			cis	-136.3	150.5	25.7	-91.7	-174	0	0	0	111.6
309	D	37.8	Very low	33.5	Very low	143 Å²	143	130 Å²	130	77%	0.765	77%	0.774	S	S	*	*				74	133.2	82.9	-121.2	-125.4	0	0	0	113.2
310	D	35.1	Very low	33.4	Very low	125 Å²	125	131.8 Å²	131.8	67%	0.668	78%	0.775	S	S	*	*			cis	-156.8	160.8	5.9	-159.5	-140.8	0	0	0	113.2
311	E	36.6	Very low	33.6	Very low	151 Å²	151	131 Å²	131	71%	0.706	78%	0.775	S	S	*	*			trans	4.1	162	151.2	-67.5	-59.4	104.9	0	0	122.9
312	N	32.5	Very low	34	Very low	131 Å²	131	128 Å²	128	70%	0.701	77%	0.774	S	S	*	*			cis	-166.7	175.3	-2.3	164.6	32.5	0	0	0	109.9
313	S	32.7	Very low	33.9	Very low	105 Å²	105	123 Å²	123	73%	0.734	77%	0.765	S	S	*	*			trans	-56.9	163.8	177.4	66.2	0	0	0	0	118.6
314	G	27.6	Very low	33.8	Very low	79 Å²	79	127.6 Å²	127.6	81%	0.814	77%	0.765	S	S	*	*			trans	179.9	131	164.5	0	0	0	0	0	113.7
315	S	30.8	Very low	34.1	Very low	115 Å²	115	120.8 Å²	120.8	80%	0.804	76%	0.756	S	S	*	*			trans	-121.4	-176.2	172.1	-174	0	0	0	0	109.6
316	S	31.6	Very low	34.2	Very low	116 Å²	116	124.6 Å²	124.6	81%	0.811	76%	0.763	S	S	*	*			trans	71.8	153.8	177.9	78.8	0	0	0	0	115.6
317	D	33.3	Very low	34.1	Very low	156 Å²	156	123.3 Å²	123.3	83%	0.834	77%	0.766	S	S	*	*			cis	-164.5	166.2	-19	167	44.4	0	0	0	107.5
318	G	27.5	Very low	33.9	Very low	73 Å²	73	122.9 Å²	122.9	75%	0.753	77%	0.769	S	S	*	*			trans	178.2	48.8	-177.6	0	0	0	0	0	118.3
319	S	34.3	Very low	34.1	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	77%	0.772	S	S	*	*			trans	-69.9	161.9	161.2	-152.6	0	0	0	0	110.1
320	V	31.6	Very low	33.6	Very low	137 Å²	137	124.9 Å²	124.9	83%	0.83	77%	0.769	S	S	*	*			cis	-150.3	176.7	26.6	-159.2	0	0	0	0	109.4
321	G	34.2	Very low	33.5	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	78%	0.778	S	S	*	*			trans	-70.6	-157.9	168.3	0	0	0	0	0	114.9
322	P	51.5	Low	33.2	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	78%	0.777	S	S	*	*			cis	-152.8	-173.2	34.5	42.7	-20.4	0	0	0	118.7
323	D	31.5	Very low	33.2	Very low	121 Å²	121	131 Å²	131	65%	0.647	78%	0.784	S	S	*	*			trans	87.2	147	138.2	-139.7	1.4	0	0	0	124.2
324	R	35.3	Very low	33	Very low	209 Å²	209	129.8 Å²	129.8	79%	0.789	79%	0.789	S	S	*	*			trans	64.9	136.2	157.7	-83.5	147.7	-148.8	-101.2	-6.5	124.9
325	S	36.7	Very low	33.3	Very low	111 Å²	111	132 Å²	132	78%	0.776	79%	0.792	S	S	*	*			trans	-90	143.7	176.2	54.6	0	0	0	0	114.7
326	L	35.2	Very low	33	Very low	171 Å²	171	134.1 Å²	134.1	90%	0.895	79%	0.794	S	S	*	*			trans	-158.3	166.8	155.3	52.4	159.7	0	0	0	111.4
327	A	31.1	Very low	33	Very low	105 Å²	105	134 Å²	134	87%	0.868	79%	0.793	S	S	*	*			trans	-131.4	152.1	-159.1	0	0	0	0	0	116.1
328	A	32.8	Very low	32.8	Very low	96 Å²	96	129.6 Å²	129.6	79%	0.793	79%	0.785	S	S	*	*			trans	-166.3	130.9	151.7	0	0	0	0	0	107.3
329	K	35.5	Very low	32.8	Very low	197 Å²	197	131.6 Å²	131.6	86%	0.857	79%	0.787	S	S	*	*			cis	92	115.1	20.2	-154.9	177.2	-174.8	176.4	0	115.3
330	L	27.9	Very low	32.5	Very low	134 Å²	134	133.1 Å²	133.1	70%	0.702	79%	0.788	S	S	*	*			trans	83.5	116.6	156.5	-151.3	83.7	0	0	0	121.1
331	R	33.7	Very low	32.6	Very low	227 Å²	227	134.4 Å²	134.4	86%	0.857	78%	0.784	S	S	*	*			trans	151.7	110	144.6	-85.8	162.9	-172.4	-81.7	-1.4	108
332	E	30.2	Very low	32.5	Very low	147 Å²	147	140 Å²	140	69%	0.687	79%	0.794	S	S	*	*			cis	93.3	130.9	28.2	-154.7	-160.1	155.9	0	0	114.2
333	L	32.8	Very low	31.5	Very low	161 Å²	161	139.8 Å²	139.8	84%	0.843	79%	0.785	S	S	*	*			trans	75.5	133.1	174.5	-49	-177.5	0	0	0	118.9
334	G	27.4	Very low	31.6	Very low	81 Å²	81	144 Å²	144	84%	0.835	79%	0.792	S	S	*	*			trans	145	67.5	162.5	0	0	0	0	0	117.7
335	S	34.4	Very low	31.4	Very low	125 Å²	125	139.5 Å²	139.5	87%	0.874	79%	0.793	S	S	*	*			trans	-128.8	129.3	167.5	-63.7	0	0	0	0	111.5
336	D	25.1	Very low	31.3	Very low	159 Å²	159	144 Å²	144	85%	0.85	80%	0.798	S	S	*	*			trans	-167.2	140.9	156.7	-130	-158.8	0	0	0	106.1
337	S	31.9	Very low	31.7	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	79%	0.79	S	S	*	*			cis	88.2	145.2	26.7	-148.2	0	0	0	0	115
338	G	28	Very low	31.6	Very low	63 Å²	63	142.3 Å²	142.3	65%	0.649	79%	0.787	S	S	*	*			trans	94.5	127.7	-166.9	0	0	0	0	0	112.6
339	S	28.4	Very low	31.4	Very low	115 Å²	115	142 Å²	142	80%	0.804	78%	0.784	S	S	*	*				70.7	133	61.3	-79.3	0	0	0	0	113.4
340	D	28.1	Very low	31.4	Very low	134 Å²	134	139.4 Å²	139.4	72%	0.717	79%	0.785	S	S	*	*			cis	-163.1	-177.6	-6.3	-138.7	-41.6	0	0	0	111.7
341	E	33.4	Very low	31.7	Very low	164 Å²	164	139.9 Å²	139.9	77%	0.766	78%	0.781	S	S	*	*			trans	73.4	122.8	155.3	-71.1	170.8	-131.1	0	0	121.7
342	E	32.3	Very low	31.7	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	78%	0.776	S	S	*	*			trans	36.2	144.8	138.2	-46.8	-159.9	147.3	0	0	121.8
343	D	30.2	Very low	31.8	Very low	120 Å²	120	137.7 Å²	137.7	64%	0.642	78%	0.783	S	S	*	*			cis	-156	166.6	37.7	-176.8	25.9	0	0	0	113.3
344	R	33	Very low	32.4	Very low	210 Å²	210	136.2 Å²	136.2	79%	0.792	77%	0.771	S	S	*	*			trans	20.8	128.4	157.8	-84.3	152.5	153.3	170.4	-3.4	119.1
345	S	31.3	Very low	33.3	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	77%	0.773	S	S	*	*			cis	-178	162.2	47.4	37.4	0	0	0	0	113.6
346	K	34.3	Very low	33.7	Very low	204 Å²	204	140.3 Å²	140.3	89%	0.887	77%	0.768	S	S	*	*			trans	-107.3	176.1	163.4	-69.1	-179	178.6	174.3	0	108.7
347	P	44.9	Very low	34.9	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	76%	0.757	S	S	*	*			cis	-132.3	-179.7	-0.3	41.2	-24.7	0	0	0	114.9
348	T	28.3	Very low	35.4	Very low	130 Å²	130	137 Å²	137	80%	0.798	74%	0.737	S	S	*	*			trans	162.7	122.6	133.5	36.1	0	0	0	0	107.8
349	A	29	Very low	36.1	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	74%	0.743	S	S	*	*				75	73	58.2	0	0	0	0	0	113.2	K351	A349-K351 VanDerWaalsContact C-N 3.31Å; A349-K351 PolarHBondContact O-N 3.36Å
350	V	36	Very low	36.7	Very low	143 Å²	143	136.2 Å²	136.2	87%	0.867	73%	0.733	S	S	*	*			trans	-76.9	80.7	171.7	-174.9	0	0	0	0	109.6
351	K	32.3	Very low	37.1	Very low	144 Å²	144	136.1 Å²	136.1	63%	0.626	73%	0.733	S	S	*	*			trans	-66.2	136.6	158.5	-78.7	178.3	168.5	171.8	0	107.7	A349 D383	A349-K351 VanDerWaalsContact C-N 3.31Å; A349-K351 PolarHBondContact O-N 3.36Å; K351-D383 WeakPolarHBondContact CE-OD1 3.37Å; K351-D383 IonicContact NZ-OD1 3.56Å; K351-D383 PolarHBondContact NZ-OD1 3.38Å; K351-D383 IonicContact NZ-OD2 2.83Å; K351-D383 PolarHBondContact NZ-OD2 3.22Å
352	K	35.2	Very low	37.5	Very low	174 Å²	174	133.5 Å²	133.5	76%	0.757	73%	0.732	S	S	*	*			trans	-119.9	121.8	-176.1	-177.9	-170.3	176.1	-165.5	0	108.7	E354	K352-E354 PolarHBondContact O-N 3.46Å
353	D	32.4	Very low	37.6	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	73%	0.726	S	S	*	*			trans	-68.2	115.9	-171	-50.1	-86.4	0	0	0	112.9
354	E	44.1	Very low	38.6	Very low	129 Å²	129	130.8 Å²	130.8	60%	0.603	73%	0.733	S	S	*	*			trans	-112.7	14.6	168.5	-68.9	-156.6	130.8	0	0	113.2	K352 A356	K352-E354 PolarHBondContact O-N 3.46Å; E354-A356 PolarHBondContact O-N 3.07Å; E354-A356 VanDerWaalsContact O-N 3.08Å
355	K	47.3	Very low	39.2	Very low	201 Å²	201	123.9 Å²	123.9	87%	0.874	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	31.5	173.8	-78.4	-160.2	171.8	-168	0	114.2
356	A	41.8	Very low	40.1	Very low	92 Å²	92	124.6 Å²	124.6	76%	0.76	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	17.1	-176.4	0	0	0	0	0	114.6	E354	E354-A356 PolarHBondContact O-N 3.07Å; E354-A356 VanDerWaalsContact O-N 3.08Å
357	L	50.2	Low	41.2	Very low	117 Å²	117	118.3 Å²	118.3	61%	0.613	69%	0.692	S	S	*	*	S	Bend	trans	-84.2	-22.7	-178.7	-170.3	61.7	0	0	0	113.6	L583	L357-L583 HydrophobicContact CD2-CD1 4.12Å
358	F	43.8	Very low	42.2	Very low	86 Å²	86	118 Å²	118	38%	0.377	68%	0.684	S	S	.	*			trans	-108.2	105.2	176.5	-173.5	-100.2	0	0	0	110.2	F594 L596	F358-F594 HydrophobicContact CB-CZ 4.39Å; F358-F594 HydrophobicContact CD1-CD1 4.31Å; F358-F594 AromaticContact CD1-CE1 3.7Å; F358-F594 HydrophobicContact CD1-CE1 3.7Å; F358-F594 AromaticContact CD1-CZ 3.81Å; F358-F594 HydrophobicContact CD1-CZ 3.81Å; F358-F594 HydrophobicContact CD2-CD1 4.37Å; F358-F594 AromaticContact CD2-CD2 3.79Å; F358-F594 HydrophobicContact CD2-CD2 3.79Å; F358-F594 AromaticContact CD2-CE1 3.99Å; F358-F594 HydrophobicContact CD2-CE1 3.99Å; F358-F594 AromaticContact CD2-CE2 3.39Å; F358-F594 HydrophobicContact CD2-CE2 3.39Å; F358-F594 HydrophobicContact CD2-CG 4.24Å; F358-F594 AromaticContact CD2-CZ 3.45Å; F358-F594 HydrophobicContact CD2-CZ 3.45Å; F358-F594 VanDerWaalsContact CD2-CZ 3.45Å; F358-F594 AromaticContact CE1-CD1 3.6Å; F358-F594 HydrophobicContact CE1-CD1 3.6Å; F358-F594 AromaticContact CE1-CE1 3.43Å; F358-F594 HydrophobicContact CE1-CE1 3.43Å; F358-F594 VanDerWaalsContact CE1-CE1 3.43Å; F358-F594 HydrophobicContact CE1-CG 4.17Å; F358-F594 AromaticContact CE1-CZ 3.93Å; F358-F594 HydrophobicContact CE1-CZ 3.93Å; F358-F594 HydrophobicContact CE2-CB 3.85Å; F358-F594 AromaticContact CE2-CD1 3.67Å; F358-F594 HydrophobicContact CE2-CD1 3.67Å; F358-F594 AromaticContact CE2-CD2 3.25Å; F358-F594 HydrophobicContact CE2-CD2 3.25Å; F358-F594 AromaticContact CE2-CE1 3.75Å; F358-F594 HydrophobicContact CE2-CE1 3.75Å; F358-F594 AromaticContact CE2-CE2 3.38Å; F358-F594 HydrophobicContact CE2-CE2 3.38Å; F358-F594 AromaticContact CE2-CG 3.37Å; F358-F594 HydrophobicContact CE2-CG 3.37Å; F358-F594 AromaticContact CE2-CZ 3.59Å; F358-F594 HydrophobicContact CE2-CZ 3.59Å; F358-F594 AromaticContact CG-CE1 3.97Å; F358-F594 HydrophobicContact CG-CE1 3.97Å; F358-F594 HydrophobicContact CG-CE2 4.02Å; F358-F594 AromaticContact CG-CZ 3.58Å; F358-F594 HydrophobicContact CG-CZ 3.58Å; F358-F594 HydrophobicContact CZ-CB 3.68Å; F358-F594 AromaticContact CZ-CD1 3.23Å; F358-F594 HydrophobicContact CZ-CD1 3.23Å; F358-F594 AromaticContact CZ-CD2 3.77Å; F358-F594 HydrophobicContact CZ-CD2 3.77Å; F358-F594 AromaticContact CZ-CE1 3.47Å; F358-F594 HydrophobicContact CZ-CE1 3.47Å; F358-F594 VanDerWaalsContact CZ-CE1 3.47Å; F358-F594 HydrophobicContact CZ-CE2 4.01Å; F358-F594 AromaticContact CZ-CG 3.34Å; F358-F594 HydrophobicContact CZ-CG 3.34Å; F358-F594 AromaticContact CZ-CZ 3.83Å; F358-F594 HydrophobicContact CZ-CZ 3.83Å; F358-L596 HydrophobicContact CE2-CD1 3.76Å; F358-L596 HydrophobicContact CE2-CD2 3.83Å; F358-L596 HydrophobicContact CE2-CG 4.41Å; F358-L596 HydrophobicContact CZ-CD1 3.65Å; F358-L596 HydrophobicContact CZ-CD2 4.44Å
359	G	42.9	Very low	44.1	Very low	77 Å²	77	117.8 Å²	117.8	79%	0.794	67%	0.674	S	S	*	*			trans	-105.7	84.9	-176.8	0	0	0	0	0	112.6
360	S	39.2	Very low	46.1	Very low	85 Å²	85	115.6 Å²	115.6	59%	0.594	65%	0.648	S	S	*	*			trans	-154.9	129.6	161	-158.6	0	0	0	0	108.4
361	D	38.3	Very low	47.8	Very low	131 Å²	131	115.3 Å²	115.3	70%	0.701	64%	0.638	S	S	*	*			trans	-138.2	89.1	-170.9	169.3	19.1	0	0	0	108.9
362	S	40.4	Very low	50	Low	109 Å²	109	114.8 Å²	114.8	76%	0.762	64%	0.636	S	S	*	*			trans	157.3	107.4	160.3	-71.8	0	0	0	0	111.3
363	D	34.5	Very low	51.9	Low	132 Å²	132	109 Å²	109	71%	0.706	61%	0.612	S	S	*	*				-163.3	108.4	98.8	-164.9	37.5	0	0	0	111.3	G365	D363-G365 PolarHBondContact O-N 3.35Å
364	S	51.1	Low	54.1	Low	112 Å²	112	103.5 Å²	103.5	78%	0.783	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	119.8	-162	58.6	0	0	0	0	113.4	D367	S364-D367 WeakPolarHBondContact CA-OD2 3.29Å
365	G	47	Very low	55.9	Low	66 Å²	66	98.7 Å²	98.7	68%	0.68	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	132.8	-7.9	175.7	0	0	0	0	0	114.2	D363	D363-G365 PolarHBondContact O-N 3.35Å
366	K	49.7	Very low	57.6	Low	129 Å²	129	92.7 Å²	92.7	56%	0.561	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-24.9	171.7	-136.6	178.6	-172.5	-174.7	0	113.8	D368 E369 E370	K366-D368 PolarHBondContact O-N 3.04Å; K366-E369 PolarHBondContact O-N 2.89Å; K366-E370 PolarHBondContact O-N 2.92Å
367	D	57.5	Low	59.6	Low	72 Å²	72	88.3 Å²	88.3	39%	0.385	51%	0.506	S	S	.	.	H	α-helix	trans	-51.8	-40.2	178.9	-49.3	-61.2	0	0	0	111.9	S364 E369 E370 E371	S364-D367 WeakPolarHBondContact CA-OD2 3.29Å; D367-E369 VanDerWaalsContact C-N 3.32Å; D367-E369 PolarHBondContact O-N 3.34Å; D367-E370 PolarHBondContact O-N 3.44Å; D367-E371 WeakPolarHBondContact O-CB 3.31Å; D367-E371 WeakPolarHBondContact O-CG 3.22Å; D367-E371 PolarHBondContact O-N 2.83Å
368	D	64.9	Low	61.1	Low	105 Å²	105	83.2 Å²	83.2	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-59	-35.8	177.4	-72.3	-61.3	0	0	0	113.9	K366 K372	K366-D368 PolarHBondContact O-N 3.04Å; D368-K372 WeakPolarHBondContact O-CD 3.45Å; D368-K372 WeakPolarHBondContact O-CE 3.35Å; D368-K372 WeakPolarHBondContact O-CG 3.44Å; D368-K372 PolarHBondContact O-N 3.36Å
369	E	69.3	Low	62.3	Low	127 Å²	127	80.2 Å²	80.2	59%	0.593	47%	0.472	S	S	*	.	H	α-helix	trans	-76.9	-42.4	176.6	-64.8	-169.6	152	0	0	110.6	K366 D367 K372 M373	K366-E369 PolarHBondContact O-N 2.89Å; D367-E369 VanDerWaalsContact C-N 3.32Å; D367-E369 PolarHBondContact O-N 3.34Å; E369-K372 PolarHBondContact O-N 3.1Å; E369-M373 VanDerWaalsContact O-CG 3.3Å; E369-M373 WeakPolarHBondContact O-CG 3.42Å; E369-M373 PolarHBondContact O-N 2.81Å
370	E	69.5	Low	62.7	Low	42 Å²	42	84.1 Å²	84.1	20%	0.196	47%	0.469	C	S	.	.	H	α-helix	trans	-65.7	-44.4	-179.8	-66.3	-174.5	-157.4	0	0	111.6	K366 D367 K372 M373 I374 F594	K366-E370 PolarHBondContact O-N 2.92Å; D367-E370 PolarHBondContact O-N 3.44Å; E370-K372 PolarHBondContact O-N 3.16Å; E370-M373 PolarHBondContact O-N 3.32Å; E370-I374 WeakPolarHBondContact O-CD1 3.18Å; E370-I374 VanDerWaalsContact O-CG1 3.26Å; E370-I374 WeakPolarHBondContact O-CG1 3.35Å; E370-I374 PolarHBondContact O-N 2.97Å; E370-F594 WeakPolarHBondContact OE2-CA 3.17Å
371	E	71.9	Confident	63.1	Low	138 Å²	138	84.2 Å²	84.2	65%	0.645	47%	0.47	S	S	*	.	H	α-helix	trans	-60.4	-42.8	174.6	-72.9	-161.2	161.9	0	0	112.2	D367 M373 I374 A375	D367-E371 WeakPolarHBondContact O-CB 3.31Å; D367-E371 WeakPolarHBondContact O-CG 3.22Å; D367-E371 PolarHBondContact O-N 2.83Å; E371-M373 PolarHBondContact O-N 2.8Å; E371-I374 WeakPolarHBondContact O-CB 3.46Å; E371-I374 PolarHBondContact O-N 3.18Å; E371-I374 VanDerWaalsContact O-N 3.09Å; E371-A375 PolarHBondContact O-N 2.87Å
372	K	78.3	Confident	63.4	Low	133 Å²	133	79.7 Å²	79.7	58%	0.578	45%	0.454	S	S	*	.	H	α-helix	trans	-60.7	-44.1	173.7	-71.3	169.6	-153.1	-51.3	0	111.6	D368 E369 E370 I374 A375 D376	D368-K372 WeakPolarHBondContact O-CD 3.45Å; D368-K372 WeakPolarHBondContact O-CE 3.35Å; D368-K372 WeakPolarHBondContact O-CG 3.44Å; D368-K372 PolarHBondContact O-N 3.36Å; E369-K372 PolarHBondContact O-N 3.1Å; E370-K372 PolarHBondContact O-N 3.16Å; K372-I374 PolarHBondContact O-N 2.88Å; K372-A375 PolarHBondContact O-N 3.16Å; K372-D376 PolarHBondContact O-N 2.92Å
373	M	75.1	Confident	63.4	Low	51 Å²	51	80.3 Å²	80.3	25%	0.251	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-25.2	175.7	-67.9	-155.5	-76.6	0	0	113.4	E369 E370 E371 I377 Q553 I593	E369-M373 VanDerWaalsContact O-CG 3.3Å; E369-M373 WeakPolarHBondContact O-CG 3.42Å; E369-M373 PolarHBondContact O-N 2.81Å; E370-M373 PolarHBondContact O-N 3.32Å; E371-M373 PolarHBondContact O-N 2.8Å; M373-I377 WeakPolarHBondContact O-CB 3.39Å; M373-I377 VanDerWaalsContact O-CD1 3.27Å; M373-I377 WeakPolarHBondContact O-CD1 3.18Å; M373-I377 WeakPolarHBondContact O-CG1 3.11Å; M373-I377 PolarHBondContact O-N 2.89Å; M373-Q553 PolarHBondContact SD-NE2 3.28Å; M373-I593 HydrophobicContact CB-CG2 4.39Å; M373-I593 HydrophobicContact CE-CG2 4.25Å
374	I	79.6	Confident	63.5	Low	40 Å²	40	83 Å²	83	21%	0.205	46%	0.458	C	S	.	.	H	α-helix	trans	-81	-40.6	176	-67.5	153.2	0	0	0	111	E370 E371 K372 D376 I377 F378 I593 F594	E370-I374 WeakPolarHBondContact O-CD1 3.18Å; E370-I374 VanDerWaalsContact O-CG1 3.26Å; E370-I374 WeakPolarHBondContact O-CG1 3.35Å; E370-I374 PolarHBondContact O-N 2.97Å; E371-I374 WeakPolarHBondContact O-CB 3.46Å; E371-I374 PolarHBondContact O-N 3.18Å; E371-I374 VanDerWaalsContact O-N 3.09Å; K372-I374 PolarHBondContact O-N 2.88Å; I374-D376 VanDerWaalsContact C-N 3.3Å; I374-D376 PolarHBondContact O-N 3.05Å; I374-I377 PolarHBondContact O-N 3.12Å; I374-F378 HydrophobicContact CG2-CD2 4.22Å; I374-F378 PolarHBondContact O-N 2.62Å; I374-I593 HydrophobicContact CG1-CD1 4.39Å; I374-I593 HydrophobicContact CG1-CG2 4.38Å; I374-F594 HydrophobicContact CD1-CD1 4.07Å; I374-F594 HydrophobicContact CD1-CE1 3.23Å; I374-F594 HydrophobicContact CD1-CE2 3.93Å; I374-F594 HydrophobicContact CD1-CZ 3.16Å; I374-F594 HydrophobicContact CG1-CZ 4.21Å
375	A	81.5	Confident	62.9	Low	28 Å²	28	87 Å²	87	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-58.8	-42.4	170.5	0	0	0	0	0	111.2	E371 K372 I377 G379 E380	E371-A375 PolarHBondContact O-N 2.87Å; K372-A375 PolarHBondContact O-N 3.16Å; A375-I377 PolarHBondContact O-N 2.71Å; A375-G379 WeakPolarHBondContact O-CA 3.33Å; A375-G379 PolarHBondContact O-N 3.18Å; A375-E380 HydrophobicContact CB-CB 4.4Å
376	D	83.1	Confident	62.5	Low	75 Å²	75	92.4 Å²	92.4	40%	0.401	47%	0.471	S	S	.	.	H	α-helix	trans	-54.4	-52.7	171.7	-77.2	-20.7	0	0	0	112	K372 I374 K557 R563	K372-D376 PolarHBondContact O-N 2.92Å; I374-D376 VanDerWaalsContact C-N 3.3Å; I374-D376 PolarHBondContact O-N 3.05Å; D376-K557 IonicContact OD2-NZ 2.74Å; D376-K557 PolarHBondContact OD2-NZ 3.27Å; D376-R563 VanDerWaalsContact O-CZ 3.24Å; D376-R563 PolarHBondContact O-NE 3.24Å; D376-R563 PolarHBondContact O-NH2 3.33Å
377	I	82.9	Confident	61.9	Low	0 Å²	0	95.8 Å²	95.8	0%	0	49%	0.489	C	S	.	.	H	α-helix	trans	-80.4	-41.5	-167.9	-71.3	167.8	0	0	0	112.5	M373 I374 A375 Q553 L556 K557 G562 R563 I593	M373-I377 WeakPolarHBondContact O-CB 3.39Å; M373-I377 VanDerWaalsContact O-CD1 3.27Å; M373-I377 WeakPolarHBondContact O-CD1 3.18Å; M373-I377 WeakPolarHBondContact O-CG1 3.11Å; M373-I377 PolarHBondContact O-N 2.89Å; I374-I377 PolarHBondContact O-N 3.12Å; A375-I377 PolarHBondContact O-N 2.71Å; I377-Q553 HydrophobicContact CD1-CG 3.74Å; I377-L556 HydrophobicContact CD1-CD2 4.34Å; I377-L556 HydrophobicContact CG2-CD2 3.39Å; I377-L556 HydrophobicContact CG2-CG 3.86Å; I377-K557 HydrophobicContact CD1-CG 3.79Å; I377-K557 HydrophobicContact CG1-CB 4.47Å; I377-K557 HydrophobicContact CG1-CD 4.47Å; I377-K557 HydrophobicContact CG1-CG 3.43Å; I377-K557 VanDerWaalsContact CG1-CG 3.43Å; I377-G562 CarbonylContact O-C 3.58Å; I377-G562 WeakPolarHBondContact O-CA 3.38Å; I377-R563 VanDerWaalsContact O-CG 3.26Å; I377-R563 WeakPolarHBondContact O-CG 3.48Å; I377-R563 PolarHBondContact O-N 3.01Å; I377-I593 HydrophobicContact CD1-CD1 3.59Å; I377-I593 HydrophobicContact CD1-CG1 4.48Å
378	F	81.5	Confident	60.8	Low	10 Å²	10	100.5 Å²	100.5	4%	0.044	51%	0.509	C	S	.	.	H	α-helix	trans	-113.5	-15.7	-170	-67.8	-72	0	0	0	114.2	I374 M566 I586 W589 I593	I374-F378 HydrophobicContact CG2-CD2 4.22Å; I374-F378 PolarHBondContact O-N 2.62Å; F378-M566 HydrophobicContact CB-CE 3.68Å; F378-M566 HydrophobicContact CB-SD 4.09Å; F378-M566 HydrophobicContact CD1-CB 4.39Å; F378-M566 HydrophobicContact CD1-CE 3.97Å; F378-M566 HydrophobicContact CG-CE 3.94Å; F378-I586 HydrophobicContact CD1-CG1 4.4Å; F378-I586 HydrophobicContact CD1-CG2 4.45Å; F378-I586 HydrophobicContact CE1-CB 4.2Å; F378-I586 HydrophobicContact CE1-CG1 3.9Å; F378-I586 HydrophobicContact CE1-CG2 3.98Å; F378-I586 HydrophobicContact CZ-CG2 4.21Å; F378-W589 HydrophobicContact CE1-CE3 4.49Å; F378-W589 HydrophobicContact CZ-CB 4.26Å; F378-I593 HydrophobicContact CE2-CD1 4.39Å
379	G	70.3	Confident	59.3	Low	23 Å²	23	105.1 Å²	105.1	24%	0.237	52%	0.524	C	S	.	.			trans	89.2	132.4	178.7	0	0	0	0	0	112.9	A375 S381	A375-G379 WeakPolarHBondContact O-CA 3.33Å; A375-G379 PolarHBondContact O-N 3.18Å; G379-S381 PolarHBondContact O-N 2.74Å
380	E	51.6	Low	57.4	Low	158 Å²	158	105 Å²	105	74%	0.738	53%	0.532	S	S	*	.			trans	-65.8	95.9	173.2	-177.9	122.1	-135.9	0	0	110.4	A375 G382	A375-E380 HydrophobicContact CB-CB 4.4Å; E380-G382 PolarHBondContact O-N 3.23Å
381	S	46.9	Very low	55.3	Low	88 Å²	88	105.6 Å²	105.6	62%	0.615	55%	0.55	S	S	*	*			trans	-83.3	56.6	175.8	175.3	0	0	0	0	109.9	G379 K570	G379-S381 PolarHBondContact O-N 2.74Å; S381-K570 PolarHBondContact OG-NZ 3.48Å
382	G	43.6	Very low	53	Low	35 Å²	35	108.6 Å²	108.6	36%	0.361	56%	0.561	S	S	.	*	S	Bend	trans	-120.2	13	-152.8	0	0	0	0	0	118.1	E380	E380-G382 PolarHBondContact O-N 3.23Å
383	D	40.9	Very low	50.5	Low	122 Å²	122	108.4 Å²	108.4	65%	0.652	57%	0.567	S	S	*	*			trans	75.2	47.4	165.4	-163.4	57.6	0	0	0	116.9	K351	K351-D383 WeakPolarHBondContact CE-OD1 3.37Å; K351-D383 IonicContact NZ-OD1 3.56Å; K351-D383 PolarHBondContact NZ-OD1 3.38Å; K351-D383 IonicContact NZ-OD2 2.83Å; K351-D383 PolarHBondContact NZ-OD2 3.22Å
384	E	37.9	Very low	48.5	Very low	190 Å²	190	112.4 Å²	112.4	89%	0.888	59%	0.585	S	S	*	*			trans	-115.9	99.1	165.8	-68.6	-174	166.6	0	0	111.3
385	E	38.7	Very low	46.3	Very low	196 Å²	196	118.1 Å²	118.1	92%	0.916	61%	0.611	S	S	*	*			trans	-100.8	66.7	161.1	-73.7	-168.9	146.3	0	0	108.9
386	E	38.3	Very low	43.8	Very low	179 Å²	179	125.3 Å²	125.3	84%	0.836	64%	0.639	S	S	*	*			trans	-152.9	64.7	175.9	-135.8	170.9	-102.8	0	0	114.4
387	E	36.9	Very low	41.2	Very low	200 Å²	200	128.9 Å²	128.9	94%	0.935	66%	0.657	S	S	*	*			trans	-114	80	149.6	-79.1	-163.8	159.9	0	0	108.7	F389	E387-F389 PolarHBondContact O-N 2.92Å; E387-F389 VanDerWaalsContact O-N 3.11Å
388	E	33.1	Very low	38.6	Very low	171 Å²	171	137.6 Å²	137.6	80%	0.799	70%	0.698	S	S	*	*			trans	-68.3	106.8	168	-79.7	-155.5	134.1	0	0	109.8	T390	E388-T390 VanDerWaalsContact C-N 3.33Å; E388-T390 PolarHBondContact O-N 3.17Å
389	F	35.1	Very low	36	Very low	202 Å²	202	141.4 Å²	141.4	89%	0.886	73%	0.732	S	S	*	*			trans	-58.5	90.4	170.5	171.1	-106.5	0	0	0	111.1	E387	E387-F389 PolarHBondContact O-N 2.92Å; E387-F389 VanDerWaalsContact O-N 3.11Å
390	T	28.1	Very low	34	Very low	123 Å²	123	145 Å²	145	76%	0.755	76%	0.759	S	S	*	*			trans	-100.5	143.7	157.8	60.3	0	0	0	0	108	E388	E388-T390 VanDerWaalsContact C-N 3.33Å; E388-T390 PolarHBondContact O-N 3.17Å
391	G	26.3	Very low	32.8	Very low	56 Å²	56	141.8 Å²	141.8	58%	0.577	75%	0.754	S	S	*	*			cis	140.3	100.8	-1.1	0	0	0	0	0	110
392	F	23.5	Very low	32.1	Very low	201 Å²	201	146.7 Å²	146.7	88%	0.882	76%	0.764	S	S	*	*			trans	67.7	153.7	-174.6	-85.4	-121.4	0	0	0	115.1
393	N	25.8	Very low	31.5	Very low	129 Å²	129	151.8 Å²	151.8	69%	0.69	78%	0.778	S	S	*	*			cis	-132.5	159.8	3	-166.6	37.6	0	0	0	114.1
394	Q	32.1	Very low	31.1	Very low	135 Å²	135	151.3 Å²	151.3	63%	0.631	78%	0.782	S	S	*	*			trans	-63.4	140.3	167.1	-179.7	65.6	21.5	0	0	112.3
395	E	33.8	Very low	30.7	Very low	160 Å²	160	150.1 Å²	150.1	75%	0.748	77%	0.774	S	S	*	*			trans	49.3	115.4	143.2	-164.1	171.1	-168.4	0	0	120.5
396	E	28.7	Very low	30.4	Very low	178 Å²	178	146.9 Å²	146.9	83%	0.832	76%	0.759	S	S	*	*				179.1	162	117.4	-172.2	163.8	-158.9	0	0	110.9
397	L	28.1	Very low	30	Very low	150 Å²	150	146 Å²	146	79%	0.785	76%	0.755	S	S	*	*			trans	90.2	117.9	155.1	-135.7	74	0	0	0	120.3
398	E	29	Very low	29.9	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	73%	0.731	S	S	*	*			trans	-70.9	-158.1	164.3	-48.7	172.5	112.7	0	0	112.1
399	A	27.3	Very low	29.8	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	72%	0.722	S	S	*	*			trans	77.4	71	160.7	0	0	0	0	0	119
400	A	27.2	Very low	29.6	Very low	97 Å²	97	132.1 Å²	132.1	80%	0.802	70%	0.703	S	S	*	*				41.6	128.9	123.3	0	0	0	0	0	122.2
401	S	27.3	Very low	30.1	Very low	91 Å²	91	128.7 Å²	128.7	64%	0.636	69%	0.687	S	S	*	*				178.5	131.9	111.1	-104.8	0	0	0	0	114.8
402	K	32.9	Very low	30.6	Very low	192 Å²	192	132.9 Å²	132.9	84%	0.835	70%	0.696	S	S	*	*			trans	63.8	149.4	142.2	-66.2	164.2	-170.5	164.7	0	117.6
403	Q	30.6	Very low	31.1	Very low	141 Å²	141	131.2 Å²	131.2	66%	0.659	69%	0.691	S	S	*	*			cis	-177.4	154.7	-18.2	-113.7	-96.4	-32.4	0	0	105
404	P	33.2	Very low	31.4	Very low	113 Å²	113	130.4 Å²	130.4	73%	0.734	70%	0.695	S	S	*	*				-152.7	141.1	86.8	36.4	-16.4	0	0	0	117.9
405	K	28.6	Very low	31.5	Very low	165 Å²	165	130.8 Å²	130.8	72%	0.717	70%	0.702	S	S	*	*			trans	60	117.5	146.3	-63.2	179.1	177.7	-179.3	0	118.7
