A0A087XML0_POEFO Loading...

Centromere protein J

AlphaFold DB , UniProt , Accession A0A087XML0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,254 aa.

						>A0A087XML0_POEFO|A0A087XML0
MSSPSELQYSSADFLTKWMPSSTRAGVILSPPPELAASLRHTAAAVPAPLHPDDSFVSDFAPLPASTDSSCFGVDGRGEGARPVSYLRPAPQGISDGHFENLGKMTSRTQDLPLMMKLEELKKWQHHMHEQLKAHQLEELLCLQEQQHRLLGLGDEPQICTEENPGLPGAQWRKDTVQCSPDRNCGLRQELQLSDQQEHEDDEGMWDSGEENPKQSLESDDAFMQPEANSRQQEDDLHDRPIKPGIGGQKKTFEELLEEQLRLEEQRLKSAQQQPKPASPEAAFPPKRPFLKRGQGLSRFTSSSKASAQKAKDKKEQKPQAITRSNSAPSSILKASCSAGPPLPVQRKTAVLNKENRGRGLRSPPQYVRAESRAARTTRVLGSHQRQNTGPATAPEPRPVKHLLEPEKEYNTGVPVQVVRNTGPSLQPNPVIKRVGLSGDAGKEKSCVSKAQSAGAGGGGGLPRDSFELSFQEKLQRWECNRQLENMELGEFELLEQAAEELSFSSNSSFVMKVLCLDQQKRHSAIGLHQRRLSSTPIKSASESKPQKGGGVQLTDGLEREGISLESVASEGSMRGNALQSEVTEGGRESEAPQDDEISEFGGKEVTVCFSAPSNPTYDKRSYQDEESLGEEVEEDDDEESNSFASNADGSTLIEDGRDRQRKVIFDDDDTWNDLDDTAVTEDSDSRGVSPVPKLTAGRVSPLEKAVLRKVAVSRAVEPDEGPESELAPASQLMTRLFPSLKPKAQSAPPPAAPAAPAASENRKQDNTAQQVQSRQLRERLAELEMEIERFKKENAALTKLRQENERRQEDLRKERLMFEEAKAQELANFEEYKREENRKLQKERKLFEKHVSAARAIPDKKEREEIQLLKQQLSSQQEELKRRESRWASTHGRLRQQIDSLHQENDALRDEIRTLEKLRLSAWKKSSASAEKGVQTKDGPRVSESSLAKGVTFATPLDSRGSSSSPPLSSARRNSKDNGQAAAGMKSSLRRSVGSSLSSSSTFSGRRTEEKPRPTSRSQEKPSNQKPEQEHDCSPRIDLEPEQLESCETRDPELPQEVITHPDGKVEKVLAGGDRVIVFPNGTRKEVSADGLSAKVTFFNGDTKQITADQRVIYYYAEAQTTHITYPDGMEVLHFPNNQTEKHFPDGRKEITFPDQTVKNLFPDGREESVLTDGTIIQVNPDGTKEIHFNTGQKEIHTAEYKRREYPDGTVKTVYTDGRQETRYPTGRLRVKDKDGNVVLDNRLQPAAPNQHF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	33.6	Very low	236 Å²	236	141.5 Å²	141.5	100%	1.163	79%	0.794	S	S	*	*				0	116.1	0	-71.4	-105.3	73.6	0	0	106
2	S	31.4	Very low	33.2	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	79%	0.793	S	S	*	*			trans	-138.5	106.5	-167	-53.7	0	0	0	0	112.5
3	S	46.1	Very low	33.2	Very low	122 Å²	122	136.8 Å²	136.8	85%	0.853	79%	0.785	S	S	*	*			trans	-166.7	137	163.6	-69.7	0	0	0	0	103.4
4	P	55.2	Low	33	Very low	116 Å²	116	138.9 Å²	138.9	75%	0.753	78%	0.781	S	S	*	*				-146.5	-174.4	67.3	41.9	-23.6	0	0	0	114.6
5	S	36.1	Very low	32.9	Very low	103 Å²	103	141.5 Å²	141.5	72%	0.72	79%	0.791	S	S	*	*			trans	39.3	155	138.9	-56.5	0	0	0	0	121.9
6	E	29.2	Very low	32.9	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	78%	0.775	S	S	*	*			cis	-156.4	-153.6	12.6	-140.5	162.7	172.9	0	0	114.4
7	L	31.7	Very low	32.7	Very low	131 Å²	131	139.2 Å²	139.2	69%	0.686	77%	0.769	S	S	*	*			trans	-78.1	154.2	-166.1	-72.2	156.5	0	0	0	117.4
8	Q	28.6	Very low	32.4	Very low	154 Å²	154	143.6 Å²	143.6	72%	0.72	77%	0.773	S	S	*	*			trans	78.7	153.4	135.6	-81.8	177	17.1	0	0	124.4
9	Y	26.5	Very low	32.6	Very low	196 Å²	196	144.6 Å²	144.6	77%	0.769	77%	0.774	S	S	*	*			trans	71.4	102.2	153.3	-81.8	-65.5	0	0	0	123.7
10	S	26.5	Very low	32.6	Very low	94 Å²	94	143.8 Å²	143.8	66%	0.657	78%	0.777	S	S	*	*				57	140.1	123	65.6	0	0	0	0	125.5
11	S	24.8	Very low	32.4	Very low	106 Å²	106	141.8 Å²	141.8	74%	0.741	77%	0.774	S	S	*	*			trans	72.5	95.9	137.3	64.3	0	0	0	0	121.7
12	A	29.3	Very low	32.1	Very low	95 Å²	95	135.4 Å²	135.4	79%	0.785	75%	0.752	S	S	*	*			trans	-171.2	115.5	135.4	0	0	0	0	0	106.1
13	D	32.8	Very low	32.2	Very low	128 Å²	128	135.5 Å²	135.5	68%	0.684	75%	0.748	S	S	*	*			cis	48.7	105.8	30.7	-68.8	-19.3	0	0	0	111.2
14	F	30.8	Very low	31.5	Very low	166 Å²	166	140.7 Å²	140.7	73%	0.728	75%	0.749	S	S	*	*				-168.7	141.5	61.7	-95.3	-82.1	0	0	0	112.1	T16	F14-T16 HydrophobicContact CD1-CG2 3.86Å; F14-T16 HydrophobicContact CE1-CG2 4.15Å
15	L	31.9	Very low	30.3	Very low	177 Å²	177	140 Å²	140	93%	0.927	75%	0.753	S	S	*	*			trans	-140.3	57	154	-130	169.8	0	0	0	111.8
16	T	32	Very low	29.9	Very low	88 Å²	88	138.5 Å²	138.5	54%	0.54	75%	0.754	S	S	.	*			trans	-81.2	166.8	158.8	62.9	0	0	0	0	108.8	F14	F14-T16 HydrophobicContact CD1-CG2 3.86Å; F14-T16 HydrophobicContact CE1-CG2 4.15Å
17	K	29.5	Very low	29.9	Very low	156 Å²	156	136.1 Å²	136.1	68%	0.678	75%	0.751	S	S	*	*			cis	-176.3	174.1	31	-157.6	163.9	169.7	177.9	0	111.6
18	W	28.3	Very low	29.5	Very low	219 Å²	219	136.9 Å²	136.9	83%	0.83	75%	0.754	S	S	*	*			trans	83.6	121.6	158.5	-61.9	107.3	0	0	0	119.4
19	M	35.6	Very low	29.6	Very low	162 Å²	162	137.1 Å²	137.1	80%	0.798	76%	0.759	S	S	*	*			trans	-76.6	161	150.1	-52	154.5	61.1	0	0	110.1
20	P	31.6	Very low	29.5	Very low	128 Å²	128	132.6 Å²	132.6	83%	0.831	76%	0.757	S	S	*	*			trans	-101	146.2	142.7	34.4	-27.8	0	0	0	111.2
21	S	28.6	Very low	30.2	Very low	102 Å²	102	134.1 Å²	134.1	71%	0.713	76%	0.764	S	S	*	*			trans	-110.1	152.8	178.5	57.8	0	0	0	0	112.2
22	S	28.4	Very low	31.2	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	76%	0.763	S	S	*	*			trans	16	134.5	146.5	-173.4	0	0	0	0	117.6
23	T	33.8	Very low	32	Very low	124 Å²	124	134.6 Å²	134.6	76%	0.761	76%	0.757	S	S	*	*				175.5	160.2	78.9	-51.2	0	0	0	0	110.3
24	R	30.3	Very low	31.7	Very low	231 Å²	231	136.3 Å²	136.3	87%	0.872	76%	0.761	S	S	*	*			trans	113.3	90.5	135.1	-157.5	173.2	-172.7	175.2	1.3	120.6
25	A	29.1	Very low	31.7	Very low	102 Å²	102	135.5 Å²	135.5	84%	0.843	76%	0.763	S	S	*	*				63.1	141.3	127.5	0	0	0	0	0	123.1
26	G	28.3	Very low	31.5	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	75%	0.753	S	S	*	*			trans	132.2	152.3	161.2	0	0	0	0	0	114
27	V	28.9	Very low	31.3	Very low	127 Å²	127	131.5 Å²	131.5	77%	0.77	77%	0.765	S	S	*	*				-173.7	123.6	-53.6	134.2	0	0	0	0	107.5
28	I	24.9	Very low	31.3	Very low	147 Å²	147	128.3 Å²	128.3	75%	0.754	76%	0.762	S	S	*	*			trans	53.1	124.2	156.3	-55.4	169.6	0	0	0	119
29	L	28.8	Very low	31.5	Very low	159 Å²	159	123.2 Å²	123.2	83%	0.832	75%	0.751	S	S	*	*				-174	162.4	113.9	-97	177.2	0	0	0	113.4
30	S	25.4	Very low	31.2	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	75%	0.751	S	S	*	*			trans	-157.7	-178	175.2	-37	0	0	0	0	107.4
31	P	41.8	Very low	31.2	Very low	125 Å²	125	126.8 Å²	126.8	81%	0.812	75%	0.745	S	S	*	*			cis	-125.9	-97.1	-12.6	20.7	6.6	0	0	0	116.4
32	P	45.2	Very low	31.3	Very low	109 Å²	109	128.4 Å²	128.4	71%	0.708	75%	0.751	S	S	*	*			trans	-122.3	-151	-148	39.2	-14.5	0	0	0	112.6
33	P	46.9	Very low	31.2	Very low	103 Å²	103	127.6 Å²	127.6	67%	0.669	75%	0.75	S	S	*	*			cis	-147.7	-163	0.8	46.3	-24.4	0	0	0	118.4
34	E	26	Very low	30.9	Very low	164 Å²	164	126.6 Å²	126.6	77%	0.766	75%	0.754	S	S	*	*			trans	84.6	120.8	145.7	-78.7	-173.6	141.8	0	0	126.1
35	L	30.6	Very low	30.9	Very low	148 Å²	148	119.6 Å²	119.6	78%	0.775	75%	0.746	S	S	*	*				59.6	126.4	126.3	-66	173.1	0	0	0	126
36	A	28	Very low	30.8	Very low	86 Å²	86	121.5 Å²	121.5	71%	0.711	75%	0.747	S	S	*	*				98.5	143.2	126.4	0	0	0	0	0	123.8
37	A	26.8	Very low	31.8	Very low	96 Å²	96	124 Å²	124	79%	0.793	75%	0.75	S	S	*	*			trans	70.2	167.7	153.9	0	0	0	0	0	120.4
38	S	30.9	Very low	31.8	Very low	89 Å²	89	122.3 Å²	122.3	62%	0.622	75%	0.749	S	S	*	*			cis	-172.9	135.3	-46	-159.8	0	0	0	0	113.1
39	L	31.1	Very low	32.8	Very low	112 Å²	112	120.6 Å²	120.6	59%	0.586	75%	0.748	S	S	*	*			trans	74.6	144.7	144.1	-133.9	72.6	0	0	0	123.4	V700	L39-V700 HydrophobicContact CD1-CG2 4.21Å
40	R	29.1	Very low	32.8	Very low	213 Å²	213	120.8 Å²	120.8	80%	0.804	75%	0.749	S	S	*	*			trans	80.3	157.8	156.3	-53.5	-158.2	-178.5	177.7	3.6	120.1
41	H	32.8	Very low	33	Very low	151 Å²	151	124 Å²	124	70%	0.699	75%	0.753	S	S	*	*			cis	178.4	144.7	-44	-104.1	-52.3	0	0	0	111.6
42	T	29.9	Very low	33.6	Very low	137 Å²	137	122.3 Å²	122.3	84%	0.84	74%	0.742	S	S	*	*			trans	63.9	163.1	153.1	57.3	0	0	0	0	118.4
43	A	27.3	Very low	32.8	Very low	85 Å²	85	125 Å²	125	70%	0.702	75%	0.75	S	S	*	*			cis	-150.7	149	5.1	0	0	0	0	0	110.3
44	A	27.1	Very low	32	Very low	102 Å²	102	127.2 Å²	127.2	84%	0.843	76%	0.756	S	S	*	*				72.3	154.1	91.6	0	0	0	0	0	117.4
45	A	30.5	Very low	32.1	Very low	85 Å²	85	124.2 Å²	124.2	70%	0.702	75%	0.753	S	S	*	*			cis	178.7	158.4	-27.2	0	0	0	0	0	111.9
46	V	26.6	Very low	32	Very low	141 Å²	141	125.8 Å²	125.8	86%	0.855	75%	0.754	S	S	*	*			trans	71.4	154.7	150	149.6	0	0	0	0	116.8
47	P	49.5	Very low	32.2	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	76%	0.758	S	S	*	*			cis	-135.7	-175.1	26.2	38.4	-16.6	0	0	0	119.5
48	A	28.4	Very low	32.5	Very low	91 Å²	91	127.2 Å²	127.2	75%	0.752	75%	0.748	S	S	*	*			trans	-128.7	178.8	172.4	0	0	0	0	0	111.4
49	P	45.8	Very low	32.5	Very low	112 Å²	112	128.7 Å²	128.7	73%	0.727	75%	0.748	S	S	*	*			trans	-156.1	139.9	132.2	34.1	-13.5	0	0	0	120.2
50	L	29.6	Very low	32.5	Very low	163 Å²	163	132.5 Å²	132.5	85%	0.853	76%	0.76	S	S	*	*			trans	67.1	156.9	141.6	-58.7	171.4	0	0	0	121.9
51	H	28.5	Very low	32.7	Very low	170 Å²	170	126.3 Å²	126.3	79%	0.787	76%	0.755	S	S	*	*			cis	-152.4	-103.8	-30.2	-168.8	-120.3	0	0	0	115.5
52	P	55.7	Low	33.1	Very low	89 Å²	89	124.5 Å²	124.5	58%	0.578	76%	0.757	S	S	*	*			trans	-130.4	167	-155.3	48.2	-31.9	0	0	0	118.5
53	D	28.3	Very low	33.4	Very low	164 Å²	164	125.7 Å²	125.7	88%	0.877	76%	0.757	S	S	*	*				-177.7	171.1	98.2	-104.9	-5.7	0	0	0	112
54	D	28.6	Very low	34.1	Very low	151 Å²	151	127.2 Å²	127.2	81%	0.807	76%	0.76	S	S	*	*			trans	-131.7	149.6	-154.3	-175.3	17	0	0	0	114.5
55	S	30.1	Very low	34.2	Very low	101 Å²	101	126.6 Å²	126.6	71%	0.706	76%	0.755	S	S	*	*			trans	-170.8	122.5	166.7	-88	0	0	0	0	117.9
56	F	28.2	Very low	34.1	Very low	181 Å²	181	127.8 Å²	127.8	79%	0.794	76%	0.758	S	S	*	*			trans	68	107.1	141.4	-81.6	-98	0	0	0	123
57	V	32.2	Very low	34.4	Very low	129 Å²	129	126.7 Å²	126.7	78%	0.782	75%	0.751	S	S	*	*				63.8	146.4	119.2	164.7	0	0	0	0	120.6
58	S	32.5	Very low	33.3	Very low	83 Å²	83	128.9 Å²	128.9	58%	0.58	76%	0.756	S	S	*	*			cis	174.3	162.7	-32.4	-139.2	0	0	0	0	108.1
59	D	31.3	Very low	33.4	Very low	120 Å²	120	129.2 Å²	129.2	64%	0.642	75%	0.754	S	S	*	*			trans	69.1	145.2	148.3	-60.9	3.7	0	0	0	119.8
60	F	30	Very low	32.9	Very low	191 Å²	191	128.4 Å²	128.4	84%	0.838	75%	0.751	S	S	*	*			cis	-148.1	-173.1	-6.9	-122	-47.4	0	0	0	112.6
61	A	33.2	Very low	33	Very low	84 Å²	84	126.7 Å²	126.7	69%	0.694	75%	0.751	S	S	*	*			trans	-104.2	171.9	-157.7	0	0	0	0	0	115.1
62	P	42.2	Very low	33	Very low	113 Å²	113	129.2 Å²	129.2	73%	0.734	76%	0.76	S	S	*	*			trans	-101	-172	-167.1	39.5	-35.4	0	0	0	116.1
63	L	35.6	Very low	31.7	Very low	162 Å²	162	128.2 Å²	128.2	85%	0.848	77%	0.766	S	S	*	*			trans	85.7	157.4	176.2	-48.9	-179.4	0	0	0	115
64	P	42.3	Very low	31.7	Very low	117 Å²	117	127.4 Å²	127.4	76%	0.76	77%	0.766	S	S	*	*			cis	-138.8	165.7	11.4	43.3	-25.7	0	0	0	119.1
65	A	29.3	Very low	32	Very low	89 Å²	89	127.2 Å²	127.2	74%	0.736	77%	0.765	S	S	*	*			trans	48.9	137.6	138.7	0	0	0	0	0	125.8
66	S	28.3	Very low	31.9	Very low	109 Å²	109	124.8 Å²	124.8	76%	0.762	76%	0.756	S	S	*	*			trans	94.7	129.7	142.8	-63.9	0	0	0	0	122.3