406	Q	31.6	Very low	31.4	Very low	128 Å²	128	127.8 Å²	127.8	60%	0.598	70%	0.698	S	S	*	*				71.1	136	66.6	-69.7	-177.7	-50.7	0	0	113.7
407	Q	30.6	Very low	32	Very low	161 Å²	161	126.2 Å²	126.2	75%	0.752	70%	0.696	S	S	*	*			cis	-128.9	148.2	6.7	-89.6	117.5	-6.7	0	0	110.1
408	Q	35.2	Very low	32.8	Very low	90 Å²	90	126.9 Å²	126.9	42%	0.421	70%	0.695	S	S	.	*			cis	85.6	106.4	46.5	-73.4	176.5	-90.6	0	0	115.5	E87	E87-Q408 HydrophobicContact CG-CB 4.14Å; E87-Q408 VanDerWaalsContact OE1-CB 3.31Å; E87-Q408 WeakPolarHBondContact OE1-CB 3.45Å; E87-Q408 WeakPolarHBondContact OE1-CG 3.5Å; E87-Q408 PolarHBondContact OE1-NE2 2.81Å; E87-Q408 PolarHBondContact OE2-NE2 3.22Å
409	Q	31.7	Very low	33.3	Very low	131 Å²	131	126 Å²	126	61%	0.612	69%	0.691	S	S	*	*			trans	-169.5	130.5	156.9	-75	-141	-95	0	0	116.5	D85 S86 E87	D85-Q409 PolarHBondContact OD2-NE2 3.27Å; S86-Q409 WeakPolarHBondContact O-CA 3.41Å; S86-Q409 VanDerWaalsContact O-CB 3.28Å; S86-Q409 WeakPolarHBondContact O-CB 3.38Å; S86-Q409 WeakPolarHBondContact O-CG 3.45Å; S86-Q409 PolarHBondContact O-NE2 3.18Å; E87-Q409 VanDerWaalsContact C-C 3.47Å
410	A	31	Very low	34.1	Very low	60 Å²	60	127.2 Å²	127.2	50%	0.496	69%	0.689	S	S	.	*			trans	-172.1	-102.8	168.8	0	0	0	0	0	115.5	S86 E87	S86-A410 VanDerWaalsContact C-N 3.28Å; S86-A410 CarbonylContact C-O 3.38Å; S86-A410 WeakPolarHBondContact CA-O 3.38Å; S86-A410 PolarHBondContact N-O 2.67Å; S86-A410 PolarHBondContact O-N 2.95Å; E87-A410 PolarHBondContact N-O 2.84Å; E87-A410 CarbonylContact O-C 3.56Å; E87-A410 VanDerWaalsContact O-C 3.25Å; E87-A410 WeakPolarHBondContact O-CA 3.34Å; E87-A410 WeakPolarHBondContact O-CB 3.48Å; E87-A410 PolarHBondContact O-N 3.12Å
411	A	38	Very low	34.6	Very low	51 Å²	51	127.9 Å²	127.9	42%	0.421	68%	0.679	S	S	.	*			trans	17.8	142	174	0	0	0	0	0	123.6	S86 E87	S86-A411 PolarHBondContact OG-O 3.48Å; E87-A411 PolarHBondContact O-N 3.32Å
412	D	37.4	Very low	35.2	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	69%	0.686	S	S	*	*			cis	-161.5	170.7	-7.3	-145.5	-32.3	0	0	0	112.4
413	E	33.7	Very low	35.5	Very low	167 Å²	167	129.2 Å²	129.2	78%	0.78	68%	0.681	S	S	*	*			trans	44.4	114.7	156.1	69.7	-167	132.6	0	0	123.8
414	S	32	Very low	36.4	Very low	111 Å²	111	126.2 Å²	126.2	78%	0.776	69%	0.688	S	S	*	*				157.3	143.7	91	-157	0	0	0	0	118
415	D	33.5	Very low	36.9	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	69%	0.689	S	S	*	*			trans	85.3	130.4	147.8	-144.5	2.1	0	0	0	125.1
416	S	32.5	Very low	37.6	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	68%	0.68	S	S	*	*			trans	53.2	125	159.6	-65	0	0	0	0	122
417	D	40.3	Very low	38.5	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	69%	0.691	S	S	*	*			cis	91.7	137.9	33.3	-156.6	48.4	0	0	0	113.3
418	E	46.2	Very low	39.7	Very low	164 Å²	164	122.8 Å²	122.8	77%	0.766	69%	0.688	S	S	*	*			cis	-147.5	-169.7	3.6	-154	-173	168.8	0	0	110.9
419	E	38.1	Very low	40.4	Very low	166 Å²	166	127.3 Å²	127.3	78%	0.776	71%	0.706	S	S	*	*			trans	74.1	134.3	171.7	-74.2	-138.8	95.5	0	0	120.1
420	V	43.7	Very low	41.7	Very low	114 Å²	114	126.3 Å²	126.3	69%	0.691	70%	0.703	S	S	*	*			cis	-151.3	128.8	-27.4	-102.3	0	0	0	0	112.5
421	D	39.5	Very low	43.7	Very low	111 Å²	111	127.1 Å²	127.1	59%	0.594	71%	0.705	S	S	*	*			trans	1.1	127.6	134.9	-170	24.8	0	0	0	120.6
422	R	39.8	Very low	45	Very low	208 Å²	208	129.8 Å²	129.8	79%	0.785	71%	0.712	S	S	*	*				166.3	136.8	110.2	-87.1	-176.3	-174.6	139	27.9	117.8
423	S	37.5	Very low	46.6	Very low	104 Å²	104	129.9 Å²	129.9	73%	0.727	71%	0.706	S	S	*	*			trans	62.8	143.1	159.8	65.3	0	0	0	0	118
424	G	51	Low	48.8	Very low	78 Å²	78	125.9 Å²	125.9	80%	0.804	69%	0.69	S	S	*	*			cis	96.7	63.3	6.9	0	0	0	0	0	112.9
425	Q	44.1	Very low	51	Low	165 Å²	165	124.6 Å²	124.6	77%	0.771	67%	0.673	S	S	*	*			trans	-136	121.7	-178.7	-97.5	-171.7	-73.7	0	0	114.4
426	D	41.9	Very low	53	Low	97 Å²	97	122 Å²	122	52%	0.519	66%	0.658	S	S	.	*			trans	42.5	95.4	142.2	-68.7	-42.3	0	0	0	120.7	S428 F429	D426-S428 PolarHBondContact O-N 2.94Å; D426-S428 WeakPolarHBondContact OD1-CB 3.26Å; D426-F429 HydrophobicContact CB-CB 4.28Å
427	T	51.4	Low	55.3	Low	135 Å²	135	121.5 Å²	121.5	83%	0.828	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-63.6	-11.9	138.7	48.8	0	0	0	0	112.6	F429	T427-F429 VanDerWaalsContact C-N 3.29Å; T427-F429 PolarHBondContact O-N 3.19Å
428	S	55	Low	57.1	Low	98 Å²	98	117.3 Å²	117.3	69%	0.685	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-64.7	-23.9	176.7	-159	0	0	0	0	114.3	D426 M430	D426-S428 PolarHBondContact O-N 2.94Å; D426-S428 WeakPolarHBondContact OD1-CB 3.26Å; S428-M430 VanDerWaalsContact C-N 3.34Å; S428-M430 PolarHBondContact O-N 3.16Å
429	F	49.6	Very low	58.6	Low	185 Å²	185	117.1 Å²	117.1	81%	0.811	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-87.1	1.7	-174.7	-144.6	-94.4	0	0	0	114.2	D426 T427 S431	D426-F429 HydrophobicContact CB-CB 4.28Å; T427-F429 VanDerWaalsContact C-N 3.29Å; T427-F429 PolarHBondContact O-N 3.19Å; F429-S431 PolarHBondContact O-N 2.92Å
430	M	58.6	Low	60.4	Low	110 Å²	110	117.5 Å²	117.5	54%	0.542	62%	0.624	S	S	.	*	S	Bend	trans	-72.1	112.3	172.1	-65.8	-169.3	72.7	0	0	110	S428 I435	S428-M430 VanDerWaalsContact C-N 3.34Å; S428-M430 PolarHBondContact O-N 3.16Å; M430-I435 HydrophobicContact CB-CD1 4.21Å; M430-I435 HydrophobicContact CB-CG1 4.07Å; M430-I435 WeakPolarHBondContact O-CD1 3.29Å
431	S	73	Confident	62.1	Low	76 Å²	76	119.8 Å²	119.8	53%	0.531	62%	0.624	S	S	.	*			trans	-57.1	141.2	177.4	-172.4	0	0	0	0	111.3	F429 F433 D434 I435	F429-S431 PolarHBondContact O-N 2.92Å; S431-F433 PolarHBondContact O-N 3.19Å; S431-D434 PolarHBondContact O-N 3.37Å; S431-I435 PolarHBondContact O-N 3.47Å; S431-I435 VanDerWaalsContact O-N 3.13Å
432	D	65.4	Low	63.7	Low	108 Å²	108	117.4 Å²	117.4	58%	0.578	62%	0.62	S	S	*	*	H	α-helix	trans	-51	-30.5	175.1	178.7	51.2	0	0	0	112.2	D434 I435 M436	D432-D434 PolarHBondContact O-N 3.26Å; D432-I435 PolarHBondContact O-N 2.89Å; D432-M436 WeakPolarHBondContact O-CB 3.45Å; D432-M436 PolarHBondContact O-N 3.32Å; D432-M436 WeakPolarHBondContact OD2-CE 3.43Å
433	F	71.1	Confident	65	Low	144 Å²	144	115 Å²	115	63%	0.632	62%	0.62	S	S	*	*	H	α-helix	trans	-59.5	-45.2	173.1	-174.1	-97.6	0	0	0	113.2	S431 M436 L437	S431-F433 PolarHBondContact O-N 3.19Å; F433-M436 PolarHBondContact O-N 3.02Å; F433-L437 HydrophobicContact CE1-CD2 4.38Å; F433-L437 WeakPolarHBondContact O-CB 3.2Å; F433-L437 PolarHBondContact O-N 2.94Å
434	D	80.1	Confident	66.2	Low	84 Å²	84	114.4 Å²	114.4	45%	0.449	61%	0.608	S	S	.	*	H	α-helix	trans	-74.2	-36.4	178.3	-87.4	-34	0	0	0	112	S431 D432 M436 L437 A438	S431-D434 PolarHBondContact O-N 3.37Å; D432-D434 PolarHBondContact O-N 3.26Å; D434-M436 VanDerWaalsContact C-N 3.32Å; D434-M436 PolarHBondContact O-N 3Å; D434-L437 PolarHBondContact O-N 3.35Å; D434-A438 VanDerWaalsContact O-CB 3.26Å; D434-A438 WeakPolarHBondContact O-CB 3.4Å; D434-A438 PolarHBondContact O-N 3.29Å
435	I	78.4	Confident	66.8	Low	83 Å²	83	113.3 Å²	113.3	43%	0.426	59%	0.588	S	S	.	*	H	α-helix	trans	-60.8	-45.3	172.7	-61	174.9	0	0	0	109.8	M430 S431 D432 K439	M430-I435 HydrophobicContact CB-CD1 4.21Å; M430-I435 HydrophobicContact CB-CG1 4.07Å; M430-I435 WeakPolarHBondContact O-CD1 3.29Å; S431-I435 PolarHBondContact O-N 3.47Å; S431-I435 VanDerWaalsContact O-N 3.13Å; D432-I435 PolarHBondContact O-N 2.89Å; I435-K439 VanDerWaalsContact O-CB 3.25Å; I435-K439 WeakPolarHBondContact O-CB 3.45Å; I435-K439 PolarHBondContact O-N 3.24Å
436	M	76.1	Confident	67.6	Low	89 Å²	89	114.4 Å²	114.4	44%	0.438	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-35.1	178	-163.8	-175.6	-51.1	0	0	112.4	D432 F433 D434 R440	D432-M436 WeakPolarHBondContact O-CB 3.45Å; D432-M436 PolarHBondContact O-N 3.32Å; D432-M436 WeakPolarHBondContact OD2-CE 3.43Å; F433-M436 PolarHBondContact O-N 3.02Å; D434-M436 VanDerWaalsContact C-N 3.32Å; D434-M436 PolarHBondContact O-N 3Å; M436-R440 VanDerWaalsContact O-CB 3.22Å; M436-R440 WeakPolarHBondContact O-CB 3.5Å; M436-R440 PolarHBondContact O-N 2.89Å
437	L	79.7	Confident	68.4	Low	86 Å²	86	117.8 Å²	117.8	45%	0.45	60%	0.595	S	S	.	*	H	α-helix	trans	-68.5	-43	174.9	-170.7	66.4	0	0	0	111.2	F433 D434 R440 K441	F433-L437 HydrophobicContact CE1-CD2 4.38Å; F433-L437 WeakPolarHBondContact O-CB 3.2Å; F433-L437 PolarHBondContact O-N 2.94Å; D434-L437 PolarHBondContact O-N 3.35Å; L437-R440 PolarHBondContact O-N 3.22Å; L437-K441 WeakPolarHBondContact O-CB 3.37Å; L437-K441 PolarHBondContact O-N 3.23Å
438	A	78.7	Confident	68.6	Low	58 Å²	58	119.8 Å²	119.8	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-61.5	-47.8	172.8	0	0	0	0	0	111.3	D434 R440 K441 A442	D434-A438 VanDerWaalsContact O-CB 3.26Å; D434-A438 WeakPolarHBondContact O-CB 3.4Å; D434-A438 PolarHBondContact O-N 3.29Å; A438-R440 PolarHBondContact O-N 3.48Å; A438-K441 PolarHBondContact O-N 3.34Å; A438-K441 VanDerWaalsContact O-N 3.16Å; A438-A442 WeakPolarHBondContact O-CB 3.42Å; A438-A442 PolarHBondContact O-N 3.06Å
439	K	78.6	Confident	68.8	Low	161 Å²	161	125 Å²	125	70%	0.7	59%	0.592	S	S	*	*	H	α-helix	trans	-59	-43.4	176.1	-167.2	169.1	-174.3	171.7	0	111.9	I435 M443	I435-K439 VanDerWaalsContact O-CB 3.25Å; I435-K439 WeakPolarHBondContact O-CB 3.45Å; I435-K439 PolarHBondContact O-N 3.24Å; K439-M443 WeakPolarHBondContact O-CB 3.48Å; K439-M443 PolarHBondContact O-N 2.86Å
440	R	76.3	Confident	69.1	Low	174 Å²	174	122.1 Å²	122.1	66%	0.657	58%	0.581	S	S	*	*	H	α-helix	trans	-67.1	-37.7	174.6	-178.3	170.1	-76.4	168.9	-1.6	112.5	M436 L437 A438 N444	M436-R440 VanDerWaalsContact O-CB 3.22Å; M436-R440 WeakPolarHBondContact O-CB 3.5Å; M436-R440 PolarHBondContact O-N 2.89Å; L437-R440 PolarHBondContact O-N 3.22Å; A438-R440 PolarHBondContact O-N 3.48Å; R440-N444 VanDerWaalsContact O-CB 3.3Å; R440-N444 WeakPolarHBondContact O-CB 3.37Å; R440-N444 PolarHBondContact O-N 3.32Å
441	K	78.3	Confident	69	Low	162 Å²	162	127.3 Å²	127.3	70%	0.704	60%	0.595	S	S	*	*	H	α-helix	trans	-67.9	-40.4	177	-168.7	175.2	-177.7	-178.2	0	111.6	L437 A438 S445	L437-K441 WeakPolarHBondContact O-CB 3.37Å; L437-K441 PolarHBondContact O-N 3.23Å; A438-K441 PolarHBondContact O-N 3.34Å; A438-K441 VanDerWaalsContact O-N 3.16Å; K441-S445 WeakPolarHBondContact O-CB 3.37Å; K441-S445 PolarHBondContact O-N 2.74Å; K441-S445 PolarHBondContact O-OG 2.71Å
442	A	72.8	Confident	68	Low	60 Å²	60	130 Å²	130	50%	0.496	60%	0.603	S	S	.	*	H	α-helix	trans	-65.7	-44.9	173.1	0	0	0	0	0	112.4	A438 N444 S445 R446	A438-A442 WeakPolarHBondContact O-CB 3.42Å; A438-A442 PolarHBondContact O-N 3.06Å; A442-N444 VanDerWaalsContact C-N 3.31Å; A442-N444 PolarHBondContact O-N 2.69Å; A442-S445 PolarHBondContact O-N 3.47Å; A442-S445 PolarHBondContact O-OG 3.32Å; A442-R446 PolarHBondContact O-N 3.27Å
443	M	67.8	Low	67.5	Low	159 Å²	159	128.2 Å²	128.2	78%	0.783	61%	0.61	S	S	*	*	H	α-helix	trans	-64.2	-35.6	178.5	-159.5	177.5	-160.7	0	0	112.3	K439	K439-M443 WeakPolarHBondContact O-CB 3.48Å; K439-M443 PolarHBondContact O-N 2.86Å
444	N	62.9	Low	66.8	Low	90 Å²	90	123.6 Å²	123.6	48%	0.481	60%	0.604	S	S	.	*	H	α-helix	trans	-86.1	-21.8	-179.5	-155.3	16.5	0	0	0	113.8	R440 A442	R440-N444 VanDerWaalsContact O-CB 3.3Å; R440-N444 WeakPolarHBondContact O-CB 3.37Å; R440-N444 PolarHBondContact O-N 3.32Å; A442-N444 VanDerWaalsContact C-N 3.31Å; A442-N444 PolarHBondContact O-N 2.69Å
445	S	62.8	Low	65.7	Low	56 Å²	56	122.3 Å²	122.3	39%	0.392	60%	0.599	S	S	.	*	H	α-helix	trans	-72.9	-41.5	174.5	69.6	0	0	0	0	111.8	K441 A442 K447 R448 R449	K441-S445 WeakPolarHBondContact O-CB 3.37Å; K441-S445 PolarHBondContact O-N 2.74Å; K441-S445 PolarHBondContact O-OG 2.71Å; A442-S445 PolarHBondContact O-N 3.47Å; A442-S445 PolarHBondContact O-OG 3.32Å; S445-K447 VanDerWaalsContact C-N 3.25Å; S445-K447 PolarHBondContact O-N 2.94Å; S445-R448 PolarHBondContact O-N 2.65Å; S445-R449 PolarHBondContact O-N 3.02Å
446	R	60.8	Low	64.7	Low	188 Å²	188	127 Å²	127	71%	0.709	62%	0.616	S	S	*	*	H	α-helix	trans	-56.6	-40.1	175.4	-162.9	168.2	-176.3	158.7	-0.3	111.3	A442 R448 R449 H450	A442-R446 PolarHBondContact O-N 3.27Å; R446-R448 VanDerWaalsContact C-N 3.26Å; R446-R448 PolarHBondContact O-N 3.22Å; R446-R449 PolarHBondContact O-N 3.29Å; R446-H450 PolarHBondContact O-CD2 3.28Å
447	K	58.3	Low	64	Low	168 Å²	168	128 Å²	128	73%	0.73	62%	0.623	S	S	*	*	H	α-helix	trans	-69.4	-13.4	177.5	-164.5	164.2	-175.3	171.4	0	115	S445	S445-K447 VanDerWaalsContact C-N 3.25Å; S445-K447 PolarHBondContact O-N 2.94Å
448	R	56.4	Low	63.9	Low	177 Å²	177	126.5 Å²	126.5	67%	0.668	62%	0.619	S	S	*	*	H	α-helix	trans	-87.1	-40	172.4	-67.6	-172.6	-177.7	-164.7	-0.7	112.5	S445 R446 H450 R451	S445-R448 PolarHBondContact O-N 2.65Å; R446-R448 VanDerWaalsContact C-N 3.26Å; R446-R448 PolarHBondContact O-N 3.22Å; R448-H450 PolarHBondContact O-N 3.08Å; R448-R451 PolarHBondContact O-N 3.02Å
449	R	58.9	Low	64.1	Low	207 Å²	207	128.8 Å²	128.8	78%	0.781	62%	0.623	S	S	*	*	H	α-helix	trans	-59.4	-29.1	-179.3	-64.4	-173	-177.9	-174.7	0.5	113.8	S445 R446 R451	S445-R449 PolarHBondContact O-N 3.02Å; R446-R449 PolarHBondContact O-N 3.29Å; R449-R451 VanDerWaalsContact C-N 3.25Å; R449-R451 PolarHBondContact O-N 2.87Å
450	H	55.7	Low	64.4	Low	124 Å²	124	122.7 Å²	122.7	57%	0.574	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	14.8	175.2	-67.5	-79.8	0	0	0	114.6	R446 R448 T455	R446-H450 PolarHBondContact O-CD2 3.28Å; R448-H450 PolarHBondContact O-N 3.08Å; H450-T455 HydrophobicContact CB-CG2 4.32Å
451	R	56.4	Low	65.1	Low	219 Å²	219	117.2 Å²	117.2	83%	0.826	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-0.8	176.5	-147.2	168.4	77.5	159.9	5.9	114.5	R448 R449 G453	R448-R451 PolarHBondContact O-N 3.02Å; R449-R451 VanDerWaalsContact C-N 3.25Å; R449-R451 PolarHBondContact O-N 2.87Å; R451-G453 PolarHBondContact O-N 3.34Å
452	D	52.3	Low	65.6	Low	132 Å²	132	113.7 Å²	113.7	71%	0.706	58%	0.576	S	S	*	*	S	Bend	trans	-104.8	69.8	-174.4	-56.3	-36.3	0	0	0	110.6	G454	D452-G454 VanDerWaalsContact C-N 3.29Å; D452-G454 PolarHBondContact O-N 3.13Å
453	G	54.2	Low	66.5	Low	71 Å²	71	114.3 Å²	114.3	73%	0.732	57%	0.573	S	S	*	*	S	Bend	trans	73.7	-37.5	163.2	0	0	0	0	0	119.2	R451 T455	R451-G453 PolarHBondContact O-N 3.34Å; G453-T455 PolarHBondContact O-N 3.06Å
454	G	56.7	Low	67.7	Low	48 Å²	48	106.7 Å²	106.7	50%	0.495	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.6	-163.6	0	0	0	0	0	117.8	D452 F456 I457 S458	D452-G454 VanDerWaalsContact C-N 3.29Å; D452-G454 PolarHBondContact O-N 3.13Å; G454-F456 VanDerWaalsContact C-N 3.35Å; G454-F456 PolarHBondContact O-N 3.08Å; G454-I457 PolarHBondContact O-N 3.21Å; G454-S458 PolarHBondContact O-N 2.86Å
455	T	58.1	Low	69.1	Low	57 Å²	57	105 Å²	105	35%	0.35	53%	0.531	S	S	.	.	H	α-helix	trans	-67.5	-30.8	-168.8	57.9	0	0	0	0	114	H450 G453 I457 S458 D459	H450-T455 HydrophobicContact CB-CG2 4.32Å; G453-T455 PolarHBondContact O-N 3.06Å; T455-I457 PolarHBondContact O-N 2.77Å; T455-S458 PolarHBondContact O-N 2.94Å; T455-D459 VanDerWaalsContact O-CG 3.23Å; T455-D459 PolarHBondContact O-N 3.44Å
456	F	56.5	Low	70.5	Confident	180 Å²	180	104.4 Å²	104.4	79%	0.789	53%	0.529	S	S	*	.	H	α-helix	trans	-67.6	-21.5	-177.9	-171.5	-98.1	0	0	0	113.5	G454	G454-F456 VanDerWaalsContact C-N 3.35Å; G454-F456 PolarHBondContact O-N 3.08Å
457	I	62.4	Low	72.1	Confident	111 Å²	111	95.9 Å²	95.9	57%	0.569	50%	0.498	S	S	*	.	H	α-helix	trans	-87.2	-49.6	175.3	-60.3	175.2	0	0	0	109.2	G454 T455 D459 A460 D461	G454-I457 PolarHBondContact O-N 3.21Å; T455-I457 PolarHBondContact O-N 2.77Å; I457-D459 VanDerWaalsContact C-N 3.34Å; I457-D459 PolarHBondContact O-N 2.97Å; I457-A460 WeakPolarHBondContact O-CB 3.37Å; I457-A460 PolarHBondContact O-N 3.39Å; I457-D461 WeakPolarHBondContact CG2-OD2 3.09Å; I457-D461 PolarHBondContact O-N 3.12Å; I457-D461 VanDerWaalsContact O-N 3.13Å
458	S	77.2	Confident	73.9	Confident	54 Å²	54	88.7 Å²	88.7	38%	0.378	47%	0.467	S	S	.	.	H	α-helix	trans	-49.9	-50.3	175.8	-161.3	0	0	0	0	112.3	G454 T455 A460 D461 D462	G454-S458 PolarHBondContact O-N 2.86Å; T455-S458 PolarHBondContact O-N 2.94Å; S458-A460 PolarHBondContact O-N 3.37Å; S458-D461 PolarHBondContact O-N 2.99Å; S458-D462 VanDerWaalsContact C-OD2 3.28Å; S458-D462 VanDerWaalsContact O-CB 3.26Å; S458-D462 WeakPolarHBondContact O-CB 3.25Å; S458-D462 VanDerWaalsContact O-CG 3.28Å; S458-D462 PolarHBondContact O-N 3.44Å; S458-D462 PolarHBondContact OG-OD2 2.85Å
459	D	83.1	Confident	75.7	Confident	107 Å²	107	83.8 Å²	83.8	57%	0.572	46%	0.457	S	S	*	.	H	α-helix	trans	-57.3	-25.6	-177.1	-69.7	-4.8	0	0	0	113.3	T455 I457 V463	T455-D459 VanDerWaalsContact O-CG 3.23Å; T455-D459 PolarHBondContact O-N 3.44Å; I457-D459 VanDerWaalsContact C-N 3.34Å; I457-D459 PolarHBondContact O-N 2.97Å; D459-V463 VanDerWaalsContact O-CG2 3.28Å; D459-V463 WeakPolarHBondContact O-CG2 3.45Å
460	A	85.6	Confident	77.5	Confident	33 Å²	33	78.9 Å²	78.9	27%	0.273	44%	0.441	S	S	.	.	H	α-helix	trans	-84.8	-46.2	174.6	0	0	0	0	0	111.9	I457 S458 D462 V463 V464 L507	I457-A460 WeakPolarHBondContact O-CB 3.37Å; I457-A460 PolarHBondContact O-N 3.39Å; S458-A460 PolarHBondContact O-N 3.37Å; A460-D462 VanDerWaalsContact C-N 3.33Å; A460-D462 PolarHBondContact O-N 3.39Å; A460-V463 PolarHBondContact O-N 3.18Å; A460-V464 WeakPolarHBondContact O-CG2 3.25Å; A460-V464 PolarHBondContact O-N 3.04Å; A460-L507 HydrophobicContact CB-CD2 4.4Å
461	D	89.2	Confident	79.4	Confident	58 Å²	58	73 Å²	73	31%	0.31	41%	0.414	S	S	.	.	H	α-helix	trans	-67.5	-32.9	-179.7	-64.3	-24.1	0	0	0	112.2	I457 S458 V464 S465 T510	I457-D461 WeakPolarHBondContact CG2-OD2 3.09Å; I457-D461 PolarHBondContact O-N 3.12Å; I457-D461 VanDerWaalsContact O-N 3.13Å; S458-D461 PolarHBondContact O-N 2.99Å; D461-V464 PolarHBondContact O-N 3.03Å; D461-S465 VanDerWaalsContact O-CB 3.22Å; D461-S465 WeakPolarHBondContact O-CB 3.29Å; D461-S465 PolarHBondContact O-N 3.28Å; D461-S465 PolarHBondContact O-OG 3.04Å; D461-T510 WeakPolarHBondContact OD1-CG2 3.45Å
462	D	90.4	Very high	81.3	Confident	89 Å²	89	65.8 Å²	65.8	48%	0.476	39%	0.392	S	S	.	.	H	α-helix	trans	-64.9	-40.4	172	-75.5	-53.8	0	0	0	111	S458 A460 A466	S458-D462 VanDerWaalsContact C-OD2 3.28Å; S458-D462 VanDerWaalsContact O-CB 3.26Å; S458-D462 WeakPolarHBondContact O-CB 3.25Å; S458-D462 VanDerWaalsContact O-CG 3.28Å; S458-D462 PolarHBondContact O-N 3.44Å; S458-D462 PolarHBondContact OG-OD2 2.85Å; A460-D462 VanDerWaalsContact C-N 3.33Å; A460-D462 PolarHBondContact O-N 3.39Å; D462-A466 WeakPolarHBondContact O-CB 3.5Å; D462-A466 PolarHBondContact O-N 3.26Å
463	V	90.3	Very high	83.4	Confident	72 Å²	72	64.1 Å²	64.1	44%	0.436	38%	0.38	S	S	.	.	H	α-helix	trans	-70.9	-35.2	175.9	166.3	0	0	0	0	112	D459 A460 M467	D459-V463 VanDerWaalsContact O-CG2 3.28Å; D459-V463 WeakPolarHBondContact O-CG2 3.45Å; A460-V463 PolarHBondContact O-N 3.18Å; V463-M467 WeakPolarHBondContact O-CB 3.23Å; V463-M467 PolarHBondContact O-N 2.97Å
464	V	92.8	Very high	85.4	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-68.6	-50.6	174.5	161.1	0	0	0	0	110.5	A460 D461 A466 M467 I468 L507 F511 S514	A460-V464 WeakPolarHBondContact O-CG2 3.25Å; A460-V464 PolarHBondContact O-N 3.04Å; D461-V464 PolarHBondContact O-N 3.03Å; V464-A466 PolarHBondContact O-N 2.82Å; V464-M467 WeakPolarHBondContact O-CA 3.34Å; V464-M467 WeakPolarHBondContact O-CB 3.5Å; V464-M467 PolarHBondContact O-N 2.94Å; V464-I468 HydrophobicContact CG1-CD1 4.11Å; V464-I468 PolarHBondContact O-N 3.09Å; V464-L507 HydrophobicContact CG2-CB 4.48Å; V464-L507 HydrophobicContact CG2-CD2 4.45Å; V464-F511 HydrophobicContact CB-CD1 4.36Å; V464-F511 HydrophobicContact CB-CE1 4.18Å; V464-F511 HydrophobicContact CB-CZ 4.49Å; V464-F511 HydrophobicContact CG1-CD1 3.62Å; V464-F511 HydrophobicContact CG1-CE1 3.86Å; V464-F511 HydrophobicContact CG1-CG 4.14Å; V464-F511 HydrophobicContact CG2-CD1 4.21Å; V464-F511 HydrophobicContact CG2-CD2 4.18Å; V464-F511 HydrophobicContact CG2-CE1 4.05Å; V464-F511 HydrophobicContact CG2-CE2 4.02Å; V464-F511 HydrophobicContact CG2-CG 4.25Å; V464-F511 HydrophobicContact CG2-CZ 3.94Å; V464-S514 WeakPolarHBondContact CG1-OG 3.34Å
465	S	92.8	Very high	87.2	Confident	55 Å²	55	58.8 Å²	58.8	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-60.1	-48.8	178.8	-58.9	0	0	0	0	111.2	D461 M467 I468 T469	D461-S465 VanDerWaalsContact O-CB 3.22Å; D461-S465 WeakPolarHBondContact O-CB 3.29Å; D461-S465 PolarHBondContact O-N 3.28Å; D461-S465 PolarHBondContact O-OG 3.04Å; S465-M467 PolarHBondContact O-N 2.75Å; S465-M467 VanDerWaalsContact O-N 3.16Å; S465-I468 PolarHBondContact O-N 3.49Å; S465-T469 PolarHBondContact O-N 2.88Å; S465-T469 PolarHBondContact O-OG1 2.67Å; S465-T469 VanDerWaalsContact O-OG1 3.08Å
466	A	93.4	Very high	88.9	Confident	43 Å²	43	62.2 Å²	62.2	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-65.8	-16.4	176.7	0	0	0	0	0	114.1	D462 V464 K470	D462-A466 WeakPolarHBondContact O-CB 3.5Å; D462-A466 PolarHBondContact O-N 3.26Å; V464-A466 PolarHBondContact O-N 2.82Å; A466-K470 VanDerWaalsContact O-CD 3.28Å; A466-K470 WeakPolarHBondContact O-CD 3.32Å; A466-K470 VanDerWaalsContact O-CG 3.29Å; A466-K470 WeakPolarHBondContact O-CG 3.49Å
467	M	94.5	Very high	90.7	Very high	9 Å²	9	57.7 Å²	57.7	4%	0.044	32%	0.317	C	S	.	.	H	α-helix	trans	-80.8	-42.7	168.2	-175.3	61.6	66.9	0	0	111.2	V463 V464 S465 K470 M471 Q497 V498 H501 F511	V463-M467 WeakPolarHBondContact O-CB 3.23Å; V463-M467 PolarHBondContact O-N 2.97Å; V464-M467 WeakPolarHBondContact O-CA 3.34Å; V464-M467 WeakPolarHBondContact O-CB 3.5Å; V464-M467 PolarHBondContact O-N 2.94Å; S465-M467 PolarHBondContact O-N 2.75Å; S465-M467 VanDerWaalsContact O-N 3.16Å; M467-K470 PolarHBondContact O-N 2.87Å; M467-M471 WeakPolarHBondContact O-CG 3.38Å; M467-M471 PolarHBondContact O-N 3.24Å; M467-Q497 HydrophobicContact CE-CG 3.91Å; M467-V498 HydrophobicContact SD-CG2 3.83Å; M467-H501 HydrophobicContact CE-CB 4.32Å; M467-F511 HydrophobicContact CB-CE1 4.17Å; M467-F511 HydrophobicContact CB-CZ 4.34Å; M467-F511 HydrophobicContact CG-CE1 4.21Å; M467-F511 HydrophobicContact CG-CZ 4.26Å
468	I	94.9	Very high	92.2	Very high	17 Å²	17	52.7 Å²	52.7	9%	0.087	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-43.3	178.1	-68.4	172.5	0	0	0	111	V464 S465 K470 M471 N472 F511 S514 V516 A519	V464-I468 HydrophobicContact CG1-CD1 4.11Å; V464-I468 PolarHBondContact O-N 3.09Å; S465-I468 PolarHBondContact O-N 3.49Å; I468-K470 PolarHBondContact O-N 3.43Å; I468-M471 WeakPolarHBondContact O-CB 3.39Å; I468-M471 PolarHBondContact O-N 2.87Å; I468-N472 PolarHBondContact O-N 3.19Å; I468-F511 HydrophobicContact CD1-CD1 4.28Å; I468-F511 HydrophobicContact CG1-CD1 4.38Å; I468-F511 HydrophobicContact CG1-CE1 4.43Å; I468-S514 WeakPolarHBondContact CD1-O 3.25Å; I468-S514 WeakPolarHBondContact CD1-OG 3.29Å; I468-V516 HydrophobicContact CD1-CB 4Å; I468-V516 HydrophobicContact CD1-CG2 4.4Å; I468-V516 HydrophobicContact CG1-CB 4.28Å; I468-V516 HydrophobicContact CG1-CG2 4.14Å; I468-A519 HydrophobicContact CG2-CB 4.32Å
469	T	95.5	Very high	92.9	Very high	74 Å²	74	55.2 Å²	55.2	45%	0.454	29%	0.293	S	S	.	.	H	α-helix	trans	-55.6	-50.9	172.9	-51	0	0	0	0	110.8	S465 M471 N472 E473	S465-T469 PolarHBondContact O-N 2.88Å; S465-T469 PolarHBondContact O-OG1 2.67Å; S465-T469 VanDerWaalsContact O-OG1 3.08Å; T469-M471 VanDerWaalsContact C-N 3.29Å; T469-M471 PolarHBondContact O-N 3.23Å; T469-N472 PolarHBondContact O-N 2.86Å; T469-N472 VanDerWaalsContact O-N 3.07Å; T469-E473 HydrophobicContact CG2-CG 4.34Å; T469-E473 WeakPolarHBondContact O-CG 3.38Å; T469-E473 PolarHBondContact O-N 2.91Å
470	K	95.5	Very high	93.4	Very high	103 Å²	103	53.3 Å²	53.3	45%	0.448	29%	0.285	S	S	.	.	H	α-helix	trans	-63.3	-32	177.7	-73.2	171.8	-172	164.6	0	113.7	A466 M467 I468 E473 A474 L494	A466-K470 VanDerWaalsContact O-CD 3.28Å; A466-K470 WeakPolarHBondContact O-CD 3.32Å; A466-K470 VanDerWaalsContact O-CG 3.29Å; A466-K470 WeakPolarHBondContact O-CG 3.49Å; M467-K470 PolarHBondContact O-N 2.87Å; I468-K470 PolarHBondContact O-N 3.43Å; K470-E473 WeakPolarHBondContact CA-OE2 3.34Å; K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.12Å; K470-L494 HydrophobicContact CB-CD2 3.99Å; K470-L494 WeakPolarHBondContact O-CD2 3.35Å
471	M	96.2	Very high	93.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-46	171.8	-76.5	-179.3	65.4	0	0	111	M467 I468 T469 A475 V498 V516 A519 I520 W523	M467-M471 WeakPolarHBondContact O-CG 3.38Å; M467-M471 PolarHBondContact O-N 3.24Å; I468-M471 WeakPolarHBondContact O-CB 3.39Å; I468-M471 PolarHBondContact O-N 2.87Å; T469-M471 VanDerWaalsContact C-N 3.29Å; T469-M471 PolarHBondContact O-N 3.23Å; M471-A475 WeakPolarHBondContact O-CB 3.26Å; M471-A475 PolarHBondContact O-N 3.34Å; M471-A475 VanDerWaalsContact O-N 3.08Å; M471-V498 HydrophobicContact CE-CG1 3.89Å; M471-V498 HydrophobicContact CG-CG1 4.44Å; M471-V498 HydrophobicContact CG-CG2 3.57Å; M471-V498 HydrophobicContact SD-CB 4.38Å; M471-V498 HydrophobicContact SD-CG1 3.62Å; M471-V498 HydrophobicContact SD-CG2 3.81Å; M471-V516 HydrophobicContact SD-CG2 4.34Å; M471-A519 HydrophobicContact CB-CB 4.06Å; M471-A519 HydrophobicContact CE-CB 4Å; M471-I520 HydrophobicContact CE-CG1 4.07Å; M471-W523 HydrophobicContact CB-CZ2 4.16Å; M471-W523 HydrophobicContact CE-CD2 4.31Å; M471-W523 HydrophobicContact CE-CG 4.42Å; M471-W523 HydrophobicContact CG-CZ2 3.97Å; M471-W523 PolarHBondContact O-NE1 3.5Å
472	N	95.5	Very high	93.8	Very high	69 Å²	69	54 Å²	54	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-48.3	179.3	-65.9	-16.6	0	0	0	111.3	I468 T469 A474 A475 E476 A519	I468-N472 PolarHBondContact O-N 3.19Å; T469-N472 PolarHBondContact O-N 2.86Å; T469-N472 VanDerWaalsContact O-N 3.07Å; N472-A474 PolarHBondContact O-N 3.36Å; N472-A475 WeakPolarHBondContact O-CB 3.06Å; N472-A475 PolarHBondContact O-N 2.9Å; N472-E476 PolarHBondContact O-N 2.86Å; N472-A519 WeakPolarHBondContact OD1-CA 3.48Å; N472-A519 WeakPolarHBondContact OD1-CB 3.49Å
473	E	96.2	Very high	93.8	Very high	97 Å²	97	53.7 Å²	53.7	45%	0.453	29%	0.289	S	S	.	.	H	α-helix	trans	-50.2	-57	172.6	-71.3	168.7	169.8	0	0	110.9	T469 K470 A475 E476 E477	T469-E473 HydrophobicContact CG2-CG 4.34Å; T469-E473 WeakPolarHBondContact O-CG 3.38Å; T469-E473 PolarHBondContact O-N 2.91Å; K470-E473 WeakPolarHBondContact CA-OE2 3.34Å; E473-A475 PolarHBondContact O-N 3.5Å; E473-A475 VanDerWaalsContact O-N 3.13Å; E473-E476 PolarHBondContact O-N 2.88Å; E473-E477 WeakPolarHBondContact O-CB 3.16Å; E473-E477 VanDerWaalsContact O-CG 3.26Å; E473-E477 WeakPolarHBondContact O-CG 3.36Å; E473-E477 PolarHBondContact O-N 3.41Å
474	A	95.9	Very high	93.9	Very high	6 Å²	6	55.5 Å²	55.5	5%	0.05	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-26.6	-178.9	0	0	0	0	0	113.2	K470 N472 D478 K490 K491 L494 W523	K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.12Å; N472-A474 PolarHBondContact O-N 3.36Å; A474-D478 VanDerWaalsContact O-CB 3.31Å; A474-D478 WeakPolarHBondContact O-CB 3.29Å; A474-D478 PolarHBondContact O-N 3.28Å; A474-K490 HydrophobicContact CB-CB 4.09Å; A474-K491 HydrophobicContact CB-CG 4.46Å; A474-K491 WeakPolarHBondContact O-CG 3.07Å; A474-L494 HydrophobicContact CB-CD2 3.76Å; A474-W523 HydrophobicContact CB-CZ2 4.26Å
475	A	94.8	Very high	93.8	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-77.7	-44.5	176.3	0	0	0	0	0	112.9	M471 N472 E473 D478 R479 K491 E522	M471-A475 WeakPolarHBondContact O-CB 3.26Å; M471-A475 PolarHBondContact O-N 3.34Å; M471-A475 VanDerWaalsContact O-N 3.08Å; N472-A475 WeakPolarHBondContact O-CB 3.06Å; N472-A475 PolarHBondContact O-N 2.9Å; E473-A475 PolarHBondContact O-N 3.5Å; E473-A475 VanDerWaalsContact O-N 3.13Å; A475-D478 PolarHBondContact O-N 2.86Å; A475-R479 VanDerWaalsContact O-CB 3.32Å; A475-R479 WeakPolarHBondContact O-CB 3.37Å; A475-R479 PolarHBondContact O-N 3.43Å; A475-K491 HydrophobicContact CB-CD 3.79Å; A475-K491 HydrophobicContact CB-CG 4.32Å; A475-E522 HydrophobicContact CB-CG 3.86Å
476	E	93.9	Very high	93.8	Very high	130 Å²	130	67.7 Å²	67.7	61%	0.607	34%	0.338	S	S	*	.	H	α-helix	trans	-67.5	-41.4	176.6	179.7	171.2	-152.7	0	0	111.8	N472 E473 R479 T480	N472-E476 PolarHBondContact O-N 2.86Å; E473-E476 PolarHBondContact O-N 2.88Å; E476-R479 WeakPolarHBondContact O-CB 3.19Å; E476-R479 PolarHBondContact O-N 3.04Å; E476-R479 VanDerWaalsContact O-N 3.12Å; E476-T480 WeakPolarHBondContact O-CG2 3.46Å; E476-T480 PolarHBondContact O-N 3.16Å; E476-T480 PolarHBondContact O-OG1 3.09Å
477	E	94.2	Very high	93.6	Very high	84 Å²	84	70.6 Å²	70.6	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-38.1	174.8	-67	-169.3	107.7	0	0	111.7	E473 T480 L481 K490	E473-E477 WeakPolarHBondContact O-CB 3.16Å; E473-E477 VanDerWaalsContact O-CG 3.26Å; E473-E477 WeakPolarHBondContact O-CG 3.36Å; E473-E477 PolarHBondContact O-N 3.41Å; E477-T480 WeakPolarHBondContact CA-OG1 3.42Å; E477-T480 PolarHBondContact O-OG1 2.83Å; E477-L481 WeakPolarHBondContact O-CB 3.19Å; E477-L481 WeakPolarHBondContact O-CG 3.42Å; E477-L481 PolarHBondContact O-N 3.26Å; E477-K490 HydrophobicContact CB-CD 3.63Å; E477-K490 HydrophobicContact CG-CD 4.42Å; E477-K490 IonicContact OE1-NZ 3.18Å; E477-K490 PolarHBondContact OE1-NZ 3.07Å; E477-K490 WeakPolarHBondContact OE2-CD 3.26Å; E477-K490 WeakPolarHBondContact OE2-CE 3.34Å; E477-K490 IonicContact OE2-NZ 2.67Å; E477-K490 PolarHBondContact OE2-NZ 3.32Å
478	D	94.2	Very high	93.5	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.032	36%	0.362	C	S	.	.	H	α-helix	trans	-68.1	-34	169.9	-88	-7.8	0	0	0	111.9	A474 A475 N482 A488 L489 K490 K491	A474-D478 VanDerWaalsContact O-CB 3.31Å; A474-D478 WeakPolarHBondContact O-CB 3.29Å; A474-D478 PolarHBondContact O-N 3.28Å; A475-D478 PolarHBondContact O-N 2.86Å; D478-N482 WeakPolarHBondContact O-CB 3.38Å; D478-N482 VanDerWaalsContact O-CG 3.31Å; D478-N482 PolarHBondContact O-N 3.41Å; D478-N482 PolarHBondContact O-ND2 3.48Å; D478-A488 HydrophobicContact CB-CB 3.79Å; D478-A488 WeakPolarHBondContact OD1-CA 3.29Å; D478-A488 WeakPolarHBondContact OD1-CB 3.16Å; D478-L489 PolarHBondContact OD1-N 3.32Å; D478-K490 WeakPolarHBondContact OD1-CB 3.42Å; D478-K490 PolarHBondContact OD1-N 3.46Å; D478-K490 PolarHBondContact OD2-N 2.91Å; D478-K491 HydrophobicContact CB-CG 4.41Å; D478-K491 VanDerWaalsContact OD2-CB 3.29Å; D478-K491 WeakPolarHBondContact OD2-CB 3.41Å; D478-K491 WeakPolarHBondContact OD2-CG 3.4Å; D478-K491 PolarHBondContact OD2-N 3.45Å
479	R	91.6	Very high	93.5	Very high	108 Å²	108	75.1 Å²	75.1	41%	0.408	38%	0.381	S	S	.	.	H	α-helix	trans	-66.3	-46	177.3	-168.1	172.6	-175.8	146.8	-5.7	111	A475 E476 N482 S483 E522	A475-R479 VanDerWaalsContact O-CB 3.32Å; A475-R479 WeakPolarHBondContact O-CB 3.37Å; A475-R479 PolarHBondContact O-N 3.43Å; E476-R479 WeakPolarHBondContact O-CB 3.19Å; E476-R479 PolarHBondContact O-N 3.04Å; E476-R479 VanDerWaalsContact O-N 3.12Å; R479-N482 PolarHBondContact O-N 2.78Å; R479-S483 PolarHBondContact O-N 2.83Å; R479-S483 PolarHBondContact O-OG 3.1Å; R479-E522 IonicContact CZ-OE1 3.07Å; R479-E522 IonicContact NH1-OE1 2.94Å; R479-E522 PolarHBondContact NH1-OE1 3.31Å; R479-E522 IonicContact NH1-OE2 2.71Å; R479-E522 PolarHBondContact NH1-OE2 2.81Å
480	T	93.4	Very high	93.4	Very high	67 Å²	67	75 Å²	75	41%	0.411	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-38.7	175.6	52.7	0	0	0	0	112.4	E476 E477 S483 Q484	E476-T480 WeakPolarHBondContact O-CG2 3.46Å; E476-T480 PolarHBondContact O-N 3.16Å; E476-T480 PolarHBondContact O-OG1 3.09Å; E477-T480 WeakPolarHBondContact CA-OG1 3.42Å; E477-T480 PolarHBondContact O-OG1 2.83Å; T480-S483 PolarHBondContact O-N 3.41Å; T480-Q484 WeakPolarHBondContact O-CB 3.31Å; T480-Q484 VanDerWaalsContact O-CG 3.29Å; T480-Q484 WeakPolarHBondContact O-CG 3.39Å; T480-Q484 PolarHBondContact O-N 2.93Å
481	L	92.9	Very high	93.4	Very high	41 Å²	41	70.7 Å²	70.7	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-61.6	-44.8	172	-75.4	170.7	0	0	0	112.1	E477 Q484 K485 K486 A488	E477-L481 WeakPolarHBondContact O-CB 3.19Å; E477-L481 WeakPolarHBondContact O-CG 3.42Å; E477-L481 PolarHBondContact O-N 3.26Å; L481-Q484 CarbonylContact O-C 3.4Å; L481-Q484 WeakPolarHBondContact O-CA 3.46Å; L481-Q484 PolarHBondContact O-N 2.74Å; L481-K485 PolarHBondContact O-N 3.32Å; L481-K485 VanDerWaalsContact O-N 3.12Å; L481-K486 CarbonylContact C-O 3.59Å; L481-K486 HydrophobicContact CB-CB 4.37Å; L481-K486 HydrophobicContact CD2-CB 3.83Å; L481-K486 HydrophobicContact CD2-CD 3.93Å; L481-K486 PolarHBondContact O-N 3.01Å; L481-A488 HydrophobicContact CB-CB 4.33Å
482	N	90.8	Very high	93.3	Very high	64 Å²	64	74.2 Å²	74.2	34%	0.342	37%	0.374	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175.5	-77.8	-55.4	0	0	0	111.9	D478 R479 Q484 K485 A488 L527	D478-N482 WeakPolarHBondContact O-CB 3.38Å; D478-N482 VanDerWaalsContact O-CG 3.31Å; D478-N482 PolarHBondContact O-N 3.41Å; D478-N482 PolarHBondContact O-ND2 3.48Å; R479-N482 PolarHBondContact O-N 2.78Å; N482-Q484 VanDerWaalsContact C-N 3.27Å; N482-Q484 PolarHBondContact O-N 3.21Å; N482-K485 WeakPolarHBondContact O-CA 3.28Å; N482-K485 PolarHBondContact O-N 2.72Å; N482-A488 WeakPolarHBondContact ND2-CB 3.29Å; N482-L527 HydrophobicContact CB-CD2 4.35Å
483	S	91	Very high	93.3	Very high	82 Å²	82	75.9 Å²	75.9	57%	0.573	39%	0.387	S	S	*	.	H	α-helix	trans	-60.4	-36	173.6	-64.6	0	0	0	0	112.6	R479 T480 K485	R479-S483 PolarHBondContact O-N 2.83Å; R479-S483 PolarHBondContact O-OG 3.1Å; T480-S483 PolarHBondContact O-N 3.41Å; S483-K485 PolarHBondContact O-N 2.9Å
484	Q	92.9	Very high	93.3	Very high	111 Å²	111	72.4 Å²	72.4	52%	0.519	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	3.8	172.1	-67.7	177.1	26.9	0	0	113.8	T480 L481 N482 K486	T480-Q484 WeakPolarHBondContact O-CB 3.31Å; T480-Q484 VanDerWaalsContact O-CG 3.29Å; T480-Q484 WeakPolarHBondContact O-CG 3.39Å; T480-Q484 PolarHBondContact O-N 2.93Å; L481-Q484 CarbonylContact O-C 3.4Å; L481-Q484 WeakPolarHBondContact O-CA 3.46Å; L481-Q484 PolarHBondContact O-N 2.74Å; N482-Q484 VanDerWaalsContact C-N 3.27Å; N482-Q484 PolarHBondContact O-N 3.21Å; Q484-K486 HydrophobicContact CB-CD 4.01Å; Q484-K486 HydrophobicContact CB-CG 4.2Å; Q484-K486 PolarHBondContact O-N 3.19Å
485	K	90.6	Very high	93.3	Very high	200 Å²	200	72.7 Å²	72.7	87%	0.87	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	28.5	-176.4	-55.1	178.4	-176.2	174.8	0	113.7	L481 N482 S483	L481-K485 PolarHBondContact O-N 3.32Å; L481-K485 VanDerWaalsContact O-N 3.12Å; N482-K485 WeakPolarHBondContact O-CA 3.28Å; N482-K485 PolarHBondContact O-N 2.72Å; S483-K485 PolarHBondContact O-N 2.9Å
486	K	91.8	Very high	93.3	Very high	110 Å²	110	76.9 Å²	76.9	48%	0.478	40%	0.4	S	S	.	.			trans	-97.9	153.8	176.1	-68.8	171.8	-175.1	170.3	0	110.2	L481 Q484 A488	L481-K486 CarbonylContact C-O 3.59Å; L481-K486 HydrophobicContact CB-CB 4.37Å; L481-K486 HydrophobicContact CD2-CB 3.83Å; L481-K486 HydrophobicContact CD2-CD 3.93Å; L481-K486 PolarHBondContact O-N 3.01Å; Q484-K486 HydrophobicContact CB-CD 4.01Å; Q484-K486 HydrophobicContact CB-CG 4.2Å; Q484-K486 PolarHBondContact O-N 3.19Å; K486-A488 PolarHBondContact O-N 3.07Å
487	P	89.9	Confident	93.3	Very high	104 Å²	104	75 Å²	75	68%	0.675	39%	0.391	S	S	*	.			trans	-65.3	109.5	178.8	26.3	-34.3	0	0	0	111.6
488	A	92.6	Very high	93.3	Very high	26 Å²	26	71 Å²	71	22%	0.215	37%	0.372	C	S	.	.			trans	-75.2	124.3	169.7	0	0	0	0	0	110.5	D478 L481 N482 K486	D478-A488 HydrophobicContact CB-CB 3.79Å; D478-A488 WeakPolarHBondContact OD1-CA 3.29Å; D478-A488 WeakPolarHBondContact OD1-CB 3.16Å; L481-A488 HydrophobicContact CB-CB 4.33Å; N482-A488 WeakPolarHBondContact ND2-CB 3.29Å; K486-A488 PolarHBondContact O-N 3.07Å
489	L	93.2	Very high	93.3	Very high	95 Å²	95	71.5 Å²	71.5	50%	0.497	38%	0.375	S	S	.	.			trans	-140.6	-8.3	-173	-67.6	176.6	0	0	0	113.4	D478 L492 T493	D478-L489 PolarHBondContact OD1-N 3.32Å; L489-L492 HydrophobicContact CD2-CD2 4.29Å; L489-L492 WeakPolarHBondContact O-CB 3.37Å; L489-L492 PolarHBondContact O-N 2.91Å; L489-L492 VanDerWaalsContact O-N 3.16Å; L489-T493 PolarHBondContact O-N 3.43Å; L489-T493 PolarHBondContact O-OG1 3.05Å
490	K	94.6	Very high	93.4	Very high	73 Å²	73	71.7 Å²	71.7	32%	0.317	38%	0.382	S	S	.	.	H	α-helix	trans	-71	-45.1	-168	-64.7	-172	172.6	-168.2	0	111.9	A474 E477 D478 L492 T493 L494	A474-K490 HydrophobicContact CB-CB 4.09Å; E477-K490 HydrophobicContact CB-CD 3.63Å; E477-K490 HydrophobicContact CG-CD 4.42Å; E477-K490 IonicContact OE1-NZ 3.18Å; E477-K490 PolarHBondContact OE1-NZ 3.07Å; E477-K490 WeakPolarHBondContact OE2-CD 3.26Å; E477-K490 WeakPolarHBondContact OE2-CE 3.34Å; E477-K490 IonicContact OE2-NZ 2.67Å; E477-K490 PolarHBondContact OE2-NZ 3.32Å; D478-K490 WeakPolarHBondContact OD1-CB 3.42Å; D478-K490 PolarHBondContact OD1-N 3.46Å; D478-K490 PolarHBondContact OD2-N 2.91Å; K490-L492 PolarHBondContact O-N 3.24Å; K490-T493 WeakPolarHBondContact CA-OG1 3.32Å; K490-T493 PolarHBondContact O-N 3.03Å; K490-T493 VanDerWaalsContact O-N 3.16Å; K490-T493 PolarHBondContact O-OG1 2.76Å; K490-L494 WeakPolarHBondContact O-CB 3.48Å; K490-L494 PolarHBondContact O-N 3.14Å
491	K	95.2	Very high	93.3	Very high	12 Å²	12	69.5 Å²	69.5	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-40.3	169.7	-68.6	-166.4	-97.1	-159.8	0	111.1	A474 A475 D478 L494 L495 E522 W523 I537	A474-K491 HydrophobicContact CB-CG 4.46Å; A474-K491 WeakPolarHBondContact O-CG 3.07Å; A475-K491 HydrophobicContact CB-CD 3.79Å; A475-K491 HydrophobicContact CB-CG 4.32Å; D478-K491 HydrophobicContact CB-CG 4.41Å; D478-K491 VanDerWaalsContact OD2-CB 3.29Å; D478-K491 WeakPolarHBondContact OD2-CB 3.41Å; D478-K491 WeakPolarHBondContact OD2-CG 3.4Å; D478-K491 PolarHBondContact OD2-N 3.45Å; K491-L494 PolarHBondContact O-N 3.22Å; K491-L495 VanDerWaalsContact O-CB 3.31Å; K491-L495 WeakPolarHBondContact O-CB 3.31Å; K491-L495 PolarHBondContact O-N 2.94Å; K491-E522 PolarHBondContact NZ-O 3.01Å; K491-E522 VanDerWaalsContact NZ-O 3.13Å; K491-W523 HydrophobicContact CB-CD2 4.22Å; K491-W523 HydrophobicContact CB-CE3 3.96Å; K491-W523 HydrophobicContact CB-CH2 3.92Å; K491-W523 HydrophobicContact CB-CZ2 4.13Å; K491-W523 HydrophobicContact CB-CZ3 3.82Å; K491-W523 HydrophobicContact CD-CB 4.25Å; K491-W523 HydrophobicContact CD-CD2 3.62Å; K491-W523 HydrophobicContact CD-CE3 4.11Å; K491-W523 HydrophobicContact CD-CG 3.67Å; K491-W523 HydrophobicContact CD-CZ2 4.47Å; K491-W523 HydrophobicContact CG-CD2 3.89Å; K491-W523 HydrophobicContact CG-CE3 4.16Å; K491-W523 HydrophobicContact CG-CG 4.43Å; K491-W523 HydrophobicContact CG-CH2 4.18Å; K491-W523 HydrophobicContact CG-CZ2 3.86Å; K491-W523 HydrophobicContact CG-CZ3 4.31Å; K491-W523 VanDerWaalsContact O-CH2 3.29Å; K491-W523 WeakPolarHBondContact O-CH2 3.48Å; K491-W523 VanDerWaalsContact O-CZ3 3.22Å; K491-W523 WeakPolarHBondContact O-CZ3 3.29Å; K491-I537 HydrophobicContact CB-CD1 3.7Å
492	L	94.9	Very high	93.2	Very high	73 Å²	73	67.6 Å²	67.6	38%	0.382	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-40.5	178.1	-166.8	75.2	0	0	0	112.4	L489 K490 R536	L489-L492 HydrophobicContact CD2-CD2 4.29Å; L489-L492 WeakPolarHBondContact O-CB 3.37Å; L489-L492 PolarHBondContact O-N 2.91Å; L489-L492 VanDerWaalsContact O-N 3.16Å; K490-L492 PolarHBondContact O-N 3.24Å; L492-R536 HydrophobicContact CD1-CB 4.18Å
493	T	95.4	Very high	93.3	Very high	105 Å²	105	68.1 Å²	68.1	64%	0.644	36%	0.357	S	S	*	.	H	α-helix	trans	-71.6	-33.3	177.2	51.6	0	0	0	0	113.7	L489 K490 P496	L489-T493 PolarHBondContact O-N 3.43Å; L489-T493 PolarHBondContact O-OG1 3.05Å; K490-T493 WeakPolarHBondContact CA-OG1 3.32Å; K490-T493 PolarHBondContact O-N 3.03Å; K490-T493 VanDerWaalsContact O-N 3.16Å; K490-T493 PolarHBondContact O-OG1 2.76Å; T493-P496 WeakPolarHBondContact O-CD 3.42Å
494	L	95.4	Very high	93.3	Very high	23 Å²	23	67.7 Å²	67.7	12%	0.12	34%	0.344	C	S	.	.	H	α-helix	trans	-86.1	-24.2	-177.9	-178.4	59.9	0	0	0	112.8	K470 A474 K490 K491 P496 Q497 V498 W523	K470-L494 HydrophobicContact CB-CD2 3.99Å; K470-L494 WeakPolarHBondContact O-CD2 3.35Å; A474-L494 HydrophobicContact CB-CD2 3.76Å; K490-L494 WeakPolarHBondContact O-CB 3.48Å; K490-L494 PolarHBondContact O-N 3.14Å; K491-L494 PolarHBondContact O-N 3.22Å; L494-P496 VanDerWaalsContact C-CD 3.41Å; L494-Q497 HydrophobicContact CD1-CB 4.28Å; L494-Q497 PolarHBondContact O-N 2.84Å; L494-V498 HydrophobicContact CD1-CG2 4.42Å; L494-V498 HydrophobicContact CD2-CG2 4.47Å; L494-V498 HydrophobicContact CG-CG2 3.89Å; L494-V498 PolarHBondContact O-N 3.05Å; L494-V498 VanDerWaalsContact O-N 3.1Å; L494-W523 HydrophobicContact CB-CH2 4.03Å; L494-W523 HydrophobicContact CD2-CH2 4.34Å; L494-W523 HydrophobicContact CD2-CZ2 4.08Å; L494-W523 HydrophobicContact CG-CH2 4.18Å; L494-W523 HydrophobicContact CG-CZ2 4.41Å
495	L	95.4	Very high	93.2	Very high	12 Å²	12	68.7 Å²	68.7	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-46.3	-45.6	179.8	-176.5	69.6	0	0	0	114.7	K491 Q497 V498 V499 W523 I537 E540 L541	K491-L495 VanDerWaalsContact O-CB 3.31Å; K491-L495 WeakPolarHBondContact O-CB 3.31Å; K491-L495 PolarHBondContact O-N 2.94Å; L495-Q497 VanDerWaalsContact C-N 3.3Å; L495-Q497 PolarHBondContact O-N 2.83Å; L495-V498 PolarHBondContact O-N 2.96Å; L495-V499 HydrophobicContact CD1-CG2 3.91Å; L495-V499 HydrophobicContact CG-CG2 4.15Å; L495-V499 WeakPolarHBondContact O-CB 3.19Å; L495-V499 VanDerWaalsContact O-CG2 3.26Å; L495-V499 WeakPolarHBondContact O-CG2 3.24Å; L495-V499 PolarHBondContact O-N 3.2Å; L495-W523 HydrophobicContact CB-CZ3 4.04Å; L495-W523 HydrophobicContact CD1-CE3 4.37Å; L495-W523 HydrophobicContact CD1-CZ3 3.93Å; L495-I537 HydrophobicContact CD2-CG1 4.06Å; L495-E540 HydrophobicContact CD1-CB 4.32Å; L495-E540 HydrophobicContact CD2-CB 4.45Å; L495-L541 HydrophobicContact CD1-CD2 4.4Å; L495-L541 HydrophobicContact CD1-CG 4.32Å
496	P	95.8	Very high	93.1	Very high	89 Å²	89	65.4 Å²	65.4	58%	0.578	34%	0.341	S	S	*	.	H	α-helix	trans	-64.7	-33.9	-178.2	-20.7	34.5	0	0	0	112.9	T493 L494 M500	T493-P496 WeakPolarHBondContact O-CD 3.42Å; L494-P496 VanDerWaalsContact C-CD 3.41Å; P496-M500 WeakPolarHBondContact O-CB 3.26Å; P496-M500 PolarHBondContact O-N 3.36Å; P496-M500 VanDerWaalsContact O-N 3.07Å
497	Q	93.8	Very high	93	Very high	91 Å²	91	61 Å²	61	43%	0.425	32%	0.323	S	S	.	.	H	α-helix	trans	-74.4	-42	177.8	-167.1	-179.5	-1.3	0	0	111.1	M467 L494 L495 M500 H501	M467-Q497 HydrophobicContact CE-CG 3.91Å; L494-Q497 HydrophobicContact CD1-CB 4.28Å; L494-Q497 PolarHBondContact O-N 2.84Å; L495-Q497 VanDerWaalsContact C-N 3.3Å; L495-Q497 PolarHBondContact O-N 2.83Å; Q497-M500 HydrophobicContact CG-CE 4.28Å; Q497-M500 PolarHBondContact O-N 3.44Å; Q497-H501 PolarHBondContact O-CD2 3.21Å; Q497-H501 PolarHBondContact O-N 3.05Å
498	V	94.2	Very high	93.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-52.5	173.5	169.8	0	0	0	0	110.3	M467 M471 L494 L495 M500 H501 L502 W523	M467-V498 HydrophobicContact SD-CG2 3.83Å; M471-V498 HydrophobicContact CE-CG1 3.89Å; M471-V498 HydrophobicContact CG-CG1 4.44Å; M471-V498 HydrophobicContact CG-CG2 3.57Å; M471-V498 HydrophobicContact SD-CB 4.38Å; M471-V498 HydrophobicContact SD-CG1 3.62Å; M471-V498 HydrophobicContact SD-CG2 3.81Å; L494-V498 HydrophobicContact CD1-CG2 4.42Å; L494-V498 HydrophobicContact CD2-CG2 4.47Å; L494-V498 HydrophobicContact CG-CG2 3.89Å; L494-V498 PolarHBondContact O-N 3.05Å; L494-V498 VanDerWaalsContact O-N 3.1Å; L495-V498 PolarHBondContact O-N 2.96Å; V498-M500 VanDerWaalsContact C-N 3.27Å; V498-M500 PolarHBondContact O-N 3.32Å; V498-H501 PolarHBondContact O-N 3.25Å; V498-L502 HydrophobicContact CG1-CD1 3.55Å; V498-L502 HydrophobicContact CG1-CG 4.12Å; V498-L502 WeakPolarHBondContact O-CG 3.24Å; V498-L502 PolarHBondContact O-N 3.21Å; V498-W523 HydrophobicContact CG2-CH2 4.18Å
499	V	94	Very high	93	Very high	16 Å²	16	61.8 Å²	61.8	10%	0.097	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-36.5	178.2	170.3	0	0	0	0	112	L495 K503 E540 I544	L495-V499 HydrophobicContact CD1-CG2 3.91Å; L495-V499 HydrophobicContact CG-CG2 4.15Å; L495-V499 WeakPolarHBondContact O-CB 3.19Å; L495-V499 VanDerWaalsContact O-CG2 3.26Å; L495-V499 WeakPolarHBondContact O-CG2 3.24Å; L495-V499 PolarHBondContact O-N 3.2Å; V499-K503 HydrophobicContact CG1-CD 3.86Å; V499-K503 WeakPolarHBondContact O-CB 3.28Å; V499-K503 VanDerWaalsContact O-CG 3.32Å; V499-K503 WeakPolarHBondContact O-CG 3.46Å; V499-K503 PolarHBondContact O-N 3.13Å; V499-E540 HydrophobicContact CG2-CB 3.82Å; V499-E540 HydrophobicContact CG2-CG 4.32Å; V499-I544 HydrophobicContact CG1-CD1 4.38Å; V499-I544 HydrophobicContact CG2-CG1 4.45Å
500	M	93.2	Very high	92.9	Very high	111 Å²	111	59.1 Å²	59.1	55%	0.547	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-34.2	174.5	179.9	-178.1	67.5	0	0	113	P496 Q497 V498	P496-M500 WeakPolarHBondContact O-CB 3.26Å; P496-M500 PolarHBondContact O-N 3.36Å; P496-M500 VanDerWaalsContact O-N 3.07Å; Q497-M500 HydrophobicContact CG-CE 4.28Å; Q497-M500 PolarHBondContact O-N 3.44Å; V498-M500 VanDerWaalsContact C-N 3.27Å; V498-M500 PolarHBondContact O-N 3.32Å
501	H	91.8	Very high	92.8	Very high	21 Å²	21	55.6 Å²	55.6	10%	0.097	29%	0.285	C	S	.	.	H	α-helix	trans	-79.8	-45.2	177.8	-83.2	-121.9	0	0	0	112.1	M467 Q497 V498 K503 K504 F511	M467-H501 HydrophobicContact CE-CB 4.32Å; Q497-H501 PolarHBondContact O-CD2 3.21Å; Q497-H501 PolarHBondContact O-N 3.05Å; V498-H501 PolarHBondContact O-N 3.25Å; H501-K503 PolarHBondContact O-N 3.1Å; H501-K504 VanDerWaalsContact O-CB 3.29Å; H501-K504 WeakPolarHBondContact O-CB 3.5Å; H501-K504 PolarHBondContact O-N 2.97Å; H501-F511 HydrophobicContact CB-CE2 4.11Å; H501-F511 HydrophobicContact CB-CZ 3.97Å
502	L	90.8	Very high	92.6	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-68.6	-17	-178.9	-59	179.9	0	0	0	113.6	V498 K504 K508 F511 V516 I520 I544	V498-L502 HydrophobicContact CG1-CD1 3.55Å; V498-L502 HydrophobicContact CG1-CG 4.12Å; V498-L502 WeakPolarHBondContact O-CG 3.24Å; V498-L502 PolarHBondContact O-N 3.21Å; L502-K504 VanDerWaalsContact C-N 3.34Å; L502-K508 WeakPolarHBondContact O-CE 3.45Å; L502-F511 HydrophobicContact CD2-CB 4.29Å; L502-F511 HydrophobicContact CD2-CD1 3.66Å; L502-F511 HydrophobicContact CD2-CD2 3.6Å; L502-F511 HydrophobicContact CD2-CE1 3.8Å; L502-F511 HydrophobicContact CD2-CE2 3.74Å; L502-F511 HydrophobicContact CD2-CG 3.59Å; L502-F511 HydrophobicContact CD2-CZ 3.85Å; L502-V516 HydrophobicContact CD2-CG2 3.94Å; L502-I520 HydrophobicContact CD1-CD1 4.19Å; L502-I544 HydrophobicContact CB-CD1 4.03Å; L502-I544 HydrophobicContact CB-CG2 3.75Å; L502-I544 HydrophobicContact CD1-CG2 3.79Å; L502-I544 HydrophobicContact CG-CG2 4.39Å
503	K	92.3	Very high	92.4	Very high	76 Å²	76	58.8 Å²	58.8	33%	0.33	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.4	171.6	-77.3	173.2	170.8	155.8	0	114.2	V499 H501 Q505 E540 I544 E547	V499-K503 HydrophobicContact CG1-CD 3.86Å; V499-K503 WeakPolarHBondContact O-CB 3.28Å; V499-K503 VanDerWaalsContact O-CG 3.32Å; V499-K503 WeakPolarHBondContact O-CG 3.46Å; V499-K503 PolarHBondContact O-N 3.13Å; H501-K503 PolarHBondContact O-N 3.1Å; K503-Q505 PolarHBondContact O-N 3.36Å; K503-E540 IonicContact NZ-OE2 3.33Å; K503-E540 PolarHBondContact NZ-OE2 3.23Å; K503-I544 HydrophobicContact CD-CD1 4.07Å; K503-I544 HydrophobicContact CG-CD1 3.58Å; K503-E547 WeakPolarHBondContact CE-OE1 3.2Å; K503-E547 IonicContact NZ-OE1 2.67Å
504	K	91.5	Very high	92.2	Very high	73 Å²	73	56 Å²	56	32%	0.317	29%	0.288	S	S	.	.			trans	-77.5	107	174.1	-65.6	172	-179.1	172.2	0	109.7	H501 L502 D506 L507 K508	H501-K504 VanDerWaalsContact O-CB 3.29Å; H501-K504 WeakPolarHBondContact O-CB 3.5Å; H501-K504 PolarHBondContact O-N 2.97Å; L502-K504 VanDerWaalsContact C-N 3.34Å; K504-D506 WeakPolarHBondContact CB-OD1 3.35Å; K504-D506 PolarHBondContact O-N 3.4Å; K504-L507 HydrophobicContact CB-CB 4.33Å; K504-L507 HydrophobicContact CB-CD1 4.28Å; K504-L507 HydrophobicContact CB-CG 4.16Å; K504-L507 HydrophobicContact CD-CD1 3.64Å; K504-L507 HydrophobicContact CD-CG 4.28Å; K504-L507 PolarHBondContact O-N 3.25Å; K504-K508 PolarHBondContact O-N 3.05Å