67	T	33	Very low	32.1	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.724	76%	0.762	S	S	*	*			trans	18.5	121.7	146.6	56.6	0	0	0	0	120.1
68	D	27.1	Very low	32	Very low	169 Å²	169	124.9 Å²	124.9	90%	0.904	76%	0.757	S	S	*	*				-176.2	-171.1	93	-105.4	-24.5	0	0	0	113.6
69	S	30.5	Very low	31.9	Very low	99 Å²	99	131 Å²	131	69%	0.692	78%	0.777	S	S	*	*			trans	-100.1	154.7	-167.1	174.3	0	0	0	0	115.7
70	S	33.8	Very low	31.8	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	78%	0.784	S	S	*	*			trans	67.9	118.2	146.5	48.8	0	0	0	0	122.2
71	C	32.3	Very low	31.8	Very low	127 Å²	127	124.6 Å²	124.6	86%	0.858	78%	0.783	S	S	*	*				65.4	130.8	127.6	-55.7	0	0	0	0	121.7
72	F	28.8	Very low	31.9	Very low	223 Å²	223	132 Å²	132	98%	0.978	79%	0.793	S	S	*	*			trans	-111.7	155.2	154.9	-95.3	-85.7	0	0	0	110.5
73	G	28.7	Very low	32.7	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	79%	0.792	S	S	*	*			trans	-166	165.3	175.7	0	0	0	0	0	112.2
74	V	27.5	Very low	32.5	Very low	146 Å²	146	130.2 Å²	130.2	89%	0.885	79%	0.788	S	S	*	*			trans	-158.7	134.1	-175.6	174.9	0	0	0	0	106.3
75	D	34	Very low	32	Very low	148 Å²	148	128.5 Å²	128.5	79%	0.791	78%	0.78	S	S	*	*			cis	-150	172.1	-12.5	-156.1	33.4	0	0	0	105.5
76	G	28.7	Very low	32	Very low	49 Å²	49	133.8 Å²	133.8	51%	0.505	78%	0.782	S	S	.	*			cis	167.1	167.1	3.6	0	0	0	0	0	112.8
77	R	32.3	Very low	32.2	Very low	246 Å²	246	135.8 Å²	135.8	93%	0.928	78%	0.783	S	S	*	*			trans	65.3	139.1	175.6	-50.6	172	179.7	-97.5	-2.7	114.8
78	G	29.7	Very low	32.1	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	79%	0.791	S	S	*	*			cis	172.5	152.4	-9.1	0	0	0	0	0	112
79	E	30.6	Very low	33.2	Very low	212 Å²	212	139 Å²	139	99%	0.991	79%	0.785	S	S	*	*			trans	65.4	143.1	171.8	-49.8	-173.2	125	0	0	117.1
80	G	30.1	Very low	33.2	Very low	76 Å²	76	138.6 Å²	138.6	78%	0.784	79%	0.787	S	S	*	*			cis	-178.3	165.2	-9	0	0	0	0	0	114.7
81	A	30.5	Very low	34	Very low	100 Å²	100	139.3 Å²	139.3	83%	0.826	79%	0.79	S	S	*	*			trans	65.1	99.5	158.8	0	0	0	0	0	124.5
82	R	35.2	Very low	34.1	Very low	241 Å²	241	142.6 Å²	142.6	91%	0.909	79%	0.793	S	S	*	*				34.8	160.2	109.3	-81.3	-171.6	175.2	-166.3	0.4	122.4
83	P	57.9	Low	34	Very low	107 Å²	107	135.5 Å²	135.5	70%	0.695	78%	0.782	S	S	*	*			cis	-147.3	-151.4	-47.2	40.9	-17.6	0	0	0	114.5
84	V	31.5	Very low	34.2	Very low	129 Å²	129	140 Å²	140	78%	0.782	79%	0.789	S	S	*	*			trans	90.8	153.9	162	-165.8	0	0	0	0	118.6
85	S	32	Very low	34.3	Very low	82 Å²	82	137.9 Å²	137.9	57%	0.573	78%	0.78	S	S	*	*				177.4	161.5	-51.7	-167.6	0	0	0	0	113.7
86	Y	30.5	Very low	34.1	Very low	199 Å²	199	138 Å²	138	78%	0.78	78%	0.781	S	S	*	*			trans	94.5	118.2	147.7	-62.2	-52.5	0	0	0	126.5
87	L	31.7	Very low	34.1	Very low	152 Å²	152	139.3 Å²	139.3	80%	0.796	79%	0.794	S	S	*	*				81.1	116.1	126.6	-63	170.8	0	0	0	127
88	R	30	Very low	34.1	Very low	234 Å²	234	135.4 Å²	135.4	88%	0.883	79%	0.786	S	S	*	*				13.9	167.7	123.5	-93.4	-174.3	-179.8	178	1.7	123.1
89	P	50.7	Low	34	Very low	121 Å²	121	141 Å²	141	79%	0.786	79%	0.792	S	S	*	*			cis	-138.6	-164.1	-11.7	37.9	-15.1	0	0	0	116.3
90	A	31.6	Very low	34.4	Very low	89 Å²	89	140.2 Å²	140.2	74%	0.736	79%	0.789	S	S	*	*			trans	-96.7	179.4	-178	0	0	0	0	0	115.8
91	P	50.8	Low	34.8	Very low	111 Å²	111	143.8 Å²	143.8	72%	0.721	79%	0.79	S	S	*	*				-160	152.8	97.4	41.5	-21.4	0	0	0	121.4
92	Q	34	Very low	35.1	Very low	196 Å²	196	147.5 Å²	147.5	92%	0.916	80%	0.795	S	S	*	*			trans	53.3	140.2	136.2	-66.8	171.7	-59.3	0	0	127
93	G	27	Very low	35.3	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	78%	0.783	S	S	*	*			trans	-164.3	161.7	162.8	0	0	0	0	0	110.4
94	I	32.6	Very low	34.2	Very low	163 Å²	163	143.2 Å²	143.2	84%	0.836	79%	0.79	S	S	*	*			trans	-141.2	135.3	-160.5	-55.4	168.1	0	0	0	114.5
95	S	28.4	Very low	34.2	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	80%	0.796	S	S	*	*				163.6	122.2	127.9	-170.5	0	0	0	0	114.6
96	D	30.7	Very low	34.6	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	80%	0.799	S	S	*	*			trans	28.6	135.4	143.5	-46.9	-79.5	0	0	0	123.5
97	G	29	Very low	35.1	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	79%	0.791	S	S	*	*			trans	-178.8	24.5	174.2	0	0	0	0	0	125.1
98	H	32.1	Very low	35.6	Very low	163 Å²	163	144.8 Å²	144.8	76%	0.755	79%	0.793	S	S	*	*			trans	64	152.4	162.5	-147.4	-64.6	0	0	0	119.9
99	F	27.5	Very low	36.2	Very low	183 Å²	183	138.9 Å²	138.9	80%	0.803	78%	0.783	S	S	*	*			trans	70.9	87.2	171.6	-68.7	-68.3	0	0	0	119.8
100	E	38.1	Very low	35.9	Very low	197 Å²	197	140 Å²	140	92%	0.921	78%	0.778	S	S	*	*			trans	-98.8	121.5	133.2	-70.2	-170.8	137.6	0	0	108.4
101	N	40.1	Very low	36.7	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	76%	0.76	S	S	*	*			trans	174.9	91.3	140.5	-167.7	4.5	0	0	0	112.8
102	L	36.4	Very low	36.8	Very low	177 Å²	177	138.6 Å²	138.6	93%	0.927	75%	0.751	S	S	*	*	S	Bend	trans	-155.8	21.3	158.8	-152.3	59.8	0	0	0	114.6
103	G	38.2	Very low	38.4	Very low	65 Å²	65	133.2 Å²	133.2	67%	0.67	73%	0.733	S	S	*	*	S	Bend	trans	-106.3	-0	-163.8	0	0	0	0	0	118.2
104	K	35.7	Very low	40.1	Very low	194 Å²	194	135.2 Å²	135.2	84%	0.843	73%	0.726	S	S	*	*	S	Bend	trans	-143.8	33.1	-164	-70.7	-171.9	176	172.6	0	116.5
105	M	31.5	Very low	41.8	Very low	185 Å²	185	132.4 Å²	132.4	91%	0.911	71%	0.71	S	S	*	*	S	Bend	trans	-134.7	4.3	180	-119.8	172.2	-176	0	0	117.1
106	T	40.4	Very low	44	Very low	103 Å²	103	134.1 Å²	134.1	63%	0.632	71%	0.709	S	S	*	*	S	Bend	trans	-102.3	-33.9	176.6	46.2	0	0	0	0	113.5	R108	T106-R108 VanDerWaalsContact C-N 3.26Å; T106-R108 PolarHBondContact O-N 3.26Å
107	S	40.3	Very low	46.2	Very low	88 Å²	88	134 Å²	134	62%	0.615	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	51.6	-172	67.8	0	0	0	0	114.6
108	R	42.8	Very low	48.5	Very low	218 Å²	218	134.7 Å²	134.7	82%	0.823	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.6	-21.1	171.5	-149.1	172.9	-174.8	179.1	2.4	115.8	T106	T106-R108 VanDerWaalsContact C-N 3.26Å; T106-R108 PolarHBondContact O-N 3.26Å
109	T	43	Very low	51	Low	111 Å²	111	131.8 Å²	131.8	68%	0.681	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-28.3	179.4	-3.3	0	0	0	0	112.6
110	Q	44.2	Very low	53.3	Low	145 Å²	145	129.3 Å²	129.3	68%	0.678	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-19.5	179.5	-70	178.2	-26.1	0	0	113.6	L112 P113	Q110-L112 VanDerWaalsContact C-N 3.34Å; Q110-L112 PolarHBondContact O-N 3.2Å; Q110-P113 WeakPolarHBondContact O-CD 3.25Å
111	D	48	Very low	55.3	Low	69 Å²	69	124.5 Å²	124.5	37%	0.369	64%	0.644	S	S	.	*	H	α-helix	trans	-78	-13.8	-175.8	-60.7	-50.4	0	0	0	114.1	L114 M115	D111-L114 PolarHBondContact O-N 3.17Å; D111-M115 HydrophobicContact CB-CE 4.13Å; D111-M115 WeakPolarHBondContact O-CB 3.48Å; D111-M115 WeakPolarHBondContact O-CG 3.46Å; D111-M115 PolarHBondContact O-N 3.42Å
112	L	52.5	Low	57.4	Low	101 Å²	101	123.1 Å²	123.1	53%	0.529	63%	0.631	S	S	.	*	H	α-helix	trans	-65.9	-48.7	-175.1	-80.9	160.8	0	0	0	113.5	Q110 L114 M115 M116	Q110-L112 VanDerWaalsContact C-N 3.34Å; Q110-L112 PolarHBondContact O-N 3.2Å; L112-L114 VanDerWaalsContact C-N 3.33Å; L112-L114 PolarHBondContact O-N 2.76Å; L112-M115 HydrophobicContact CD2-CE 4.12Å; L112-M115 HydrophobicContact CG-CE 4.4Å; L112-M116 PolarHBondContact O-N 2.66Å; L112-M116 VanDerWaalsContact O-N 3.12Å
113	P	67.4	Low	59.7	Low	83 Å²	83	120.8 Å²	120.8	54%	0.539	61%	0.613	S	S	.	*	H	α-helix	trans	-65.9	-34.1	173.5	-20.7	33.8	0	0	0	113	Q110 M116 K117	Q110-P113 WeakPolarHBondContact O-CD 3.25Å; P113-M116 PolarHBondContact O-N 2.67Å; P113-K117 PolarHBondContact O-N 2.9Å
114	L	62.8	Low	61.7	Low	115 Å²	115	125.2 Å²	125.2	60%	0.602	61%	0.61	S	S	*	*	H	α-helix	trans	-69.7	-41.1	177.9	-85.5	165	0	0	0	112.1	D111 L112 K117 L118	D111-L114 PolarHBondContact O-N 3.17Å; L112-L114 VanDerWaalsContact C-N 3.33Å; L112-L114 PolarHBondContact O-N 2.76Å; L114-K117 PolarHBondContact O-N 3.42Å; L114-L118 WeakPolarHBondContact O-CB 3.27Å; L114-L118 PolarHBondContact O-N 3.23Å
115	M	68.7	Low	63.8	Low	105 Å²	105	122 Å²	122	52%	0.517	60%	0.598	S	S	.	*	H	α-helix	trans	-63.6	-41.2	172.6	-77.6	-172.2	-67.7	0	0	111.7	D111 L112 L118 E119	D111-M115 HydrophobicContact CB-CE 4.13Å; D111-M115 WeakPolarHBondContact O-CB 3.48Å; D111-M115 WeakPolarHBondContact O-CG 3.46Å; D111-M115 PolarHBondContact O-N 3.42Å; L112-M115 HydrophobicContact CD2-CE 4.12Å; L112-M115 HydrophobicContact CG-CE 4.4Å; M115-L118 PolarHBondContact O-N 3.42Å; M115-E119 WeakPolarHBondContact O-CB 3.44Å; M115-E119 PolarHBondContact O-N 3.49Å
116	M	75.1	Confident	66.4	Low	137 Å²	137	119 Å²	119	68%	0.675	58%	0.581	S	S	*	*	H	α-helix	trans	-58.8	-51.4	173.2	-96.3	-179.4	61.4	0	0	111.7	L112 P113 L118 E119 E120	L112-M116 PolarHBondContact O-N 2.66Å; L112-M116 VanDerWaalsContact O-N 3.12Å; P113-M116 PolarHBondContact O-N 2.67Å; M116-L118 VanDerWaalsContact C-N 3.3Å; M116-L118 PolarHBondContact O-N 2.93Å; M116-E119 PolarHBondContact O-N 3.4Å; M116-E120 VanDerWaalsContact O-CB 3.32Å; M116-E120 WeakPolarHBondContact O-CB 3.16Å; M116-E120 PolarHBondContact O-N 2.95Å
117	K	75.8	Confident	68.6	Low	148 Å²	148	118.5 Å²	118.5	64%	0.643	57%	0.572	S	S	*	*	H	α-helix	trans	-63.8	-33	177.7	-73.4	-173.8	175	-174.8	0	113	P113 L114 L121	P113-K117 PolarHBondContact O-N 2.9Å; L114-K117 PolarHBondContact O-N 3.42Å; K117-L121 WeakPolarHBondContact O-CB 3.35Å; K117-L121 PolarHBondContact O-N 3.25Å
118	L	78.4	Confident	70.5	Confident	90 Å²	90	118.1 Å²	118.1	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-72.6	-33.7	175.4	-174.2	66	0	0	0	112.2	L114 M115 M116 K122	L114-L118 WeakPolarHBondContact O-CB 3.27Å; L114-L118 PolarHBondContact O-N 3.23Å; M115-L118 PolarHBondContact O-N 3.42Å; M116-L118 VanDerWaalsContact C-N 3.3Å; M116-L118 PolarHBondContact O-N 2.93Å; L118-K122 WeakPolarHBondContact O-CB 3.48Å; L118-K122 WeakPolarHBondContact O-CD 3.27Å; L118-K122 WeakPolarHBondContact O-CG 3.34Å; L118-K122 PolarHBondContact O-N 2.86Å
119	E	85.1	Confident	72.5	Confident	103 Å²	103	112.1 Å²	112.1	48%	0.481	54%	0.542	S	S	.	.	H	α-helix	trans	-73.3	-39.1	174.3	-164.3	-171	145	0	0	111.4	M115 M116 K122 K123	M115-E119 WeakPolarHBondContact O-CB 3.44Å; M115-E119 PolarHBondContact O-N 3.49Å; M116-E119 PolarHBondContact O-N 3.4Å; E119-K122 PolarHBondContact O-N 3.2Å; E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.25Å; E119-K123 PolarHBondContact O-N 2.67Å; E119-K123 WeakPolarHBondContact OE1-CE 3.39Å; E119-K123 IonicContact OE1-NZ 3.96Å; E119-K123 PolarHBondContact OE1-NZ 3.44Å
120	E	75.4	Confident	74.8	Confident	131 Å²	131	112.1 Å²	112.1	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-45.8	172.7	-171.5	166.1	-126.8	0	0	111.4	M116 K122 K123 W124	M116-E120 VanDerWaalsContact O-CB 3.32Å; M116-E120 WeakPolarHBondContact O-CB 3.16Å; M116-E120 PolarHBondContact O-N 2.95Å; E120-K122 VanDerWaalsContact C-N 3.34Å; E120-K122 PolarHBondContact O-N 3.3Å; E120-K123 PolarHBondContact O-N 2.81Å; E120-W124 PolarHBondContact O-N 3Å