505	Q	90.3	Very high	91.9	Very high	132 Å²	132	56.2 Å²	56.2	62%	0.617	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-56.8	-37.3	-178.3	-59.2	-71.8	6.8	0	0	111.6	K503 L507 K508	K503-Q505 PolarHBondContact O-N 3.36Å; Q505-L507 PolarHBondContact O-N 3.49Å; Q505-K508 VanDerWaalsContact CD-NZ 3.34Å; Q505-K508 PolarHBondContact O-N 2.98Å; Q505-K508 VanDerWaalsContact OE1-CD 3.3Å
506	D	90.2	Very high	91.9	Very high	131 Å²	131	55.7 Å²	55.7	70%	0.701	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-62.5	-13.5	176.1	48.3	-57.3	0	0	0	115.3	K504	K504-D506 WeakPolarHBondContact CB-OD1 3.35Å; K504-D506 PolarHBondContact O-N 3.4Å
507	L	89.4	Confident	91.7	Very high	18 Å²	18	51.5 Å²	51.5	9%	0.094	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-113.8	-2.8	174.5	-58.3	-177.1	0	0	0	113.4	A460 V464 K504 Q505 E509 T510 F511	A460-L507 HydrophobicContact CB-CD2 4.4Å; V464-L507 HydrophobicContact CG2-CB 4.48Å; V464-L507 HydrophobicContact CG2-CD2 4.45Å; K504-L507 HydrophobicContact CB-CB 4.33Å; K504-L507 HydrophobicContact CB-CD1 4.28Å; K504-L507 HydrophobicContact CB-CG 4.16Å; K504-L507 HydrophobicContact CD-CD1 3.64Å; K504-L507 HydrophobicContact CD-CG 4.28Å; K504-L507 PolarHBondContact O-N 3.25Å; Q505-L507 PolarHBondContact O-N 3.49Å; L507-E509 PolarHBondContact O-N 3.02Å; L507-T510 PolarHBondContact O-OG1 2.88Å; L507-T510 VanDerWaalsContact O-OG1 3.12Å; L507-F511 HydrophobicContact CB-CD2 3.68Å; L507-F511 HydrophobicContact CB-CE2 3.75Å; L507-F511 HydrophobicContact CD1-CE2 4Å; L507-F511 VanDerWaalsContact O-CB 3.29Å; L507-F511 WeakPolarHBondContact O-CB 3.49Å; L507-F511 WeakPolarHBondContact O-CD2 3.47Å; L507-F511 PolarHBondContact O-N 2.94Å
508	K	90.6	Very high	91.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-36.4	-171	-78.9	-178.3	-176.4	172.6	0	113.4	L502 K504 Q505 I512 E547 L548 P549	L502-K508 WeakPolarHBondContact O-CE 3.45Å; K504-K508 PolarHBondContact O-N 3.05Å; Q505-K508 VanDerWaalsContact CD-NZ 3.34Å; Q505-K508 PolarHBondContact O-N 2.98Å; Q505-K508 VanDerWaalsContact OE1-CD 3.3Å; K508-I512 WeakPolarHBondContact O-CD1 3.47Å; K508-I512 VanDerWaalsContact O-CG1 3.25Å; K508-I512 WeakPolarHBondContact O-CG1 3.16Å; K508-I512 PolarHBondContact O-N 3.24Å; K508-I512 VanDerWaalsContact O-N 3.09Å; K508-E547 PolarHBondContact NZ-O 2.94Å; K508-L548 HydrophobicContact CB-CD2 4.31Å; K508-L548 HydrophobicContact CD-CD2 3.99Å; K508-L548 HydrophobicContact CG-CD2 3.91Å; K508-P549 HydrophobicContact CB-CG 4.47Å
509	E	90.4	Very high	91.8	Very high	141 Å²	141	50.1 Å²	50.1	66%	0.659	27%	0.266	S	S	*	.	H	α-helix	trans	-67.4	-53.3	177.2	-67.8	169.5	177.8	0	0	109.5	L507 F511 I512 D513	L507-E509 PolarHBondContact O-N 3.02Å; E509-F511 VanDerWaalsContact C-N 3.3Å; E509-F511 PolarHBondContact O-N 2.76Å; E509-I512 WeakPolarHBondContact O-CA 3.3Å; E509-I512 WeakPolarHBondContact O-CB 3.49Å; E509-I512 PolarHBondContact O-N 3.32Å; E509-D513 PolarHBondContact O-N 3.22Å
510	T	91.7	Very high	91.8	Very high	39 Å²	39	49.4 Å²	49.4	24%	0.239	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-33.1	176.6	55.5	0	0	0	0	113.6	D461 L507 S514	D461-T510 WeakPolarHBondContact OD1-CG2 3.45Å; L507-T510 PolarHBondContact O-OG1 2.88Å; L507-T510 VanDerWaalsContact O-OG1 3.12Å; T510-S514 VanDerWaalsContact O-CB 3.29Å; T510-S514 WeakPolarHBondContact O-CB 3.31Å; T510-S514 PolarHBondContact O-N 3.32Å; T510-S514 PolarHBondContact O-OG 3.16Å
511	F	92.4	Very high	91.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-37.4	170.4	-91	-59.6	0	0	0	113.1	V464 M467 I468 H501 L502 L507 E509 S514 G515 V516	V464-F511 HydrophobicContact CB-CD1 4.36Å; V464-F511 HydrophobicContact CB-CE1 4.18Å; V464-F511 HydrophobicContact CB-CZ 4.49Å; V464-F511 HydrophobicContact CG1-CD1 3.62Å; V464-F511 HydrophobicContact CG1-CE1 3.86Å; V464-F511 HydrophobicContact CG1-CG 4.14Å; V464-F511 HydrophobicContact CG2-CD1 4.21Å; V464-F511 HydrophobicContact CG2-CD2 4.18Å; V464-F511 HydrophobicContact CG2-CE1 4.05Å; V464-F511 HydrophobicContact CG2-CE2 4.02Å; V464-F511 HydrophobicContact CG2-CG 4.25Å; V464-F511 HydrophobicContact CG2-CZ 3.94Å; M467-F511 HydrophobicContact CB-CE1 4.17Å; M467-F511 HydrophobicContact CB-CZ 4.34Å; M467-F511 HydrophobicContact CG-CE1 4.21Å; M467-F511 HydrophobicContact CG-CZ 4.26Å; I468-F511 HydrophobicContact CD1-CD1 4.28Å; I468-F511 HydrophobicContact CG1-CD1 4.38Å; I468-F511 HydrophobicContact CG1-CE1 4.43Å; H501-F511 HydrophobicContact CB-CE2 4.11Å; H501-F511 HydrophobicContact CB-CZ 3.97Å; L502-F511 HydrophobicContact CD2-CB 4.29Å; L502-F511 HydrophobicContact CD2-CD1 3.66Å; L502-F511 HydrophobicContact CD2-CD2 3.6Å; L502-F511 HydrophobicContact CD2-CE1 3.8Å; L502-F511 HydrophobicContact CD2-CE2 3.74Å; L502-F511 HydrophobicContact CD2-CG 3.59Å; L502-F511 HydrophobicContact CD2-CZ 3.85Å; L507-F511 HydrophobicContact CB-CD2 3.68Å; L507-F511 HydrophobicContact CB-CE2 3.75Å; L507-F511 HydrophobicContact CD1-CE2 4Å; L507-F511 VanDerWaalsContact O-CB 3.29Å; L507-F511 WeakPolarHBondContact O-CB 3.49Å; L507-F511 WeakPolarHBondContact O-CD2 3.47Å; L507-F511 PolarHBondContact O-N 2.94Å; E509-F511 VanDerWaalsContact C-N 3.3Å; E509-F511 PolarHBondContact O-N 2.76Å; F511-S514 WeakPolarHBondContact CA-OG 3.27Å; F511-S514 PolarHBondContact O-OG 2.95Å; F511-G515 PolarHBondContact O-N 3.07Å; F511-V516 HydrophobicContact CB-CB 4.23Å; F511-V516 HydrophobicContact CB-CG1 4Å; F511-V516 HydrophobicContact CD1-CB 4.07Å; F511-V516 HydrophobicContact CD1-CG2 3.94Å; F511-V516 WeakPolarHBondContact O-CB 3.46Å; F511-V516 WeakPolarHBondContact O-CG1 3.01Å; F511-V516 PolarHBondContact O-N 3.17Å
512	I	91.4	Very high	92	Very high	17 Å²	17	49.3 Å²	49.3	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-69.2	-47.1	176.9	-73.2	166.1	0	0	0	109.9	K508 E509 S514 G515 L548 P549 T555	K508-I512 WeakPolarHBondContact O-CD1 3.47Å; K508-I512 VanDerWaalsContact O-CG1 3.25Å; K508-I512 WeakPolarHBondContact O-CG1 3.16Å; K508-I512 PolarHBondContact O-N 3.24Å; K508-I512 VanDerWaalsContact O-N 3.09Å; E509-I512 WeakPolarHBondContact O-CA 3.3Å; E509-I512 WeakPolarHBondContact O-CB 3.49Å; E509-I512 PolarHBondContact O-N 3.32Å; I512-S514 PolarHBondContact O-N 3.45Å; I512-G515 PolarHBondContact O-N 2.91Å; I512-L548 HydrophobicContact CG1-CD1 4.49Å; I512-P549 HydrophobicContact CD1-CG 3.75Å; I512-T555 HydrophobicContact CG2-CG2 4.14Å
513	D	90.8	Very high	92.2	Very high	134 Å²	134	49.2 Å²	49.2	72%	0.717	26%	0.258	S	S	*	.	H	α-helix	trans	-65.3	-38.1	-177.5	-61	-25.2	0	0	0	112.5	E509 G515	E509-D513 PolarHBondContact O-N 3.22Å; D513-G515 PolarHBondContact O-N 2.7Å
514	S	90.3	Very high	92.3	Very high	47 Å²	47	45.6 Å²	45.6	33%	0.329	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	4.3	172.9	58.5	0	0	0	0	114.5	V464 I468 T510 F511 I512	V464-S514 WeakPolarHBondContact CG1-OG 3.34Å; I468-S514 WeakPolarHBondContact CD1-O 3.25Å; I468-S514 WeakPolarHBondContact CD1-OG 3.29Å; T510-S514 VanDerWaalsContact O-CB 3.29Å; T510-S514 WeakPolarHBondContact O-CB 3.31Å; T510-S514 PolarHBondContact O-N 3.32Å; T510-S514 PolarHBondContact O-OG 3.16Å; F511-S514 WeakPolarHBondContact CA-OG 3.27Å; F511-S514 PolarHBondContact O-OG 2.95Å; I512-S514 PolarHBondContact O-N 3.45Å
515	G	90.8	Very high	92.3	Very high	28 Å²	28	43.7 Å²	43.7	29%	0.289	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	24.1	169.1	0	0	0	0	0	116	F511 I512 D513 M517 S518	F511-G515 PolarHBondContact O-N 3.07Å; I512-G515 PolarHBondContact O-N 2.91Å; D513-G515 PolarHBondContact O-N 2.7Å; G515-M517 PolarHBondContact O-N 2.85Å; G515-S518 WeakPolarHBondContact O-CB 3.13Å; G515-S518 PolarHBondContact O-N 2.68Å
516	V	93.6	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-51.7	-27.2	179.6	78.9	0	0	0	0	113.4	I468 M471 L502 F511 S518 A519 I520	I468-V516 HydrophobicContact CD1-CB 4Å; I468-V516 HydrophobicContact CD1-CG2 4.4Å; I468-V516 HydrophobicContact CG1-CB 4.28Å; I468-V516 HydrophobicContact CG1-CG2 4.14Å; M471-V516 HydrophobicContact SD-CG2 4.34Å; L502-V516 HydrophobicContact CD2-CG2 3.94Å; F511-V516 HydrophobicContact CB-CB 4.23Å; F511-V516 HydrophobicContact CB-CG1 4Å; F511-V516 HydrophobicContact CD1-CB 4.07Å; F511-V516 HydrophobicContact CD1-CG2 3.94Å; F511-V516 WeakPolarHBondContact O-CB 3.46Å; F511-V516 WeakPolarHBondContact O-CG1 3.01Å; F511-V516 PolarHBondContact O-N 3.17Å; V516-S518 PolarHBondContact O-N 2.94Å; V516-A519 WeakPolarHBondContact O-CB 3.38Å; V516-A519 PolarHBondContact O-N 3.08Å; V516-A519 VanDerWaalsContact O-N 3.11Å; V516-I520 HydrophobicContact CG1-CD1 4.09Å; V516-I520 HydrophobicContact CG2-CD1 4.13Å; V516-I520 HydrophobicContact CG2-CG1 4.27Å; V516-I520 WeakPolarHBondContact O-CG1 3.4Å; V516-I520 PolarHBondContact O-N 2.88Å
517	M	92.6	Very high	92	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-31.1	178.7	-56.4	-152.9	83	0	0	112.9	G515 K521 L545 V551 T555 I561	G515-M517 PolarHBondContact O-N 2.85Å; M517-K521 WeakPolarHBondContact O-CB 3.46Å; M517-K521 PolarHBondContact O-N 2.81Å; M517-L545 HydrophobicContact CE-CD2 3.86Å; M517-V551 HydrophobicContact CE-CB 4.39Å; M517-V551 HydrophobicContact CE-CG1 3.81Å; M517-V551 HydrophobicContact CE-CG2 3.68Å; M517-V551 HydrophobicContact SD-CB 4.37Å; M517-V551 HydrophobicContact SD-CG1 3.44Å; M517-V551 WeakPolarHBondContact SD-CG1 3.26Å; M517-V551 HydrophobicContact SD-CG2 3.95Å; M517-T555 HydrophobicContact CG-CG2 4.26Å; M517-T555 HydrophobicContact SD-CG2 3.85Å; M517-I561 HydrophobicContact CE-CG2 3.88Å
518	S	94.1	Very high	91.5	Very high	62 Å²	62	37.5 Å²	37.5	43%	0.434	22%	0.216	S	C	.	.	H	α-helix	trans	-71.1	-42.7	174.5	-164	0	0	0	0	111.6	G515 V516 K521 E522	G515-S518 WeakPolarHBondContact O-CB 3.13Å; G515-S518 PolarHBondContact O-N 2.68Å; V516-S518 PolarHBondContact O-N 2.94Å; S518-K521 WeakPolarHBondContact O-CB 3.34Å; S518-K521 PolarHBondContact O-N 3.05Å; S518-E522 PolarHBondContact O-N 3.03Å; S518-E522 VanDerWaalsContact O-N 3.07Å
519	A	94.9	Very high	91.1	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-42.3	173.9	0	0	0	0	0	111.8	I468 M471 N472 V516 K521 E522 W523	I468-A519 HydrophobicContact CG2-CB 4.32Å; M471-A519 HydrophobicContact CB-CB 4.06Å; M471-A519 HydrophobicContact CE-CB 4Å; N472-A519 WeakPolarHBondContact OD1-CA 3.48Å; N472-A519 WeakPolarHBondContact OD1-CB 3.49Å; V516-A519 WeakPolarHBondContact O-CB 3.38Å; V516-A519 PolarHBondContact O-N 3.08Å; V516-A519 VanDerWaalsContact O-N 3.11Å; A519-K521 VanDerWaalsContact C-N 3.32Å; A519-K521 PolarHBondContact O-N 2.72Å; A519-E522 PolarHBondContact O-N 3.07Å; A519-W523 PolarHBondContact O-N 3.01Å
520	I	95.1	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-40.2	175.3	-66.9	169.7	0	0	0	110.9	M471 L502 V516 W523 I524 L541 L545 I561	M471-I520 HydrophobicContact CE-CG1 4.07Å; L502-I520 HydrophobicContact CD1-CD1 4.19Å; V516-I520 HydrophobicContact CG1-CD1 4.09Å; V516-I520 HydrophobicContact CG2-CD1 4.13Å; V516-I520 HydrophobicContact CG2-CG1 4.27Å; V516-I520 WeakPolarHBondContact O-CG1 3.4Å; V516-I520 PolarHBondContact O-N 2.88Å; I520-W523 WeakPolarHBondContact O-CB 3.38Å; I520-W523 PolarHBondContact O-N 3.41Å; I520-I524 WeakPolarHBondContact O-CG1 3.32Å; I520-I524 PolarHBondContact O-N 3.33Å; I520-L541 HydrophobicContact CG1-CD2 4.49Å; I520-L541 HydrophobicContact CG2-CB 4.36Å; I520-L541 HydrophobicContact CG2-CD1 4.35Å; I520-L545 HydrophobicContact CD1-CD2 4.34Å; I520-L545 HydrophobicContact CG2-CD1 3.89Å; I520-L545 HydrophobicContact CG2-CD2 4.11Å; I520-L545 HydrophobicContact CG2-CG 4.09Å; I520-I561 HydrophobicContact CG2-CD1 4.05Å
521	K	94.4	Very high	90.4	Very high	74 Å²	74	43.7 Å²	43.7	32%	0.322	25%	0.248	S	C	.	.	H	α-helix	trans	-58.3	-50.9	174.2	167.5	-172.5	173.8	-163.4	0	111.5	M517 S518 A519 W523 I524 S525 S559 I561 A564	M517-K521 WeakPolarHBondContact O-CB 3.46Å; M517-K521 PolarHBondContact O-N 2.81Å; S518-K521 WeakPolarHBondContact O-CB 3.34Å; S518-K521 PolarHBondContact O-N 3.05Å; A519-K521 VanDerWaalsContact C-N 3.32Å; A519-K521 PolarHBondContact O-N 2.72Å; K521-W523 PolarHBondContact O-N 3.2Å; K521-I524 PolarHBondContact O-N 2.89Å; K521-I524 VanDerWaalsContact O-N 3.14Å; K521-S525 WeakPolarHBondContact O-CA 3.46Å; K521-S525 VanDerWaalsContact O-CB 3.24Å; K521-S525 WeakPolarHBondContact O-CB 3.45Å; K521-S525 PolarHBondContact O-N 2.98Å; K521-S559 WeakPolarHBondContact CD-O 3.16Å; K521-S559 WeakPolarHBondContact CE-O 3.09Å; K521-S559 PolarHBondContact NZ-O 3.02Å; K521-I561 HydrophobicContact CB-CD1 3.75Å; K521-A564 HydrophobicContact CG-CB 4.22Å
522	E	94.2	Very high	90.3	Very high	56 Å²	56	44.9 Å²	44.9	26%	0.262	25%	0.254	S	S	.	.	H	α-helix	trans	-66.1	-21.2	178.7	-178.3	54.3	-151.7	0	0	112.8	A475 R479 K491 S518 A519	A475-E522 HydrophobicContact CB-CG 3.86Å; R479-E522 IonicContact CZ-OE1 3.07Å; R479-E522 IonicContact NH1-OE1 2.94Å; R479-E522 PolarHBondContact NH1-OE1 3.31Å; R479-E522 IonicContact NH1-OE2 2.71Å; R479-E522 PolarHBondContact NH1-OE2 2.81Å; K491-E522 PolarHBondContact NZ-O 3.01Å; K491-E522 VanDerWaalsContact NZ-O 3.13Å; S518-E522 PolarHBondContact O-N 3.03Å; S518-E522 VanDerWaalsContact O-N 3.07Å; A519-E522 PolarHBondContact O-N 3.07Å
523	W	95.1	Very high	90.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-76.4	-36.6	170.7	-82.3	49.2	0	0	0	114.1	M471 A474 K491 L494 L495 V498 A519 I520 K521 P533 I537 L541	M471-W523 HydrophobicContact CB-CZ2 4.16Å; M471-W523 HydrophobicContact CE-CD2 4.31Å; M471-W523 HydrophobicContact CE-CG 4.42Å; M471-W523 HydrophobicContact CG-CZ2 3.97Å; M471-W523 PolarHBondContact O-NE1 3.5Å; A474-W523 HydrophobicContact CB-CZ2 4.26Å; K491-W523 HydrophobicContact CB-CD2 4.22Å; K491-W523 HydrophobicContact CB-CE3 3.96Å; K491-W523 HydrophobicContact CB-CH2 3.92Å; K491-W523 HydrophobicContact CB-CZ2 4.13Å; K491-W523 HydrophobicContact CB-CZ3 3.82Å; K491-W523 HydrophobicContact CD-CB 4.25Å; K491-W523 HydrophobicContact CD-CD2 3.62Å; K491-W523 HydrophobicContact CD-CE3 4.11Å; K491-W523 HydrophobicContact CD-CG 3.67Å; K491-W523 HydrophobicContact CD-CZ2 4.47Å; K491-W523 HydrophobicContact CG-CD2 3.89Å; K491-W523 HydrophobicContact CG-CE3 4.16Å; K491-W523 HydrophobicContact CG-CG 4.43Å; K491-W523 HydrophobicContact CG-CH2 4.18Å; K491-W523 HydrophobicContact CG-CZ2 3.86Å; K491-W523 HydrophobicContact CG-CZ3 4.31Å; K491-W523 VanDerWaalsContact O-CH2 3.29Å; K491-W523 WeakPolarHBondContact O-CH2 3.48Å; K491-W523 VanDerWaalsContact O-CZ3 3.22Å; K491-W523 WeakPolarHBondContact O-CZ3 3.29Å; L494-W523 HydrophobicContact CB-CH2 4.03Å; L494-W523 HydrophobicContact CD2-CH2 4.34Å; L494-W523 HydrophobicContact CD2-CZ2 4.08Å; L494-W523 HydrophobicContact CG-CH2 4.18Å; L494-W523 HydrophobicContact CG-CZ2 4.41Å; L495-W523 HydrophobicContact CB-CZ3 4.04Å; L495-W523 HydrophobicContact CD1-CE3 4.37Å; L495-W523 HydrophobicContact CD1-CZ3 3.93Å; V498-W523 HydrophobicContact CG2-CH2 4.18Å; A519-W523 PolarHBondContact O-N 3.01Å; I520-W523 WeakPolarHBondContact O-CB 3.38Å; I520-W523 PolarHBondContact O-N 3.41Å; K521-W523 PolarHBondContact O-N 3.2Å; W523-P533 WeakPolarHBondContact O-CB 3.32Å; W523-P533 WeakPolarHBondContact O-CG 3.38Å; W523-I537 HydrophobicContact CB-CG2 4.43Å; W523-I537 HydrophobicContact CE3-CG2 3.86Å; W523-L541 HydrophobicContact CB-CD1 3.47Å; W523-L541 VanDerWaalsContact CB-CD1 3.47Å; W523-L541 HydrophobicContact CD2-CD1 4.3Å; W523-L541 HydrophobicContact CE3-CD1 3.92Å; W523-L541 HydrophobicContact CG-CD1 4.18Å
524	I	94.6	Very high	90.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-101	-13.7	-176.2	73.5	173.4	0	0	0	114.7	I520 K521 L541 L545 I561 A564 V565 L568	I520-I524 WeakPolarHBondContact O-CG1 3.32Å; I520-I524 PolarHBondContact O-N 3.33Å; K521-I524 PolarHBondContact O-N 2.89Å; K521-I524 VanDerWaalsContact O-N 3.14Å; I524-L541 HydrophobicContact CG2-CB 3.84Å; I524-L541 HydrophobicContact CG2-CD1 3.62Å; I524-L541 HydrophobicContact CG2-CG 4.38Å; I524-L545 HydrophobicContact CD1-CD1 4.36Å; I524-I561 HydrophobicContact CD1-CD1 3.72Å; I524-I561 HydrophobicContact CG1-CD1 4.29Å; I524-A564 HydrophobicContact CD1-CB 4.3Å; I524-A564 HydrophobicContact CG1-CB 4.09Å; I524-V565 HydrophobicContact CD1-CG2 3.75Å; I524-L568 HydrophobicContact CB-CD1 4.21Å; I524-L568 HydrophobicContact CD1-CD1 4.21Å
525	S	92.1	Very high	90.6	Very high	32 Å²	32	41.9 Å²	41.9	22%	0.224	24%	0.242	C	C	.	.	S	Bend	trans	-54.1	144.6	176.6	-179.7	0	0	0	0	110.9	K521 P533	K521-S525 WeakPolarHBondContact O-CA 3.46Å; K521-S525 VanDerWaalsContact O-CB 3.24Å; K521-S525 WeakPolarHBondContact O-CB 3.45Å; K521-S525 PolarHBondContact O-N 2.98Å; S525-P533 VanDerWaalsContact O-CD 3.29Å; S525-P533 WeakPolarHBondContact O-CD 3.48Å; S525-P533 WeakPolarHBondContact O-CG 3.2Å
526	P	87.6	Confident	90.7	Very high	33 Å²	33	47.4 Å²	47.4	21%	0.214	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-53.9	145.8	165.2	23.7	-33.2	0	0	0	111.3	S531 F567	P526-S531 VanDerWaalsContact CA-O 3.3Å; P526-S531 WeakPolarHBondContact CA-O 3.4Å; P526-F567 HydrophobicContact CB-CD1 4.13Å; P526-F567 HydrophobicContact CB-CE1 3.6Å; P526-F567 HydrophobicContact CB-CZ 3.82Å; P526-F567 HydrophobicContact CG-CD1 3.84Å; P526-F567 HydrophobicContact CG-CD2 4.26Å; P526-F567 HydrophobicContact CG-CE1 3.75Å; P526-F567 HydrophobicContact CG-CE2 4.17Å; P526-F567 HydrophobicContact CG-CG 4.1Å; P526-F567 HydrophobicContact CG-CZ 3.92Å
527	L	85.4	Confident	90.8	Very high	27 Å²	27	47.6 Å²	47.6	14%	0.141	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-69.6	163	168.5	-77	160.7	0	0	0	110	N482 D529 K530 S531	N482-L527 HydrophobicContact CB-CD2 4.35Å; L527-D529 WeakPolarHBondContact CB-OD1 3.28Å; L527-D529 PolarHBondContact O-N 3.26Å; L527-D529 VanDerWaalsContact O-N 3.1Å; L527-K530 WeakPolarHBondContact O-CA 3.16Å; L527-K530 PolarHBondContact O-N 3.33Å; L527-S531 WeakPolarHBondContact CD1-OG 3.42Å; L527-S531 PolarHBondContact N-O 3.43Å
528	P	79.1	Confident	90.9	Very high	92 Å²	92	48.5 Å²	48.5	60%	0.597	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.5	-177.4	23.5	-34.7	0	0	0	114.3	K530	P528-K530 PolarHBondContact O-N 3.41Å
529	D	82.1	Confident	91	Very high	116 Å²	116	47.1 Å²	47.1	62%	0.62	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	10.9	171	71	-20.3	0	0	0	113.6	L527 S531	L527-D529 WeakPolarHBondContact CB-OD1 3.28Å; L527-D529 PolarHBondContact O-N 3.26Å; L527-D529 VanDerWaalsContact O-N 3.1Å; D529-S531 VanDerWaalsContact CG-OG 3.23Å; D529-S531 PolarHBondContact O-N 3.01Å; D529-S531 WeakPolarHBondContact OD1-CB 3.32Å; D529-S531 PolarHBondContact OD1-N 2.88Å; D529-S531 PolarHBondContact OD1-OG 3.36Å; D529-S531 WeakPolarHBondContact OD2-CB 3.34Å; D529-S531 PolarHBondContact OD2-OG 3.31Å; D529-S531 VanDerWaalsContact OD2-OG 3.08Å
530	K	81.8	Confident	91	Very high	159 Å²	159	48.8 Å²	48.8	69%	0.691	25%	0.253	S	S	*	.	S	Bend	trans	60.5	14.1	-172.2	-54.2	-179.3	-178.3	-179.6	0	113.9	L527 P528	L527-K530 WeakPolarHBondContact O-CA 3.16Å; L527-K530 PolarHBondContact O-N 3.33Å; P528-K530 PolarHBondContact O-N 3.41Å
531	S	87.1	Confident	91	Very high	39 Å²	39	48.8 Å²	48.8	27%	0.273	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-80.3	159.8	176.3	77.5	0	0	0	0	112.6	P526 L527 D529	P526-S531 VanDerWaalsContact CA-O 3.3Å; P526-S531 WeakPolarHBondContact CA-O 3.4Å; L527-S531 WeakPolarHBondContact CD1-OG 3.42Å; L527-S531 PolarHBondContact N-O 3.43Å; D529-S531 VanDerWaalsContact CG-OG 3.23Å; D529-S531 PolarHBondContact O-N 3.01Å; D529-S531 WeakPolarHBondContact OD1-CB 3.32Å; D529-S531 PolarHBondContact OD1-N 2.88Å; D529-S531 PolarHBondContact OD1-OG 3.36Å; D529-S531 WeakPolarHBondContact OD2-CB 3.34Å; D529-S531 PolarHBondContact OD2-OG 3.31Å; D529-S531 VanDerWaalsContact OD2-OG 3.08Å
532	L	90.3	Very high	91.1	Very high	25 Å²	25	45.2 Å²	45.2	13%	0.131	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-89.9	136.6	179.7	-67.6	-172.9	0	0	0	111.7	F567 L568 H571 E574	L532-F567 HydrophobicContact CD2-CD1 4.13Å; L532-F567 HydrophobicContact CD2-CE1 3.72Å; L532-L568 HydrophobicContact CD2-CD2 3.57Å; L532-H571 VanDerWaalsContact CD1-ND1 3.25Å; L532-H571 WeakPolarHBondContact CD1-ND1 3.47Å; L532-H571 HydrophobicContact CD2-CB 4.37Å; L532-H571 WeakPolarHBondContact CG-ND1 3.33Å; L532-E574 HydrophobicContact CD1-CB 4.04Å
533	P	91.2	Very high	91.1	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.052	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-51.9	156.8	167.9	-27.4	35.5	0	0	0	112.9	W523 S525 L535 R538	W523-P533 WeakPolarHBondContact O-CB 3.32Å; W523-P533 WeakPolarHBondContact O-CG 3.38Å; S525-P533 VanDerWaalsContact O-CD 3.29Å; S525-P533 WeakPolarHBondContact O-CD 3.48Å; S525-P533 WeakPolarHBondContact O-CG 3.2Å; P533-L535 PolarHBondContact O-N 3.06Å; P533-R538 HydrophobicContact CB-CG 4.49Å; P533-R538 VanDerWaalsContact O-CD 3.23Å; P533-R538 WeakPolarHBondContact O-CD 3.49Å; P533-R538 WeakPolarHBondContact O-CG 3.47Å; P533-R538 PolarHBondContact O-NH1 2.86Å
534	A	93	Very high	91	Very high	53 Å²	53	47.2 Å²	47.2	44%	0.438	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-51	132.9	-173.1	0	0	0	0	0	113.2	R536 I537 R538	A534-R536 PolarHBondContact O-N 3.18Å; A534-I537 HydrophobicContact CB-CD1 4.13Å; A534-I537 WeakPolarHBondContact O-CB 3.5Å; A534-I537 PolarHBondContact O-N 3.09Å; A534-R538 PolarHBondContact O-N 3.01Å
535	L	93.4	Very high	91	Very high	74 Å²	74	47.4 Å²	47.4	39%	0.387	24%	0.244	S	C	.	.	H	α-helix	trans	-47.8	-41.5	-171	175.1	64.2	0	0	0	113.6	P533 I537 R538 E539 N578	P533-L535 PolarHBondContact O-N 3.06Å; L535-I537 VanDerWaalsContact C-N 3.29Å; L535-I537 PolarHBondContact O-N 3.26Å; L535-R538 PolarHBondContact O-N 2.96Å; L535-R538 VanDerWaalsContact O-N 3.12Å; L535-E539 HydrophobicContact CD1-CG 4.11Å; L535-E539 HydrophobicContact CG-CG 4.18Å; L535-E539 WeakPolarHBondContact O-CG 3.37Å; L535-E539 PolarHBondContact O-N 3.44Å; L535-N578 WeakPolarHBondContact CD1-ND2 3.46Å
536	R	93.8	Very high	91	Very high	143 Å²	143	50.3 Å²	50.3	54%	0.54	25%	0.254	S	S	.	.	H	α-helix	trans	-57.5	-37.5	178.9	-61	-104.1	64.8	-164	-3.3	113.2	L492 A534 E539 E540	L492-R536 HydrophobicContact CD1-CB 4.18Å; A534-R536 PolarHBondContact O-N 3.18Å; R536-E539 IonicContact CZ-OE2 2.71Å; R536-E539 IonicContact NE-OE2 3.51Å; R536-E539 PolarHBondContact NE-OE2 3.21Å; R536-E539 IonicContact NH2-OE2 3.73Å; R536-E539 PolarHBondContact NH2-OE2 2.89Å; R536-E540 PolarHBondContact O-N 2.92Å
537	I	95.3	Very high	91.1	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-67.4	-46.7	176.6	-64.2	166.3	0	0	0	109.5	K491 L495 W523 A534 L535 E540 L541	K491-I537 HydrophobicContact CB-CD1 3.7Å; L495-I537 HydrophobicContact CD2-CG1 4.06Å; W523-I537 HydrophobicContact CB-CG2 4.43Å; W523-I537 HydrophobicContact CE3-CG2 3.86Å; A534-I537 HydrophobicContact CB-CD1 4.13Å; A534-I537 WeakPolarHBondContact O-CB 3.5Å; A534-I537 PolarHBondContact O-N 3.09Å; L535-I537 VanDerWaalsContact C-N 3.29Å; L535-I537 PolarHBondContact O-N 3.26Å; I537-E540 PolarHBondContact O-N 3.28Å; I537-L541 HydrophobicContact CG2-CD1 3.66Å; I537-L541 HydrophobicContact CG2-CG 4.27Å; I537-L541 WeakPolarHBondContact O-CB 3.45Å; I537-L541 WeakPolarHBondContact O-CG 3.25Å; I537-L541 PolarHBondContact O-N 2.93Å
538	R	95.1	Very high	91.2	Very high	19 Å²	19	52.1 Å²	52.1	7%	0.072	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-42.8	-178.5	-45.2	-167.3	-47.9	-106.8	8.1	111.5	P533 A534 L535 L542 E574	P533-R538 HydrophobicContact CB-CG 4.49Å; P533-R538 VanDerWaalsContact O-CD 3.23Å; P533-R538 WeakPolarHBondContact O-CD 3.49Å; P533-R538 WeakPolarHBondContact O-CG 3.47Å; P533-R538 PolarHBondContact O-NH1 2.86Å; A534-R538 PolarHBondContact O-N 3.01Å; L535-R538 PolarHBondContact O-N 2.96Å; L535-R538 VanDerWaalsContact O-N 3.12Å; R538-L542 VanDerWaalsContact O-CB 3.29Å; R538-L542 WeakPolarHBondContact O-CB 3.29Å; R538-L542 WeakPolarHBondContact O-CD1 3.13Å; R538-L542 VanDerWaalsContact O-CG 3.25Å; R538-L542 WeakPolarHBondContact O-CG 3.15Å; R538-L542 PolarHBondContact O-N 3.16Å; R538-E574 WeakPolarHBondContact CD-OE2 3.44Å; R538-E574 IonicContact CZ-OE1 2.7Å; R538-E574 IonicContact CZ-OE2 2.87Å; R538-E574 IonicContact NE-OE1 3.33Å; R538-E574 PolarHBondContact NE-OE1 3.36Å; R538-E574 IonicContact NE-OE2 3.76Å; R538-E574 PolarHBondContact NE-OE2 3.47Å; R538-E574 VanDerWaalsContact NH2-CD 3.3Å; R538-E574 IonicContact NH2-OE1 2.72Å; R538-E574 PolarHBondContact NH2-OE1 2.71Å; R538-E574 IonicContact NH2-OE2 3.23Å; R538-E574 PolarHBondContact NH2-OE2 3.36Å
539	E	95.3	Very high	91.3	Very high	34 Å²	34	50.3 Å²	50.3	16%	0.159	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-53.4	174.3	-75.8	176.3	169.8	0	0	112.8	L535 R536 R543	L535-E539 HydrophobicContact CD1-CG 4.11Å; L535-E539 HydrophobicContact CG-CG 4.18Å; L535-E539 WeakPolarHBondContact O-CG 3.37Å; L535-E539 PolarHBondContact O-N 3.44Å; R536-E539 IonicContact CZ-OE2 2.71Å; R536-E539 IonicContact NE-OE2 3.51Å; R536-E539 PolarHBondContact NE-OE2 3.21Å; R536-E539 IonicContact NH2-OE2 3.73Å; R536-E539 PolarHBondContact NH2-OE2 2.89Å; E539-R543 WeakPolarHBondContact O-CD 3.03Å; E539-R543 VanDerWaalsContact O-CG 3.25Å; E539-R543 WeakPolarHBondContact O-CG 3.42Å; E539-R543 PolarHBondContact O-N 3.12Å
540	E	95.5	Very high	91	Very high	35 Å²	35	51.7 Å²	51.7	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-74.7	-39.4	-176.1	-73.1	-59.3	121.9	0	0	112.3	L495 V499 K503 R536 I537 R543 I544	L495-E540 HydrophobicContact CD1-CB 4.32Å; L495-E540 HydrophobicContact CD2-CB 4.45Å; V499-E540 HydrophobicContact CG2-CB 3.82Å; V499-E540 HydrophobicContact CG2-CG 4.32Å; K503-E540 IonicContact NZ-OE2 3.33Å; K503-E540 PolarHBondContact NZ-OE2 3.23Å; R536-E540 PolarHBondContact O-N 2.92Å; I537-E540 PolarHBondContact O-N 3.28Å; E540-R543 WeakPolarHBondContact O-CB 3.33Å; E540-R543 PolarHBondContact O-N 3.48Å; E540-R543 IonicContact OE1-CZ 3.27Å; E540-R543 IonicContact OE1-NH1 3.76Å; E540-R543 PolarHBondContact OE1-NH1 3.11Å; E540-I544 WeakPolarHBondContact O-CG1 3.42Å; E540-I544 PolarHBondContact O-N 2.97Å
541	L	95.3	Very high	91	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-70	-35.5	-179.9	-68.1	-177.8	0	0	0	112.9	L495 I520 W523 I524 I537 R543 I544 L545	L495-L541 HydrophobicContact CD1-CD2 4.4Å; L495-L541 HydrophobicContact CD1-CG 4.32Å; I520-L541 HydrophobicContact CG1-CD2 4.49Å; I520-L541 HydrophobicContact CG2-CB 4.36Å; I520-L541 HydrophobicContact CG2-CD1 4.35Å; W523-L541 HydrophobicContact CB-CD1 3.47Å; W523-L541 VanDerWaalsContact CB-CD1 3.47Å; W523-L541 HydrophobicContact CD2-CD1 4.3Å; W523-L541 HydrophobicContact CE3-CD1 3.92Å; W523-L541 HydrophobicContact CG-CD1 4.18Å; I524-L541 HydrophobicContact CG2-CB 3.84Å; I524-L541 HydrophobicContact CG2-CD1 3.62Å; I524-L541 HydrophobicContact CG2-CG 4.38Å; I537-L541 HydrophobicContact CG2-CD1 3.66Å; I537-L541 HydrophobicContact CG2-CG 4.27Å; I537-L541 WeakPolarHBondContact O-CB 3.45Å; I537-L541 WeakPolarHBondContact O-CG 3.25Å; I537-L541 PolarHBondContact O-N 2.93Å; L541-R543 VanDerWaalsContact C-N 3.3Å; L541-R543 PolarHBondContact O-N 2.87Å; L541-I544 PolarHBondContact O-N 3.25Å; L541-L545 WeakPolarHBondContact O-CB 3.24Å; L541-L545 VanDerWaalsContact O-CG 3.31Å; L541-L545 WeakPolarHBondContact O-CG 3.5Å; L541-L545 PolarHBondContact O-N 3.01Å
542	L	95.2	Very high	90.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-32.6	171.5	-72.6	171.3	0	0	0	112.3	R538 Q546 V565 L568 N578 L581 A582 L585	R538-L542 VanDerWaalsContact O-CB 3.29Å; R538-L542 WeakPolarHBondContact O-CB 3.29Å; R538-L542 WeakPolarHBondContact O-CD1 3.13Å; R538-L542 VanDerWaalsContact O-CG 3.25Å; R538-L542 WeakPolarHBondContact O-CG 3.15Å; R538-L542 PolarHBondContact O-N 3.16Å; L542-Q546 PolarHBondContact O-N 2.95Å; L542-V565 HydrophobicContact CD2-CG1 4.3Å; L542-V565 HydrophobicContact CD2-CG2 4.35Å; L542-L568 HydrophobicContact CD1-CD1 4.05Å; L542-L568 HydrophobicContact CD2-CD1 4.28Å; L542-L568 HydrophobicContact CG-CD1 4.33Å; L542-N578 HydrophobicContact CD1-CB 3.8Å; L542-L581 HydrophobicContact CB-CB 4.34Å; L542-L581 HydrophobicContact CB-CD1 4.33Å; L542-A582 HydrophobicContact CD2-CB 4.37Å; L542-L585 HydrophobicContact CD2-CD1 3.81Å
543	R	95.1	Very high	90.7	Very high	97 Å²	97	47.9 Å²	47.9	37%	0.366	24%	0.242	S	C	.	.	H	α-helix	trans	-68.4	-46	171.7	-70.6	165.8	-175.4	159	6	111.5	E539 E540 L541 L545 Q546 E547 L581	E539-R543 WeakPolarHBondContact O-CD 3.03Å; E539-R543 VanDerWaalsContact O-CG 3.25Å; E539-R543 WeakPolarHBondContact O-CG 3.42Å; E539-R543 PolarHBondContact O-N 3.12Å; E540-R543 WeakPolarHBondContact O-CB 3.33Å; E540-R543 PolarHBondContact O-N 3.48Å; E540-R543 IonicContact OE1-CZ 3.27Å; E540-R543 IonicContact OE1-NH1 3.76Å; E540-R543 PolarHBondContact OE1-NH1 3.11Å; L541-R543 VanDerWaalsContact C-N 3.3Å; L541-R543 PolarHBondContact O-N 2.87Å; R543-L545 PolarHBondContact O-N 3.07Å; R543-Q546 CarbonylContact O-C 3.59Å; R543-Q546 WeakPolarHBondContact O-CA 3.16Å; R543-Q546 WeakPolarHBondContact O-CB 3.29Å; R543-Q546 PolarHBondContact O-N 3.48Å; R543-E547 PolarHBondContact O-N 2.62Å; R543-L581 HydrophobicContact CG-CD1 4.22Å
544	I	93.9	Very high	90.6	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-46.1	176.7	-69.1	-65.6	0	0	0	111.2	V499 L502 K503 E540 L541 Q546 E547 L548	V499-I544 HydrophobicContact CG1-CD1 4.38Å; V499-I544 HydrophobicContact CG2-CG1 4.45Å; L502-I544 HydrophobicContact CB-CD1 4.03Å; L502-I544 HydrophobicContact CB-CG2 3.75Å; L502-I544 HydrophobicContact CD1-CG2 3.79Å; L502-I544 HydrophobicContact CG-CG2 4.39Å; K503-I544 HydrophobicContact CD-CD1 4.07Å; K503-I544 HydrophobicContact CG-CD1 3.58Å; E540-I544 WeakPolarHBondContact O-CG1 3.42Å; E540-I544 PolarHBondContact O-N 2.97Å; L541-I544 PolarHBondContact O-N 3.25Å; I544-Q546 PolarHBondContact O-N 3.19Å; I544-E547 CarbonylContact O-C 3.57Å; I544-E547 WeakPolarHBondContact O-CA 3.49Å; I544-E547 PolarHBondContact O-N 3.02Å; I544-L548 PolarHBondContact O-N 3.25Å; I544-L548 VanDerWaalsContact O-N 3.07Å
545	L	93.1	Very high	90.4	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-59.2	-27.6	176.4	-74.4	166.2	0	0	0	112.9	M517 I520 I524 L541 R543 L548 I561 V565 L585 W589	M517-L545 HydrophobicContact CE-CD2 3.86Å; I520-L545 HydrophobicContact CD1-CD2 4.34Å; I520-L545 HydrophobicContact CG2-CD1 3.89Å; I520-L545 HydrophobicContact CG2-CD2 4.11Å; I520-L545 HydrophobicContact CG2-CG 4.09Å; I524-L545 HydrophobicContact CD1-CD1 4.36Å; L541-L545 WeakPolarHBondContact O-CB 3.24Å; L541-L545 VanDerWaalsContact O-CG 3.31Å; L541-L545 WeakPolarHBondContact O-CG 3.5Å; L541-L545 PolarHBondContact O-N 3.01Å; R543-L545 PolarHBondContact O-N 3.07Å; L545-L548 HydrophobicContact CD2-CD1 4.32Å; L545-I561 HydrophobicContact CD1-CD1 4.35Å; L545-I561 HydrophobicContact CD1-CG1 4.44Å; L545-I561 HydrophobicContact CD2-CG1 4.35Å; L545-V565 HydrophobicContact CD1-CG2 4.24Å; L545-L585 HydrophobicContact CB-CD1 3.72Å; L545-L585 HydrophobicContact CB-CD2 4.19Å; L545-L585 HydrophobicContact CD1-CD1 4.29Å; L545-W589 HydrophobicContact CB-CH2 4.47Å; L545-W589 HydrophobicContact CB-CZ2 4.27Å; L545-W589 HydrophobicContact CD1-CH2 4.27Å; L545-W589 HydrophobicContact CD2-CH2 4.17Å; L545-W589 HydrophobicContact CD2-CZ2 4.16Å
546	Q	92.6	Very high	90.3	Very high	92 Å²	92	49.4 Å²	49.4	43%	0.43	24%	0.24	S	C	.	.	H	α-helix	trans	-85.1	-16.6	173.7	-153.4	-156.5	-18.6	0	0	113.3	L542 R543 I544 L581 L585	L542-Q546 PolarHBondContact O-N 2.95Å; R543-Q546 CarbonylContact O-C 3.59Å; R543-Q546 WeakPolarHBondContact O-CA 3.16Å; R543-Q546 WeakPolarHBondContact O-CB 3.29Å; R543-Q546 PolarHBondContact O-N 3.48Å; I544-Q546 PolarHBondContact O-N 3.19Å; Q546-L581 VanDerWaalsContact OE1-CD2 3.25Å; Q546-L585 HydrophobicContact CB-CD2 4.03Å; Q546-L585 HydrophobicContact CG-CD2 4.24Å
547	E	90.3	Very high	90.1	Very high	80 Å²	80	46 Å²	46	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-91.2	-12.1	174.7	-74.3	-173.6	-136.9	0	0	113.1	K503 K508 R543 I544	K503-E547 WeakPolarHBondContact CE-OE1 3.2Å; K503-E547 IonicContact NZ-OE1 2.67Å; K508-E547 PolarHBondContact NZ-O 2.94Å; R543-E547 PolarHBondContact O-N 2.62Å; I544-E547 CarbonylContact O-C 3.57Å; I544-E547 WeakPolarHBondContact O-CA 3.49Å; I544-E547 PolarHBondContact O-N 3.02Å
548	L	86.4	Confident	89.8	Confident	19 Å²	19	52.8 Å²	52.8	10%	0.099	26%	0.26	C	S	.	.	S	Bend	trans	-69.1	149.4	175.9	-69.2	-177.4	0	0	0	111.4	K508 I512 I544 L545	K508-L548 HydrophobicContact CB-CD2 4.31Å; K508-L548 HydrophobicContact CD-CD2 3.99Å; K508-L548 HydrophobicContact CG-CD2 3.91Å; I512-L548 HydrophobicContact CG1-CD1 4.49Å; I544-L548 PolarHBondContact O-N 3.25Å; I544-L548 VanDerWaalsContact O-N 3.07Å; L545-L548 HydrophobicContact CD2-CD1 4.32Å
549	P	81.1	Confident	89.7	Confident	53 Å²	53	52.3 Å²	52.3	34%	0.344	26%	0.259	S	S	.	.			trans	-62.4	166.2	168.2	30.2	-36.3	0	0	0	110.9	K508 I512 V551	K508-P549 HydrophobicContact CB-CG 4.47Å; I512-P549 HydrophobicContact CD1-CG 3.75Å; P549-V551 PolarHBondContact O-N 3.03Å
550	N	76.1	Confident	89.5	Confident	145 Å²	145	51 Å²	51	78%	0.775	26%	0.255	S	S	*	.			trans	-51.8	100.7	-175.7	-67.6	85.9	0	0	0	112.8	S552	N550-S552 PolarHBondContact O-N 3.32Å
551	V	81.8	Confident	89.4	Confident	23 Å²	23	49.3 Å²	49.3	14%	0.139	25%	0.247	C	C	.	.			trans	-60.6	131.4	178.4	173.5	0	0	0	0	110	M517 P549 L556	M517-V551 HydrophobicContact CE-CB 4.39Å; M517-V551 HydrophobicContact CE-CG1 3.81Å; M517-V551 HydrophobicContact CE-CG2 3.68Å; M517-V551 HydrophobicContact SD-CB 4.37Å; M517-V551 HydrophobicContact SD-CG1 3.44Å; M517-V551 WeakPolarHBondContact SD-CG1 3.26Å; M517-V551 HydrophobicContact SD-CG2 3.95Å; P549-V551 PolarHBondContact O-N 3.03Å; V551-L556 HydrophobicContact CG1-CB 4.21Å; V551-L556 HydrophobicContact CG1-CD1 4.14Å
552	S	84.3	Confident	89.3	Confident	52 Å²	52	49.3 Å²	49.3	36%	0.364	25%	0.247	S	C	.	.			trans	-68.6	148.3	176.3	89.1	0	0	0	0	111.3	N550 E554 T555 L556	N550-S552 PolarHBondContact O-N 3.32Å; S552-E554 PolarHBondContact O-N 2.99Å; S552-E554 PolarHBondContact OG-N 3.39Å; S552-T555 PolarHBondContact O-N 3.25Å; S552-T555 PolarHBondContact OG-N 3.34Å; S552-T555 PolarHBondContact OG-OG1 3.04Å; S552-L556 WeakPolarHBondContact O-CB 3.22Å; S552-L556 PolarHBondContact O-N 3Å
553	Q	86.9	Confident	89.2	Confident	68 Å²	68	55.6 Å²	55.6	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-58.1	-32.6	175	-170.9	-172.7	3.5	0	0	111.7	M373 I377 L556 K557 I593	M373-Q553 PolarHBondContact SD-NE2 3.28Å; I377-Q553 HydrophobicContact CD1-CG 3.74Å; Q553-L556 WeakPolarHBondContact O-CB 3.25Å; Q553-L556 PolarHBondContact O-N 2.73Å; Q553-K557 WeakPolarHBondContact O-CG 3.3Å; Q553-K557 PolarHBondContact O-N 2.72Å; Q553-I593 HydrophobicContact CG-CG1 4.23Å
554	E	88.4	Confident	89.1	Confident	132 Å²	132	51.3 Å²	51.3	62%	0.617	26%	0.256	S	S	*	.	H	α-helix	trans	-68.7	-46.8	178.5	-177.4	171	-163.8	0	0	112.3	S552 L556 K557 H558	S552-E554 PolarHBondContact O-N 2.99Å; S552-E554 PolarHBondContact OG-N 3.39Å; E554-L556 PolarHBondContact O-N 2.79Å; E554-K557 PolarHBondContact O-N 3.34Å; E554-H558 VanDerWaalsContact CG-CE1 3.49Å; E554-H558 WeakPolarHBondContact CG-CE1 3.22Å; E554-H558 WeakPolarHBondContact CG-ND1 3.39Å; E554-H558 PolarHBondContact O-N 3.41Å; E554-H558 PolarHBondContact O-ND1 3.13Å; E554-H558 IonicContact OE1-CE1 3.89Å
555	T	89.6	Confident	89.2	Confident	33 Å²	33	51.2 Å²	51.2	20%	0.202	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-34.4	175.3	-38.3	0	0	0	0	111	I512 M517 S552 S559	I512-T555 HydrophobicContact CG2-CG2 4.14Å; M517-T555 HydrophobicContact CG-CG2 4.26Å; M517-T555 HydrophobicContact SD-CG2 3.85Å; S552-T555 PolarHBondContact O-N 3.25Å; S552-T555 PolarHBondContact OG-N 3.34Å; S552-T555 PolarHBondContact OG-OG1 3.04Å; T555-S559 VanDerWaalsContact O-CB 3.31Å; T555-S559 WeakPolarHBondContact O-CB 3.11Å; T555-S559 PolarHBondContact O-N 2.77Å; T555-S559 PolarHBondContact O-OG 3.39Å
556	L	90.6	Very high	89.2	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-41.9	176.1	-163.1	79	0	0	0	112.2	I377 V551 S552 Q553 E554 S559 G560 I561 W589	I377-L556 HydrophobicContact CD1-CD2 4.34Å; I377-L556 HydrophobicContact CG2-CD2 3.39Å; I377-L556 HydrophobicContact CG2-CG 3.86Å; V551-L556 HydrophobicContact CG1-CB 4.21Å; V551-L556 HydrophobicContact CG1-CD1 4.14Å; S552-L556 WeakPolarHBondContact O-CB 3.22Å; S552-L556 PolarHBondContact O-N 3Å; Q553-L556 WeakPolarHBondContact O-CB 3.25Å; Q553-L556 PolarHBondContact O-N 2.73Å; E554-L556 PolarHBondContact O-N 2.79Å; L556-S559 PolarHBondContact O-OG 2.99Å; L556-G560 PolarHBondContact O-N 3.41Å; L556-I561 HydrophobicContact CD1-CG2 3.47Å; L556-I561 VanDerWaalsContact CD1-CG2 3.47Å; L556-I561 HydrophobicContact CG-CG2 4.32Å; L556-W589 HydrophobicContact CD1-CB 4.35Å; L556-W589 HydrophobicContact CD1-CD2 3.62Å; L556-W589 HydrophobicContact CD1-CE3 3.62Å; L556-W589 HydrophobicContact CD1-CG 3.97Å; L556-W589 HydrophobicContact CD1-CZ3 4.08Å; L556-W589 HydrophobicContact CD2-CB 3.74Å; L556-W589 HydrophobicContact CD2-CG 4.24Å
557	K	89.9	Confident	89.3	Confident	71 Å²	71	51.6 Å²	51.6	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-58.8	171.3	-80.6	-168.8	177.2	-147.2	0	111.5	D376 I377 Q553 E554 S559 G560	D376-K557 IonicContact OD2-NZ 2.74Å; D376-K557 PolarHBondContact OD2-NZ 3.27Å; I377-K557 HydrophobicContact CD1-CG 3.79Å; I377-K557 HydrophobicContact CG1-CB 4.47Å; I377-K557 HydrophobicContact CG1-CD 4.47Å; I377-K557 HydrophobicContact CG1-CG 3.43Å; I377-K557 VanDerWaalsContact CG1-CG 3.43Å; Q553-K557 WeakPolarHBondContact O-CG 3.3Å; Q553-K557 PolarHBondContact O-N 2.72Å; E554-K557 PolarHBondContact O-N 3.34Å; K557-S559 VanDerWaalsContact C-N 3.33Å; K557-S559 PolarHBondContact O-N 3.3Å; K557-G560 PolarHBondContact O-N 2.87Å
558	H	89.9	Confident	89.4	Confident	148 Å²	148	47.8 Å²	47.8	69%	0.685	24%	0.239	S	C	*	.	H	α-helix	trans	-60.9	-38.8	-174.1	-75.1	107.6	0	0	0	113.2	E554	E554-H558 VanDerWaalsContact CG-CE1 3.49Å; E554-H558 WeakPolarHBondContact CG-CE1 3.22Å; E554-H558 WeakPolarHBondContact CG-ND1 3.39Å; E554-H558 PolarHBondContact O-N 3.41Å; E554-H558 PolarHBondContact O-ND1 3.13Å; E554-H558 IonicContact OE1-CE1 3.89Å
559	S	92.3	Very high	89.8	Confident	8 Å²	8	49.2 Å²	49.2	6%	0.056	24%	0.244	C	C	.	.	H	α-helix	trans	-71.6	-38.7	172.5	61.3	0	0	0	0	112.2	K521 T555 L556 K557 I561	K521-S559 WeakPolarHBondContact CD-O 3.16Å; K521-S559 WeakPolarHBondContact CE-O 3.09Å; K521-S559 PolarHBondContact NZ-O 3.02Å; T555-S559 VanDerWaalsContact O-CB 3.31Å; T555-S559 WeakPolarHBondContact O-CB 3.11Å; T555-S559 PolarHBondContact O-N 2.77Å; T555-S559 PolarHBondContact O-OG 3.39Å; L556-S559 PolarHBondContact O-OG 2.99Å; K557-S559 VanDerWaalsContact C-N 3.33Å; K557-S559 PolarHBondContact O-N 3.3Å; S559-I561 VanDerWaalsContact C-N 3.25Å; S559-I561 PolarHBondContact O-N 3.48Å; S559-I561 WeakPolarHBondContact OG-CG2 3.05Å; S559-I561 PolarHBondContact OG-N 3.42Å
560	G	91.4	Very high	90.4	Very high	7 Å²	7	50.7 Å²	50.7	7%	0.072	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	22.1	-172	0	0	0	0	0	113.3	L556 K557 G562 R563	L556-G560 PolarHBondContact O-N 3.41Å; K557-G560 PolarHBondContact O-N 2.87Å; G560-G562 PolarHBondContact O-N 3.5Å; G560-R563 PolarHBondContact O-N 3.48Å
561	I	93.9	Very high	91.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-31	178.7	-175.2	63.7	0	0	0	112.4	M517 I520 K521 I524 L545 L556 S559 R563 A564 V565 W589	M517-I561 HydrophobicContact CE-CG2 3.88Å; I520-I561 HydrophobicContact CG2-CD1 4.05Å; K521-I561 HydrophobicContact CB-CD1 3.75Å; I524-I561 HydrophobicContact CD1-CD1 3.72Å; I524-I561 HydrophobicContact CG1-CD1 4.29Å; L545-I561 HydrophobicContact CD1-CD1 4.35Å; L545-I561 HydrophobicContact CD1-CG1 4.44Å; L545-I561 HydrophobicContact CD2-CG1 4.35Å; L556-I561 HydrophobicContact CD1-CG2 3.47Å; L556-I561 VanDerWaalsContact CD1-CG2 3.47Å; L556-I561 HydrophobicContact CG-CG2 4.32Å; S559-I561 VanDerWaalsContact C-N 3.25Å; S559-I561 PolarHBondContact O-N 3.48Å; S559-I561 WeakPolarHBondContact OG-CG2 3.05Å; S559-I561 PolarHBondContact OG-N 3.42Å; I561-R563 VanDerWaalsContact C-N 3.35Å; I561-R563 PolarHBondContact O-N 3.42Å; I561-A564 PolarHBondContact O-N 2.91Å; I561-A564 VanDerWaalsContact O-N 3.16Å; I561-V565 HydrophobicContact CD1-CG2 4.36Å; I561-V565 HydrophobicContact CG1-CG2 4.21Å; I561-V565 PolarHBondContact O-N 3.22Å; I561-W589 HydrophobicContact CG1-CH2 4.18Å; I561-W589 HydrophobicContact CG1-CZ3 4.48Å; I561-W589 HydrophobicContact CG2-CH2 4.39Å; I561-W589 HydrophobicContact CG2-CZ3 4.34Å
562	G	93.1	Very high	91.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.5	-45	179.1	0	0	0	0	0	112.7	I377 G560 A564 V565 M566	I377-G562 CarbonylContact O-C 3.58Å; I377-G562 WeakPolarHBondContact O-CA 3.38Å; G560-G562 PolarHBondContact O-N 3.5Å; G562-A564 VanDerWaalsContact C-N 3.34Å; G562-A564 PolarHBondContact O-N 2.8Å; G562-V565 PolarHBondContact O-N 3.33Å; G562-M566 WeakPolarHBondContact O-CB 3.49Å; G562-M566 PolarHBondContact O-N 3.27Å
563	R	92.7	Very high	92	Very high	131 Å²	131	55.2 Å²	55.2	49%	0.494	26%	0.261	S	S	.	.	H	α-helix	trans	-56.9	-45.1	176.1	-51.4	-164.1	-178.3	-172.4	0.5	111.9	D376 I377 G560 I561 M566 F567	D376-R563 VanDerWaalsContact O-CZ 3.24Å; D376-R563 PolarHBondContact O-NE 3.24Å; D376-R563 PolarHBondContact O-NH2 3.33Å; I377-R563 VanDerWaalsContact O-CG 3.26Å; I377-R563 WeakPolarHBondContact O-CG 3.48Å; I377-R563 PolarHBondContact O-N 3.01Å; G560-R563 PolarHBondContact O-N 3.48Å; I561-R563 VanDerWaalsContact C-N 3.35Å; I561-R563 PolarHBondContact O-N 3.42Å; R563-M566 PolarHBondContact O-N 3.27Å; R563-F567 PolarHBondContact O-N 2.99Å
564	A	93.8	Very high	92.4	Very high	7 Å²	7	52.5 Å²	52.5	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-41.2	179.8	0	0	0	0	0	112.5	K521 I524 I561 G562 F567 L568	K521-A564 HydrophobicContact CG-CB 4.22Å; I524-A564 HydrophobicContact CD1-CB 4.3Å; I524-A564 HydrophobicContact CG1-CB 4.09Å; I561-A564 PolarHBondContact O-N 2.91Å; I561-A564 VanDerWaalsContact O-N 3.16Å; G562-A564 VanDerWaalsContact C-N 3.34Å; G562-A564 PolarHBondContact O-N 2.8Å; A564-F567 WeakPolarHBondContact O-CB 3.24Å; A564-F567 PolarHBondContact O-N 2.88Å; A564-L568 PolarHBondContact O-N 3.15Å
565	V	94.8	Very high	92.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-36.3	175.6	176.8	0	0	0	0	111.5	I524 L542 L545 I561 G562 L568 Y569 A582 L585 I586 W589	I524-V565 HydrophobicContact CD1-CG2 3.75Å; L542-V565 HydrophobicContact CD2-CG1 4.3Å; L542-V565 HydrophobicContact CD2-CG2 4.35Å; L545-V565 HydrophobicContact CD1-CG2 4.24Å; I561-V565 HydrophobicContact CD1-CG2 4.36Å; I561-V565 HydrophobicContact CG1-CG2 4.21Å; I561-V565 PolarHBondContact O-N 3.22Å; G562-V565 PolarHBondContact O-N 3.33Å; V565-L568 PolarHBondContact O-N 3.16Å; V565-Y569 PolarHBondContact O-N 2.98Å; V565-A582 HydrophobicContact CG1-CB 3.71Å; V565-L585 HydrophobicContact CG1-CB 4.29Å; V565-L585 HydrophobicContact CG1-CD1 4.35Å; V565-I586 HydrophobicContact CG1-CD1 4.33Å; V565-I586 HydrophobicContact CG1-CG1 4.09Å; V565-W589 HydrophobicContact CB-CZ3 4.1Å; V565-W589 HydrophobicContact CG1-CZ3 4.3Å; V565-W589 HydrophobicContact CG2-CH2 3.99Å; V565-W589 HydrophobicContact CG2-CZ3 3.83Å
566	M	93.7	Very high	92.9	Very high	36 Å²	36	54.8 Å²	54.8	18%	0.177	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-37.2	172.2	-175	168	-71.4	0	0	112.3	F378 G562 R563 Y569 K570 I586	F378-M566 HydrophobicContact CB-CE 3.68Å; F378-M566 HydrophobicContact CB-SD 4.09Å; F378-M566 HydrophobicContact CD1-CB 4.39Å; F378-M566 HydrophobicContact CD1-CE 3.97Å; F378-M566 HydrophobicContact CG-CE 3.94Å; G562-M566 WeakPolarHBondContact O-CB 3.49Å; G562-M566 PolarHBondContact O-N 3.27Å; R563-M566 PolarHBondContact O-N 3.27Å; M566-Y569 PolarHBondContact O-N 2.92Å; M566-K570 HydrophobicContact CG-CD 4Å; M566-K570 HydrophobicContact CG-CG 4.42Å; M566-K570 WeakPolarHBondContact O-CG 3.31Å; M566-K570 PolarHBondContact O-N 2.83Å; M566-K570 HydrophobicContact SD-CD 4.49Å; M566-K570 PolarHBondContact SD-NZ 3.37Å; M566-I586 HydrophobicContact CB-CD1 4.28Å; M566-I586 HydrophobicContact CE-CG2 4.31Å
567	F	93.6	Very high	93.2	Very high	68 Å²	68	57.4 Å²	57.4	30%	0.298	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-47.7	172.1	-174.8	-86.9	0	0	0	111.4	P526 L532 R563 A564 Y569 K570 H571	P526-F567 HydrophobicContact CB-CD1 4.13Å; P526-F567 HydrophobicContact CB-CE1 3.6Å; P526-F567 HydrophobicContact CB-CZ 3.82Å; P526-F567 HydrophobicContact CG-CD1 3.84Å; P526-F567 HydrophobicContact CG-CD2 4.26Å; P526-F567 HydrophobicContact CG-CE1 3.75Å; P526-F567 HydrophobicContact CG-CE2 4.17Å; P526-F567 HydrophobicContact CG-CG 4.1Å; P526-F567 HydrophobicContact CG-CZ 3.92Å; L532-F567 HydrophobicContact CD2-CD1 4.13Å; L532-F567 HydrophobicContact CD2-CE1 3.72Å; R563-F567 PolarHBondContact O-N 2.99Å; A564-F567 WeakPolarHBondContact O-CB 3.24Å; A564-F567 PolarHBondContact O-N 2.88Å; F567-Y569 VanDerWaalsContact C-N 3.34Å; F567-Y569 PolarHBondContact O-N 3.32Å; F567-K570 PolarHBondContact O-N 2.86Å; F567-H571 HydrophobicContact CD1-CB 4.36Å; F567-H571 HydrophobicContact CE1-CB 4.09Å; F567-H571 AromaticContact CE1-CD2 3.81Å; F567-H571 AromaticContact CZ-CD2 3.82Å; F567-H571 VanDerWaalsContact O-CB 3.27Å; F567-H571 WeakPolarHBondContact O-CB 3.22Å; F567-H571 PolarHBondContact O-N 2.96Å
568	L	93.4	Very high	93.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-43.1	176	-65.2	-170.4	0	0	0	112.5	I524 L532 L542 A564 V565 K570 E574	I524-L568 HydrophobicContact CB-CD1 4.21Å; I524-L568 HydrophobicContact CD1-CD1 4.21Å; L532-L568 HydrophobicContact CD2-CD2 3.57Å; L542-L568 HydrophobicContact CD1-CD1 4.05Å; L542-L568 HydrophobicContact CD2-CD1 4.28Å; L542-L568 HydrophobicContact CG-CD1 4.33Å; A564-L568 PolarHBondContact O-N 3.15Å; V565-L568 PolarHBondContact O-N 3.16Å; L568-K570 PolarHBondContact O-N 3.36Å; L568-E574 WeakPolarHBondContact O-CB 3.44Å; L568-E574 WeakPolarHBondContact O-CG 3.48Å
569	Y	95.1	Very high	93.7	Very high	49 Å²	49	48.9 Å²	48.9	19%	0.192	24%	0.238	C	C	.	.	H	α-helix	trans	-58.9	-46.2	176.4	173.4	-106.3	0	0	0	112	V565 M566 F567 K579 L583 I586	V565-Y569 PolarHBondContact O-N 2.98Å; M566-Y569 PolarHBondContact O-N 2.92Å; F567-Y569 VanDerWaalsContact C-N 3.34Å; F567-Y569 PolarHBondContact O-N 3.32Å; Y569-K579 HydrophobicContact CD2-CB 4.21Å; Y569-K579 WeakPolarHBondContact O-CE 2.94Å; Y569-K579 PolarHBondContact O-NZ 3.41Å; Y569-L583 HydrophobicContact CD2-CB 3.87Å; Y569-L583 HydrophobicContact CE2-CB 3.76Å; Y569-L583 HydrophobicContact CE2-CD1 3.98Å; Y569-L583 HydrophobicContact CE2-CD2 3.99Å; Y569-L583 HydrophobicContact CE2-CG 4.12Å; Y569-I586 HydrophobicContact CD1-CD1 4.48Å; Y569-I586 HydrophobicContact CG-CD1 4.19Å
570	K	93.4	Very high	93.8	Very high	84 Å²	84	50.8 Å²	50.8	37%	0.365	25%	0.248	S	C	.	.	H	α-helix	trans	-74.7	-38.9	-178.5	-71.1	177.7	172.4	169.9	0	112.9	S381 M566 F567 L568 K579	S381-K570 PolarHBondContact OG-NZ 3.48Å; M566-K570 HydrophobicContact CG-CD 4Å; M566-K570 HydrophobicContact CG-CG 4.42Å; M566-K570 WeakPolarHBondContact O-CG 3.31Å; M566-K570 PolarHBondContact O-N 2.83Å; M566-K570 HydrophobicContact SD-CD 4.49Å; M566-K570 PolarHBondContact SD-NZ 3.37Å; F567-K570 PolarHBondContact O-N 2.86Å; L568-K570 PolarHBondContact O-N 3.36Å; K570-K579 PolarHBondContact O-NZ 3.38Å