121	L	80.6	Confident	76.6	Confident	95 Å²	95	110 Å²	110	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-39.8	172.1	-178	62.6	0	0	0	112.1	K117 W124 Q125	K117-L121 WeakPolarHBondContact O-CB 3.35Å; K117-L121 PolarHBondContact O-N 3.25Å; L121-W124 PolarHBondContact O-N 2.71Å; L121-Q125 WeakPolarHBondContact O-CB 3.24Å; L121-Q125 PolarHBondContact O-N 3.36Å
122	K	82.8	Confident	78.2	Confident	123 Å²	123	111.3 Å²	111.3	54%	0.535	53%	0.531	S	S	.	.	H	α-helix	trans	-64.6	-39.5	173.8	-80.2	168.7	-179.2	176.7	0	112.3	L118 E119 E120 Q125 H126	L118-K122 WeakPolarHBondContact O-CB 3.48Å; L118-K122 WeakPolarHBondContact O-CD 3.27Å; L118-K122 WeakPolarHBondContact O-CG 3.34Å; L118-K122 PolarHBondContact O-N 2.86Å; E119-K122 PolarHBondContact O-N 3.2Å; E120-K122 VanDerWaalsContact C-N 3.34Å; E120-K122 PolarHBondContact O-N 3.3Å; K122-Q125 PolarHBondContact O-N 3.39Å; K122-H126 VanDerWaalsContact O-CB 3.24Å; K122-H126 WeakPolarHBondContact O-CB 3.28Å; K122-H126 PolarHBondContact O-N 2.95Å
123	K	85.4	Confident	79.9	Confident	127 Å²	127	111.9 Å²	111.9	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-64.9	-44.8	175	-74.6	165.3	-174.8	167.1	0	111.1	E119 E120 H126 H127	E119-K123 VanDerWaalsContact O-CG 3.31Å; E119-K123 WeakPolarHBondContact O-CG 3.25Å; E119-K123 PolarHBondContact O-N 2.67Å; E119-K123 WeakPolarHBondContact OE1-CE 3.39Å; E119-K123 IonicContact OE1-NZ 3.96Å; E119-K123 PolarHBondContact OE1-NZ 3.44Å; E120-K123 PolarHBondContact O-N 2.81Å; K123-H126 PolarHBondContact O-N 2.93Å; K123-H127 WeakPolarHBondContact O-CB 3.43Å; K123-H127 PolarHBondContact O-N 3.34Å
124	W	79.2	Confident	80.8	Confident	158 Å²	158	110.6 Å²	110.6	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-45.6	174.8	-173.6	85.3	0	0	0	112.2	E120 L121 H126 H127 M128	E120-W124 PolarHBondContact O-N 3Å; L121-W124 PolarHBondContact O-N 2.71Å; W124-H126 VanDerWaalsContact C-N 3.33Å; W124-H126 PolarHBondContact O-N 2.85Å; W124-H127 PolarHBondContact O-N 2.81Å; W124-M128 HydrophobicContact CD2-CG 3.94Å; W124-M128 HydrophobicContact CE3-CG 4.02Å; W124-M128 HydrophobicContact CH2-CG 3.72Å; W124-M128 HydrophobicContact CH2-SD 4.36Å; W124-M128 HydrophobicContact CZ2-CG 3.62Å; W124-M128 HydrophobicContact CZ2-SD 3.89Å; W124-M128 HydrophobicContact CZ3-CG 3.92Å; W124-M128 WeakPolarHBondContact O-CG 3.2Å; W124-M128 PolarHBondContact O-N 3.21Å
125	Q	79.9	Confident	81.8	Confident	126 Å²	126	110.8 Å²	110.8	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-32.6	178.4	-168.4	172.4	46.9	0	0	112.4	L121 K122 H129	L121-Q125 WeakPolarHBondContact O-CB 3.24Å; L121-Q125 PolarHBondContact O-N 3.36Å; K122-Q125 PolarHBondContact O-N 3.39Å; Q125-H129 VanDerWaalsContact O-CB 3.3Å; Q125-H129 WeakPolarHBondContact O-CB 3.43Å; Q125-H129 PolarHBondContact O-N 2.82Å
126	H	85.8	Confident	82.3	Confident	123 Å²	123	110.3 Å²	110.3	57%	0.569	52%	0.52	S	S	*	.	H	α-helix	trans	-67.9	-47.3	170.9	-168.6	69.2	0	0	0	111.2	K122 K123 W124 M128 H129 E130	K122-H126 VanDerWaalsContact O-CB 3.24Å; K122-H126 WeakPolarHBondContact O-CB 3.28Å; K122-H126 PolarHBondContact O-N 2.95Å; K123-H126 PolarHBondContact O-N 2.93Å; W124-H126 VanDerWaalsContact C-N 3.33Å; W124-H126 PolarHBondContact O-N 2.85Å; H126-M128 PolarHBondContact O-N 3.33Å; H126-H129 CarbonylContact O-C 3.59Å; H126-H129 WeakPolarHBondContact O-CB 3.31Å; H126-H129 PolarHBondContact O-N 2.74Å; H126-H129 VanDerWaalsContact O-N 3.13Å; H126-E130 WeakPolarHBondContact O-CB 3.38Å; H126-E130 PolarHBondContact O-N 3.47Å
127	H	87.7	Confident	82.9	Confident	92 Å²	92	109 Å²	109	43%	0.426	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-44.3	178.2	-176.6	62	0	0	0	112.6	K123 W124 H129 E130 Q131	K123-H127 WeakPolarHBondContact O-CB 3.43Å; K123-H127 PolarHBondContact O-N 3.34Å; W124-H127 PolarHBondContact O-N 2.81Å; H127-H129 VanDerWaalsContact C-N 3.29Å; H127-H129 PolarHBondContact O-N 2.84Å; H127-E130 PolarHBondContact O-N 3.04Å; H127-Q131 PolarHBondContact NE2-NE2 3.45Å; H127-Q131 PolarHBondContact O-N 2.85Å
128	M	80.1	Confident	83.6	Confident	80 Å²	80	108.6 Å²	108.6	39%	0.394	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-38.1	173.3	-74.3	-58.4	-50.3	0	0	112.4	W124 H126 L132	W124-M128 HydrophobicContact CD2-CG 3.94Å; W124-M128 HydrophobicContact CE3-CG 4.02Å; W124-M128 HydrophobicContact CH2-CG 3.72Å; W124-M128 HydrophobicContact CH2-SD 4.36Å; W124-M128 HydrophobicContact CZ2-CG 3.62Å; W124-M128 HydrophobicContact CZ2-SD 3.89Å; W124-M128 HydrophobicContact CZ3-CG 3.92Å; W124-M128 WeakPolarHBondContact O-CG 3.2Å; W124-M128 PolarHBondContact O-N 3.21Å; H126-M128 PolarHBondContact O-N 3.33Å; M128-L132 WeakPolarHBondContact O-CB 3.4Å; M128-L132 PolarHBondContact O-N 2.86Å
129	H	84.7	Confident	83.8	Confident	93 Å²	93	109.5 Å²	109.5	43%	0.431	52%	0.517	S	S	.	.	H	α-helix	trans	-73.5	-28.8	177	-176.4	65.1	0	0	0	112.7	Q125 H126 H127 K133	Q125-H129 VanDerWaalsContact O-CB 3.3Å; Q125-H129 WeakPolarHBondContact O-CB 3.43Å; Q125-H129 PolarHBondContact O-N 2.82Å; H126-H129 CarbonylContact O-C 3.59Å; H126-H129 WeakPolarHBondContact O-CB 3.31Å; H126-H129 PolarHBondContact O-N 2.74Å; H126-H129 VanDerWaalsContact O-N 3.13Å; H127-H129 VanDerWaalsContact C-N 3.29Å; H127-H129 PolarHBondContact O-N 2.84Å; H129-K133 PolarHBondContact CD2-NZ 3.37Å; H129-K133 VanDerWaalsContact NE2-CE 3.29Å; H129-K133 WeakPolarHBondContact NE2-CE 3.21Å; H129-K133 PolarHBondContact NE2-NZ 2.96Å; H129-K133 WeakPolarHBondContact O-CB 3.38Å; H129-K133 WeakPolarHBondContact O-CG 3.25Å; H129-K133 PolarHBondContact O-N 3.39Å; H129-K133 VanDerWaalsContact O-N 3.11Å
130	E	90.4	Very high	83.8	Confident	110 Å²	110	110.1 Å²	110.1	51%	0.514	52%	0.523	S	S	.	.	H	α-helix	trans	-74.8	-42.6	173.8	-172.2	169.5	-136	0	0	111.6	H126 H127 K133 A134	H126-E130 WeakPolarHBondContact O-CB 3.38Å; H126-E130 PolarHBondContact O-N 3.47Å; H127-E130 PolarHBondContact O-N 3.04Å; E130-K133 CarbonylContact O-C 3.54Å; E130-K133 WeakPolarHBondContact O-CB 3.46Å; E130-K133 PolarHBondContact O-N 2.92Å; E130-A134 WeakPolarHBondContact O-CB 3.35Å; E130-A134 PolarHBondContact O-N 3.35Å
131	Q	82.4	Confident	84.2	Confident	100 Å²	100	108.5 Å²	108.5	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-43.5	170.2	-75.7	-171.4	-29.6	0	0	112	H127 K133 A134 H135	H127-Q131 PolarHBondContact NE2-NE2 3.45Å; H127-Q131 PolarHBondContact O-N 2.85Å; Q131-K133 VanDerWaalsContact C-N 3.28Å; Q131-K133 PolarHBondContact O-N 2.83Å; Q131-A134 PolarHBondContact O-N 3.41Å; Q131-H135 PolarHBondContact O-N 3.34Å
132	L	82.4	Confident	84	Confident	98 Å²	98	106.9 Å²	106.9	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-37.3	175.8	-171.6	67.8	0	0	0	111.7	M128 Q136	M128-L132 WeakPolarHBondContact O-CB 3.4Å; M128-L132 PolarHBondContact O-N 2.86Å; L132-Q136 WeakPolarHBondContact O-CB 3.24Å; L132-Q136 VanDerWaalsContact O-CG 3.24Å; L132-Q136 WeakPolarHBondContact O-CG 3.25Å; L132-Q136 PolarHBondContact O-N 3.21Å
133	K	88.2	Confident	83.7	Confident	113 Å²	113	104.8 Å²	104.8	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-68.8	-37.9	172.8	-83.3	168.5	164.2	166	0	113.1	H129 E130 Q131 Q136 L137	H129-K133 PolarHBondContact CD2-NZ 3.37Å; H129-K133 VanDerWaalsContact NE2-CE 3.29Å; H129-K133 WeakPolarHBondContact NE2-CE 3.21Å; H129-K133 PolarHBondContact NE2-NZ 2.96Å; H129-K133 WeakPolarHBondContact O-CB 3.38Å; H129-K133 WeakPolarHBondContact O-CG 3.25Å; H129-K133 PolarHBondContact O-N 3.39Å; H129-K133 VanDerWaalsContact O-N 3.11Å; E130-K133 CarbonylContact O-C 3.54Å; E130-K133 WeakPolarHBondContact O-CB 3.46Å; E130-K133 PolarHBondContact O-N 2.92Å; Q131-K133 VanDerWaalsContact C-N 3.28Å; Q131-K133 PolarHBondContact O-N 2.83Å; K133-Q136 PolarHBondContact O-N 2.97Å; K133-L137 WeakPolarHBondContact O-CB 3.33Å; K133-L137 PolarHBondContact O-N 3.35Å
134	A	85.7	Confident	83.1	Confident	55 Å²	55	103.5 Å²	103.5	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-46.9	175.5	0	0	0	0	0	110.8	E130 Q131 Q136 L137 E138	E130-A134 WeakPolarHBondContact O-CB 3.35Å; E130-A134 PolarHBondContact O-N 3.35Å; Q131-A134 PolarHBondContact O-N 3.41Å; A134-Q136 PolarHBondContact O-N 3.35Å; A134-L137 WeakPolarHBondContact O-CB 3.26Å; A134-L137 PolarHBondContact O-N 3.47Å; A134-L137 VanDerWaalsContact O-N 3.15Å; A134-E138 WeakPolarHBondContact O-CB 3.24Å; A134-E138 PolarHBondContact O-N 3.2Å
135	H	83.6	Confident	82.8	Confident	119 Å²	119	101.1 Å²	101.1	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-60.5	-42.3	173.9	-173	-61.2	0	0	0	112.1	Q131 L137 E138 E139	Q131-H135 PolarHBondContact O-N 3.34Å; H135-L137 VanDerWaalsContact C-N 3.32Å; H135-L137 PolarHBondContact O-N 2.98Å; H135-E138 PolarHBondContact O-N 2.92Å; H135-E139 IonicContact CE1-OE2 3.96Å; H135-E139 IonicContact ND1-OE2 2.7Å; H135-E139 VanDerWaalsContact O-CB 3.28Å; H135-E139 WeakPolarHBondContact O-CB 3.37Å; H135-E139 PolarHBondContact O-N 3.07Å
136	Q	80.4	Confident	82.3	Confident	96 Å²	96	99.9 Å²	99.9	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-34.3	175.4	-75	171.2	-4.3	0	0	112.6	L132 K133 A134 L140	L132-Q136 WeakPolarHBondContact O-CB 3.24Å; L132-Q136 VanDerWaalsContact O-CG 3.24Å; L132-Q136 WeakPolarHBondContact O-CG 3.25Å; L132-Q136 PolarHBondContact O-N 3.21Å; K133-Q136 PolarHBondContact O-N 2.97Å; A134-Q136 PolarHBondContact O-N 3.35Å; Q136-L140 WeakPolarHBondContact O-CB 3.29Å; Q136-L140 WeakPolarHBondContact O-CD1 3.18Å; Q136-L140 WeakPolarHBondContact O-CG 3.36Å; Q136-L140 PolarHBondContact O-N 2.97Å
137	L	86.3	Confident	81.1	Confident	108 Å²	108	99.6 Å²	99.6	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-71.1	-41	174.9	-167.2	79.9	0	0	0	111.5	K133 A134 H135 L140 L141	K133-L137 WeakPolarHBondContact O-CB 3.33Å; K133-L137 PolarHBondContact O-N 3.35Å; A134-L137 WeakPolarHBondContact O-CB 3.26Å; A134-L137 PolarHBondContact O-N 3.47Å; A134-L137 VanDerWaalsContact O-N 3.15Å; H135-L137 VanDerWaalsContact C-N 3.32Å; H135-L137 PolarHBondContact O-N 2.98Å; L137-L140 PolarHBondContact O-N 3.34Å; L137-L141 HydrophobicContact CD2-CD1 4.47Å; L137-L141 HydrophobicContact CG-CD1 4.23Å; L137-L141 WeakPolarHBondContact O-CB 3.3Å; L137-L141 VanDerWaalsContact O-CG 3.3Å; L137-L141 WeakPolarHBondContact O-CG 3.47Å; L137-L141 PolarHBondContact O-N 2.87Å
138	E	90.3	Very high	79.6	Confident	141 Å²	141	101.3 Å²	101.3	66%	0.659	50%	0.501	S	S	*	.	H	α-helix	trans	-65.8	-41.4	176.6	-174.2	171.5	-166.2	0	0	111.5	A134 H135 L141 C142	A134-E138 WeakPolarHBondContact O-CB 3.24Å; A134-E138 PolarHBondContact O-N 3.2Å; H135-E138 PolarHBondContact O-N 2.92Å; E138-L141 PolarHBondContact O-N 3.49Å; E138-C142 WeakPolarHBondContact O-CB 3.33Å; E138-C142 PolarHBondContact O-N 2.88Å