571	H	92.8	Very high	94	Very high	28 Å²	28	51.5 Å²	51.5	13%	0.13	25%	0.25	C	C	.	.			trans	-55.2	129.9	-169.9	-173.4	-97.2	0	0	0	113.6	L532 F567 K573 E574 K579	L532-H571 VanDerWaalsContact CD1-ND1 3.25Å; L532-H571 WeakPolarHBondContact CD1-ND1 3.47Å; L532-H571 HydrophobicContact CD2-CB 4.37Å; L532-H571 WeakPolarHBondContact CG-ND1 3.33Å; F567-H571 HydrophobicContact CD1-CB 4.36Å; F567-H571 HydrophobicContact CE1-CB 4.09Å; F567-H571 AromaticContact CE1-CD2 3.81Å; F567-H571 AromaticContact CZ-CD2 3.82Å; F567-H571 VanDerWaalsContact O-CB 3.27Å; F567-H571 WeakPolarHBondContact O-CB 3.22Å; F567-H571 PolarHBondContact O-N 2.96Å; H571-K573 VanDerWaalsContact C-N 3.33Å; H571-K573 PolarHBondContact ND1-N 3.45Å; H571-K573 PolarHBondContact O-N 3.39Å; H571-E574 PolarHBondContact O-N 3.4Å; H571-K579 WeakPolarHBondContact O-CE 3.36Å; H571-K579 PolarHBondContact O-NZ 3.01Å
572	P	91.9	Very high	94.1	Very high	111 Å²	111	51.5 Å²	51.5	72%	0.721	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.8	-170.4	24.4	-34.5	0	0	0	114.3
573	K	91.6	Very high	94.1	Very high	175 Å²	175	53.2 Å²	53.2	76%	0.761	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	14	-179	-40.8	176.9	-176.5	170.2	0	114.1	H571	H571-K573 VanDerWaalsContact C-N 3.33Å; H571-K573 PolarHBondContact ND1-N 3.45Å; H571-K573 PolarHBondContact O-N 3.39Å
574	E	94.3	Very high	94.1	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.051	26%	0.258	C	S	.	.	S	Bend	trans	-86.4	141.7	174.2	-178.5	60.2	-84.8	0	0	111.6	L532 R538 L568 H571 N578 K579	L532-E574 HydrophobicContact CD1-CB 4.04Å; R538-E574 WeakPolarHBondContact CD-OE2 3.44Å; R538-E574 IonicContact CZ-OE1 2.7Å; R538-E574 IonicContact CZ-OE2 2.87Å; R538-E574 IonicContact NE-OE1 3.33Å; R538-E574 PolarHBondContact NE-OE1 3.36Å; R538-E574 IonicContact NE-OE2 3.76Å; R538-E574 PolarHBondContact NE-OE2 3.47Å; R538-E574 VanDerWaalsContact NH2-CD 3.3Å; R538-E574 IonicContact NH2-OE1 2.72Å; R538-E574 PolarHBondContact NH2-OE1 2.71Å; R538-E574 IonicContact NH2-OE2 3.23Å; R538-E574 PolarHBondContact NH2-OE2 3.36Å; L568-E574 WeakPolarHBondContact O-CB 3.44Å; L568-E574 WeakPolarHBondContact O-CG 3.48Å; H571-E574 PolarHBondContact O-N 3.4Å; E574-N578 VanDerWaalsContact CD-CB 3.47Å; E574-N578 HydrophobicContact CG-CB 3.77Å; E574-N578 WeakPolarHBondContact OE1-CB 3.34Å; E574-N578 PolarHBondContact OE1-ND2 2.86Å; E574-K579 HydrophobicContact CB-CG 4.22Å; E574-K579 HydrophobicContact CG-CG 4.02Å
575	S	94.9	Very high	94.1	Very high	48 Å²	48	51.9 Å²	51.9	34%	0.336	26%	0.255	S	S	.	.			trans	-60	140.5	178.2	176.7	0	0	0	0	111.6	A577 N578 K579	S575-A577 VanDerWaalsContact C-N 3.28Å; S575-A577 PolarHBondContact O-N 3.29Å; S575-N578 WeakPolarHBondContact O-CB 3.47Å; S575-N578 PolarHBondContact O-N 3.5Å; S575-K579 PolarHBondContact O-N 3.49Å
576	R	94.4	Very high	94	Very high	165 Å²	165	52.5 Å²	52.5	62%	0.623	26%	0.258	S	S	*	.	H	α-helix	trans	-54.9	-43.8	179.9	-179.3	66	-149.6	-162.2	8.2	112	N578 K579 D580	R576-N578 VanDerWaalsContact C-N 3.3Å; R576-N578 PolarHBondContact O-N 3.02Å; R576-K579 WeakPolarHBondContact O-CB 3.33Å; R576-K579 PolarHBondContact O-N 3.05Å; R576-D580 WeakPolarHBondContact CG-OD2 3.45Å; R576-D580 IonicContact CZ-OD1 2.71Å; R576-D580 IonicContact CZ-OD2 2.84Å; R576-D580 IonicContact NE-OD1 3.32Å; R576-D580 PolarHBondContact NE-OD1 3.02Å; R576-D580 IonicContact NE-OD2 3.41Å; R576-D580 PolarHBondContact NE-OD2 3.47Å; R576-D580 IonicContact NH2-OD1 3.93Å; R576-D580 PolarHBondContact NH2-OD1 2.77Å; R576-D580 IonicContact NH2-OD2 2.62Å; R576-D580 PolarHBondContact O-N 2.94Å; R576-D580 VanDerWaalsContact O-OD2 3.1Å
577	A	95.4	Very high	93.8	Very high	59 Å²	59	53 Å²	53	49%	0.488	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-37.3	177.7	0	0	0	0	0	112.6	S575 D580 L581	S575-A577 VanDerWaalsContact C-N 3.28Å; S575-A577 PolarHBondContact O-N 3.29Å; A577-D580 PolarHBondContact O-N 3.36Å; A577-L581 WeakPolarHBondContact O-CG 3.44Å; A577-L581 PolarHBondContact O-N 3.37Å
578	N	95	Very high	93.6	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-71.6	-37.8	176	-70.8	-9.5	0	0	0	111.5	L535 L542 E574 S575 R576 D580 L581 A582	L535-N578 WeakPolarHBondContact CD1-ND2 3.46Å; L542-N578 HydrophobicContact CD1-CB 3.8Å; E574-N578 VanDerWaalsContact CD-CB 3.47Å; E574-N578 HydrophobicContact CG-CB 3.77Å; E574-N578 WeakPolarHBondContact OE1-CB 3.34Å; E574-N578 PolarHBondContact OE1-ND2 2.86Å; S575-N578 WeakPolarHBondContact O-CB 3.47Å; S575-N578 PolarHBondContact O-N 3.5Å; R576-N578 VanDerWaalsContact C-N 3.3Å; R576-N578 PolarHBondContact O-N 3.02Å; N578-D580 VanDerWaalsContact C-N 3.33Å; N578-L581 PolarHBondContact O-N 3.39Å; N578-A582 WeakPolarHBondContact O-CB 3.48Å; N578-A582 PolarHBondContact O-N 2.96Å
579	K	95.6	Very high	93.4	Very high	37 Å²	37	55.1 Å²	55.1	16%	0.161	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-41.7	170.7	-67.5	-176	176.7	-109.4	0	111.6	Y569 K570 H571 E574 S575 R576 L581 A582 L583	Y569-K579 HydrophobicContact CD2-CB 4.21Å; Y569-K579 WeakPolarHBondContact O-CE 2.94Å; Y569-K579 PolarHBondContact O-NZ 3.41Å; K570-K579 PolarHBondContact O-NZ 3.38Å; H571-K579 WeakPolarHBondContact O-CE 3.36Å; H571-K579 PolarHBondContact O-NZ 3.01Å; E574-K579 HydrophobicContact CB-CG 4.22Å; E574-K579 HydrophobicContact CG-CG 4.02Å; S575-K579 PolarHBondContact O-N 3.49Å; R576-K579 WeakPolarHBondContact O-CB 3.33Å; R576-K579 PolarHBondContact O-N 3.05Å; K579-L581 VanDerWaalsContact C-N 3.29Å; K579-L581 PolarHBondContact O-N 3Å; K579-A582 PolarHBondContact O-N 3.18Å; K579-L583 VanDerWaalsContact O-CB 3.26Å; K579-L583 WeakPolarHBondContact O-CB 3.36Å; K579-L583 PolarHBondContact O-N 3.32Å
580	D	95.5	Very high	93.1	Very high	48 Å²	48	53.5 Å²	53.5	26%	0.257	27%	0.268	S	S	.	.	H	α-helix	trans	-70.5	-21.8	177.3	-69.5	-42.9	0	0	0	113.5	R576 A577 N578 K584	R576-D580 WeakPolarHBondContact CG-OD2 3.45Å; R576-D580 IonicContact CZ-OD1 2.71Å; R576-D580 IonicContact CZ-OD2 2.84Å; R576-D580 IonicContact NE-OD1 3.32Å; R576-D580 PolarHBondContact NE-OD1 3.02Å; R576-D580 IonicContact NE-OD2 3.41Å; R576-D580 PolarHBondContact NE-OD2 3.47Å; R576-D580 IonicContact NH2-OD1 3.93Å; R576-D580 PolarHBondContact NH2-OD1 2.77Å; R576-D580 IonicContact NH2-OD2 2.62Å; R576-D580 PolarHBondContact O-N 2.94Å; R576-D580 VanDerWaalsContact O-OD2 3.1Å; A577-D580 PolarHBondContact O-N 3.36Å; N578-D580 VanDerWaalsContact C-N 3.33Å; D580-K584 WeakPolarHBondContact O-CD 3.47Å; D580-K584 VanDerWaalsContact O-CE 3.24Å; D580-K584 WeakPolarHBondContact O-CE 3.25Å; D580-K584 VanDerWaalsContact O-CG 3.24Å; D580-K584 WeakPolarHBondContact O-CG 3.35Å
581	L	94.9	Very high	92.7	Very high	22 Å²	22	52.7 Å²	52.7	12%	0.115	26%	0.262	C	S	.	.	H	α-helix	trans	-79.7	-50	168.1	-72.1	172.1	0	0	0	111.3	L542 R543 Q546 A577 N578 K579 L583 K584 L585	L542-L581 HydrophobicContact CB-CB 4.34Å; L542-L581 HydrophobicContact CB-CD1 4.33Å; R543-L581 HydrophobicContact CG-CD1 4.22Å; Q546-L581 VanDerWaalsContact OE1-CD2 3.25Å; A577-L581 WeakPolarHBondContact O-CG 3.44Å; A577-L581 PolarHBondContact O-N 3.37Å; N578-L581 PolarHBondContact O-N 3.39Å; K579-L581 VanDerWaalsContact C-N 3.29Å; K579-L581 PolarHBondContact O-N 3Å; L581-L583 VanDerWaalsContact C-N 3.29Å; L581-L583 PolarHBondContact O-N 3.04Å; L581-K584 WeakPolarHBondContact O-CB 3.44Å; L581-K584 PolarHBondContact O-N 2.83Å; L581-L585 PolarHBondContact O-N 2.87Å
582	A	95.4	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-56.9	-42	177.7	0	0	0	0	0	111.8	L542 V565 N578 K579 K584 L585 I586	L542-A582 HydrophobicContact CD2-CB 4.37Å; V565-A582 HydrophobicContact CG1-CB 3.71Å; N578-A582 WeakPolarHBondContact O-CB 3.48Å; N578-A582 PolarHBondContact O-N 2.96Å; K579-A582 PolarHBondContact O-N 3.18Å; A582-K584 VanDerWaalsContact C-N 3.32Å; A582-K584 PolarHBondContact O-N 2.81Å; A582-L585 PolarHBondContact O-N 3.13Å; A582-I586 WeakPolarHBondContact O-CB 3.22Å; A582-I586 WeakPolarHBondContact O-CD1 3.41Å; A582-I586 WeakPolarHBondContact O-CG1 3.47Å; A582-I586 PolarHBondContact O-N 3.43Å
583	L	94.2	Very high	91.8	Very high	36 Å²	36	51 Å²	51	19%	0.188	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-34.1	175.5	-176.5	58.9	0	0	0	112.8	L357 Y569 K579 L581 N587	L357-L583 HydrophobicContact CD2-CD1 4.12Å; Y569-L583 HydrophobicContact CD2-CB 3.87Å; Y569-L583 HydrophobicContact CE2-CB 3.76Å; Y569-L583 HydrophobicContact CE2-CD1 3.98Å; Y569-L583 HydrophobicContact CE2-CD2 3.99Å; Y569-L583 HydrophobicContact CE2-CG 4.12Å; K579-L583 VanDerWaalsContact O-CB 3.26Å; K579-L583 WeakPolarHBondContact O-CB 3.36Å; K579-L583 PolarHBondContact O-N 3.32Å; L581-L583 VanDerWaalsContact C-N 3.29Å; L581-L583 PolarHBondContact O-N 3.04Å; L583-N587 WeakPolarHBondContact CD1-ND2 3.26Å; L583-N587 WeakPolarHBondContact O-CB 3.2Å; L583-N587 PolarHBondContact O-N 2.86Å; L583-N587 PolarHBondContact O-ND2 3.16Å
584	K	93.2	Very high	91	Very high	109 Å²	109	44.6 Å²	44.6	47%	0.474	23%	0.225	S	C	.	.	H	α-helix	trans	-68.4	-47.1	174.2	-71.7	163.8	-168.2	163.9	0	110.8	D580 L581 A582 I586 N587 E588	D580-K584 WeakPolarHBondContact O-CD 3.47Å; D580-K584 VanDerWaalsContact O-CE 3.24Å; D580-K584 WeakPolarHBondContact O-CE 3.25Å; D580-K584 VanDerWaalsContact O-CG 3.24Å; D580-K584 WeakPolarHBondContact O-CG 3.35Å; L581-K584 WeakPolarHBondContact O-CB 3.44Å; L581-K584 PolarHBondContact O-N 2.83Å; A582-K584 VanDerWaalsContact C-N 3.32Å; A582-K584 PolarHBondContact O-N 2.81Å; K584-I586 PolarHBondContact O-N 3.33Å; K584-N587 CarbonylContact O-C 3.35Å; K584-N587 WeakPolarHBondContact O-CB 3.16Å; K584-N587 PolarHBondContact O-N 2.82Å; K584-E588 WeakPolarHBondContact O-CB 3.1Å; K584-E588 PolarHBondContact O-N 2.91Å
585	L	92.9	Very high	90	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-58.1	-49	176	-65.8	175.5	0	0	0	111.6	L542 L545 Q546 V565 L581 A582 N587 E588 W589	L542-L585 HydrophobicContact CD2-CD1 3.81Å; L545-L585 HydrophobicContact CB-CD1 3.72Å; L545-L585 HydrophobicContact CB-CD2 4.19Å; L545-L585 HydrophobicContact CD1-CD1 4.29Å; Q546-L585 HydrophobicContact CB-CD2 4.03Å; Q546-L585 HydrophobicContact CG-CD2 4.24Å; V565-L585 HydrophobicContact CG1-CB 4.29Å; V565-L585 HydrophobicContact CG1-CD1 4.35Å; L581-L585 PolarHBondContact O-N 2.87Å; A582-L585 PolarHBondContact O-N 3.13Å; L585-N587 VanDerWaalsContact C-N 3.31Å; L585-N587 PolarHBondContact O-N 3.1Å; L585-E588 PolarHBondContact O-N 3.34Å; L585-E588 VanDerWaalsContact O-N 3.15Å; L585-W589 HydrophobicContact CB-CD2 4.28Å; L585-W589 HydrophobicContact CB-CE3 4.21Å; L585-W589 HydrophobicContact CB-CH2 4.07Å; L585-W589 HydrophobicContact CB-CZ2 4.1Å; L585-W589 HydrophobicContact CB-CZ3 4.12Å; L585-W589 HydrophobicContact CD1-CH2 4.13Å; L585-W589 HydrophobicContact CD1-CZ2 4.32Å; L585-W589 HydrophobicContact CD2-CZ2 3.93Å; L585-W589 HydrophobicContact CG-CH2 4.48Å; L585-W589 HydrophobicContact CG-CZ2 4.34Å; L585-W589 VanDerWaalsContact O-CB 3.31Å; L585-W589 WeakPolarHBondContact O-CB 3.2Å; L585-W589 PolarHBondContact O-N 2.76Å
586	I	92	Very high	88.9	Confident	13 Å²	13	46.7 Å²	46.7	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-46	176	-67	160.4	0	0	0	110.6	F378 V565 M566 Y569 A582 K584 S590	F378-I586 HydrophobicContact CD1-CG1 4.4Å; F378-I586 HydrophobicContact CD1-CG2 4.45Å; F378-I586 HydrophobicContact CE1-CB 4.2Å; F378-I586 HydrophobicContact CE1-CG1 3.9Å; F378-I586 HydrophobicContact CE1-CG2 3.98Å; F378-I586 HydrophobicContact CZ-CG2 4.21Å; V565-I586 HydrophobicContact CG1-CD1 4.33Å; V565-I586 HydrophobicContact CG1-CG1 4.09Å; M566-I586 HydrophobicContact CB-CD1 4.28Å; M566-I586 HydrophobicContact CE-CG2 4.31Å; Y569-I586 HydrophobicContact CD1-CD1 4.48Å; Y569-I586 HydrophobicContact CG-CD1 4.19Å; A582-I586 WeakPolarHBondContact O-CB 3.22Å; A582-I586 WeakPolarHBondContact O-CD1 3.41Å; A582-I586 WeakPolarHBondContact O-CG1 3.47Å; A582-I586 PolarHBondContact O-N 3.43Å; K584-I586 PolarHBondContact O-N 3.33Å; I586-S590 WeakPolarHBondContact O-CB 3.39Å; I586-S590 PolarHBondContact O-N 3.24Å; I586-S590 PolarHBondContact O-OG 3.46Å
587	N	90.1	Very high	87.4	Confident	47 Å²	47	41.3 Å²	41.3	25%	0.251	23%	0.232	S	C	.	.	H	α-helix	trans	-65.7	-36	177	-91	-82	0	0	0	113.6	L583 K584 L585 R591	L583-N587 WeakPolarHBondContact CD1-ND2 3.26Å; L583-N587 WeakPolarHBondContact O-CB 3.2Å; L583-N587 PolarHBondContact O-N 2.86Å; L583-N587 PolarHBondContact O-ND2 3.16Å; K584-N587 CarbonylContact O-C 3.35Å; K584-N587 WeakPolarHBondContact O-CB 3.16Å; K584-N587 PolarHBondContact O-N 2.82Å; L585-N587 VanDerWaalsContact C-N 3.31Å; L585-N587 PolarHBondContact O-N 3.1Å; N587-R591 WeakPolarHBondContact O-CB 3.46Å; N587-R591 WeakPolarHBondContact O-CD 3.26Å; N587-R591 WeakPolarHBondContact O-CG 3.49Å; N587-R591 PolarHBondContact O-N 3.2Å; N587-R591 PolarHBondContact O-NE 2.72Å; N587-R591 PolarHBondContact OD1-NH2 3.22Å; N587-R591 VanDerWaalsContact OD1-NH2 3.16Å
588	E	89	Confident	85.5	Confident	90 Å²	90	42.1 Å²	42.1	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-76.2	-36.4	-177.9	-176.3	157.6	-163.5	0	0	111.4	K584 L585 P592	K584-E588 WeakPolarHBondContact O-CB 3.1Å; K584-E588 PolarHBondContact O-N 2.91Å; L585-E588 PolarHBondContact O-N 3.34Å; L585-E588 VanDerWaalsContact O-N 3.15Å; E588-P592 VanDerWaalsContact O-CD 3.24Å; E588-P592 WeakPolarHBondContact O-CD 3.27Å
589	W	90.1	Very high	83.6	Confident	21 Å²	21	46.8 Å²	46.8	8%	0.08	26%	0.258	C	S	.	.	H	α-helix	trans	-81.1	-30.6	177.7	-62.1	-20.4	0	0	0	114.1	F378 L545 L556 I561 V565 L585	F378-W589 HydrophobicContact CE1-CE3 4.49Å; F378-W589 HydrophobicContact CZ-CB 4.26Å; L545-W589 HydrophobicContact CB-CH2 4.47Å; L545-W589 HydrophobicContact CB-CZ2 4.27Å; L545-W589 HydrophobicContact CD1-CH2 4.27Å; L545-W589 HydrophobicContact CD2-CH2 4.17Å; L545-W589 HydrophobicContact CD2-CZ2 4.16Å; L556-W589 HydrophobicContact CD1-CB 4.35Å; L556-W589 HydrophobicContact CD1-CD2 3.62Å; L556-W589 HydrophobicContact CD1-CE3 3.62Å; L556-W589 HydrophobicContact CD1-CG 3.97Å; L556-W589 HydrophobicContact CD1-CZ3 4.08Å; L556-W589 HydrophobicContact CD2-CB 3.74Å; L556-W589 HydrophobicContact CD2-CG 4.24Å; I561-W589 HydrophobicContact CG1-CH2 4.18Å; I561-W589 HydrophobicContact CG1-CZ3 4.48Å; I561-W589 HydrophobicContact CG2-CH2 4.39Å; I561-W589 HydrophobicContact CG2-CZ3 4.34Å; V565-W589 HydrophobicContact CB-CZ3 4.1Å; V565-W589 HydrophobicContact CG1-CZ3 4.3Å; V565-W589 HydrophobicContact CG2-CH2 3.99Å; V565-W589 HydrophobicContact CG2-CZ3 3.83Å; L585-W589 HydrophobicContact CB-CD2 4.28Å; L585-W589 HydrophobicContact CB-CE3 4.21Å; L585-W589 HydrophobicContact CB-CH2 4.07Å; L585-W589 HydrophobicContact CB-CZ2 4.1Å; L585-W589 HydrophobicContact CB-CZ3 4.12Å; L585-W589 HydrophobicContact CD1-CH2 4.13Å; L585-W589 HydrophobicContact CD1-CZ2 4.32Å; L585-W589 HydrophobicContact CD2-CZ2 3.93Å; L585-W589 HydrophobicContact CG-CH2 4.48Å; L585-W589 HydrophobicContact CG-CZ2 4.34Å; L585-W589 VanDerWaalsContact O-CB 3.31Å; L585-W589 WeakPolarHBondContact O-CB 3.2Å; L585-W589 PolarHBondContact O-N 2.76Å
590	S	88.4	Confident	81.6	Confident	16 Å²	16	51 Å²	51	11%	0.112	27%	0.274	C	S	.	.	H	α-helix	trans	-80.9	-32.3	178.4	71.3	0	0	0	0	113.3	I586 I593 F594	I586-S590 WeakPolarHBondContact O-CB 3.39Å; I586-S590 PolarHBondContact O-N 3.24Å; I586-S590 PolarHBondContact O-OG 3.46Å; S590-I593 VanDerWaalsContact O-CB 3.26Å; S590-I593 WeakPolarHBondContact O-CB 3.26Å; S590-I593 WeakPolarHBondContact O-CG1 3.45Å; S590-I593 PolarHBondContact O-N 2.94Å; S590-F594 VanDerWaalsContact O-CD2 3.27Å; S590-F594 WeakPolarHBondContact O-CD2 3.38Å; S590-F594 PolarHBondContact O-N 3.1Å
591	R	85.9	Confident	79.7	Confident	66 Å²	66	58.3 Å²	58.3	25%	0.249	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-43.8	-177.7	-85.9	168.6	-161	-78.7	-13.4	114.9	N587 I593 F594 G595 L596 S598	N587-R591 WeakPolarHBondContact O-CB 3.46Å; N587-R591 WeakPolarHBondContact O-CD 3.26Å; N587-R591 WeakPolarHBondContact O-CG 3.49Å; N587-R591 PolarHBondContact O-N 3.2Å; N587-R591 PolarHBondContact O-NE 2.72Å; N587-R591 PolarHBondContact OD1-NH2 3.22Å; N587-R591 VanDerWaalsContact OD1-NH2 3.16Å; R591-I593 VanDerWaalsContact C-N 3.3Å; R591-I593 PolarHBondContact O-N 3.07Å; R591-F594 PolarHBondContact O-N 3.08Å; R591-G595 CarbonylContact O-C 3.53Å; R591-G595 PolarHBondContact O-N 3.42Å; R591-L596 HydrophobicContact CB-CB 4.32Å; R591-L596 WeakPolarHBondContact CB-O 3.47Å; R591-L596 HydrophobicContact CG-CB 3.94Å; R591-L596 PolarHBondContact O-N 2.58Å; R591-S598 WeakPolarHBondContact CD-OG 3.48Å
592	P	84.4	Confident	77.9	Confident	91 Å²	91	60 Å²	60	59%	0.591	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-34	175.7	-25.3	35.6	0	0	0	113.8	E588 G595	E588-P592 VanDerWaalsContact O-CD 3.24Å; E588-P592 WeakPolarHBondContact O-CD 3.27Å; P592-G595 PolarHBondContact O-N 3.27Å
593	I	79.6	Confident	75.9	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.062	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-50.5	179.8	-49.3	175.7	0	0	0	109.6	M373 I374 I377 F378 Q553 S590 R591 G595	M373-I593 HydrophobicContact CB-CG2 4.39Å; M373-I593 HydrophobicContact CE-CG2 4.25Å; I374-I593 HydrophobicContact CG1-CD1 4.39Å; I374-I593 HydrophobicContact CG1-CG2 4.38Å; I377-I593 HydrophobicContact CD1-CD1 3.59Å; I377-I593 HydrophobicContact CD1-CG1 4.48Å; F378-I593 HydrophobicContact CE2-CD1 4.39Å; Q553-I593 HydrophobicContact CG-CG1 4.23Å; S590-I593 VanDerWaalsContact O-CB 3.26Å; S590-I593 WeakPolarHBondContact O-CB 3.26Å; S590-I593 WeakPolarHBondContact O-CG1 3.45Å; S590-I593 PolarHBondContact O-N 2.94Å; R591-I593 VanDerWaalsContact C-N 3.3Å; R591-I593 PolarHBondContact O-N 3.07Å; I593-G595 VanDerWaalsContact C-N 3.32Å; I593-G595 PolarHBondContact O-N 3.48Å
594	F	75.7	Confident	74.5	Confident	42 Å²	42	62.4 Å²	62.4	18%	0.184	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.7	-179.3	-58.4	-76.4	0	0	0	114.7	F358 E370 I374 S590 R591 L596	F358-F594 HydrophobicContact CB-CZ 4.39Å; F358-F594 HydrophobicContact CD1-CD1 4.31Å; F358-F594 AromaticContact CD1-CE1 3.7Å; F358-F594 HydrophobicContact CD1-CE1 3.7Å; F358-F594 AromaticContact CD1-CZ 3.81Å; F358-F594 HydrophobicContact CD1-CZ 3.81Å; F358-F594 HydrophobicContact CD2-CD1 4.37Å; F358-F594 AromaticContact CD2-CD2 3.79Å; F358-F594 HydrophobicContact CD2-CD2 3.79Å; F358-F594 AromaticContact CD2-CE1 3.99Å; F358-F594 HydrophobicContact CD2-CE1 3.99Å; F358-F594 AromaticContact CD2-CE2 3.39Å; F358-F594 HydrophobicContact CD2-CE2 3.39Å; F358-F594 HydrophobicContact CD2-CG 4.24Å; F358-F594 AromaticContact CD2-CZ 3.45Å; F358-F594 HydrophobicContact CD2-CZ 3.45Å; F358-F594 VanDerWaalsContact CD2-CZ 3.45Å; F358-F594 AromaticContact CE1-CD1 3.6Å; F358-F594 HydrophobicContact CE1-CD1 3.6Å; F358-F594 AromaticContact CE1-CE1 3.43Å; F358-F594 HydrophobicContact CE1-CE1 3.43Å; F358-F594 VanDerWaalsContact CE1-CE1 3.43Å; F358-F594 HydrophobicContact CE1-CG 4.17Å; F358-F594 AromaticContact CE1-CZ 3.93Å; F358-F594 HydrophobicContact CE1-CZ 3.93Å; F358-F594 HydrophobicContact CE2-CB 3.85Å; F358-F594 AromaticContact CE2-CD1 3.67Å; F358-F594 HydrophobicContact CE2-CD1 3.67Å; F358-F594 AromaticContact CE2-CD2 3.25Å; F358-F594 HydrophobicContact CE2-CD2 3.25Å; F358-F594 AromaticContact CE2-CE1 3.75Å; F358-F594 HydrophobicContact CE2-CE1 3.75Å; F358-F594 AromaticContact CE2-CE2 3.38Å; F358-F594 HydrophobicContact CE2-CE2 3.38Å; F358-F594 AromaticContact CE2-CG 3.37Å; F358-F594 HydrophobicContact CE2-CG 3.37Å; F358-F594 AromaticContact CE2-CZ 3.59Å; F358-F594 HydrophobicContact CE2-CZ 3.59Å; F358-F594 AromaticContact CG-CE1 3.97Å; F358-F594 HydrophobicContact CG-CE1 3.97Å; F358-F594 HydrophobicContact CG-CE2 4.02Å; F358-F594 AromaticContact CG-CZ 3.58Å; F358-F594 HydrophobicContact CG-CZ 3.58Å; F358-F594 HydrophobicContact CZ-CB 3.68Å; F358-F594 AromaticContact CZ-CD1 3.23Å; F358-F594 HydrophobicContact CZ-CD1 3.23Å; F358-F594 AromaticContact CZ-CD2 3.77Å; F358-F594 HydrophobicContact CZ-CD2 3.77Å; F358-F594 AromaticContact CZ-CE1 3.47Å; F358-F594 HydrophobicContact CZ-CE1 3.47Å; F358-F594 VanDerWaalsContact CZ-CE1 3.47Å; F358-F594 HydrophobicContact CZ-CE2 4.01Å; F358-F594 AromaticContact CZ-CG 3.34Å; F358-F594 HydrophobicContact CZ-CG 3.34Å; F358-F594 AromaticContact CZ-CZ 3.83Å; F358-F594 HydrophobicContact CZ-CZ 3.83Å; E370-F594 WeakPolarHBondContact OE2-CA 3.17Å; I374-F594 HydrophobicContact CD1-CD1 4.07Å; I374-F594 HydrophobicContact CD1-CE1 3.23Å; I374-F594 HydrophobicContact CD1-CE2 3.93Å; I374-F594 HydrophobicContact CD1-CZ 3.16Å; I374-F594 HydrophobicContact CG1-CZ 4.21Å; S590-F594 VanDerWaalsContact O-CD2 3.27Å; S590-F594 WeakPolarHBondContact O-CD2 3.38Å; S590-F594 PolarHBondContact O-N 3.1Å; R591-F594 PolarHBondContact O-N 3.08Å; F594-L596 HydrophobicContact CB-CD1 3.71Å; F594-L596 WeakPolarHBondContact O-CD1 3.31Å; F594-L596 PolarHBondContact O-N 2.87Å
595	G	72.3	Confident	72.9	Confident	56 Å²	56	66.1 Å²	66.1	58%	0.577	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	13	-171.2	0	0	0	0	0	116.1	R591 P592 I593 T597	R591-G595 CarbonylContact O-C 3.53Å; R591-G595 PolarHBondContact O-N 3.42Å; P592-G595 PolarHBondContact O-N 3.27Å; I593-G595 VanDerWaalsContact C-N 3.32Å; I593-G595 PolarHBondContact O-N 3.48Å; G595-T597 PolarHBondContact O-N 2.79Å
596	L	73.5	Confident	71.7	Confident	47 Å²	47	71.1 Å²	71.1	25%	0.246	38%	0.376	C	S	.	.			trans	-71	102.7	-175.6	-104.5	75.9	0	0	0	111.9	F358 R591 F594 S598	F358-L596 HydrophobicContact CE2-CD1 3.76Å; F358-L596 HydrophobicContact CE2-CD2 3.83Å; F358-L596 HydrophobicContact CE2-CG 4.41Å; F358-L596 HydrophobicContact CZ-CD1 3.65Å; F358-L596 HydrophobicContact CZ-CD2 4.44Å; R591-L596 HydrophobicContact CB-CB 4.32Å; R591-L596 WeakPolarHBondContact CB-O 3.47Å; R591-L596 HydrophobicContact CG-CB 3.94Å; R591-L596 PolarHBondContact O-N 2.58Å; F594-L596 HydrophobicContact CB-CD1 3.71Å; F594-L596 WeakPolarHBondContact O-CD1 3.31Å; F594-L596 PolarHBondContact O-N 2.87Å; L596-S598 PolarHBondContact O-N 3.41Å
597	T	61.2	Low	70.7	Confident	52 Å²	52	73.1 Å²	73.1	32%	0.319	39%	0.385	S	S	.	.			trans	-57.5	102	179.8	48.1	0	0	0	0	113.4	G595 N599 R611	G595-T597 PolarHBondContact O-N 2.79Å; T597-N599 PolarHBondContact O-N 2.71Å; T597-R611 PolarHBondContact OG1-NH1 2.95Å; T597-R611 PolarHBondContact OG1-NH2 2.78Å
598	S	56.2	Low	69.8	Low	75 Å²	75	75.5 Å²	75.5	52%	0.524	39%	0.39	S	S	.	.			trans	-62.3	-32.2	172	-46.1	0	0	0	0	112.4	R591 L596 Y600	R591-S598 WeakPolarHBondContact CD-OG 3.48Å; L596-S598 PolarHBondContact O-N 3.41Å; S598-Y600 PolarHBondContact O-N 2.95Å
599	N	55.4	Low	68.9	Low	101 Å²	101	75.8 Å²	75.8	54%	0.54	39%	0.392	S	S	.	.			trans	-97.6	76.8	-168.6	-170.4	1	0	0	0	113	T597 K601 G602 M603	T597-N599 PolarHBondContact O-N 2.71Å; N599-K601 PolarHBondContact O-N 2.75Å; N599-K601 WeakPolarHBondContact OD1-CA 3.29Å; N599-K601 WeakPolarHBondContact OD1-CB 3.35Å; N599-K601 PolarHBondContact OD1-N 3.06Å; N599-G602 PolarHBondContact O-N 2.86Å; N599-G602 PolarHBondContact OD1-N 3.48Å; N599-M603 PolarHBondContact O-N 3.43Å
600	Y	54	Low	68.1	Low	126 Å²	126	80.4 Å²	80.4	49%	0.494	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	0.3	169.2	-70.3	-94.3	0	0	0	114.9	S598 M603 R608 R611	S598-Y600 PolarHBondContact O-N 2.95Å; Y600-M603 HydrophobicContact CD1-CE 3.49Å; Y600-M603 VanDerWaalsContact CD1-CE 3.49Å; Y600-M603 HydrophobicContact CD1-SD 3.9Å; Y600-M603 HydrophobicContact CE1-CE 3.69Å; Y600-M603 HydrophobicContact CE1-SD 4.37Å; Y600-M603 HydrophobicContact CG-CE 4.08Å; Y600-R608 PolarHBondContact O-NH2 2.84Å; Y600-R611 PolarHBondContact OH-NH1 2.87Å
601	K	56	Low	67.1	Low	202 Å²	202	83.4 Å²	83.4	88%	0.878	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-19	178.7	-143.9	173.2	-175.2	176.5	0	113.1	N599	N599-K601 PolarHBondContact O-N 2.75Å; N599-K601 WeakPolarHBondContact OD1-CA 3.29Å; N599-K601 WeakPolarHBondContact OD1-CB 3.35Å; N599-K601 PolarHBondContact OD1-N 3.06Å
602	G	56.3	Low	66.3	Low	56 Å²	56	82.8 Å²	82.8	58%	0.577	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-23.2	167.5	0	0	0	0	0	113.4	N599 T604	N599-G602 PolarHBondContact O-N 2.86Å; N599-G602 PolarHBondContact OD1-N 3.48Å; G602-T604 PolarHBondContact O-N 3.27Å
603	M	53.9	Low	65.6	Low	16 Å²	16	83 Å²	83	8%	0.079	42%	0.421	C	S	.	.	S	Bend	trans	-48.4	126.4	173.6	-172.4	-178.6	-72	0	0	112	N599 Y600 E607 R608 R611	N599-M603 PolarHBondContact O-N 3.43Å; Y600-M603 HydrophobicContact CD1-CE 3.49Å; Y600-M603 VanDerWaalsContact CD1-CE 3.49Å; Y600-M603 HydrophobicContact CD1-SD 3.9Å; Y600-M603 HydrophobicContact CE1-CE 3.69Å; Y600-M603 HydrophobicContact CE1-SD 4.37Å; Y600-M603 HydrophobicContact CG-CE 4.08Å; M603-E607 WeakPolarHBondContact CA-OE2 3.37Å; M603-E607 HydrophobicContact CG-CB 4.01Å; M603-E607 VanDerWaalsContact CG-CD 3.4Å; M603-E607 HydrophobicContact CG-CG 3.81Å; M603-E607 WeakPolarHBondContact CG-OE2 3.31Å; M603-R608 HydrophobicContact SD-CB 4.26Å; M603-R611 VanDerWaalsContact CE-NH1 3.26Å
604	T	63.4	Low	65.1	Low	72 Å²	72	87 Å²	87	44%	0.442	44%	0.442	S	S	.	.			trans	-65.6	163	-175.4	63.4	0	0	0	0	111.9	G602 E606 E607 R608	G602-T604 PolarHBondContact O-N 3.27Å; T604-E606 PolarHBondContact O-N 3.42Å; T604-E607 PolarHBondContact N-OE2 3.07Å; T604-E607 WeakPolarHBondContact OG1-CB 3.28Å; T604-E607 PolarHBondContact OG1-N 3.41Å; T604-R608 WeakPolarHBondContact O-CB 3.31Å; T604-R608 PolarHBondContact O-N 3Å; T604-R608 VanDerWaalsContact O-N 3.12Å
605	R	61.2	Low	64.6	Low	186 Å²	186	92.5 Å²	92.5	70%	0.702	47%	0.468	S	S	*	.	H	α-helix	trans	-62.9	-29.8	175.2	169	178.6	175.4	179.9	-2.2	110.6	Q609	R605-Q609 WeakPolarHBondContact O-CG 3.37Å; R605-Q609 PolarHBondContact O-N 2.92Å; R605-Q609 PolarHBondContact O-NE2 3.08Å
606	E	67.6	Low	63.9	Low	106 Å²	106	93.2 Å²	93.2	50%	0.495	46%	0.457	S	S	.	.	H	α-helix	trans	-78.2	-50.3	-176.6	-66.8	56	-124.4	0	0	110.2	T604 R608 Q609 Q610	T604-E606 PolarHBondContact O-N 3.42Å; E606-R608 VanDerWaalsContact C-N 3.28Å; E606-R608 PolarHBondContact O-N 2.99Å; E606-Q609 CarbonylContact O-C 3.25Å; E606-Q609 WeakPolarHBondContact O-CA 3.26Å; E606-Q609 WeakPolarHBondContact O-CB 3.42Å; E606-Q609 PolarHBondContact O-N 3.25Å; E606-Q610 PolarHBondContact O-N 3.25Å
607	E	70.1	Confident	62.8	Low	55 Å²	55	95.3 Å²	95.3	26%	0.257	47%	0.471	S	S	.	.	H	α-helix	trans	-58.8	-37	174.7	-174.3	-169.1	163.3	0	0	112.2	M603 T604 Q610 R611	M603-E607 WeakPolarHBondContact CA-OE2 3.37Å; M603-E607 HydrophobicContact CG-CB 4.01Å; M603-E607 VanDerWaalsContact CG-CD 3.4Å; M603-E607 HydrophobicContact CG-CG 3.81Å; M603-E607 WeakPolarHBondContact CG-OE2 3.31Å; T604-E607 PolarHBondContact N-OE2 3.07Å; T604-E607 WeakPolarHBondContact OG1-CB 3.28Å; T604-E607 PolarHBondContact OG1-N 3.41Å; E607-Q610 PolarHBondContact O-N 3.48Å; E607-R611 PolarHBondContact O-N 3.48Å
608	R	71.4	Confident	62.3	Low	97 Å²	97	98 Å²	98	37%	0.366	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-40.6	172.1	-169.1	-173.1	-52	-95	-9.9	112.3	Y600 M603 T604 E606 Q610 R611 D612	Y600-R608 PolarHBondContact O-NH2 2.84Å; M603-R608 HydrophobicContact SD-CB 4.26Å; T604-R608 WeakPolarHBondContact O-CB 3.31Å; T604-R608 PolarHBondContact O-N 3Å; T604-R608 VanDerWaalsContact O-N 3.12Å; E606-R608 VanDerWaalsContact C-N 3.28Å; E606-R608 PolarHBondContact O-N 2.99Å; R608-Q610 VanDerWaalsContact C-N 3.3Å; R608-R611 PolarHBondContact O-N 2.58Å; R608-D612 WeakPolarHBondContact O-CB 3.45Å; R608-D612 VanDerWaalsContact O-CG 3.29Å; R608-D612 PolarHBondContact O-N 2.71Å
609	Q	70.6	Confident	62	Low	96 Å²	96	101.4 Å²	101.4	45%	0.449	50%	0.497	S	S	.	.	H	α-helix	trans	-67.3	-32.3	175.8	-77.5	167	111	0	0	111.8	R605 E606 L613	R605-Q609 WeakPolarHBondContact O-CG 3.37Å; R605-Q609 PolarHBondContact O-N 2.92Å; R605-Q609 PolarHBondContact O-NE2 3.08Å; E606-Q609 CarbonylContact O-C 3.25Å; E606-Q609 WeakPolarHBondContact O-CA 3.26Å; E606-Q609 WeakPolarHBondContact O-CB 3.42Å; E606-Q609 PolarHBondContact O-N 3.25Å; Q609-L613 VanDerWaalsContact O-CB 3.28Å; Q609-L613 WeakPolarHBondContact O-CB 3.4Å; Q609-L613 PolarHBondContact O-N 3.28Å
610	Q	72.1	Confident	61.5	Low	118 Å²	118	108.1 Å²	108.1	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-64.7	-53.6	171.4	-70.2	173.5	-65.3	0	0	110.6	E606 E607 R608 D612 L613 D614	E606-Q610 PolarHBondContact O-N 3.25Å; E607-Q610 PolarHBondContact O-N 3.48Å; R608-Q610 VanDerWaalsContact C-N 3.3Å; Q610-D612 VanDerWaalsContact C-N 3.31Å; Q610-D612 PolarHBondContact O-N 2.99Å; Q610-L613 CarbonylContact O-C 3.49Å; Q610-L613 WeakPolarHBondContact O-CA 3.34Å; Q610-L613 WeakPolarHBondContact O-CB 3.47Å; Q610-L613 PolarHBondContact O-N 3.4Å; Q610-D614 PolarHBondContact O-N 3.02Å; Q610-D614 VanDerWaalsContact O-OD2 3.1Å
611	R	68	Low	61.1	Low	79 Å²	79	112.3 Å²	112.3	30%	0.298	53%	0.53	S	S	.	.	H	α-helix	trans	-59	-38.1	175	-76.5	-165.2	-179.3	161	13.9	113.6	T597 Y600 M603 E607 R608 L613 Q615	T597-R611 PolarHBondContact OG1-NH1 2.95Å; T597-R611 PolarHBondContact OG1-NH2 2.78Å; Y600-R611 PolarHBondContact OH-NH1 2.87Å; M603-R611 VanDerWaalsContact CE-NH1 3.26Å; E607-R611 PolarHBondContact O-N 3.48Å; R608-R611 PolarHBondContact O-N 2.58Å; R611-L613 PolarHBondContact O-N 3.22Å; R611-Q615 WeakPolarHBondContact O-CB 3.39Å; R611-Q615 WeakPolarHBondContact O-CG 3.38Å; R611-Q615 PolarHBondContact O-N 2.94Å; R611-Q615 PolarHBondContact O-NE2 3.28Å
612	D	68.9	Low	60.7	Low	53 Å²	53	114.6 Å²	114.6	28%	0.283	53%	0.533	S	S	.	.	H	α-helix	trans	-62.5	-29	173.8	-76.4	-2.6	0	0	0	111.4	R608 Q610 Q616 R688	R608-D612 WeakPolarHBondContact O-CB 3.45Å; R608-D612 VanDerWaalsContact O-CG 3.29Å; R608-D612 PolarHBondContact O-N 2.71Å; Q610-D612 VanDerWaalsContact C-N 3.31Å; Q610-D612 PolarHBondContact O-N 2.99Å; D612-Q616 WeakPolarHBondContact O-CG 3.5Å; D612-Q616 PolarHBondContact O-NE2 3.45Å; D612-R688 IonicContact OD2-NH2 3.54Å; D612-R688 PolarHBondContact OD2-NH2 2.98Å
613	L	70.3	Confident	59.8	Low	97 Å²	97	118.9 Å²	118.9	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-88.1	-39.9	180	-168.8	69.6	0	0	0	112.8	Q609 Q610 R611 Q616 T617	Q609-L613 VanDerWaalsContact O-CB 3.28Å; Q609-L613 WeakPolarHBondContact O-CB 3.4Å; Q609-L613 PolarHBondContact O-N 3.28Å; Q610-L613 CarbonylContact O-C 3.49Å; Q610-L613 WeakPolarHBondContact O-CA 3.34Å; Q610-L613 WeakPolarHBondContact O-CB 3.47Å; Q610-L613 PolarHBondContact O-N 3.4Å; R611-L613 PolarHBondContact O-N 3.22Å; L613-Q616 CarbonylContact O-C 3.57Å; L613-Q616 WeakPolarHBondContact O-CA 3.16Å; L613-Q616 WeakPolarHBondContact O-CB 3.42Å; L613-Q616 PolarHBondContact O-N 2.93Å; L613-T617 PolarHBondContact O-N 3Å; L613-T617 VanDerWaalsContact O-N 3.14Å
614	D	68.6	Low	59	Low	94 Å²	94	123.2 Å²	123.2	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-66.7	-43.2	-179.9	-60.9	-34.1	0	0	0	110.9	Q610 Q616 T617	Q610-D614 PolarHBondContact O-N 3.02Å; Q610-D614 VanDerWaalsContact O-OD2 3.1Å; D614-Q616 PolarHBondContact O-N 3.39Å; D614-T617 WeakPolarHBondContact O-CB 3.27Å; D614-T617 PolarHBondContact O-N 2.94Å; D614-T617 PolarHBondContact O-OG1 2.92Å
615	Q	65.9	Low	57.7	Low	158 Å²	158	128.2 Å²	128.2	74%	0.738	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-22.2	170.6	-73.4	171.7	98	0	0	113.1	R611	R611-Q615 WeakPolarHBondContact O-CB 3.39Å; R611-Q615 WeakPolarHBondContact O-CG 3.38Å; R611-Q615 PolarHBondContact O-N 2.94Å; R611-Q615 PolarHBondContact O-NE2 3.28Å
616	Q	57	Low	56.8	Low	72 Å²	72	124.9 Å²	124.9	34%	0.336	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-8.1	173.6	-80	-178.9	81.4	0	0	113.8	D612 L613 D614 P618	D612-Q616 WeakPolarHBondContact O-CG 3.5Å; D612-Q616 PolarHBondContact O-NE2 3.45Å; L613-Q616 CarbonylContact O-C 3.57Å; L613-Q616 WeakPolarHBondContact O-CA 3.16Å; L613-Q616 WeakPolarHBondContact O-CB 3.42Å; L613-Q616 PolarHBondContact O-N 2.93Å; D614-Q616 PolarHBondContact O-N 3.39Å; Q616-P618 WeakPolarHBondContact O-CD 3.49Å
617	T	51.1	Low	55.3	Low	91 Å²	91	127.5 Å²	127.5	56%	0.558	61%	0.607	S	S	*	*	S	Bend	trans	-71.1	110.7	165	69.9	0	0	0	0	107.6	L613 D614 Q619	L613-T617 PolarHBondContact O-N 3Å; L613-T617 VanDerWaalsContact O-N 3.14Å; D614-T617 WeakPolarHBondContact O-CB 3.27Å; D614-T617 PolarHBondContact O-N 2.94Å; D614-T617 PolarHBondContact O-OG1 2.92Å; T617-Q619 PolarHBondContact O-N 2.79Å; T617-Q619 VanDerWaalsContact O-N 3.14Å
618	P	49.9	Very low	53.7	Low	109 Å²	109	132.9 Å²	132.9	71%	0.708	63%	0.63	S	S	*	*			trans	-68.9	120.6	177.6	29.1	-32.1	0	0	0	106.8	Q616 R620	Q616-P618 WeakPolarHBondContact O-CD 3.49Å; P618-R620 PolarHBondContact O-N 3.33Å
619	Q	49.4	Very low	52.1	Low	145 Å²	145	133.8 Å²	133.8	68%	0.678	65%	0.646	S	S	*	*			trans	-43.9	112.2	177.9	-86.6	-164.2	-21.2	0	0	109.5	T617 R621	T617-Q619 PolarHBondContact O-N 2.79Å; T617-Q619 VanDerWaalsContact O-N 3.14Å; Q619-R621 PolarHBondContact O-N 2.84Å
620	R	45.5	Very low	50.7	Low	242 Å²	242	136.5 Å²	136.5	91%	0.913	66%	0.658	S	S	*	*			trans	-75.4	71.1	179.4	-73.1	-176.5	62.4	-150.7	-4.6	108.7	P618 R622	P618-R620 PolarHBondContact O-N 3.33Å; R620-R622 PolarHBondContact O-N 3.11Å
621	R	46.8	Very low	48.8	Very low	215 Å²	215	142.8 Å²	142.8	81%	0.811	68%	0.677	S	S	*	*			trans	-44.4	124	177.9	-80.6	-176.5	159.9	-168	-8.5	109.5	Q619 L623	Q619-R621 PolarHBondContact O-N 2.84Å; R621-L623 PolarHBondContact O-N 3.39Å
622	R	46.3	Very low	47.4	Very low	249 Å²	249	142.9 Å²	142.9	94%	0.94	69%	0.694	S	S	*	*			trans	-47.9	121.7	-166.1	-62.5	-177.8	176.5	-146.1	-0.1	111.9	R620	R620-R622 PolarHBondContact O-N 3.11Å
623	L	37.2	Very low	46.1	Very low	146 Å²	146	149 Å²	149	76%	0.764	72%	0.721	S	S	*	*			trans	-141.9	127.3	164.3	-76.3	179.7	0	0	0	110	R621	R621-L623 PolarHBondContact O-N 3.39Å
624	S	37.1	Very low	44.5	Very low	107 Å²	107	153.1 Å²	153.1	75%	0.748	74%	0.738	S	S	*	*			trans	46.9	99	165	60.4	0	0	0	0	117.8	P626	S624-P626 WeakPolarHBondContact O-CD 3.5Å
625	E	36.2	Very low	43.4	Very low	177 Å²	177	153.8 Å²	153.8	83%	0.827	75%	0.747	S	S	*	*			trans	-60.8	125.8	136.6	177.7	-177.5	173.9	0	0	108.9	Q627	E625-Q627 PolarHBondContact O-N 3.36Å
626	P	42.8	Very low	42.1	Very low	116 Å²	116	152.6 Å²	152.6	75%	0.753	75%	0.746	S	S	*	*			trans	-92.8	87.3	175.4	34.1	-29.8	0	0	0	110.1	S624 K628	S624-P626 WeakPolarHBondContact O-CD 3.5Å; P626-K628 PolarHBondContact O-N 3.42Å
627	Q	36.6	Very low	41.7	Very low	162 Å²	162	155.7 Å²	155.7	76%	0.757	77%	0.77	S	S	*	*			trans	-58.9	108.8	175.1	-171.8	-175.6	2.6	0	0	110.2	E625 V629	E625-Q627 PolarHBondContact O-N 3.36Å; Q627-V629 HydrophobicContact CG-CG2 4.29Å; Q627-V629 PolarHBondContact O-N 2.86Å
628	K	35.6	Very low	41.3	Very low	168 Å²	168	160.5 Å²	160.5	73%	0.73	78%	0.783	S	S	*	*			trans	-74.4	98.4	-175.7	-170.5	-157.6	177.5	-155.6	0	111	P626 E630	P626-K628 PolarHBondContact O-N 3.42Å; K628-E630 WeakPolarHBondContact CE-OE1 3.21Å; K628-E630 IonicContact NZ-OE1 2.73Å; K628-E630 PolarHBondContact NZ-OE1 3.34Å
629	V	37.3	Very low	40.6	Very low	116 Å²	116	160 Å²	160	70%	0.703	78%	0.782	S	S	*	*			trans	-118.9	114.7	167.1	-171.1	0	0	0	0	109.3	Q627	Q627-V629 HydrophobicContact CG-CG2 4.29Å; Q627-V629 PolarHBondContact O-N 2.86Å
630	E	42	Very low	40.2	Very low	152 Å²	152	158.1 Å²	158.1	71%	0.71	78%	0.783	S	S	*	*			trans	-81.8	123.2	176	-68.9	176.4	-168.2	0	0	110.5	K628	K628-E630 WeakPolarHBondContact CE-OE1 3.21Å; K628-E630 IonicContact NZ-OE1 2.73Å; K628-E630 PolarHBondContact NZ-OE1 3.34Å
631	R	32.9	Very low	40.1	Very low	251 Å²	251	152.8 Å²	152.8	95%	0.947	78%	0.779	S	S	*	*			trans	-147.3	136.5	156.5	-150.7	166.7	-167.7	146.8	5.5	110.5
632	A	37.1	Very low	39.5	Very low	80 Å²	80	149.2 Å²	149.2	66%	0.661	78%	0.781	S	S	*	*			trans	-103.4	150.8	-170.3	0	0	0	0	0	112.6
633	Q	41.6	Very low	39	Very low	183 Å²	183	143 Å²	143	86%	0.855	78%	0.776	S	S	*	*			trans	52	109.6	152.7	-64.5	172.3	49.7	0	0	118.4
634	E	37.5	Very low	39	Very low	183 Å²	183	140.8 Å²	140.8	86%	0.855	77%	0.773	S	S	*	*				-166.7	145.3	116.9	-91.6	-82.1	110.1	0	0	107.3
635	P	45.6	Very low	38.8	Very low	108 Å²	108	139 Å²	139	70%	0.701	77%	0.771	S	S	*	*			trans	-97.7	95.4	-177.6	35.1	-30.7	0	0	0	112.7
636	D	39.4	Very low	39	Very low	133 Å²	133	134 Å²	134	71%	0.711	77%	0.767	S	S	*	*			trans	-74.5	139.2	171.1	-170.6	4.9	0	0	0	111.6	F638	D636-F638 PolarHBondContact OD1-N 3.02Å
637	V	47.6	Very low	38.7	Very low	137 Å²	137	135.9 Å²	135.9	83%	0.83	77%	0.766	S	S	*	*	S	Bend	trans	-103.9	-0.9	-169.7	-174.4	0	0	0	0	111.8
638	F	43.1	Very low	39.1	Very low	192 Å²	192	130.7 Å²	130.7	84%	0.842	75%	0.745	S	S	*	*			trans	-122.2	30	-171.8	-143.1	-99.7	0	0	0	116.6	D636	D636-F638 PolarHBondContact OD1-N 3.02Å
639	S	36.1	Very low	39.7	Very low	97 Å²	97	127.7 Å²	127.7	68%	0.678	74%	0.743	S	S	*	*			trans	-96.2	130.5	169.1	-75.7	0	0	0	0	112.3
640	P	40.1	Very low	40.3	Very low	107 Å²	107	133.2 Å²	133.2	70%	0.695	75%	0.751	S	S	*	*			trans	-71.6	147.1	175.3	30.6	-34.6	0	0	0	111.1	T642	P640-T642 PolarHBondContact O-N 3.49Å; P640-T642 VanDerWaalsContact O-N 3.1Å
641	P	44.3	Very low	41.1	Very low	129 Å²	129	130.3 Å²	130.3	84%	0.838	73%	0.734	S	S	*	*			trans	-67.3	112.8	179.9	27.1	-33.8	0	0	0	110.9	S643	P641-S643 PolarHBondContact O-N 3.37Å
642	T	33.8	Very low	42.2	Very low	140 Å²	140	122 Å²	122	86%	0.859	71%	0.708	S	S	*	*			trans	-63.9	107.3	171.9	38.9	0	0	0	0	109.5	P640 S644	P640-T642 PolarHBondContact O-N 3.49Å; P640-T642 VanDerWaalsContact O-N 3.1Å; T642-S644 PolarHBondContact O-N 2.86Å
643	S	35	Very low	43.2	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	71%	0.708	S	S	*	*			trans	-65.9	101.9	-174.9	-173.3	0	0	0	0	111.2	P641 G645	P641-S643 PolarHBondContact O-N 3.37Å; S643-G645 PolarHBondContact O-N 2.79Å
644	S	37.1	Very low	43.9	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	70%	0.698	S	S	*	*			trans	-66.3	93.7	171.4	-176.2	0	0	0	0	109.8	T642 G646	T642-S644 PolarHBondContact O-N 2.86Å; S644-G646 PolarHBondContact O-N 3.04Å
645	G	33.3	Very low	45.1	Very low	69 Å²	69	118.6 Å²	118.6	71%	0.711	68%	0.68	S	S	*	*			trans	-65.7	112.4	-173.8	0	0	0	0	0	113.2	S643 Q647	S643-G645 PolarHBondContact O-N 2.79Å; G645-Q647 PolarHBondContact O-N 3.2Å
646	G	39.7	Very low	45.7	Very low	71 Å²	71	118.2 Å²	118.2	73%	0.732	67%	0.669	S	S	*	*	S	Bend	trans	93.9	-16.8	157.9	0	0	0	0	0	117.5	S644 T648	S644-G646 PolarHBondContact O-N 3.04Å; G646-T648 PolarHBondContact O-N 3.3Å
647	Q	37.6	Very low	46.6	Very low	156 Å²	156	119.1 Å²	119.1	73%	0.729	67%	0.673	S	S	*	*			trans	-90.7	78.5	177.9	-65	-164.1	11.5	0	0	112.6	G645	G645-Q647 PolarHBondContact O-N 3.2Å
648	T	43.9	Very low	47.4	Very low	53 Å²	53	116.9 Å²	116.9	33%	0.325	66%	0.66	S	S	.	*			trans	-59.8	134.3	157.5	51.2	0	0	0	0	108.7	G646 R650 R676	G646-T648 PolarHBondContact O-N 3.3Å; T648-R650 PolarHBondContact O-N 2.86Å; T648-R676 PolarHBondContact OG1-NH1 2.83Å
649	P	49.1	Very low	48.1	Very low	105 Å²	105	110.6 Å²	110.6	68%	0.682	65%	0.649	S	S	*	*			trans	-49.4	139	-178	-29.8	35.2	0	0	0	112.7	R651	P649-R651 VanDerWaalsContact C-N 3.26Å; P649-R651 PolarHBondContact O-N 3.25Å
650	R	50.3	Low	49.2	Very low	232 Å²	232	113.4 Å²	113.4	88%	0.875	65%	0.652	S	S	*	*			trans	-65.4	90.5	169.1	-90.6	-176	165.5	169.1	-4.3	108.3	T648 D652	T648-R650 PolarHBondContact O-N 2.86Å; R650-D652 PolarHBondContact O-N 2.98Å
651	R	57.3	Low	50.1	Low	92 Å²	92	111.5 Å²	111.5	35%	0.347	63%	0.633	S	S	.	*			trans	-64.7	126	174.5	-59.2	-166.7	117.4	116.8	5.1	108.7	P649 L653 Q656 E661 L664	P649-R651 VanDerWaalsContact C-N 3.26Å; P649-R651 PolarHBondContact O-N 3.25Å; R651-L653 PolarHBondContact O-N 2.88Å; R651-Q656 VanDerWaalsContact CB-NE2 3.25Å; R651-E661 WeakPolarHBondContact CB-OE2 3.26Å; R651-E661 WeakPolarHBondContact CD-OE2 3.48Å; R651-E661 WeakPolarHBondContact CG-OE2 3.33Å; R651-E661 IonicContact CZ-OE1 2.69Å; R651-E661 IonicContact CZ-OE2 2.86Å; R651-E661 IonicContact NE-OE1 2.64Å; R651-E661 PolarHBondContact NE-OE1 3.46Å; R651-E661 IonicContact NE-OE2 3.19Å; R651-E661 PolarHBondContact NE-OE2 3.01Å; R651-E661 IonicContact NH2-OE1 2.86Å; R651-E661 PolarHBondContact NH2-OE1 3.42Å; R651-L664 VanDerWaalsContact NH1-CG 3.32Å
652	D	56.3	Low	50.9	Low	75 Å²	75	113.8 Å²	113.8	40%	0.401	63%	0.63	S	S	.	*			trans	-70.3	118.7	-178.4	-173.4	-7.8	0	0	0	109.1	R650 E654 K655 Q656	R650-D652 PolarHBondContact O-N 2.98Å; D652-E654 PolarHBondContact O-N 3.32Å; D652-E654 PolarHBondContact OD1-N 3.12Å; D652-K655 HydrophobicContact CB-CB 4.24Å; D652-K655 HydrophobicContact CB-CD 4.05Å; D652-K655 HydrophobicContact CB-CG 3.98Å; D652-K655 PolarHBondContact O-N 3.27Å; D652-K655 VanDerWaalsContact O-N 3.1Å; D652-K655 VanDerWaalsContact OD2-CE 3.29Å; D652-K655 WeakPolarHBondContact OD2-CE 3.49Å; D652-Q656 PolarHBondContact O-N 3.2Å
653	L	58.6	Low	52.4	Low	127 Å²	127	111.3 Å²	111.3	67%	0.665	62%	0.624	S	S	*	*	H	α-helix	trans	-62.3	-30.2	-177.7	-86.7	82.7	0	0	0	111.3	R651 K655 Q656 L657	R651-L653 PolarHBondContact O-N 2.88Å; L653-K655 VanDerWaalsContact C-N 3.28Å; L653-K655 PolarHBondContact O-N 3.45Å; L653-Q656 PolarHBondContact O-N 2.99Å; L653-L657 PolarHBondContact O-N 3.28Å
654	E	57.1	Low	54.1	Low	141 Å²	141	108 Å²	108	66%	0.659	60%	0.597	S	S	*	*	H	α-helix	trans	-63.2	-37.6	177.6	-166.9	152.9	-115.2	0	0	110.8	D652 Q656 L657 T658	D652-E654 PolarHBondContact O-N 3.32Å; D652-E654 PolarHBondContact OD1-N 3.12Å; E654-Q656 VanDerWaalsContact C-N 3.34Å; E654-Q656 PolarHBondContact O-N 2.82Å; E654-L657 PolarHBondContact O-N 3.34Å; E654-T658 WeakPolarHBondContact O-CG2 3.35Å; E654-T658 PolarHBondContact O-N 3.04Å; E654-T658 PolarHBondContact O-OG1 3.04Å
655	K	61.2	Low	55.8	Low	107 Å²	107	111.3 Å²	111.3	47%	0.465	59%	0.594	S	S	.	*	H	α-helix	trans	-77.7	-16	179.3	-59	-174.3	-175	-175.8	0	114.6	D652 L653 T658 E660 E661	D652-K655 HydrophobicContact CB-CB 4.24Å; D652-K655 HydrophobicContact CB-CD 4.05Å; D652-K655 HydrophobicContact CB-CG 3.98Å; D652-K655 PolarHBondContact O-N 3.27Å; D652-K655 VanDerWaalsContact O-N 3.1Å; D652-K655 VanDerWaalsContact OD2-CE 3.29Å; D652-K655 WeakPolarHBondContact OD2-CE 3.49Å; L653-K655 VanDerWaalsContact C-N 3.28Å; L653-K655 PolarHBondContact O-N 3.45Å; K655-T658 WeakPolarHBondContact CA-OG1 3.39Å; K655-T658 PolarHBondContact O-OG1 3.18Å; K655-E660 PolarHBondContact O-N 3.28Å; K655-E661 PolarHBondContact O-N 3.44Å; K655-E661 VanDerWaalsContact O-N 3.17Å
656	Q	59.4	Low	57.5	Low	100 Å²	100	113.3 Å²	113.3	47%	0.467	59%	0.594	S	S	.	*	H	α-helix	trans	-82.1	-34.9	167	-65.1	179.6	14.9	0	0	111	R651 D652 L653 E654 G659	R651-Q656 VanDerWaalsContact CB-NE2 3.25Å; D652-Q656 PolarHBondContact O-N 3.2Å; L653-Q656 PolarHBondContact O-N 2.99Å; E654-Q656 VanDerWaalsContact C-N 3.34Å; E654-Q656 PolarHBondContact O-N 2.82Å; Q656-G659 PolarHBondContact O-N 3.38Å
657	L	58.3	Low	59	Low	153 Å²	153	113.5 Å²	113.5	80%	0.801	60%	0.596	S	S	*	*	H	α-helix	trans	-72.2	-32.6	175.4	-79.7	157.2	0	0	0	113.1	L653 E654 G659	L653-L657 PolarHBondContact O-N 3.28Å; E654-L657 PolarHBondContact O-N 3.34Å; L657-G659 PolarHBondContact O-N 2.87Å
658	T	63.4	Low	61	Low	90 Å²	90	109.3 Å²	109.3	55%	0.552	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-11.7	168.7	59.8	0	0	0	0	113.4	E654 K655 E660	E654-T658 WeakPolarHBondContact O-CG2 3.35Å; E654-T658 PolarHBondContact O-N 3.04Å; E654-T658 PolarHBondContact O-OG1 3.04Å; K655-T658 WeakPolarHBondContact CA-OG1 3.39Å; K655-T658 PolarHBondContact O-OG1 3.18Å; T658-E660 VanDerWaalsContact C-N 3.26Å; T658-E660 PolarHBondContact O-N 2.87Å
659	G	57.9	Low	62	Low	60 Å²	60	112.9 Å²	112.9	62%	0.619	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.2	6.9	179	0	0	0	0	0	115.2	Q656 L657	Q656-G659 PolarHBondContact O-N 3.38Å; L657-G659 PolarHBondContact O-N 2.87Å
660	E	59	Low	62.9	Low	156 Å²	156	110 Å²	110	73%	0.729	59%	0.592	S	S	*	*			trans	-69.5	-36.5	178.4	-65.9	-176	137.2	0	0	111.8	K655 T658	K655-E660 PolarHBondContact O-N 3.28Å; T658-E660 VanDerWaalsContact C-N 3.26Å; T658-E660 PolarHBondContact O-N 2.87Å
661	E	59	Low	64.1	Low	66 Å²	66	102.7 Å²	102.7	31%	0.308	57%	0.567	S	S	.	*	S	Bend	trans	-98.1	110.9	179.7	-160.6	175.1	-146.8	0	0	112.8	R651 K655 A663	R651-E661 WeakPolarHBondContact CB-OE2 3.26Å; R651-E661 WeakPolarHBondContact CD-OE2 3.48Å; R651-E661 WeakPolarHBondContact CG-OE2 3.33Å; R651-E661 IonicContact CZ-OE1 2.69Å; R651-E661 IonicContact CZ-OE2 2.86Å; R651-E661 IonicContact NE-OE1 2.64Å; R651-E661 PolarHBondContact NE-OE1 3.46Å; R651-E661 IonicContact NE-OE2 3.19Å; R651-E661 PolarHBondContact NE-OE2 3.01Å; R651-E661 IonicContact NH2-OE1 2.86Å; R651-E661 PolarHBondContact NH2-OE1 3.42Å; K655-E661 PolarHBondContact O-N 3.44Å; K655-E661 VanDerWaalsContact O-N 3.17Å; E661-A663 PolarHBondContact O-N 3.19Å
662	K	62.5	Low	64.5	Low	177 Å²	177	101 Å²	101	77%	0.77	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-73	123.4	-176.8	-143.8	164.1	-166.3	162.7	0	110.9	L664	K662-L664 PolarHBondContact O-N 3.46Å
663	A	64.4	Low	65.1	Low	88 Å²	88	101.8 Å²	101.8	73%	0.727	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-56.6	131.4	177.3	0	0	0	0	0	111.7	E661	E661-A663 PolarHBondContact O-N 3.19Å
664	L	70.3	Confident	65.7	Low	50 Å²	50	106 Å²	106	26%	0.262	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-60.2	143.3	-179.8	-64	-171.8	0	0	0	111.5	R651 K662 D668 P669 F671	R651-L664 VanDerWaalsContact NH1-CG 3.32Å; K662-L664 PolarHBondContact O-N 3.46Å; L664-D668 HydrophobicContact CB-CB 4.14Å; L664-D668 HydrophobicContact CD2-CB 3.95Å; L664-D668 HydrophobicContact CG-CB 4.42Å; L664-P669 WeakPolarHBondContact CD1-O 3.42Å; L664-F671 HydrophobicContact CB-CB 4.28Å; L664-F671 HydrophobicContact CB-CD2 4.07Å; L664-F671 WeakPolarHBondContact O-CD2 3.28Å
665	R	73.5	Confident	66.2	Low	170 Å²	170	104.2 Å²	104.2	64%	0.642	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-101.3	159.2	178.5	-64.4	-176.5	171.3	-137.6	-9.4	111.1	G667 D668 F671	R665-G667 PolarHBondContact O-N 3.28Å; R665-D668 PolarHBondContact N-OD2 3.09Å; R665-D668 PolarHBondContact O-N 3.25Å; R665-F671 WeakPolarHBondContact O-CB 3.44Å; R665-F671 VanDerWaalsContact O-CD2 3.31Å; R665-F671 WeakPolarHBondContact O-CD2 3.39Å; R665-F671 VanDerWaalsContact O-CG 3.28Å; R665-F671 WeakPolarHBondContact O-CG 3.39Å
666	P	69.4	Low	66.6	Low	111 Å²	111	106.4 Å²	106.4	72%	0.721	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	113.3	170.9	-24.4	33.2	0	0	0	111.3	F671	P666-F671 HydrophobicContact CB-CD1 4.42Å; P666-F671 HydrophobicContact CB-CE1 3.97Å; P666-F671 HydrophobicContact CB-CZ 4.19Å; P666-F671 HydrophobicContact CG-CE1 3.96Å; P666-F671 HydrophobicContact CG-CE2 4.19Å; P666-F671 HydrophobicContact CG-CZ 3.67Å
667	G	69.8	Low	67.1	Low	74 Å²	74	107.8 Å²	107.8	76%	0.763	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.3	-20.7	-176.3	0	0	0	0	0	114.8	R665	R665-G667 PolarHBondContact O-N 3.28Å
668	D	79.4	Confident	67.7	Low	69 Å²	69	105.9 Å²	105.9	37%	0.369	62%	0.619	S	S	.	*	S	Bend	trans	-72	142.7	178.3	-65.9	-26.2	0	0	0	111.5	L664 R665 G670 F671	L664-D668 HydrophobicContact CB-CB 4.14Å; L664-D668 HydrophobicContact CD2-CB 3.95Å; L664-D668 HydrophobicContact CG-CB 4.42Å; R665-D668 PolarHBondContact N-OD2 3.09Å; R665-D668 PolarHBondContact O-N 3.25Å; D668-G670 PolarHBondContact O-N 2.98Å; D668-F671 WeakPolarHBondContact O-CB 3.2Å; D668-F671 PolarHBondContact O-N 3.47Å
669	P	65.6	Low	67.8	Low	127 Å²	127	108.7 Å²	108.7	83%	0.825	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	123	175	-27.5	35.8	0	0	0	112.7	L664	L664-P669 WeakPolarHBondContact CD1-O 3.42Å
670	G	68.2	Low	68.2	Low	45 Å²	45	111.5 Å²	111.5	46%	0.464	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	86.4	1.2	-176.1	0	0	0	0	0	115.3	D668 C672	D668-G670 PolarHBondContact O-N 2.98Å; G670-C672 PolarHBondContact O-N 2.91Å