139	E	83.2	Confident	78.9	Confident	109 Å²	109	106.6 Å²	106.6	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-42.6	172.9	-171.1	172.3	-172.6	0	0	111.6	H135 C142 L143	H135-E139 IonicContact CE1-OE2 3.96Å; H135-E139 IonicContact ND1-OE2 2.7Å; H135-E139 VanDerWaalsContact O-CB 3.28Å; H135-E139 WeakPolarHBondContact O-CB 3.37Å; H135-E139 PolarHBondContact O-N 3.07Å; E139-C142 PolarHBondContact O-N 3.31Å; E139-L143 HydrophobicContact CG-CD1 4.43Å; E139-L143 WeakPolarHBondContact O-CB 3.48Å; E139-L143 VanDerWaalsContact O-CG 3.26Å; E139-L143 WeakPolarHBondContact O-CG 3.49Å; E139-L143 PolarHBondContact O-N 3.1Å
140	L	86.1	Confident	77.5	Confident	115 Å²	115	108 Å²	108	60%	0.602	53%	0.526	S	S	*	.	H	α-helix	trans	-64.5	-38.8	172.7	-77.7	169.2	0	0	0	112.9	Q136 L137 L143 Q144	Q136-L140 WeakPolarHBondContact O-CB 3.29Å; Q136-L140 WeakPolarHBondContact O-CD1 3.18Å; Q136-L140 WeakPolarHBondContact O-CG 3.36Å; Q136-L140 PolarHBondContact O-N 2.97Å; L137-L140 PolarHBondContact O-N 3.34Å; L140-L143 PolarHBondContact O-N 2.91Å; L140-Q144 WeakPolarHBondContact O-CB 3.46Å; L140-Q144 PolarHBondContact O-N 3.49Å
141	L	82.1	Confident	75.6	Confident	97 Å²	97	108.9 Å²	108.9	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-67.9	-40.6	175.7	-79.7	166	0	0	0	111.5	L137 E138 Q144 E145	L137-L141 HydrophobicContact CD2-CD1 4.47Å; L137-L141 HydrophobicContact CG-CD1 4.23Å; L137-L141 WeakPolarHBondContact O-CB 3.3Å; L137-L141 VanDerWaalsContact O-CG 3.3Å; L137-L141 WeakPolarHBondContact O-CG 3.47Å; L137-L141 PolarHBondContact O-N 2.87Å; E138-L141 PolarHBondContact O-N 3.49Å; L141-Q144 PolarHBondContact O-N 2.98Å; L141-E145 WeakPolarHBondContact O-CB 3.49Å; L141-E145 PolarHBondContact O-N 2.79Å
142	C	77.9	Confident	74.4	Confident	61 Å²	61	107.6 Å²	107.6	41%	0.412	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-41.7	174.1	-170.1	0	0	0	0	111.4	E138 E139 E145 Q146	E138-C142 WeakPolarHBondContact O-CB 3.33Å; E138-C142 PolarHBondContact O-N 2.88Å; E139-C142 PolarHBondContact O-N 3.31Å; C142-E145 PolarHBondContact O-N 2.86Å; C142-Q146 WeakPolarHBondContact O-CB 3.44Å; C142-Q146 VanDerWaalsContact O-CG 3.3Å; C142-Q146 WeakPolarHBondContact O-CG 3.43Å; C142-Q146 PolarHBondContact O-N 3.25Å
143	L	75.3	Confident	72.3	Confident	79 Å²	79	111.2 Å²	111.2	41%	0.414	57%	0.567	S	S	.	*	H	α-helix	trans	-65.7	-37.3	173.4	-72.8	168.7	0	0	0	112.3	E139 L140 Q146 Q147	E139-L143 HydrophobicContact CG-CD1 4.43Å; E139-L143 WeakPolarHBondContact O-CB 3.48Å; E139-L143 VanDerWaalsContact O-CG 3.26Å; E139-L143 WeakPolarHBondContact O-CG 3.49Å; E139-L143 PolarHBondContact O-N 3.1Å; L140-L143 PolarHBondContact O-N 2.91Å; L143-Q146 PolarHBondContact O-N 2.82Å; L143-Q147 WeakPolarHBondContact O-CG 3.36Å; L143-Q147 PolarHBondContact O-N 2.96Å
144	Q	72.6	Confident	69.6	Low	100 Å²	100	109 Å²	109	47%	0.467	58%	0.575	S	S	.	*	H	α-helix	trans	-67	-44.3	173.9	-176.5	175.3	-3.8	0	0	111.2	L140 L141 Q146 Q147 H148	L140-Q144 WeakPolarHBondContact O-CB 3.46Å; L140-Q144 PolarHBondContact O-N 3.49Å; L141-Q144 PolarHBondContact O-N 2.98Å; Q144-Q146 VanDerWaalsContact C-N 3.3Å; Q144-Q146 PolarHBondContact O-N 3.03Å; Q144-Q147 WeakPolarHBondContact O-CB 3.22Å; Q144-Q147 PolarHBondContact O-N 3.36Å; Q144-Q147 VanDerWaalsContact O-N 3.09Å; Q144-H148 PolarHBondContact NE2-NE2 3.32Å; Q144-H148 PolarHBondContact O-CD2 2.72Å; Q144-H148 VanDerWaalsContact O-CD2 3.23Å; Q144-H148 PolarHBondContact O-N 3.44Å
145	E	73.4	Confident	67	Low	109 Å²	109	114.1 Å²	114.1	51%	0.509	60%	0.595	S	S	.	*	H	α-helix	trans	-62.1	-40.3	176.4	-155.9	-153.8	136.7	0	0	111	L141 C142 H148 R149	L141-E145 WeakPolarHBondContact O-CB 3.49Å; L141-E145 PolarHBondContact O-N 2.79Å; C142-E145 PolarHBondContact O-N 2.86Å; E145-H148 PolarHBondContact O-N 2.97Å; E145-R149 VanDerWaalsContact O-CB 3.24Å; E145-R149 WeakPolarHBondContact O-CB 3.33Å; E145-R149 PolarHBondContact O-N 2.87Å; E145-R149 IonicContact OE1-CZ 3.17Å; E145-R149 IonicContact OE1-NE 3.3Å; E145-R149 IonicContact OE1-NH2 2.84Å; E145-R149 PolarHBondContact OE1-NH2 3.36Å
146	Q	69.5	Low	64.4	Low	100 Å²	100	116 Å²	116	47%	0.467	60%	0.604	S	S	.	*	H	α-helix	trans	-62.8	-39.5	171.5	-73.6	178.9	39.4	0	0	112.5	C142 L143 Q144 R149 L150	C142-Q146 WeakPolarHBondContact O-CB 3.44Å; C142-Q146 VanDerWaalsContact O-CG 3.3Å; C142-Q146 WeakPolarHBondContact O-CG 3.43Å; C142-Q146 PolarHBondContact O-N 3.25Å; L143-Q146 PolarHBondContact O-N 2.82Å; Q144-Q146 VanDerWaalsContact C-N 3.3Å; Q144-Q146 PolarHBondContact O-N 3.03Å; Q146-R149 CarbonylContact O-C 3.6Å; Q146-R149 PolarHBondContact O-N 3.34Å; Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 WeakPolarHBondContact O-CD1 3.43Å; Q146-L150 WeakPolarHBondContact O-CG 3.3Å; Q146-L150 PolarHBondContact O-N 2.98Å
147	Q	60.3	Low	62.2	Low	116 Å²	116	117.4 Å²	117.4	54%	0.542	62%	0.622	S	S	.	*	H	α-helix	trans	-64.9	-44.5	174.5	-76	176.7	31.1	0	0	112.1	L143 Q144 R149 L150 L151	L143-Q147 WeakPolarHBondContact O-CG 3.36Å; L143-Q147 PolarHBondContact O-N 2.96Å; Q144-Q147 WeakPolarHBondContact O-CB 3.22Å; Q144-Q147 PolarHBondContact O-N 3.36Å; Q144-Q147 VanDerWaalsContact O-N 3.09Å; Q147-R149 VanDerWaalsContact C-N 3.32Å; Q147-R149 PolarHBondContact O-N 2.79Å; Q147-L150 CarbonylContact O-C 3.58Å; Q147-L150 PolarHBondContact O-N 2.78Å; Q147-L150 VanDerWaalsContact O-N 3.1Å; Q147-L151 WeakPolarHBondContact O-CB 3.43Å; Q147-L151 WeakPolarHBondContact O-CD1 3.31Å; Q147-L151 VanDerWaalsContact O-CG 3.29Å; Q147-L151 WeakPolarHBondContact O-CG 3.43Å; Q147-L151 PolarHBondContact O-N 3.04Å
148	H	56.4	Low	59.5	Low	129 Å²	129	119.7 Å²	119.7	60%	0.597	63%	0.63	S	S	*	*	H	α-helix	trans	-61.8	-40	173.7	-80.7	-115.2	0	0	0	111.5	Q144 E145 L150 L151	Q144-H148 PolarHBondContact NE2-NE2 3.32Å; Q144-H148 PolarHBondContact O-CD2 2.72Å; Q144-H148 VanDerWaalsContact O-CD2 3.23Å; Q144-H148 PolarHBondContact O-N 3.44Å; E145-H148 PolarHBondContact O-N 2.97Å; H148-L150 PolarHBondContact O-N 3.18Å; H148-L151 PolarHBondContact O-N 3.04Å
149	R	64.8	Low	56.5	Low	190 Å²	190	120.8 Å²	120.8	72%	0.717	64%	0.638	S	S	*	*	H	α-helix	trans	-69.6	-17.1	175.2	-157.9	-175.3	-67.2	-165.3	0.4	113.4	E145 Q146 Q147	E145-R149 VanDerWaalsContact O-CB 3.24Å; E145-R149 WeakPolarHBondContact O-CB 3.33Å; E145-R149 PolarHBondContact O-N 2.87Å; E145-R149 IonicContact OE1-CZ 3.17Å; E145-R149 IonicContact OE1-NE 3.3Å; E145-R149 IonicContact OE1-NH2 2.84Å; E145-R149 PolarHBondContact OE1-NH2 3.36Å; Q146-R149 CarbonylContact O-C 3.6Å; Q146-R149 PolarHBondContact O-N 3.34Å; Q147-R149 VanDerWaalsContact C-N 3.32Å; Q147-R149 PolarHBondContact O-N 2.79Å
150	L	56.7	Low	53.6	Low	123 Å²	123	120.9 Å²	120.9	64%	0.644	65%	0.65	S	S	*	*	H	α-helix	trans	-94.2	-13.2	173.8	-77.2	165.1	0	0	0	113.6	Q146 Q147 H148	Q146-L150 WeakPolarHBondContact O-CB 3.48Å; Q146-L150 WeakPolarHBondContact O-CD1 3.43Å; Q146-L150 WeakPolarHBondContact O-CG 3.3Å; Q146-L150 PolarHBondContact O-N 2.98Å; Q147-L150 CarbonylContact O-C 3.58Å; Q147-L150 PolarHBondContact O-N 2.78Å; Q147-L150 VanDerWaalsContact O-N 3.1Å; H148-L150 PolarHBondContact O-N 3.18Å
151	L	49.8	Very low	50.8	Low	128 Å²	128	120.4 Å²	120.4	67%	0.67	65%	0.652	S	S	*	*			trans	-105.8	35.6	-174.5	-75.5	168.1	0	0	0	112.9	Q147 H148 L153	Q147-L151 WeakPolarHBondContact O-CB 3.43Å; Q147-L151 WeakPolarHBondContact O-CD1 3.31Å; Q147-L151 VanDerWaalsContact O-CG 3.29Å; Q147-L151 WeakPolarHBondContact O-CG 3.43Å; Q147-L151 PolarHBondContact O-N 3.04Å; H148-L151 PolarHBondContact O-N 3.04Å; L151-L153 PolarHBondContact O-N 3.18Å
152	G	58	Low	48.2	Very low	74 Å²	74	123.8 Å²	123.8	76%	0.763	67%	0.665	S	S	*	*			trans	-68	94.2	-174.6	0	0	0	0	0	114.8
153	L	37.4	Very low	45.9	Very low	174 Å²	174	129.3 Å²	129.3	91%	0.911	69%	0.685	S	S	*	*			trans	-172.8	125.9	168.7	-98.3	160.8	0	0	0	107.1	L151	L151-L153 PolarHBondContact O-N 3.18Å
154	G	31.9	Very low	43.5	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	70%	0.7	S	S	*	*			cis	-136.8	-159.1	-16.9	0	0	0	0	0	108.7
155	D	30.7	Very low	42	Very low	164 Å²	164	133.5 Å²	133.5	88%	0.877	72%	0.718	S	S	*	*			cis	-142.8	156.1	11.5	-73.5	-43.7	0	0	0	112.1
156	E	29.5	Very low	39.7	Very low	158 Å²	158	131.1 Å²	131.1	74%	0.738	72%	0.723	S	S	*	*			trans	-103.1	137.7	165.5	175.8	-166.8	-138.9	0	0	109.8
157	P	34.7	Very low	37.8	Very low	126 Å²	126	133.5 Å²	133.5	82%	0.818	74%	0.738	S	S	*	*			trans	-88.6	105.1	167.6	33.3	-29.7	0	0	0	111.8
158	Q	29.6	Very low	36.8	Very low	155 Å²	155	133.4 Å²	133.4	72%	0.724	75%	0.748	S	S	*	*			trans	-69.1	166	171	-66.2	179.8	-12.1	0	0	113.6
159	I	25.7	Very low	35.3	Very low	164 Å²	164	129.5 Å²	129.5	84%	0.841	74%	0.742	S	S	*	*			trans	139.6	120.5	134	-72.3	160.8	0	0	0	110
160	C	23.7	Very low	33.6	Very low	112 Å²	112	123.2 Å²	123.2	76%	0.757	73%	0.73	S	S	*	*			cis	-140	-123.7	-10.4	-155.7	0	0	0	0	109.8
161	T	26.7	Very low	32.3	Very low	104 Å²	104	123.7 Å²	123.7	64%	0.638	73%	0.73	S	S	*	*			cis	-163.6	137	5.1	-30	0	0	0	0	109.6
162	E	28.1	Very low	31.1	Very low	169 Å²	169	126.7 Å²	126.7	79%	0.79	73%	0.732	S	S	*	*			trans	60.7	146.8	160	-77.2	164.6	-157.1	0	0	118.8
163	E	29	Very low	29.7	Very low	177 Å²	177	132.9 Å²	132.9	83%	0.827	73%	0.732	S	S	*	*			cis	-154.8	172.9	-10.8	-138.6	178.3	-160.4	0	0	110
164	N	25.4	Very low	29.4	Very low	137 Å²	137	132.9 Å²	132.9	73%	0.733	73%	0.725	S	S	*	*			trans	-138	132.3	-179.5	-176.4	-0.4	0	0	0	111	G166	N164-G166 PolarHBondContact OD1-N 2.9Å; N164-G166 VanDerWaalsContact OD1-N 3.11Å
165	P	40.8	Very low	29.4	Very low	129 Å²	129	133.7 Å²	133.7	84%	0.838	71%	0.714	S	S	*	*				-145.1	121	126.1	33.1	-15.8	0	0	0	114
166	G	26	Very low	29.4	Very low	60 Å²	60	129.7 Å²	129.7	62%	0.619	70%	0.696	S	S	*	*			trans	-87.5	-170.1	-169	0	0	0	0	0	119.8	N164	N164-G166 PolarHBondContact OD1-N 2.9Å; N164-G166 VanDerWaalsContact OD1-N 3.11Å
167	L	27.8	Very low	29.5	Very low	149 Å²	149	128 Å²	128	78%	0.78	70%	0.696	S	S	*	*			trans	68.5	160.2	174.1	-62.4	173.4	0	0	0	115.9	P593	L167-P593 HydrophobicContact CD2-CG 4.38Å
168	P	39.3	Very low	29.1	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	69%	0.69	S	S	*	*			cis	-130.2	177	-0.1	41.6	-27.3	0	0	0	115.4
169	G	25.1	Very low	28.8	Very low	46 Å²	46	128.1 Å²	128.1	47%	0.474	70%	0.698	S	S	.	*			trans	109.5	72.1	130.3	0	0	0	0	0	119.9	S590	G169-S590 VanDerWaalsContact O-CB 3.24Å; G169-S590 WeakPolarHBondContact O-CB 3.17Å; G169-S590 PolarHBondContact O-OG 3.48Å