671	F	76.6	Confident	68.6	Low	78 Å²	78	107.9 Å²	107.9	34%	0.342	63%	0.627	S	S	.	*			trans	-62	129.8	169.2	178.5	-96.8	0	0	0	110.7	L664 R665 P666 D668 A673	L664-F671 HydrophobicContact CB-CB 4.28Å; L664-F671 HydrophobicContact CB-CD2 4.07Å; L664-F671 WeakPolarHBondContact O-CD2 3.28Å; R665-F671 WeakPolarHBondContact O-CB 3.44Å; R665-F671 VanDerWaalsContact O-CD2 3.31Å; R665-F671 WeakPolarHBondContact O-CD2 3.39Å; R665-F671 VanDerWaalsContact O-CG 3.28Å; R665-F671 WeakPolarHBondContact O-CG 3.39Å; P666-F671 HydrophobicContact CB-CD1 4.42Å; P666-F671 HydrophobicContact CB-CE1 3.97Å; P666-F671 HydrophobicContact CB-CZ 4.19Å; P666-F671 HydrophobicContact CG-CE1 3.96Å; P666-F671 HydrophobicContact CG-CE2 4.19Å; P666-F671 HydrophobicContact CG-CZ 3.67Å; D668-F671 WeakPolarHBondContact O-CB 3.2Å; D668-F671 PolarHBondContact O-N 3.47Å; F671-A673 HydrophobicContact CD1-CB 4.5Å; F671-A673 HydrophobicContact CE1-CB 3.78Å
672	C	65.2	Low	68.6	Low	57 Å²	57	111.3 Å²	111.3	39%	0.385	65%	0.648	S	S	.	*			trans	-115	110	176.9	-160.4	0	0	0	0	109.5	G670 R674	G670-C672 PolarHBondContact O-N 2.91Å; C672-R674 PolarHBondContact O-N 3.26Å
673	A	68.5	Low	68.9	Low	92 Å²	92	111 Å²	111	76%	0.76	65%	0.646	S	S	*	*	S	Bend	trans	-68.9	-11	-178.6	0	0	0	0	0	114.2	F671	F671-A673 HydrophobicContact CD1-CB 4.5Å; F671-A673 HydrophobicContact CE1-CB 3.78Å
674	R	71.9	Confident	68.8	Low	215 Å²	215	111.8 Å²	111.8	81%	0.811	64%	0.638	S	S	*	*	S	Bend	trans	-98.7	132.3	176.1	-72.9	172.2	130.5	154.6	-4.9	109.1	C672 R676	C672-R674 PolarHBondContact O-N 3.26Å; R674-R676 PolarHBondContact O-N 2.92Å; R674-R676 VanDerWaalsContact O-N 3.1Å
675	A	67.7	Low	68.5	Low	104 Å²	104	119 Å²	119	86%	0.86	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-57.1	116.7	170	0	0	0	0	0	109.4
676	R	69.3	Low	67.9	Low	152 Å²	152	114.7 Å²	114.7	57%	0.574	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-76.7	123.7	171.2	-70.3	178.4	173	177.4	-6.7	107.5	T648 R674 P678	T648-R676 PolarHBondContact OG1-NH1 2.83Å; R674-R676 PolarHBondContact O-N 2.92Å; R674-R676 VanDerWaalsContact O-N 3.1Å; R676-P678 WeakPolarHBondContact O-CD 3.46Å
677	V	68.6	Low	67.8	Low	130 Å²	130	115.4 Å²	115.4	79%	0.788	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-56.6	125.2	172.6	-178.5	0	0	0	0	107.7	M679	V677-M679 PolarHBondContact O-N 2.83Å
678	P	72.2	Confident	67.8	Low	113 Å²	113	119.7 Å²	119.7	73%	0.734	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57	128.6	173.7	-23.6	34.1	0	0	0	109.2	R676	R676-P678 WeakPolarHBondContact O-CD 3.46Å
679	M	65.3	Low	67.6	Low	148 Å²	148	121.7 Å²	121.7	73%	0.729	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-59.6	138.1	172.8	-59.1	-161.1	-42	0	0	108.6	V677 S681	V677-M679 PolarHBondContact O-N 2.83Å; M679-S681 PolarHBondContact O-N 3.18Å
680	P	66.2	Low	67.5	Low	119 Å²	119	124.8 Å²	124.8	77%	0.773	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-48.5	128.4	173.1	-29.6	36.6	0	0	0	110.6	N682	P680-N682 PolarHBondContact O-N 3.46Å
681	S	66.6	Low	67.7	Low	81 Å²	81	132.8 Å²	132.8	57%	0.566	68%	0.684	S	S	*	*			trans	-88.7	104.2	-175.6	171.3	0	0	0	0	108.8	M679 K683	M679-S681 PolarHBondContact O-N 3.18Å; S681-K683 PolarHBondContact O-N 3.04Å; S681-K683 VanDerWaalsContact OG-CD 3.31Å; S681-K683 WeakPolarHBondContact OG-CD 3.34Å; S681-K683 VanDerWaalsContact OG-CG 3.26Å; S681-K683 WeakPolarHBondContact OG-CG 3.13Å
682	N	60.5	Low	67.3	Low	138 Å²	138	136.6 Å²	136.6	74%	0.738	71%	0.708	S	S	*	*			trans	-66.8	65.3	170.7	-60.9	21.3	0	0	0	110.8	P680 D684	P680-N682 PolarHBondContact O-N 3.46Å; N682-D684 VanDerWaalsContact C-N 3.34Å
683	K	67.3	Low	67.1	Low	170 Å²	170	138 Å²	138	74%	0.739	72%	0.715	S	S	*	*			trans	-102.2	56.3	173.3	-80.6	178.2	-175.2	178.7	0	108.8	S681	S681-K683 PolarHBondContact O-N 3.04Å; S681-K683 VanDerWaalsContact OG-CD 3.31Å; S681-K683 WeakPolarHBondContact OG-CD 3.34Å; S681-K683 VanDerWaalsContact OG-CG 3.26Å; S681-K683 WeakPolarHBondContact OG-CG 3.13Å
684	D	63.1	Low	66.4	Low	104 Å²	104	143.2 Å²	143.2	56%	0.556	72%	0.723	S	S	*	*			trans	-69.8	137.9	174.9	-60.8	-69.2	0	0	0	109.5	N682 V686	N682-D684 VanDerWaalsContact C-N 3.34Å; D684-V686 VanDerWaalsContact C-N 3.32Å; D684-V686 WeakPolarHBondContact O-CG2 3.41Å; D684-V686 PolarHBondContact O-N 3.22Å
685	Y	64.3	Low	65.6	Low	203 Å²	203	134.9 Å²	134.9	80%	0.796	71%	0.705	S	S	*	*			trans	-78.6	76.8	-169.8	-75.8	-89	0	0	0	112.2	V687 R688	Y685-V687 VanDerWaalsContact C-N 3.27Å; Y685-V687 PolarHBondContact O-N 3.44Å; Y685-R688 PolarHBondContact O-N 2.76Å
686	V	60.7	Low	64.7	Low	78 Å²	78	134.8 Å²	134.8	47%	0.473	69%	0.69	S	S	.	*	S	Bend	trans	-53.5	-47.2	174.6	-150.3	0	0	0	0	110.9	D684 R688	D684-V686 VanDerWaalsContact C-N 3.32Å; D684-V686 WeakPolarHBondContact O-CG2 3.41Å; D684-V686 PolarHBondContact O-N 3.22Å; V686-R688 VanDerWaalsContact C-N 3.29Å; V686-R688 PolarHBondContact O-N 3.38Å
687	V	66.9	Low	64.1	Low	126 Å²	126	133.3 Å²	133.3	76%	0.764	70%	0.703	S	S	*	*	S	Bend	trans	-81.1	82.2	172	-173.2	0	0	0	0	108.2	Y685	Y685-V687 VanDerWaalsContact C-N 3.27Å; Y685-V687 PolarHBondContact O-N 3.44Å
688	R	69.7	Low	63.2	Low	165 Å²	165	131.7 Å²	131.7	62%	0.623	70%	0.697	S	S	*	*			trans	-51.8	128.3	168.4	-58.8	178.3	-170.3	-120.4	-1.2	108	D612 Y685 V686 K690	D612-R688 IonicContact OD2-NH2 3.54Å; D612-R688 PolarHBondContact OD2-NH2 2.98Å; Y685-R688 PolarHBondContact O-N 2.76Å; V686-R688 VanDerWaalsContact C-N 3.29Å; V686-R688 PolarHBondContact O-N 3.38Å; R688-K690 PolarHBondContact O-N 3.02Å
689	P	75	Confident	62.5	Low	111 Å²	111	136.2 Å²	136.2	72%	0.721	70%	0.7	S	S	*	*			trans	-58.6	133.7	-174.2	22.5	-33	0	0	0	110.4	W691	P689-W691 PolarHBondContact O-N 3.19Å; P689-W691 VanDerWaalsContact O-N 3.08Å
690	K	64.5	Low	62.2	Low	192 Å²	192	131.5 Å²	131.5	84%	0.835	69%	0.689	S	S	*	*			trans	-61.5	115.5	175.9	-70.9	-174.8	178.4	-178.6	0	108.4	R688 N692	R688-K690 PolarHBondContact O-N 3.02Å; K690-N692 PolarHBondContact O-N 3.26Å; K690-N692 PolarHBondContact O-OD1 3.42Å
691	W	71.3	Confident	61.5	Low	213 Å²	213	132 Å²	132	81%	0.807	69%	0.692	S	S	*	*			trans	-51.3	112.3	-178	179.6	-103.2	0	0	0	110.7	P689 V693	P689-W691 PolarHBondContact O-N 3.19Å; P689-W691 VanDerWaalsContact O-N 3.08Å; W691-V693 VanDerWaalsContact CD1-O 3.28Å; W691-V693 HydrophobicContact CZ2-CG2 4.13Å; W691-V693 PolarHBondContact O-N 3.38Å; W691-V693 VanDerWaalsContact O-N 3.1Å
692	N	69.6	Low	61.2	Low	158 Å²	158	134.1 Å²	134.1	85%	0.845	70%	0.701	S	S	*	*	S	Bend	trans	-70.9	-4.2	-169.1	-69.5	89.9	0	0	0	115	K690	K690-N692 PolarHBondContact O-N 3.26Å; K690-N692 PolarHBondContact O-OD1 3.42Å
693	V	59.9	Low	61.2	Low	87 Å²	87	137.2 Å²	137.2	53%	0.527	71%	0.708	S	S	.	*			trans	-87.2	115.7	168.9	-161.5	0	0	0	0	107.6	W691 G695	W691-V693 VanDerWaalsContact CD1-O 3.28Å; W691-V693 HydrophobicContact CZ2-CG2 4.13Å; W691-V693 PolarHBondContact O-N 3.38Å; W691-V693 VanDerWaalsContact O-N 3.1Å; V693-G695 PolarHBondContact O-N 3.2Å
694	E	54.8	Low	61.2	Low	200 Å²	200	138.7 Å²	138.7	94%	0.935	72%	0.715	S	S	*	*			trans	-70.5	63.4	159.4	-66.7	-171.2	149.9	0	0	109	D696	E694-D696 VanDerWaalsContact C-N 3.28Å; E694-D696 PolarHBondContact O-N 2.93Å
695	G	54.4	Low	61.4	Low	41 Å²	41	137 Å²	137	42%	0.423	72%	0.721	S	S	.	*			trans	-75.1	83.1	178.8	0	0	0	0	0	108.9	V693 S697	V693-G695 PolarHBondContact O-N 3.2Å; G695-S697 PolarHBondContact O-N 3.38Å; G695-S697 PolarHBondContact O-OG 3.45Å
696	D	48.2	Very low	61.7	Low	101 Å²	101	130.9 Å²	130.9	54%	0.54	70%	0.702	S	S	.	*			trans	-47	98.2	177.2	177.7	11.6	0	0	0	110.9	E694 S698	E694-D696 VanDerWaalsContact C-N 3.28Å; E694-D696 PolarHBondContact O-N 2.93Å; D696-S698 PolarHBondContact O-N 3.22Å; D696-S698 WeakPolarHBondContact OD1-CA 3.43Å; D696-S698 VanDerWaalsContact OD1-CB 3.25Å; D696-S698 WeakPolarHBondContact OD1-CB 3.45Å; D696-S698 PolarHBondContact OD1-N 3.47Å; D696-S698 PolarHBondContact OD1-OG 3.2Å; D696-S698 PolarHBondContact OD2-OG 2.87Å
697	S	56.5	Low	62.6	Low	122 Å²	122	129.9 Å²	129.9	85%	0.853	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	5.4	-179.8	-61.9	0	0	0	0	111.6	G695 R699	G695-S697 PolarHBondContact O-N 3.38Å; G695-S697 PolarHBondContact O-OG 3.45Å; S697-R699 PolarHBondContact O-N 3.06Å
698	S	51.2	Low	63.1	Low	95 Å²	95	134 Å²	134	66%	0.664	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	13	166.6	81.4	0	0	0	0	113.2	D696 G700	D696-S698 PolarHBondContact O-N 3.22Å; D696-S698 WeakPolarHBondContact OD1-CA 3.43Å; D696-S698 VanDerWaalsContact OD1-CB 3.25Å; D696-S698 WeakPolarHBondContact OD1-CB 3.45Å; D696-S698 PolarHBondContact OD1-N 3.47Å; D696-S698 PolarHBondContact OD1-OG 3.2Å; D696-S698 PolarHBondContact OD2-OG 2.87Å; S698-G700 PolarHBondContact O-N 3.14Å
699	R	56.3	Low	63.5	Low	209 Å²	209	130.3 Å²	130.3	79%	0.789	70%	0.696	S	S	*	*			trans	-60.3	78.1	155.8	-74.5	-172.2	178.4	-170.6	1.6	110.4	S697	S697-R699 PolarHBondContact O-N 3.06Å
700	G	60.3	Low	63.9	Low	49 Å²	49	128.3 Å²	128.3	51%	0.505	68%	0.679	S	S	.	*			trans	-54.4	161.6	176.5	0	0	0	0	0	112.2	S698 V702	S698-G700 PolarHBondContact O-N 3.14Å; G700-V702 PolarHBondContact O-N 2.96Å
701	P	50.2	Low	65	Low	129 Å²	129	124.7 Å²	124.7	84%	0.838	66%	0.663	S	S	*	*			trans	-45.8	105	-157.2	15.3	-31.3	0	0	0	112.5	K703	P701-K703 PolarHBondContact O-N 3.14Å
702	V	60.1	Low	65.6	Low	125 Å²	125	119.5 Å²	119.5	76%	0.758	65%	0.648	S	S	*	*			trans	-56.5	115.9	-177.1	-167.4	0	0	0	0	107.2	G700 K704	G700-V702 PolarHBondContact O-N 2.96Å; V702-K704 VanDerWaalsContact C-N 3.25Å; V702-K704 PolarHBondContact O-N 2.89Å
703	K	62.1	Low	66.3	Low	204 Å²	204	118.2 Å²	118.2	89%	0.887	64%	0.639	S	S	*	*			trans	-65.3	84.4	-170.2	-71.1	-179.6	179.3	174.1	0	110.6	P701 G705	P701-K703 PolarHBondContact O-N 3.14Å; K703-G705 PolarHBondContact O-N 2.76Å
704	K	65.8	Low	67.5	Low	201 Å²	201	121.8 Å²	121.8	87%	0.874	64%	0.643	S	S	*	*			trans	-55.1	112.7	179.6	-158.8	168.1	-172.1	173.5	0	107.2	V702 L706	V702-K704 VanDerWaalsContact C-N 3.25Å; V702-K704 PolarHBondContact O-N 2.89Å; K704-L706 PolarHBondContact O-N 3.36Å; K704-L706 VanDerWaalsContact O-N 3.09Å
705	G	66.9	Low	69	Low	67 Å²	67	121.3 Å²	121.3	69%	0.691	63%	0.632	S	S	*	*			trans	-58.7	118.7	-167.9	0	0	0	0	0	110.4	K703 S707	K703-G705 PolarHBondContact O-N 2.76Å; G705-S707 PolarHBondContact O-N 2.9Å
706	L	71.8	Confident	70.3	Confident	76 Å²	76	124.9 Å²	124.9	40%	0.398	64%	0.637	S	S	.	*			trans	-35.8	124.5	-173.2	-73	165.2	0	0	0	111.8	K704 D710 K711	K704-L706 PolarHBondContact O-N 3.36Å; K704-L706 VanDerWaalsContact O-N 3.09Å; L706-D710 HydrophobicContact CB-CB 4.26Å; L706-D710 HydrophobicContact CD2-CB 3.99Å; L706-K711 HydrophobicContact CB-CG 4.17Å; L706-K711 WeakPolarHBondContact O-CD 3.18Å; L706-K711 WeakPolarHBondContact O-CE 3.39Å; L706-K711 PolarHBondContact O-NZ 3.4Å
707	S	79.4	Confident	72.1	Confident	56 Å²	56	122.9 Å²	122.9	39%	0.392	63%	0.634	S	S	.	*			trans	-56.2	158.1	-176.5	-177.3	0	0	0	0	111	G705 V709 D710 K711	G705-S707 PolarHBondContact O-N 2.9Å; S707-V709 PolarHBondContact O-N 2.82Å; S707-V709 PolarHBondContact OG-N 3.22Å; S707-D710 VanDerWaalsContact CB-CG 3.48Å; S707-D710 VanDerWaalsContact CB-OD2 3.26Å; S707-D710 WeakPolarHBondContact CB-OD2 3.43Å; S707-D710 PolarHBondContact N-OD2 3.2Å; S707-D710 PolarHBondContact O-N 2.79Å; S707-D710 VanDerWaalsContact O-N 3.17Å; S707-K711 WeakPolarHBondContact O-CB 3.2Å; S707-K711 WeakPolarHBondContact O-CG 3.11Å; S707-K711 PolarHBondContact O-N 2.73Å
708	R	77.2	Confident	73.3	Confident	212 Å²	212	120.9 Å²	120.9	80%	0.8	61%	0.614	S	S	*	*	H	α-helix	trans	-54.9	-34.3	169.5	177.9	173	163.6	173.4	-7	110.9	Q712	R708-Q712 WeakPolarHBondContact O-CB 3.3Å; R708-Q712 PolarHBondContact O-N 3.03Å
709	V	79.1	Confident	74.7	Confident	88 Å²	88	121.1 Å²	121.1	53%	0.533	61%	0.606	S	S	.	*	H	α-helix	trans	-67.5	-52.9	173.8	-177.7	0	0	0	0	111	S707 K711 Q712 M713	S707-V709 PolarHBondContact O-N 2.82Å; S707-V709 PolarHBondContact OG-N 3.22Å; V709-K711 VanDerWaalsContact C-N 3.27Å; V709-K711 PolarHBondContact O-N 3.32Å; V709-Q712 CarbonylContact O-C 3.57Å; V709-Q712 WeakPolarHBondContact O-CA 3.49Å; V709-Q712 PolarHBondContact O-N 3.41Å; V709-M713 HydrophobicContact CG1-CG 4.4Å; V709-M713 PolarHBondContact O-N 2.91Å
710	D	83.4	Confident	75.7	Confident	69 Å²	69	120.5 Å²	120.5	37%	0.369	60%	0.604	S	S	.	*	H	α-helix	trans	-57.6	-39.5	179.8	-43	-18.5	0	0	0	112.4	L706 S707 Q712 R714	L706-D710 HydrophobicContact CB-CB 4.26Å; L706-D710 HydrophobicContact CD2-CB 3.99Å; S707-D710 VanDerWaalsContact CB-CG 3.48Å; S707-D710 VanDerWaalsContact CB-OD2 3.26Å; S707-D710 WeakPolarHBondContact CB-OD2 3.43Å; S707-D710 PolarHBondContact N-OD2 3.2Å; S707-D710 PolarHBondContact O-N 2.79Å; S707-D710 VanDerWaalsContact O-N 3.17Å; D710-Q712 VanDerWaalsContact C-N 3.31Å; D710-Q712 PolarHBondContact O-N 3.38Å; D710-R714 WeakPolarHBondContact O-CB 3.47Å; D710-R714 WeakPolarHBondContact O-CG 3.29Å; D710-R714 PolarHBondContact O-N 3.45Å
711	K	86	Confident	76.5	Confident	116 Å²	116	126.3 Å²	126.3	50%	0.504	61%	0.611	S	S	.	*	H	α-helix	trans	-63.6	-36	174.9	-75	163.9	174.1	145.8	0	112	L706 S707 V709 R715	L706-K711 HydrophobicContact CB-CG 4.17Å; L706-K711 WeakPolarHBondContact O-CD 3.18Å; L706-K711 WeakPolarHBondContact O-CE 3.39Å; L706-K711 PolarHBondContact O-NZ 3.4Å; S707-K711 WeakPolarHBondContact O-CB 3.2Å; S707-K711 WeakPolarHBondContact O-CG 3.11Å; S707-K711 PolarHBondContact O-N 2.73Å; V709-K711 VanDerWaalsContact C-N 3.27Å; V709-K711 PolarHBondContact O-N 3.32Å; K711-R715 WeakPolarHBondContact O-CG 3.5Å; K711-R715 PolarHBondContact O-N 3Å; K711-R715 VanDerWaalsContact O-N 3.16Å
712	Q	84.6	Confident	77.5	Confident	104 Å²	104	126.6 Å²	126.6	49%	0.486	60%	0.604	S	S	.	*	H	α-helix	trans	-78.8	-40.1	177.9	-170	166	-11.1	0	0	111.8	R708 V709 D710 R715 F716	R708-Q712 WeakPolarHBondContact O-CB 3.3Å; R708-Q712 PolarHBondContact O-N 3.03Å; V709-Q712 CarbonylContact O-C 3.57Å; V709-Q712 WeakPolarHBondContact O-CA 3.49Å; V709-Q712 PolarHBondContact O-N 3.41Å; D710-Q712 VanDerWaalsContact C-N 3.31Å; D710-Q712 PolarHBondContact O-N 3.38Å; Q712-R715 PolarHBondContact O-N 3.47Å; Q712-F716 HydrophobicContact CG-CD2 4.08Å; Q712-F716 HydrophobicContact CG-CE2 3.75Å; Q712-F716 VanDerWaalsContact O-CD2 3.29Å; Q712-F716 WeakPolarHBondContact O-CD2 3.48Å; Q712-F716 PolarHBondContact O-N 3.31Å
713	M	84.2	Confident	77.9	Confident	131 Å²	131	125.2 Å²	125.2	65%	0.645	60%	0.597	S	S	*	*	H	α-helix	trans	-56.1	-48.7	169.4	-79.6	-68.3	-174.3	0	0	111.5	V709 R715 F716 A717	V709-M713 HydrophobicContact CG1-CG 4.4Å; V709-M713 PolarHBondContact O-N 2.91Å; M713-R715 PolarHBondContact O-N 3.27Å; M713-F716 PolarHBondContact O-N 2.69Å; M713-A717 PolarHBondContact O-N 2.86Å
714	R	85.4	Confident	78	Confident	162 Å²	162	124 Å²	124	61%	0.611	59%	0.592	S	S	*	*	H	α-helix	trans	-59.4	-42.3	174.9	-80	-178.6	165.2	-140.2	-5.5	112.6	D710 F716 A717 D718	D710-R714 WeakPolarHBondContact O-CB 3.47Å; D710-R714 WeakPolarHBondContact O-CG 3.29Å; D710-R714 PolarHBondContact O-N 3.45Å; R714-F716 PolarHBondContact O-N 3.17Å; R714-A717 PolarHBondContact O-N 3.33Å; R714-D718 PolarHBondContact O-N 3.34Å
715	R	85.8	Confident	77.8	Confident	190 Å²	190	120.2 Å²	120.2	72%	0.717	59%	0.585	S	S	*	*	H	α-helix	trans	-61.6	-42.2	174.4	-78	-179.1	178.1	-150.7	-0.4	112.4	K711 Q712 M713 D718 I719	K711-R715 WeakPolarHBondContact O-CG 3.5Å; K711-R715 PolarHBondContact O-N 3Å; K711-R715 VanDerWaalsContact O-N 3.16Å; Q712-R715 PolarHBondContact O-N 3.47Å; M713-R715 PolarHBondContact O-N 3.27Å; R715-D718 PolarHBondContact O-N 3.1Å; R715-I719 WeakPolarHBondContact O-CB 3.2Å; R715-I719 WeakPolarHBondContact O-CD1 3.31Å; R715-I719 WeakPolarHBondContact O-CG1 3.4Å; R715-I719 PolarHBondContact O-N 2.86Å
716	F	82.6	Confident	77.6	Confident	117 Å²	117	120.2 Å²	120.2	51%	0.513	59%	0.585	S	S	.	*	H	α-helix	trans	-66.1	-36.9	174.6	-76.1	-58.7	0	0	0	112.6	Q712 M713 R714 I719 R720	Q712-F716 HydrophobicContact CG-CD2 4.08Å; Q712-F716 HydrophobicContact CG-CE2 3.75Å; Q712-F716 VanDerWaalsContact O-CD2 3.29Å; Q712-F716 WeakPolarHBondContact O-CD2 3.48Å; Q712-F716 PolarHBondContact O-N 3.31Å; M713-F716 PolarHBondContact O-N 2.69Å; R714-F716 PolarHBondContact O-N 3.17Å; F716-I719 PolarHBondContact O-N 2.96Å; F716-R720 WeakPolarHBondContact O-CB 3.15Å; F716-R720 VanDerWaalsContact O-CG 3.31Å; F716-R720 WeakPolarHBondContact O-CG 3.14Å; F716-R720 PolarHBondContact O-N 3.28Å
717	A	84.7	Confident	76.8	Confident	59 Å²	59	125 Å²	125	49%	0.488	61%	0.605	S	S	.	*	H	α-helix	trans	-65	-45.3	174.4	0	0	0	0	0	112.1	M713 R714 R720 R721	M713-A717 PolarHBondContact O-N 2.86Å; R714-A717 PolarHBondContact O-N 3.33Å; A717-R720 PolarHBondContact O-N 3.2Å; A717-R721 WeakPolarHBondContact O-CB 3.01Å; A717-R721 PolarHBondContact O-N 3.36Å
718	D	82.5	Confident	75.9	Confident	80 Å²	80	126.6 Å²	126.6	43%	0.428	62%	0.621	S	S	.	*	H	α-helix	trans	-65.9	-38.5	175.3	-90.6	-46.2	0	0	0	112.5	R714 R715 R721 L722	R714-D718 PolarHBondContact O-N 3.34Å; R715-D718 PolarHBondContact O-N 3.1Å; D718-R721 PolarHBondContact O-N 2.82Å; D718-R721 IonicContact OD1-CZ 2.87Å; D718-R721 IonicContact OD1-NE 2.58Å; D718-R721 PolarHBondContact OD1-NE 2.92Å; D718-R721 IonicContact OD1-NH2 2.69Å; D718-R721 PolarHBondContact OD1-NH2 3.1Å; D718-L722 WeakPolarHBondContact O-CB 3.15Å; D718-L722 PolarHBondContact O-N 3.41Å
719	I	80.2	Confident	75.1	Confident	99 Å²	99	121.9 Å²	121.9	51%	0.508	62%	0.616	S	S	.	*	H	α-helix	trans	-62	-48.1	172.7	-70.3	164	0	0	0	110.3	R715 F716 R721 L722 T723	R715-I719 WeakPolarHBondContact O-CB 3.2Å; R715-I719 WeakPolarHBondContact O-CD1 3.31Å; R715-I719 WeakPolarHBondContact O-CG1 3.4Å; R715-I719 PolarHBondContact O-N 2.86Å; F716-I719 PolarHBondContact O-N 2.96Å; I719-R721 VanDerWaalsContact C-N 3.28Å; I719-R721 PolarHBondContact O-N 3.06Å; I719-L722 PolarHBondContact O-N 3.22Å; I719-T723 HydrophobicContact CG2-CG2 4.48Å; I719-T723 WeakPolarHBondContact O-CG2 3.28Å; I719-T723 PolarHBondContact O-N 3.29Å; I719-T723 PolarHBondContact O-OG1 3.21Å; I719-T723 VanDerWaalsContact O-OG1 3.12Å
720	R	77.9	Confident	74.1	Confident	196 Å²	196	126.7 Å²	126.7	74%	0.74	63%	0.63	S	S	*	*	H	α-helix	trans	-59.8	-36.8	175.3	-74.5	174.9	74.5	-172.8	3.4	112.1	F716 A717 T723 K724	F716-R720 WeakPolarHBondContact O-CB 3.15Å; F716-R720 VanDerWaalsContact O-CG 3.31Å; F716-R720 WeakPolarHBondContact O-CG 3.14Å; F716-R720 PolarHBondContact O-N 3.28Å; A717-R720 PolarHBondContact O-N 3.2Å; R720-T723 PolarHBondContact O-OG1 2.98Å; R720-K724 VanDerWaalsContact O-CB 3.28Å; R720-K724 WeakPolarHBondContact O-CB 3.39Å; R720-K724 PolarHBondContact O-N 3.06Å; R720-K724 VanDerWaalsContact O-N 3.09Å
721	R	77.6	Confident	72.8	Confident	171 Å²	171	130 Å²	130	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-68.2	-40.4	176	-172.7	173.7	67.3	95.4	-2	111.9	A717 D718 I719	A717-R721 WeakPolarHBondContact O-CB 3.01Å; A717-R721 PolarHBondContact O-N 3.36Å; D718-R721 PolarHBondContact O-N 2.82Å; D718-R721 IonicContact OD1-CZ 2.87Å; D718-R721 IonicContact OD1-NE 2.58Å; D718-R721 PolarHBondContact OD1-NE 2.92Å; D718-R721 IonicContact OD1-NH2 2.69Å; D718-R721 PolarHBondContact OD1-NH2 3.1Å; I719-R721 VanDerWaalsContact C-N 3.28Å; I719-R721 PolarHBondContact O-N 3.06Å
722	L	70.5	Confident	71.4	Confident	135 Å²	135	126.6 Å²	126.6	71%	0.707	64%	0.637	S	S	*	*	H	α-helix	trans	-76.1	-26.2	-179.4	-155.8	73	0	0	0	113	D718 I719 T725	D718-L722 WeakPolarHBondContact O-CB 3.15Å; D718-L722 PolarHBondContact O-N 3.41Å; I719-L722 PolarHBondContact O-N 3.22Å; L722-T725 PolarHBondContact O-OG1 2.95Å; L722-T725 VanDerWaalsContact O-OG1 3.1Å
723	T	68.6	Low	70.1	Confident	97 Å²	97	128.9 Å²	128.9	60%	0.595	66%	0.658	S	S	*	*	H	α-helix	trans	-85.5	-23.8	172.7	57.2	0	0	0	0	113.5	I719 R720 T725 G726	I719-T723 HydrophobicContact CG2-CG2 4.48Å; I719-T723 WeakPolarHBondContact O-CG2 3.28Å; I719-T723 PolarHBondContact O-N 3.29Å; I719-T723 PolarHBondContact O-OG1 3.21Å; I719-T723 VanDerWaalsContact O-OG1 3.12Å; R720-T723 PolarHBondContact O-OG1 2.98Å; T723-T725 PolarHBondContact O-N 2.98Å; T723-T725 VanDerWaalsContact O-N 3.16Å; T723-G726 PolarHBondContact O-N 2.96Å
724	K	64.6	Low	69.2	Low	179 Å²	179	130.4 Å²	130.4	78%	0.778	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-14.4	179.3	-169	170.3	-177.8	-178.2	0	114.2	R720 G726	R720-K724 VanDerWaalsContact O-CB 3.28Å; R720-K724 WeakPolarHBondContact O-CB 3.39Å; R720-K724 PolarHBondContact O-N 3.06Å; R720-K724 VanDerWaalsContact O-N 3.09Å; K724-G726 VanDerWaalsContact C-N 3.3Å
725	T	60.6	Low	67.9	Low	120 Å²	120	124.8 Å²	124.8	74%	0.736	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-10.8	172.1	51.2	0	0	0	0	113.7	L722 T723 H727	L722-T725 PolarHBondContact O-OG1 2.95Å; L722-T725 VanDerWaalsContact O-OG1 3.1Å; T723-T725 PolarHBondContact O-N 2.98Å; T723-T725 VanDerWaalsContact O-N 3.16Å; T725-H727 PolarHBondContact O-N 3.45Å
726	G	62.5	Low	66.6	Low	67 Å²	67	122.8 Å²	122.8	69%	0.691	66%	0.659	S	S	*	*			trans	-76	51	176.4	0	0	0	0	0	114.3	T723 K724 A728	T723-G726 PolarHBondContact O-N 2.96Å; K724-G726 VanDerWaalsContact C-N 3.3Å; G726-A728 PolarHBondContact O-N 2.76Å
727	H	54.8	Low	65.5	Low	177 Å²	177	126.1 Å²	126.1	82%	0.819	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-68.1	121.8	172.4	-105.6	-31.3	0	0	0	110.2	T725 V729	T725-H727 PolarHBondContact O-N 3.45Å; H727-V729 PolarHBondContact O-N 3.07Å
728	A	60.8	Low	64.1	Low	89 Å²	89	130.3 Å²	130.3	74%	0.736	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-57.7	133.2	178.7	0	0	0	0	0	111.3	G726 K730	G726-A728 PolarHBondContact O-N 2.76Å; A728-K730 PolarHBondContact O-N 2.75Å
729	V	60.6	Low	62.8	Low	113 Å²	113	132 Å²	132	69%	0.685	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-61.8	122	175.1	179.2	0	0	0	0	108.6	H727 I731	H727-V729 PolarHBondContact O-N 3.07Å; V729-I731 VanDerWaalsContact C-N 3.31Å; V729-I731 PolarHBondContact O-N 2.91Å
730	K	57.5	Low	61.2	Low	190 Å²	190	139 Å²	139	83%	0.826	73%	0.732	S	S	*	*			trans	-71.1	89.5	172.4	-69.3	-172.5	178.1	-175.1	0	109.2	A728 S732	A728-K730 PolarHBondContact O-N 2.75Å; K730-S732 PolarHBondContact O-N 2.65Å
731	I	57.4	Low	60.3	Low	137 Å²	137	136.2 Å²	136.2	70%	0.703	73%	0.732	S	S	*	*			trans	-56.1	119.4	170.2	-59.4	173.7	0	0	0	107.5	V729	V729-I731 VanDerWaalsContact C-N 3.31Å; V729-I731 PolarHBondContact O-N 2.91Å
732	S	56.6	Low	59.4	Low	45 Å²	45	134.4 Å²	134.4	32%	0.315	74%	0.736	S	S	.	*			trans	-84.2	134.4	176.8	-164.4	0	0	0	0	109.7	K730 E734 G735	K730-S732 PolarHBondContact O-N 2.65Å; S732-E734 PolarHBondContact O-N 2.64Å; S732-G735 PolarHBondContact O-N 3.32Å
733	V	57.8	Low	58.8	Low	153 Å²	153	134.3 Å²	134.3	93%	0.927	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-22.8	-178.9	-175	0	0	0	0	111.8	G735	V733-G735 VanDerWaalsContact C-N 3.26Å; V733-G735 PolarHBondContact O-N 2.73Å
734	E	64.6	Low	58.2	Low	163 Å²	163	136.5 Å²	136.5	76%	0.762	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	8.6	170.9	-65.7	-175.4	116.5	0	0	114.6	S732 N736	S732-E734 PolarHBondContact O-N 2.64Å; E734-N736 PolarHBondContact O-N 2.72Å
735	G	56.9	Low	57.8	Low	44 Å²	44	133.9 Å²	133.9	45%	0.454	74%	0.744	S	S	.	*	S	Bend	trans	72.6	-21.3	170.7	0	0	0	0	0	117.3	S732 V733 R737	S732-G735 PolarHBondContact O-N 3.32Å; V733-G735 VanDerWaalsContact C-N 3.26Å; V733-G735 PolarHBondContact O-N 2.73Å; G735-R737 PolarHBondContact O-N 2.8Å
736	N	59	Low	57.7	Low	147 Å²	147	134.8 Å²	134.8	79%	0.786	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	11.4	-172.1	-78.1	-29.2	0	0	0	117.1	E734	E734-N736 PolarHBondContact O-N 2.72Å
737	R	59.5	Low	57.3	Low	188 Å²	188	139.6 Å²	139.6	71%	0.709	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	61.4	170.8	-77.2	-161.4	-75.1	-143.8	-6.7	112.8	G735	G735-R737 PolarHBondContact O-N 2.8Å
738	M	55.7	Low	57.5	Low	147 Å²	147	136.8 Å²	136.8	72%	0.724	74%	0.743	S	S	*	*			trans	-92.6	135.9	156.8	-71.4	-83.4	-78.8	0	0	109
739	P	54.5	Low	57.2	Low	114 Å²	114	140.8 Å²	140.8	74%	0.74	74%	0.744	S	S	*	*			trans	-70.3	145.3	162.2	31.3	-32.4	0	0	0	110
740	L	46.7	Very low	56.9	Low	248 Å²	248	143.3 Å²	143.3	100%	1.298	75%	0.749	S	S	*	*			trans	-94.9	0	167.7	-73.3	169.8	0	0	0	110.1

Retrieved 740 of 740 residues in 122 ms (Link to these results)

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