170	A	30.3	Very low	28.7	Very low	58 Å²	58	125.1 Å²	125.1	48%	0.479	69%	0.692	S	S	.	*				26	152.6	127	0	0	0	0	0	123.4	S590	A170-S590 WeakPolarHBondContact CA-O 3.5Å
171	Q	28.1	Very low	29.2	Very low	134 Å²	134	125.8 Å²	125.8	63%	0.626	70%	0.695	S	S	*	*			trans	85.4	128.9	143.6	-125	167.3	85.4	0	0	115.1	E589	Q171-E589 PolarHBondContact N-O 2.95Å
172	W	24.9	Very low	29.1	Very low	190 Å²	190	127.3 Å²	127.3	72%	0.72	70%	0.699	S	S	*	*			cis	-138.9	151.5	37.9	-85	62.3	0	0	0	116.1
173	R	30	Very low	29.1	Very low	204 Å²	204	130.5 Å²	130.5	77%	0.77	70%	0.704	S	S	*	*			trans	-80.9	168.4	161.1	-68.2	-179.2	172.5	-129.1	0.2	111.2
174	K	30.8	Very low	28.9	Very low	174 Å²	174	129.2 Å²	129.2	76%	0.757	70%	0.703	S	S	*	*				171.2	151.4	114	-86.7	-140.9	175.2	-116.9	0	111.3
175	D	31.7	Very low	28.9	Very low	82 Å²	82	128.6 Å²	128.6	44%	0.439	71%	0.708	S	S	.	*			cis	-165.7	139.8	-27.6	-114.8	-18.8	0	0	0	106.4
176	T	30.6	Very low	28	Very low	81 Å²	81	126.4 Å²	126.4	50%	0.497	71%	0.709	S	S	.	*				64.9	126	98	-54.1	0	0	0	0	113	Q178	T176-Q178 HydrophobicContact CG2-CG 3.91Å
177	V	30.6	Very low	28.1	Very low	122 Å²	122	131.7 Å²	131.7	74%	0.739	72%	0.722	S	S	*	*				-153.5	110.9	78.7	164.4	0	0	0	0	107.6
178	Q	26.8	Very low	28	Very low	151 Å²	151	135 Å²	135	71%	0.706	72%	0.724	S	S	*	*				69.8	140.3	91.9	-69.7	163.5	-12.9	0	0	113.9	T176	T176-Q178 HydrophobicContact CG2-CG 3.91Å
179	C	22.7	Very low	27.9	Very low	132 Å²	132	138.3 Å²	138.3	89%	0.892	73%	0.73	S	S	*	*			cis	-126.2	170.6	38.2	-155.5	0	0	0	0	115.5
180	S	25.1	Very low	27.8	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	75%	0.746	S	S	*	*			trans	-110.5	166.8	-167.1	-63.7	0	0	0	0	113.4
181	P	34.2	Very low	27.4	Very low	125 Å²	125	148.5 Å²	148.5	81%	0.812	76%	0.759	S	S	*	*			trans	-98	173.9	-158.4	39.2	-37.2	0	0	0	115.4
182	D	24.3	Very low	27.2	Very low	137 Å²	137	149.6 Å²	149.6	73%	0.733	76%	0.764	S	S	*	*			trans	-77	123.8	176.3	-94.9	-57.8	0	0	0	114.1
183	R	27.4	Very low	27	Very low	235 Å²	235	148.3 Å²	148.3	89%	0.887	77%	0.77	S	S	*	*				42.9	126.2	127.4	-60.6	176.3	179.4	-133.6	-7.4	119.6
184	N	25.3	Very low	26.7	Very low	150 Å²	150	143 Å²	143	80%	0.802	76%	0.764	S	S	*	*			trans	-111.8	148.7	161.7	-163.1	19.5	0	0	0	111.5
185	C	24.7	Very low	26.4	Very low	124 Å²	124	140.9 Å²	140.9	84%	0.838	76%	0.762	S	S	*	*			trans	28.1	132	167.2	-70.3	0	0	0	0	122.9
186	G	23.4	Very low	26.1	Very low	83 Å²	83	145.2 Å²	145.2	86%	0.856	78%	0.779	S	S	*	*			trans	-157.6	136.5	158.1	0	0	0	0	0	109.6
187	L	27.2	Very low	25.9	Very low	172 Å²	172	149 Å²	149	90%	0.901	79%	0.791	S	S	*	*			trans	-115.7	162.1	-162.8	-132.1	152.7	0	0	0	112.8
188	R	25.3	Very low	25.7	Very low	217 Å²	217	150.1 Å²	150.1	82%	0.819	79%	0.788	S	S	*	*			trans	78	144.3	171.1	-75.1	179.1	155.6	-103	-1.7	118.7
189	Q	37.3	Very low	25.7	Very low	186 Å²	186	150.4 Å²	150.4	87%	0.869	79%	0.789	S	S	*	*			trans	-89.2	133.5	162.3	-63.7	169.3	-52.4	0	0	109.2
190	E	23.1	Very low	26.1	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.822	78%	0.781	S	S	*	*			trans	-159.7	-171.3	140.2	-125.8	175.3	136.1	0	0	111
191	L	23	Very low	26.4	Very low	142 Å²	142	154.1 Å²	154.1	74%	0.743	79%	0.787	S	S	*	*			trans	-91.2	132.4	-152.1	-92.3	70.5	0	0	0	116.8
192	Q	21.9	Very low	26.2	Very low	157 Å²	157	155.8 Å²	155.8	73%	0.734	79%	0.789	S	S	*	*				58.9	144.3	124.2	-114.2	170.5	-1.7	0	0	123
193	L	22.6	Very low	26.6	Very low	163 Å²	163	157.6 Å²	157.6	85%	0.853	79%	0.793	S	S	*	*			trans	72.4	143.9	163.9	-56.8	166.5	0	0	0	116.5
194	S	22.6	Very low	26.6	Very low	92 Å²	92	149.7 Å²	149.7	64%	0.643	79%	0.785	S	S	*	*			cis	-142.4	175.2	-7.7	53.7	0	0	0	0	108.3
195	D	24.4	Very low	26.7	Very low	130 Å²	130	149.6 Å²	149.6	70%	0.695	78%	0.782	S	S	*	*			cis	-166.1	176.2	40.2	-114.9	-53.9	0	0	0	113.3
196	Q	25.4	Very low	26.8	Very low	172 Å²	172	154.3 Å²	154.3	80%	0.804	78%	0.782	S	S	*	*			trans	72.2	104.3	175	-67.2	166.7	42.3	0	0	115.3
197	Q	26.8	Very low	26.8	Very low	161 Å²	161	156.2 Å²	156.2	75%	0.752	77%	0.773	S	S	*	*			cis	76.3	136	42	-143.2	-162.5	-37.9	0	0	110.8
198	E	25.3	Very low	26.8	Very low	145 Å²	145	153.2 Å²	153.2	68%	0.678	77%	0.766	S	S	*	*			cis	-139.9	139.7	26.9	-69.1	163.8	148.3	0	0	114.9
199	H	27	Very low	26.9	Very low	158 Å²	158	146.2 Å²	146.2	73%	0.731	76%	0.761	S	S	*	*				161.4	103.4	119.5	-93.5	-57.2	0	0	0	114
200	E	31.2	Very low	26.4	Very low	154 Å²	154	147 Å²	147	72%	0.72	77%	0.765	S	S	*	*				25.9	132.5	122.2	-63.8	157	158.3	0	0	119.5
201	D	30.9	Very low	26.7	Very low	157 Å²	157	146.7 Å²	146.7	84%	0.84	76%	0.764	S	S	*	*			cis	-125.4	-129.2	2.5	-65.5	-57.4	0	0	0	112.8
202	D	30.4	Very low	27	Very low	160 Å²	160	146.4 Å²	146.4	86%	0.856	76%	0.763	S	S	*	*			cis	-153.1	176.1	11.9	-168.4	7.2	0	0	0	110.6
203	E	33	Very low	28.6	Very low	175 Å²	175	143.7 Å²	143.7	82%	0.818	76%	0.759	S	S	*	*			trans	-84.7	139	-163.5	-80	-101.2	135.2	0	0	119.2
204	G	28.4	Very low	28.8	Very low	69 Å²	69	144 Å²	144	71%	0.711	75%	0.753	S	S	*	*			trans	93.5	162	136.6	0	0	0	0	0	120.8
205	M	27.1	Very low	28.9	Very low	149 Å²	149	147.1 Å²	147.1	73%	0.734	76%	0.758	S	S	*	*			cis	-170.1	101	-13.7	-165.6	66.5	163.4	0	0	112.7
206	W	26.1	Very low	29	Very low	223 Å²	223	145.9 Å²	145.9	85%	0.845	76%	0.759	S	S	*	*			trans	64.3	169.1	162.3	-61.8	55	0	0	0	117.9
207	D	24.5	Very low	29	Very low	123 Å²	123	144.4 Å²	144.4	66%	0.658	76%	0.756	S	S	*	*			cis	-171.6	160.8	-39	176.7	51.7	0	0	0	109.8
208	S	26.6	Very low	28.9	Very low	108 Å²	108	144.6 Å²	144.6	76%	0.755	76%	0.757	S	S	*	*			trans	62.9	155.3	170.2	-67.6	0	0	0	0	116.8
209	G	26.9	Very low	29	Very low	70 Å²	70	142.1 Å²	142.1	72%	0.722	76%	0.756	S	S	*	*			cis	-178.9	173.6	-3	0	0	0	0	0	107.4
210	E	26.8	Very low	29	Very low	202 Å²	202	141.7 Å²	141.7	94%	0.944	76%	0.759	S	S	*	*			cis	-145.1	-148.9	0.8	-62.9	-176.5	76.2	0	0	109
211	E	29.4	Very low	28.7	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	77%	0.765	S	S	*	*			trans	-129.9	177.3	-175.1	-59	-170.2	137.9	0	0	115.8
212	N	29.3	Very low	28.5	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	76%	0.76	S	S	*	*			trans	86.7	162.7	141.8	-87.7	-41.9	0	0	0	120.9
213	P	55.4	Low	28.4	Very low	100 Å²	100	140.1 Å²	140.1	65%	0.649	76%	0.759	S	S	*	*			trans	-142.3	-145.7	-141.2	36.3	-9	0	0	0	114.1
214	K	27.3	Very low	28.2	Very low	169 Å²	169	140.2 Å²	140.2	74%	0.735	76%	0.762	S	S	*	*			trans	83.2	132.2	155.8	-79.5	169.8	167.1	-177.4	0	121.5
215	Q	25.4	Very low	28.3	Very low	159 Å²	159	144.8 Å²	144.8	74%	0.743	76%	0.764	S	S	*	*			trans	61.3	112.4	131.5	-63.5	176.4	-86.2	0	0	122.8
216	S	25.3	Very low	28.7	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	77%	0.765	S	S	*	*				79.4	153	110.9	-154.7	0	0	0	0	122.9
217	L	26.2	Very low	28.7	Very low	140 Å²	140	141.3 Å²	141.3	73%	0.733	77%	0.766	S	S	*	*			trans	85.6	146	155.9	-81.1	155.8	0	0	0	121.9
218	E	25.3	Very low	28.8	Very low	165 Å²	165	140.6 Å²	140.6	77%	0.771	78%	0.777	S	S	*	*			trans	65.9	153.2	153.9	-73	161.9	-149.3	0	0	119.6
219	S	25.8	Very low	28.8	Very low	94 Å²	94	143.1 Å²	143.1	66%	0.657	78%	0.782	S	S	*	*			cis	-168.1	170.6	-29	-109.5	0	0	0	0	111.6
220	D	26.9	Very low	28.9	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	78%	0.776	S	S	*	*			trans	58.1	104.5	151.9	-57.4	-16.4	0	0	0	123.5
221	D	25.7	Very low	29	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	77%	0.768	S	S	*	*				71	173.6	117.9	-144.8	0.1	0	0	0	122.3
222	A	27.8	Very low	29	Very low	90 Å²	90	143.1 Å²	143.1	74%	0.744	76%	0.764	S	S	*	*			trans	81.8	95.8	172.8	0	0	0	0	0	119.4
223	F	28.2	Very low	28.9	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.833	76%	0.755	S	S	*	*			trans	-42.1	146.8	161.1	-83.4	-115.1	0	0	0	116.2
224	M	27.8	Very low	27.6	Very low	178 Å²	178	144.6 Å²	144.6	88%	0.877	76%	0.758	S	S	*	*				-167.1	139.1	109.7	-98.4	-59.1	169.9	0	0	112.3
225	Q	29.7	Very low	27.7	Very low	164 Å²	164	143.1 Å²	143.1	77%	0.766	76%	0.758	S	S	*	*			trans	-96	175.2	163.1	-64.5	-169.9	-8.7	0	0	110.1
226	P	37.3	Very low	28.1	Very low	116 Å²	116	142 Å²	142	75%	0.753	76%	0.757	S	S	*	*				-146.3	159.4	92.4	39	-23.4	0	0	0	116.4
227	E	25.4	Very low	28.4	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	75%	0.752	S	S	*	*			trans	61.3	102.5	154.1	-59.5	-82	123.2	0	0	118.9
228	A	26.5	Very low	28.7	Very low	108 Å²	108	143.6 Å²	143.6	89%	0.893	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-99.2	116.4	166	0	0	0	0	0	111.3
229	N	26.5	Very low	29.2	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-97.4	157.4	177.4	-156	-9.7	0	0	0	111.8
230	S	29.6	Very low	30.2	Very low	85 Å²	85	147.5 Å²	147.5	59%	0.594	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-95.5	158.5	-160.1	68.3	0	0	0	0	116.2
231	R	28.6	Very low	31.1	Very low	208 Å²	208	146.7 Å²	146.7	79%	0.785	76%	0.759	S	S	*	*			trans	98.9	135.2	153.8	-65.5	178.3	-177.6	-172.9	-0.1	119.7
232	Q	28.8	Very low	31.7	Very low	150 Å²	150	145.2 Å²	145.2	70%	0.701	75%	0.749	S	S	*	*			trans	69.4	155	143.7	-71.6	174.1	-89.2	0	0	118
233	Q	27.3	Very low	32.2	Very low	117 Å²	117	149.8 Å²	149.8	55%	0.547	75%	0.753	S	S	.	*			cis	-171.6	141.4	-22.4	170.7	167.3	1.5	0	0	108.6
234	E	27.9	Very low	33.1	Very low	150 Å²	150	147 Å²	147	70%	0.701	75%	0.753	S	S	*	*			trans	65.6	151.4	159.2	-81.1	147.2	-154.3	0	0	121.9
235	D	30.6	Very low	33	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	74%	0.74	S	S	*	*			trans	76	86.4	145.5	-62.7	6.1	0	0	0	125.2
236	D	33.6	Very low	33	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	75%	0.749	S	S	*	*				83.9	139.2	97.4	-116.7	-1.2	0	0	0	125.3
237	L	30.5	Very low	32.6	Very low	120 Å²	120	140.3 Å²	140.3	63%	0.628	75%	0.75	S	S	*	*			trans	101.4	134	139.6	-70.7	168.2	0	0	0	126
238	H	32.2	Very low	33.1	Very low	157 Å²	157	135 Å²	135	73%	0.727	75%	0.745	S	S	*	*			trans	67.7	129.3	156.7	-60.1	-48.7	0	0	0	119.9
239	D	35.8	Very low	33.9	Very low	140 Å²	140	139 Å²	139	75%	0.749	75%	0.745	S	S	*	*			cis	108.1	154.5	21	-166.7	33.9	0	0	0	114.2
240	R	47.4	Very low	35	Very low	200 Å²	200	141.3 Å²	141.3	76%	0.755	75%	0.747	S	S	*	*			trans	-80.1	155.9	-156.4	-57.9	163.2	171.8	-178.1	-3.2	115.6
241	P	45.4	Very low	36.6	Very low	131 Å²	131	140.9 Å²	140.9	85%	0.851	74%	0.735	S	S	*	*			trans	-81.3	138.3	155.4	33.7	-31.7	0	0	0	112.3
242	I	38.3	Very low	38.5	Very low	127 Å²	127	135.2 Å²	135.2	65%	0.651	72%	0.723	S	S	*	*			trans	-150.4	154.5	171.5	-47.1	172.7	0	0	0	106.3
243	K	38	Very low	39.3	Very low	187 Å²	187	136.4 Å²	136.4	81%	0.813	73%	0.726	S	S	*	*			trans	141.1	168.3	148	-77.5	150.2	-158.3	162.4	0	112
244	P	48.1	Very low	41.1	Very low	130 Å²	130	137.8 Å²	137.8	84%	0.844	73%	0.733	S	S	*	*			cis	-119.6	170.7	-1.6	18.1	6	0	0	0	114.5
245	G	25.7	Very low	43.2	Very low	59 Å²	59	134.6 Å²	134.6	61%	0.608	72%	0.718	S	S	*	*			cis	157.6	-162.7	-3.9	0	0	0	0	0	113.3
246	I	30	Very low	45.5	Very low	183 Å²	183	132.3 Å²	132.3	94%	0.938	71%	0.705	S	S	*	*			trans	66.9	122.1	174.3	-50.5	172.7	0	0	0	114.5
247	G	29.4	Very low	47.3	Very low	77 Å²	77	130.3 Å²	130.3	79%	0.794	69%	0.694	S	S	*	*			cis	171.7	115	-5.7	0	0	0	0	0	111.3
248	G	34.5	Very low	49.4	Very low	71 Å²	71	131.2 Å²	131.2	73%	0.732	70%	0.695	S	S	*	*			trans	-178.7	142.9	-179.7	0	0	0	0	0	110.3
249	Q	44.6	Very low	51.5	Low	193 Å²	193	127.2 Å²	127.2	90%	0.902	68%	0.677	S	S	*	*			trans	-72.2	137.6	-172	-69.1	177.9	-25.1	0	0	111.5
250	K	48.8	Very low	53.1	Low	209 Å²	209	126.6 Å²	126.6	91%	0.909	67%	0.669	S	S	*	*			trans	-100.9	115.9	172.6	-69.9	-172.8	177.4	-173.8	0	109.2
251	K	63.2	Low	54.1	Low	76 Å²	76	122.2 Å²	122.2	33%	0.33	66%	0.66	S	S	.	*			trans	-83.5	155.2	167.4	-64.1	-167.8	167.4	-172.7	0	110.4	E255 L256 E259	K251-E255 WeakPolarHBondContact CA-OE2 3.4Å; K251-E255 HydrophobicContact CB-CB 4.22Å; K251-E255 HydrophobicContact CB-CG 4.18Å; K251-E255 VanDerWaalsContact CB-OE2 3.25Å; K251-E255 WeakPolarHBondContact CB-OE2 3.3Å; K251-E255 HydrophobicContact CD-CG 4.07Å; K251-E255 VanDerWaalsContact CD-OE1 3.29Å; K251-E255 WeakPolarHBondContact CD-OE1 3.46Å; K251-E255 VanDerWaalsContact CE-OE1 3.24Å; K251-E255 WeakPolarHBondContact CE-OE1 3.37Å; K251-E255 VanDerWaalsContact CG-CD 3.48Å; K251-E255 HydrophobicContact CG-CG 4.33Å; K251-E255 WeakPolarHBondContact CG-OE1 3.47Å; K251-E255 WeakPolarHBondContact CG-OE2 3.48Å; K251-E255 IonicContact NZ-OE1 3.16Å; K251-L256 HydrophobicContact CB-CG 4.27Å; K251-E259 WeakPolarHBondContact CD-OE2 3.39Å; K251-E259 IonicContact NZ-OE1 2.73Å; K251-E259 PolarHBondContact NZ-OE1 2.85Å; K251-E259 IonicContact NZ-OE2 2.67Å; K251-E259 PolarHBondContact NZ-OE2 3.49Å
252	T	68.9	Low	55.6	Low	88 Å²	88	124.6 Å²	124.6	54%	0.54	65%	0.652	S	S	.	*			trans	-73.1	164.9	171.7	69.1	0	0	0	0	110.7	E254 E255 L256	T252-E254 PolarHBondContact O-N 2.77Å; T252-E255 PolarHBondContact N-OE2 3.43Å; T252-E255 PolarHBondContact O-N 3.01Å; T252-E255 WeakPolarHBondContact OG1-CB 3.34Å; T252-E255 PolarHBondContact OG1-N 2.8Å; T252-E255 VanDerWaalsContact OG1-N 3.09Å; T252-L256 WeakPolarHBondContact O-CB 3.49Å; T252-L256 PolarHBondContact O-N 3.06Å
253	F	45.7	Very low	57.3	Low	175 Å²	175	123 Å²	123	77%	0.768	64%	0.644	S	S	*	*	H	α-helix	trans	-60.8	-36.8	175.8	176.5	-100.9	0	0	0	112	L256 L257	F253-L256 PolarHBondContact O-N 3.06Å; F253-L257 PolarHBondContact O-N 2.91Å
254	E	65.1	Low	58.7	Low	147 Å²	147	120 Å²	120	69%	0.687	63%	0.634	S	S	*	*	H	α-helix	trans	-70.3	-43.1	177.2	-167.5	162.8	-148.4	0	0	111.7	T252 L256 L257 E258	T252-E254 PolarHBondContact O-N 2.77Å; E254-L256 VanDerWaalsContact C-N 3.31Å; E254-L256 PolarHBondContact O-N 3.26Å; E254-L257 WeakPolarHBondContact O-CB 3.41Å; E254-L257 PolarHBondContact O-N 3.34Å; E254-L257 VanDerWaalsContact O-N 3.09Å; E254-E258 PolarHBondContact O-N 2.96Å
255	E	72.3	Confident	60	Low	82 Å²	82	118.5 Å²	118.5	38%	0.383	62%	0.615	S	S	.	*	H	α-helix	trans	-64.2	-34.6	173.5	-170.4	-166.2	167.7	0	0	112.1	K251 T252 E259	K251-E255 WeakPolarHBondContact CA-OE2 3.4Å; K251-E255 HydrophobicContact CB-CB 4.22Å; K251-E255 HydrophobicContact CB-CG 4.18Å; K251-E255 VanDerWaalsContact CB-OE2 3.25Å; K251-E255 WeakPolarHBondContact CB-OE2 3.3Å; K251-E255 HydrophobicContact CD-CG 4.07Å; K251-E255 VanDerWaalsContact CD-OE1 3.29Å; K251-E255 WeakPolarHBondContact CD-OE1 3.46Å; K251-E255 VanDerWaalsContact CE-OE1 3.24Å; K251-E255 WeakPolarHBondContact CE-OE1 3.37Å; K251-E255 VanDerWaalsContact CG-CD 3.48Å; K251-E255 HydrophobicContact CG-CG 4.33Å; K251-E255 WeakPolarHBondContact CG-OE1 3.47Å; K251-E255 WeakPolarHBondContact CG-OE2 3.48Å; K251-E255 IonicContact NZ-OE1 3.16Å; T252-E255 PolarHBondContact N-OE2 3.43Å; T252-E255 PolarHBondContact O-N 3.01Å; T252-E255 WeakPolarHBondContact OG1-CB 3.34Å; T252-E255 PolarHBondContact OG1-N 2.8Å; T252-E255 VanDerWaalsContact OG1-N 3.09Å; E255-E259 VanDerWaalsContact O-CB 3.31Å; E255-E259 WeakPolarHBondContact O-CB 3.46Å; E255-E259 PolarHBondContact O-N 2.84Å
256	L	78.8	Confident	61.8	Low	91 Å²	91	121 Å²	121	48%	0.476	61%	0.611	S	S	.	*	H	α-helix	trans	-67.3	-35.6	171.2	-99.9	165.1	0	0	0	112.5	K251 T252 F253 E254 Q260	K251-L256 HydrophobicContact CB-CG 4.27Å; T252-L256 WeakPolarHBondContact O-CB 3.49Å; T252-L256 PolarHBondContact O-N 3.06Å; F253-L256 PolarHBondContact O-N 3.06Å; E254-L256 VanDerWaalsContact C-N 3.31Å; E254-L256 PolarHBondContact O-N 3.26Å; L256-Q260 WeakPolarHBondContact O-CB 3.43Å; L256-Q260 PolarHBondContact O-N 3.46Å
257	L	71.8	Confident	63.5	Low	94 Å²	94	121.3 Å²	121.3	49%	0.492	60%	0.6	S	S	.	*	H	α-helix	trans	-70.3	-41.9	176.4	-174.2	63	0	0	0	111.3	F253 E254 Q260 L261	F253-L257 PolarHBondContact O-N 2.91Å; E254-L257 WeakPolarHBondContact O-CB 3.41Å; E254-L257 PolarHBondContact O-N 3.34Å; E254-L257 VanDerWaalsContact O-N 3.09Å; L257-Q260 PolarHBondContact O-N 3.22Å; L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 PolarHBondContact O-N 2.97Å
258	E	73.6	Confident	64.6	Low	138 Å²	138	123.2 Å²	123.2	65%	0.645	59%	0.592	S	S	*	*	H	α-helix	trans	-64.9	-40.2	171.7	-71.5	-158.6	131.9	0	0	112.3	E254 L261 R262	E254-E258 PolarHBondContact O-N 2.96Å; E258-L261 PolarHBondContact O-N 3.47Å; E258-R262 WeakPolarHBondContact O-CB 3.16Å; E258-R262 PolarHBondContact O-N 2.87Å
259	E	75.3	Confident	65.6	Low	73 Å²	73	124.9 Å²	124.9	34%	0.341	58%	0.579	S	S	.	*	H	α-helix	trans	-63.5	-41.1	174	179.5	157.7	-118.2	0	0	111.7	K251 E255 R262 L263	K251-E259 WeakPolarHBondContact CD-OE2 3.39Å; K251-E259 IonicContact NZ-OE1 2.73Å; K251-E259 PolarHBondContact NZ-OE1 2.85Å; K251-E259 IonicContact NZ-OE2 2.67Å; K251-E259 PolarHBondContact NZ-OE2 3.49Å; E255-E259 VanDerWaalsContact O-CB 3.31Å; E255-E259 WeakPolarHBondContact O-CB 3.46Å; E255-E259 PolarHBondContact O-N 2.84Å; E259-R262 PolarHBondContact O-N 2.81Å; E259-L263 HydrophobicContact CG-CD1 3.91Å; E259-L263 HydrophobicContact CG-CG 4.33Å; E259-L263 WeakPolarHBondContact O-CB 3.35Å; E259-L263 VanDerWaalsContact O-CG 3.25Å; E259-L263 WeakPolarHBondContact O-CG 3.36Å; E259-L263 PolarHBondContact O-N 3.47Å
260	Q	70.4	Confident	65.6	Low	127 Å²	127	119.5 Å²	119.5	59%	0.593	56%	0.563	S	S	*	*	H	α-helix	trans	-62.6	-47.4	176.1	-164.4	81.4	-28.1	0	0	111.5	L256 L257 R262 L263 E264	L256-Q260 WeakPolarHBondContact O-CB 3.43Å; L256-Q260 PolarHBondContact O-N 3.46Å; L257-Q260 PolarHBondContact O-N 3.22Å; Q260-R262 PolarHBondContact O-N 2.85Å; Q260-L263 PolarHBondContact O-N 3.41Å; Q260-E264 PolarHBondContact O-N 2.84Å
261	L	69.2	Low	65.5	Low	108 Å²	108	113.7 Å²	113.7	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-60.7	-43.1	175.1	-83.7	163.4	0	0	0	112.1	L257 E258 E264 E265	L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 PolarHBondContact O-N 2.97Å; E258-L261 PolarHBondContact O-N 3.47Å; L261-E264 PolarHBondContact O-N 3.38Å; L261-E265 WeakPolarHBondContact O-CB 3.3Å; L261-E265 PolarHBondContact O-N 2.89Å
262	R	76.4	Confident	64.8	Low	181 Å²	181	117.9 Å²	117.9	68%	0.683	57%	0.574	S	S	*	*	H	α-helix	trans	-67.4	-37.5	177.8	177.2	177.4	159	165.6	-5.6	112.4	E258 E259 Q260 E264 E265 Q266	E258-R262 WeakPolarHBondContact O-CB 3.16Å; E258-R262 PolarHBondContact O-N 2.87Å; E259-R262 PolarHBondContact O-N 2.81Å; Q260-R262 PolarHBondContact O-N 2.85Å; R262-E264 VanDerWaalsContact C-N 3.35Å; R262-E265 PolarHBondContact O-N 3.2Å; R262-Q266 VanDerWaalsContact O-CB 3.25Å; R262-Q266 WeakPolarHBondContact O-CB 3.26Å; R262-Q266 PolarHBondContact O-N 3.34Å
263	L	73.1	Confident	63.7	Low	93 Å²	93	120.9 Å²	120.9	49%	0.487	58%	0.582	S	S	.	*	H	α-helix	trans	-66.6	-37.2	173.5	-76.6	169.1	0	0	0	111.4	E259 Q260 R267	E259-L263 HydrophobicContact CG-CD1 3.91Å; E259-L263 HydrophobicContact CG-CG 4.33Å; E259-L263 WeakPolarHBondContact O-CB 3.35Å; E259-L263 VanDerWaalsContact O-CG 3.25Å; E259-L263 WeakPolarHBondContact O-CG 3.36Å; E259-L263 PolarHBondContact O-N 3.47Å; Q260-L263 PolarHBondContact O-N 3.41Å; L263-R267 VanDerWaalsContact O-CB 3.27Å; L263-R267 WeakPolarHBondContact O-CB 3.48Å; L263-R267 PolarHBondContact O-N 2.88Å
264	E	68.1	Low	63	Low	126 Å²	126	121.1 Å²	121.1	59%	0.589	59%	0.586	S	S	*	*	H	α-helix	trans	-69.2	-41.5	174.4	-170.7	158.2	-119.9	0	0	112.1	Q260 L261 R262 Q266 R267 L268	Q260-E264 PolarHBondContact O-N 2.84Å; L261-E264 PolarHBondContact O-N 3.38Å; R262-E264 VanDerWaalsContact C-N 3.35Å; E264-Q266 PolarHBondContact O-N 3.29Å; E264-R267 WeakPolarHBondContact O-CB 3.23Å; E264-R267 PolarHBondContact O-N 3.2Å; E264-L268 WeakPolarHBondContact O-CG 3.39Å; E264-L268 PolarHBondContact O-N 2.8Å
265	E	74.9	Confident	61.6	Low	98 Å²	98	119.5 Å²	119.5	46%	0.458	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-39	173.3	-157.5	-140	-173.9	0	0	112	L261 R262 L268 K269	L261-E265 WeakPolarHBondContact O-CB 3.3Å; L261-E265 PolarHBondContact O-N 2.89Å; R262-E265 PolarHBondContact O-N 3.2Å; E265-L268 PolarHBondContact O-N 3.21Å; E265-K269 VanDerWaalsContact CD-CE 3.44Å; E265-K269 WeakPolarHBondContact O-CG 3.29Å; E265-K269 PolarHBondContact O-N 3.47Å; E265-K269 WeakPolarHBondContact OE1-CE 3.28Å; E265-K269 IonicContact OE1-NZ 2.66Å; E265-K269 PolarHBondContact OE1-NZ 3.49Å; E265-K269 IonicContact OE2-NZ 2.76Å; E265-K269 PolarHBondContact OE2-NZ 2.8Å
266	Q	64.3	Low	59.8	Low	112 Å²	112	125.1 Å²	125.1	52%	0.523	61%	0.611	S	S	.	*	H	α-helix	trans	-67.5	-35.6	173.6	-171.4	170.1	2.5	0	0	111.8	R262 E264 K269 S270	R262-Q266 VanDerWaalsContact O-CB 3.25Å; R262-Q266 WeakPolarHBondContact O-CB 3.26Å; R262-Q266 PolarHBondContact O-N 3.34Å; E264-Q266 PolarHBondContact O-N 3.29Å; Q266-K269 PolarHBondContact O-N 3.11Å; Q266-S270 WeakPolarHBondContact O-CB 3.31Å; Q266-S270 PolarHBondContact O-N 3.44Å
267	R	64.1	Low	57.6	Low	188 Å²	188	126.6 Å²	126.6	71%	0.709	63%	0.626	S	S	*	*	H	α-helix	trans	-65.7	-43.1	173.3	-171	173.9	-179.2	170.4	-1.6	111.3	L263 E264 S270 A271	L263-R267 VanDerWaalsContact O-CB 3.27Å; L263-R267 WeakPolarHBondContact O-CB 3.48Å; L263-R267 PolarHBondContact O-N 2.88Å; E264-R267 WeakPolarHBondContact O-CB 3.23Å; E264-R267 PolarHBondContact O-N 3.2Å; R267-S270 PolarHBondContact O-N 3.39Å; R267-S270 PolarHBondContact O-OG 3.41Å; R267-A271 PolarHBondContact O-N 2.83Å
268	L	52.4	Low	55.5	Low	118 Å²	118	126.8 Å²	126.8	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-59.9	-45.9	172.4	-76.3	163.8	0	0	0	111.8	E264 E265 S270 A271 Q272	E264-L268 WeakPolarHBondContact O-CG 3.39Å; E264-L268 PolarHBondContact O-N 2.8Å; E265-L268 PolarHBondContact O-N 3.21Å; L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 2.83Å; L268-A271 PolarHBondContact O-N 3.21Å; L268-Q272 PolarHBondContact O-N 3.23Å
269	K	55.7	Low	53.4	Low	106 Å²	106	125.7 Å²	125.7	46%	0.461	65%	0.649	S	S	.	*	H	α-helix	trans	-61.4	-37.6	174.4	-73.2	166.9	-178.9	169.8	0	112.5	E265 Q266 Q272	E265-K269 VanDerWaalsContact CD-CE 3.44Å; E265-K269 WeakPolarHBondContact O-CG 3.29Å; E265-K269 PolarHBondContact O-N 3.47Å; E265-K269 WeakPolarHBondContact OE1-CE 3.28Å; E265-K269 IonicContact OE1-NZ 2.66Å; E265-K269 PolarHBondContact OE1-NZ 3.49Å; E265-K269 IonicContact OE2-NZ 2.76Å; E265-K269 PolarHBondContact OE2-NZ 2.8Å; Q266-K269 PolarHBondContact O-N 3.11Å; K269-Q272 WeakPolarHBondContact O-CB 3.5Å; K269-Q272 PolarHBondContact O-N 3.28Å
270	S	44.6	Very low	51.8	Low	80 Å²	80	127.3 Å²	127.3	56%	0.559	67%	0.666	S	S	*	*	H	α-helix	trans	-68.7	-37	175.4	78	0	0	0	0	113.1	Q266 R267 L268 Q272 Q273	Q266-S270 WeakPolarHBondContact O-CB 3.31Å; Q266-S270 PolarHBondContact O-N 3.44Å; R267-S270 PolarHBondContact O-N 3.39Å; R267-S270 PolarHBondContact O-OG 3.41Å; L268-S270 VanDerWaalsContact C-N 3.33Å; L268-S270 PolarHBondContact O-N 2.83Å; S270-Q272 PolarHBondContact O-N 3.27Å; S270-Q272 VanDerWaalsContact O-N 3.17Å; S270-Q273 PolarHBondContact O-N 2.77Å
271	A	48.3	Very low	49.8	Very low	87 Å²	87	129.4 Å²	129.4	72%	0.719	68%	0.676	S	S	*	*	H	α-helix	trans	-66.6	-13.8	174.5	0	0	0	0	0	113.1	R267 L268	R267-A271 PolarHBondContact O-N 2.83Å; L268-A271 PolarHBondContact O-N 3.21Å
272	Q	46.9	Very low	47.9	Very low	164 Å²	164	128 Å²	128	77%	0.766	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	0.4	178.2	-148.6	170.6	20.6	0	0	113.7	L268 K269 S270	L268-Q272 PolarHBondContact O-N 3.23Å; K269-Q272 WeakPolarHBondContact O-CB 3.5Å; K269-Q272 PolarHBondContact O-N 3.28Å; S270-Q272 PolarHBondContact O-N 3.27Å; S270-Q272 VanDerWaalsContact O-N 3.17Å
273	Q	46.4	Very low	45.6	Very low	151 Å²	151	124.1 Å²	124.1	71%	0.706	69%	0.686	S	S	*	*			trans	-132.3	63.8	-174.7	-64.4	-165.9	7.1	0	0	115.2	S270	S270-Q273 PolarHBondContact O-N 2.77Å
274	Q	31.5	Very low	43.4	Very low	180 Å²	180	129.5 Å²	129.5	84%	0.841	71%	0.706	S	S	*	*	S	Bend	trans	-146.3	155	145.8	-82.3	-48.4	-67	0	0	109.7
275	P	36.4	Very low	42.8	Very low	113 Å²	113	128.8 Å²	128.8	73%	0.734	71%	0.712	S	S	*	*			trans	-99.4	158.4	-143.8	-2.8	23.8	0	0	0	115.2
276	K	32.7	Very low	41	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	73%	0.731	S	S	*	*			trans	-139.3	102.4	174.4	-170.8	179.4	-174.9	178.9	0	111.8
277	P	33.9	Very low	39.8	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	75%	0.747	S	S	*	*			trans	-81.3	141.1	164.6	32.7	-31.2	0	0	0	110.1
278	A	27.4	Very low	39	Very low	98 Å²	98	136.7 Å²	136.7	81%	0.81	76%	0.756	S	S	*	*			cis	-149.4	167.7	-10.3	0	0	0	0	0	110.2
279	S	29.4	Very low	38.5	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	76%	0.763	S	S	*	*			trans	-87	175.2	169	-114.6	0	0	0	0	111.1
280	P	42.3	Very low	37.8	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	78%	0.776	S	S	*	*			cis	-129.9	-159.4	18.6	45	-26.6	0	0	0	112.9
281	E	28	Very low	37.5	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	78%	0.784	S	S	*	*			cis	-158.2	170.7	2.5	-148.2	-177.1	108.9	0	0	112.3
282	A	29.2	Very low	37.6	Very low	78 Å²	78	146.1 Å²	146.1	65%	0.645	78%	0.784	S	S	*	*			trans	67.7	140.6	140.1	0	0	0	0	0	124.6
283	A	27.7	Very low	37.4	Very low	100 Å²	100	150.9 Å²	150.9	83%	0.826	80%	0.795	S	S	*	*			trans	83.5	140.6	147.7	0	0	0	0	0	122.2
284	F	27.4	Very low	37.7	Very low	205 Å²	205	146.6 Å²	146.6	90%	0.899	79%	0.791	S	S	*	*			trans	-98.8	-162.3	172	-65	-97.8	0	0	0	110.8
285	P	54.6	Low	38.3	Very low	112 Å²	112	143.9 Å²	143.9	73%	0.727	78%	0.778	S	S	*	*				-111.8	-169.5	-90.6	39.8	-23.2	0	0	0	111.7
286	P	39	Very low	38.7	Very low	130 Å²	130	141.7 Å²	141.7	84%	0.844	78%	0.776	S	S	*	*				-153.3	-179.9	93.8	38.8	-19.3	0	0	0	115.9
287	K	37.7	Very low	39.5	Very low	200 Å²	200	139.5 Å²	139.5	87%	0.87	77%	0.773	S	S	*	*			trans	-104.3	136.1	178.2	-67.7	178	178.5	176.3	0	113
288	R	47.2	Very low	40	Very low	234 Å²	234	138.6 Å²	138.6	88%	0.883	77%	0.77	S	S	*	*			trans	57.6	146.7	153.4	-68.2	-179.1	170.8	172.4	-3.6	118.8
289	P	43.4	Very low	40.9	Very low	119 Å²	119	144.4 Å²	144.4	77%	0.773	77%	0.771	S	S	*	*				-122.6	165	113.8	36.2	-34.5	0	0	0	114
290	F	39.8	Very low	41.5	Very low	165 Å²	165	147.9 Å²	147.9	72%	0.724	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-92.1	148.2	-176.2	28.9	-96	0	0	0	111.6
291	L	38.2	Very low	41.1	Very low	142 Å²	142	148.7 Å²	148.7	74%	0.743	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-84	141.6	173.5	-149.8	74	0	0	0	110.7	Q295	L291-Q295 HydrophobicContact CD2-CB 3.97Å; L291-Q295 HydrophobicContact CG-CB 4.3Å
292	K	51.1	Low	41.3	Very low	162 Å²	162	145.4 Å²	145.4	70%	0.704	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-90.1	153.5	-172.3	-75.7	-176.1	177.8	178.4	0	113.6	G294 Q295	K292-G294 PolarHBondContact O-N 3.48Å; K292-Q295 PolarHBondContact O-N 3.31Å
293	R	42.8	Very low	41.2	Very low	264 Å²	264	146.6 Å²	146.6	100%	0.996	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.1	117.9	174	-156.7	178.2	-153.9	150.7	5.2	110.6
294	G	51.7	Low	41.3	Very low	62 Å²	62	146.6 Å²	146.6	64%	0.639	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.3	-16.4	176.5	0	0	0	0	0	116.6	K292 G296	K292-G294 PolarHBondContact O-N 3.48Å; G294-G296 VanDerWaalsContact C-N 3.28Å; G294-G296 PolarHBondContact O-N 3.2Å
295	Q	45.3	Very low	41.4	Very low	122 Å²	122	146.2 Å²	146.2	57%	0.57	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-78.7	4.6	-176.8	-90.5	178.9	-41.5	0	0	116.2	L291 K292 L297	L291-Q295 HydrophobicContact CD2-CB 3.97Å; L291-Q295 HydrophobicContact CG-CB 4.3Å; K292-Q295 PolarHBondContact O-N 3.31Å; Q295-L297 VanDerWaalsContact C-N 3.25Å; Q295-L297 PolarHBondContact O-N 3.07Å
296	G	44.9	Very low	40.2	Very low	67 Å²	67	145.4 Å²	145.4	69%	0.691	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-72.9	-7.4	179	0	0	0	0	0	115.9	G294	G294-G296 VanDerWaalsContact C-N 3.28Å; G294-G296 PolarHBondContact O-N 3.2Å
297	L	48.2	Very low	39.6	Very low	154 Å²	154	144.3 Å²	144.3	81%	0.806	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-96.1	-7.7	-168.4	-78.9	161.8	0	0	0	115.6	Q295 R299	Q295-L297 VanDerWaalsContact C-N 3.25Å; Q295-L297 PolarHBondContact O-N 3.07Å; L297-R299 VanDerWaalsContact C-N 3.31Å; L297-R299 PolarHBondContact O-N 3.31Å
298	S	44.6	Very low	39.2	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	10.2	-179.4	69.9	0	0	0	0	114.8
299	R	46.8	Very low	38.3	Very low	220 Å²	220	137.2 Å²	137.2	83%	0.83	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-6.1	178.3	-79.5	-170.6	164.8	-136.4	-4	114.7	L297	L297-R299 VanDerWaalsContact C-N 3.31Å; L297-R299 PolarHBondContact O-N 3.31Å
300	F	42.2	Very low	37.5	Very low	188 Å²	188	140.8 Å²	140.8	83%	0.825	76%	0.763	S	S	*	*	S	Bend	trans	-129.7	61	-176.6	-63.6	-74.3	0	0	0	112.9
301	T	33.2	Very low	37	Very low	124 Å²	124	137.5 Å²	137.5	76%	0.761	77%	0.766	S	S	*	*			trans	-166.7	153.6	157.5	2.7	0	0	0	0	113.8
302	S	32.1	Very low	36.4	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	77%	0.769	S	S	*	*			trans	59.2	85.4	161.1	52.8	0	0	0	0	120.8
303	S	27.6	Very low	35.4	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	78%	0.778	S	S	*	*				59.4	107.2	116	65.5	0	0	0	0	123.2
304	S	29.7	Very low	34.7	Very low	100 Å²	100	136 Å²	136	70%	0.699	77%	0.769	S	S	*	*				86.4	144.7	117.6	80.7	0	0	0	0	123
305	K	30	Very low	33.6	Very low	197 Å²	197	139.8 Å²	139.8	86%	0.857	77%	0.767	S	S	*	*			trans	80.1	143.4	158.8	-67.5	-174.3	174.8	-175.8	0	120.2
306	A	28.5	Very low	32.7	Very low	95 Å²	95	139.8 Å²	139.8	79%	0.785	77%	0.768	S	S	*	*			trans	72.4	145.1	155.4	0	0	0	0	0	118.4
307	S	27	Very low	32	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	76%	0.763	S	S	*	*			cis	-170.4	153.2	-17.5	51.6	0	0	0	0	112.7
308	A	29.1	Very low	31.1	Very low	85 Å²	85	143.8 Å²	143.8	70%	0.702	76%	0.761	S	S	*	*			trans	59.6	107.5	146.2	0	0	0	0	0	119.7
309	Q	27.4	Very low	31.3	Very low	199 Å²	199	143.1 Å²	143.1	93%	0.93	76%	0.755	S	S	*	*			trans	-64.2	150.9	137.2	-75.9	178.1	-31.7	0	0	110
310	K	26.9	Very low	30.3	Very low	195 Å²	195	141.6 Å²	141.6	85%	0.848	76%	0.757	S	S	*	*			trans	-119.1	112.1	171.2	-79.7	180	176.4	173.3	0	110.6
311	A	29	Very low	29.5	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	75%	0.749	S	S	*	*			trans	-97.2	123.3	137.1	0	0	0	0	0	105.1
312	K	27.1	Very low	29.3	Very low	187 Å²	187	137.6 Å²	137.6	81%	0.813	75%	0.749	S	S	*	*				45.8	96.2	56.6	-73.8	-171.8	176.8	178.6	0	111.2
313	D	29.2	Very low	29	Very low	166 Å²	166	137.9 Å²	137.9	89%	0.888	75%	0.747	S	S	*	*				-141.6	168.6	107.3	-112.8	-36.2	0	0	0	113.6
314	K	28.4	Very low	28.9	Very low	184 Å²	184	143.9 Å²	143.9	80%	0.8	75%	0.753	S	S	*	*			trans	-130.6	155.6	-177.9	-78.7	-176.7	172.5	-179.5	0	107
315	K	27.7	Very low	28.7	Very low	140 Å²	140	143.2 Å²	143.2	61%	0.609	75%	0.749	S	S	*	*			cis	-167.3	153.9	0	-121.9	-177.7	130.5	-142.8	0	107.1
316	E	27	Very low	28.5	Very low	123 Å²	123	140.9 Å²	140.9	58%	0.575	75%	0.746	S	S	*	*			trans	67.5	161	143.3	-68.4	178	139.2	0	0	118.9
317	Q	30.4	Very low	28.4	Very low	127 Å²	127	141.1 Å²	141.1	59%	0.593	74%	0.742	S	S	*	*			cis	-152.2	149.5	-8.2	-124.4	174.2	50.4	0	0	107.8
318	K	28.5	Very low	28.4	Very low	177 Å²	177	140.7 Å²	140.7	77%	0.77	75%	0.745	S	S	*	*				135.1	176.5	91.6	-120.2	177.4	177.1	169.3	0	107.9
319	P	48.5	Very low	29.2	Very low	90 Å²	90	141.9 Å²	141.9	58%	0.584	75%	0.745	S	S	*	*			cis	-130.8	174.8	-22.4	40.1	-25.5	0	0	0	114.2
320	Q	27.2	Very low	29.1	Very low	188 Å²	188	137.1 Å²	137.1	88%	0.879	73%	0.734	S	S	*	*			trans	64	160.7	153.9	-72	162.5	-10.2	0	0	119.1
321	A	25.6	Very low	29.1	Very low	79 Å²	79	132.3 Å²	132.3	65%	0.653	73%	0.725	S	S	*	*			cis	-168.4	-177.2	-34.8	0	0	0	0	0	110.3
322	I	28.6	Very low	29.1	Very low	148 Å²	148	135.1 Å²	135.1	76%	0.759	73%	0.725	S	S	*	*			trans	79.9	94.1	153.2	-64.6	162.4	0	0	0	119.3
323	T	25	Very low	29.2	Very low	110 Å²	110	133 Å²	133	68%	0.675	72%	0.722	S	S	*	*			trans	59.4	138.7	131.6	72.2	0	0	0	0	126
324	R	26.1	Very low	29.1	Very low	227 Å²	227	133.6 Å²	133.6	86%	0.857	72%	0.717	S	S	*	*				87.3	124	126.7	-88.3	171	179.6	177.5	-0.9	122.7
325	S	25.4	Very low	29	Very low	86 Å²	86	129.2 Å²	129.2	60%	0.601	71%	0.714	S	S	*	*				84.1	129.1	124.7	-69.5	0	0	0	0	122.5
326	N	25	Very low	28.9	Very low	148 Å²	148	127.2 Å²	127.2	79%	0.791	72%	0.718	S	S	*	*				62.2	150.4	129.9	-56.8	6.8	0	0	0	120.9
327	S	26.8	Very low	28.8	Very low	100 Å²	100	127.5 Å²	127.5	70%	0.699	73%	0.733	S	S	*	*			cis	178.3	127.8	-35.5	48.8	0	0	0	0	110.3
328	A	27.1	Very low	28.6	Very low	100 Å²	100	127 Å²	127	83%	0.826	74%	0.743	S	S	*	*			trans	63	-176.9	153.3	0	0	0	0	0	116.4
329	P	46.4	Very low	28.5	Very low	109 Å²	109	123.5 Å²	123.5	71%	0.708	75%	0.747	S	S	*	*			cis	-135.9	-171.1	-2.2	40.7	-21.3	0	0	0	116.5
330	S	25.7	Very low	27.4	Very low	100 Å²	100	122.5 Å²	122.5	70%	0.699	75%	0.753	S	S	*	*			trans	67.7	124.8	159.9	35.7	0	0	0	0	118.4
331	S	27.3	Very low	28.2	Very low	94 Å²	94	119.6 Å²	119.6	66%	0.657	75%	0.751	S	S	*	*			cis	87.5	101.4	43.2	78.9	0	0	0	0	113.4
332	I	28	Very low	29.1	Very low	155 Å²	155	120.8 Å²	120.8	80%	0.795	75%	0.751	S	S	*	*				84.7	154.2	90.2	-73.2	164.4	0	0	0	113.4
333	L	29.2	Very low	29.1	Very low	141 Å²	141	121.4 Å²	121.4	74%	0.738	76%	0.756	S	S	*	*			trans	89	140.4	-176.7	-49.1	-177.9	0	0	0	114.2
334	K	27.4	Very low	29.9	Very low	180 Å²	180	121.6 Å²	121.6	78%	0.783	76%	0.759	S	S	*	*			cis	-161.3	167	-3	-129.7	168	-178.4	174.4	0	112.4
335	A	25.3	Very low	29.9	Very low	91 Å²	91	116.3 Å²	116.3	75%	0.752	75%	0.751	S	S	*	*			trans	70.5	163.2	153.4	0	0	0	0	0	119.7
336	S	26	Very low	30.1	Very low	98 Å²	98	118.9 Å²	118.9	69%	0.685	75%	0.754	S	S	*	*				-178.5	132.4	-53.1	52.4	0	0	0	0	111.4
337	C	25.6	Very low	30.4	Very low	130 Å²	130	121.7 Å²	121.7	88%	0.878	75%	0.753	S	S	*	*			trans	59	162.5	162.6	-59.5	0	0	0	0	116.3
338	S	25.3	Very low	30.7	Very low	115 Å²	115	126 Å²	126	80%	0.804	76%	0.76	S	S	*	*			cis	-170	165.2	-21.4	51	0	0	0	0	106.6
339	A	26.9	Very low	31.1	Very low	105 Å²	105	127.7 Å²	127.7	87%	0.868	76%	0.759	S	S	*	*			cis	-145.6	-128.9	13	0	0	0	0	0	111
340	G	26.4	Very low	30.3	Very low	68 Å²	68	126.6 Å²	126.6	70%	0.701	76%	0.76	S	S	*	*			trans	-110.5	-155.4	171.6	0	0	0	0	0	112.9
341	P	43.6	Very low	30.6	Very low	128 Å²	128	128.1 Å²	128.1	83%	0.831	76%	0.764	S	S	*	*			cis	-134.9	-161.1	34.3	49.4	-31.2	0	0	0	113
342	P	43	Very low	30.9	Very low	103 Å²	103	130.3 Å²	130.3	67%	0.669	77%	0.768	S	S	*	*				-145.8	145.2	-105.5	37.7	-14.2	0	0	0	120.2
343	L	28.4	Very low	31	Very low	162 Å²	162	129.5 Å²	129.5	85%	0.848	77%	0.766	S	S	*	*			trans	58.4	-163.7	150.1	-58.9	174.2	0	0	0	115.5
344	P	42.2	Very low	31.6	Very low	114 Å²	114	131.8 Å²	131.8	74%	0.74	77%	0.769	S	S	*	*			cis	-109.1	156.1	-30.3	6.9	18.2	0	0	0	112.2
345	V	27.3	Very low	32.1	Very low	116 Å²	116	130.6 Å²	130.6	70%	0.703	77%	0.767	S	S	*	*				74.4	132.6	66.8	173.5	0	0	0	0	116
346	Q	29	Very low	32.3	Very low	140 Å²	140	133.8 Å²	133.8	65%	0.654	77%	0.771	S	S	*	*			trans	100.3	118.6	160.1	-85.9	175.3	81.1	0	0	123.7
347	R	30.9	Very low	32.7	Very low	206 Å²	206	140.5 Å²	140.5	78%	0.777	78%	0.781	S	S	*	*				63.8	115.1	128.6	-69.9	170.3	179.6	168.7	-11	123.8
348	K	34	Very low	33.2	Very low	192 Å²	192	138.2 Å²	138.2	84%	0.835	78%	0.779	S	S	*	*				65.1	153.5	128.6	-74	-168.3	173.3	-173	0	122
349	T	34.2	Very low	33.4	Very low	134 Å²	134	144.7 Å²	144.7	82%	0.822	79%	0.786	S	S	*	*			trans	73.2	109.2	155.3	32.7	0	0	0	0	121.5
350	A	30.3	Very low	33.7	Very low	86 Å²	86	143.2 Å²	143.2	71%	0.711	78%	0.781	S	S	*	*				79.7	114.2	124.4	0	0	0	0	0	123
351	V	33	Very low	34	Very low	132 Å²	132	147.9 Å²	147.9	80%	0.8	79%	0.789	S	S	*	*				83.7	144.5	124.1	171.4	0	0	0	0	120.7
352	L	31.8	Very low	33.3	Very low	141 Å²	141	152.8 Å²	152.8	74%	0.738	79%	0.791	S	S	*	*			trans	83.8	115.9	163.2	-84.2	164.3	0	0	0	122.7
353	N	31.1	Very low	32.8	Very low	138 Å²	138	153 Å²	153	74%	0.738	80%	0.795	S	S	*	*			trans	42.9	117.1	134.8	-70	1.4	0	0	0	124.5
354	K	41.8	Very low	34.4	Very low	188 Å²	188	150.6 Å²	150.6	82%	0.817	79%	0.789	S	S	*	*				47.7	130.4	120.9	-91.8	-168.8	175.5	-170.7	0	123
355	E	37	Very low	35.2	Very low	156 Å²	156	150.2 Å²	150.2	73%	0.729	79%	0.787	S	S	*	*			trans	88.8	139.2	134.7	-158	173.3	149.8	0	0	120
356	N	31.1	Very low	35.5	Very low	158 Å²	158	153 Å²	153	85%	0.845	79%	0.792	S	S	*	*			trans	-100.3	145.9	-179.9	-79.3	-32	0	0	0	111.9
357	R	34.3	Very low	35.5	Very low	239 Å²	239	155.8 Å²	155.8	90%	0.902	80%	0.798	S	S	*	*			trans	-139.1	143.4	158	-77	-167.5	173.2	-162.4	-2.8	112.1
358	G	35	Very low	35.5	Very low	81 Å²	81	151.9 Å²	151.9	84%	0.835	80%	0.797	S	S	*	*			trans	-86.5	-172.2	179	0	0	0	0	0	114.8
359	R	30.5	Very low	35.1	Very low	252 Å²	252	153.5 Å²	153.5	95%	0.951	80%	0.798	S	S	*	*			trans	-146.8	107	-167.1	-169.6	-169.2	-61.6	-112.9	5.2	114.9
360	G	31.9	Very low	35	Very low	74 Å²	74	151 Å²	151	76%	0.763	79%	0.791	S	S	*	*			trans	75.9	178.5	152.6	0	0	0	0	0	119.8
361	L	34.3	Very low	35.1	Very low	165 Å²	165	154.8 Å²	154.8	86%	0.864	79%	0.794	S	S	*	*			cis	-170.9	164.8	-16.4	-119.7	177.6	0	0	0	113.8
362	R	27.4	Very low	35.3	Very low	232 Å²	232	152.1 Å²	152.1	88%	0.875	78%	0.781	S	S	*	*			trans	82.8	157.8	163.5	-74.1	-173.5	171.9	-123.1	-2	120.7
363	S	33.2	Very low	35.4	Very low	107 Å²	107	155.8 Å²	155.8	75%	0.748	79%	0.785	S	S	*	*			trans	-173	-163.1	-152.3	60.2	0	0	0	0	109.4
364	P	62.5	Low	35.5	Very low	112 Å²	112	153.8 Å²	153.8	73%	0.727	79%	0.787	S	S	*	*			cis	-119.3	-123.7	-16.3	28.8	-2.5	0	0	0	109.6
365	P	59.6	Low	35.2	Very low	106 Å²	106	148.7 Å²	148.7	69%	0.688	78%	0.781	S	S	*	*			cis	-136.9	-163.3	-26.2	34	-9.3	0	0	0	116.2
366	Q	33.7	Very low	35.1	Very low	175 Å²	175	152.3 Å²	152.3	82%	0.818	79%	0.787	S	S	*	*			trans	77.3	139	165.6	-62.2	-161.4	18.9	0	0	119.2
367	Y	27	Very low	35	Very low	197 Å²	197	150.2 Å²	150.2	77%	0.773	78%	0.78	S	S	*	*			cis	-160.6	162.2	-12.8	-147.3	-114.4	0	0	0	112.1
368	V	32.1	Very low	34.7	Very low	124 Å²	124	144.1 Å²	144.1	75%	0.752	77%	0.77	S	S	*	*			trans	52.4	155.3	170.1	-76.4	0	0	0	0	121.7
369	R	26.3	Very low	34.6	Very low	226 Å²	226	151.2 Å²	151.2	85%	0.853	77%	0.772	S	S	*	*			cis	-171.9	143.2	-35	171.4	170.8	-173.7	176.6	3.1	111.5
370	A	31.8	Very low	34.4	Very low	82 Å²	82	145.6 Å²	145.6	68%	0.678	77%	0.765	S	S	*	*			trans	67.3	149.4	163	0	0	0	0	0	118.4
371	E	31.3	Very low	34.2	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	77%	0.769	S	S	*	*			cis	-172.7	-178.3	-30.4	-135.1	-174.9	-85.7	0	0	106.2
372	S	37.8	Very low	33.8	Very low	76 Å²	76	145.6 Å²	145.6	53%	0.531	77%	0.766	S	S	.	*			cis	-165.5	154.1	-3.2	-145.9	0	0	0	0	104.3
373	R	34	Very low	33.7	Very low	218 Å²	218	140 Å²	140	82%	0.823	76%	0.762	S	S	*	*			cis	-144.3	160.8	13.1	-72.3	-178.8	-178	153.6	5.5	107.8
374	A	33.5	Very low	33.8	Very low	95 Å²	95	143.6 Å²	143.6	79%	0.785	77%	0.767	S	S	*	*			cis	82	131	31.3	0	0	0	0	0	115.2
375	A	35.2	Very low	32.3	Very low	82 Å²	82	145.2 Å²	145.2	68%	0.678	77%	0.765	S	S	*	*			cis	-171.1	178.2	-11.8	0	0	0	0	0	112.1
376	R	34.1	Very low	31.1	Very low	231 Å²	231	150 Å²	150	87%	0.872	77%	0.769	S	S	*	*			trans	75.2	153	156	-64.2	174	-179	178.8	-0.9	116.4
377	T	29.8	Very low	30.9	Very low	114 Å²	114	148.9 Å²	148.9	70%	0.699	76%	0.764	S	S	*	*			cis	-162.2	144.6	-3.6	11.8	0	0	0	0	113.9
378	T	28.6	Very low	30.9	Very low	111 Å²	111	145.7 Å²	145.7	68%	0.681	76%	0.76	S	S	*	*			trans	35.8	134.7	142.7	60	0	0	0	0	124.7
379	R	31.1	Very low	30.8	Very low	231 Å²	231	147 Å²	147	87%	0.872	77%	0.768	S	S	*	*			trans	62.1	147.2	136.9	-67.1	174.8	173.7	-166.3	-0.6	119.9
380	V	27.4	Very low	30.7	Very low	133 Å²	133	139.4 Å²	139.4	81%	0.806	76%	0.761	S	S	*	*				159.4	160.7	116.5	162.7	0	0	0	0	110.5
381	L	27.9	Very low	31.1	Very low	162 Å²	162	141.4 Å²	141.4	85%	0.848	77%	0.767	S	S	*	*			trans	-48	161.4	172.8	-56.5	161.9	0	0	0	114.3
382	G	25.1	Very low	30.7	Very low	78 Å²	78	137.7 Å²	137.7	80%	0.804	76%	0.764	S	S	*	*			trans	-82.1	157.2	167.7	0	0	0	0	0	113.7
383	S	26.3	Very low	30.1	Very low	114 Å²	114	140.2 Å²	140.2	80%	0.797	78%	0.777	S	S	*	*			trans	-156.9	157	169.3	57.1	0	0	0	0	111.2
384	H	34.6	Very low	29.9	Very low	183 Å²	183	134.2 Å²	134.2	85%	0.847	77%	0.774	S	S	*	*			trans	-90.7	133.8	170.2	-65.9	-48.4	0	0	0	111.3
385	Q	31.9	Very low	30.7	Very low	146 Å²	146	135.7 Å²	135.7	68%	0.682	78%	0.775	S	S	*	*			trans	-150.7	132.9	158.1	-141.3	91.1	4.6	0	0	104.8
386	R	32.9	Very low	30.2	Very low	207 Å²	207	137.8 Å²	137.8	78%	0.781	77%	0.771	S	S	*	*			cis	60.7	141.6	42	-55.8	-171.5	179.5	-89.9	2.6	110.5
387	Q	29.7	Very low	30.8	Very low	150 Å²	150	131.7 Å²	131.7	70%	0.701	76%	0.761	S	S	*	*			cis	-146.9	143.9	38.4	-68.3	165.9	-8.8	0	0	113.8
388	N	28.5	Very low	30.6	Very low	131 Å²	131	135.6 Å²	135.6	70%	0.701	76%	0.763	S	S	*	*				21.1	128.7	127.6	-49.9	2.6	0	0	0	121.4
389	T	29.4	Very low	31.4	Very low	150 Å²	150	135.2 Å²	135.2	92%	0.92	76%	0.763	S	S	*	*				-158.1	148.5	128.9	21.8	0	0	0	0	110.5
390	G	23.4	Very low	31.1	Very low	67 Å²	67	129.9 Å²	129.9	69%	0.691	76%	0.756	S	S	*	*			trans	-101.1	168.9	167.1	0	0	0	0	0	111.3
391	P	39.8	Very low	31.4	Very low	125 Å²	125	132.2 Å²	132.2	81%	0.812	76%	0.755	S	S	*	*				-119.3	171.7	73.2	0.2	23.7	0	0	0	113.3
392	A	24.4	Very low	31.1	Very low	87 Å²	87	132.4 Å²	132.4	72%	0.719	75%	0.751	S	S	*	*				66.3	134.8	58.9	0	0	0	0	0	113.9
393	T	25.3	Very low	31.3	Very low	130 Å²	130	134.9 Å²	134.9	80%	0.798	75%	0.745	S	S	*	*			cis	-162.5	145	8.1	-13.6	0	0	0	0	114
394	A	28.7	Very low	31.5	Very low	91 Å²	91	136.2 Å²	136.2	75%	0.752	74%	0.742	S	S	*	*			trans	64.2	165.5	141.8	0	0	0	0	0	121.8
395	P	51.6	Low	31	Very low	127 Å²	127	133.8 Å²	133.8	83%	0.825	73%	0.732	S	S	*	*			cis	-126.2	177.5	-7.2	20.3	4.5	0	0	0	117.2
396	E	24.5	Very low	31.6	Very low	126 Å²	126	132.2 Å²	132.2	59%	0.589	73%	0.734	S	S	*	*			trans	-51.1	-174.9	155.3	-113.5	-149.4	133.1	0	0	114.1	R398	E396-R398 WeakPolarHBondContact OE1-CG 3.42Å; E396-R398 IonicContact OE1-CZ 3.6Å; E396-R398 IonicContact OE1-NE 3.39Å; E396-R398 PolarHBondContact OE1-NE 3.15Å; E396-R398 IonicContact OE1-NH2 2.94Å; E396-R398 PolarHBondContact OE1-NH2 3.26Å; E396-R398 IonicContact OE2-CZ 3.61Å; E396-R398 IonicContact OE2-NE 3.81Å; E396-R398 PolarHBondContact OE2-NE 2.81Å; E396-R398 IonicContact OE2-NH2 2.64Å; E396-R398 PolarHBondContact OE2-NH2 2.75Å
397	P	45.8	Very low	31.3	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	73%	0.725	S	S	*	*			cis	-143.2	150.9	6.3	25.2	0.5	0	0	0	119.5
398	R	26.1	Very low	31.5	Very low	197 Å²	197	127.6 Å²	127.6	74%	0.743	72%	0.719	S	S	*	*			trans	61.5	-173.1	130.9	-58.2	-178.1	-163.2	-170.5	9.7	119.6	E396	E396-R398 WeakPolarHBondContact OE1-CG 3.42Å; E396-R398 IonicContact OE1-CZ 3.6Å; E396-R398 IonicContact OE1-NE 3.39Å; E396-R398 PolarHBondContact OE1-NE 3.15Å; E396-R398 IonicContact OE1-NH2 2.94Å; E396-R398 PolarHBondContact OE1-NH2 3.26Å; E396-R398 IonicContact OE2-CZ 3.61Å; E396-R398 IonicContact OE2-NE 3.81Å; E396-R398 PolarHBondContact OE2-NE 2.81Å; E396-R398 IonicContact OE2-NH2 2.64Å; E396-R398 PolarHBondContact OE2-NH2 2.75Å
399	P	45.2	Very low	31.4	Very low	103 Å²	103	127.9 Å²	127.9	67%	0.669	72%	0.717	S	S	*	*				-139.8	-179.3	-65.8	40.8	-25.4	0	0	0	117.1
400	V	25.7	Very low	31.5	Very low	119 Å²	119	129.9 Å²	129.9	72%	0.721	71%	0.708	S	S	*	*			trans	83.2	150.8	138.3	146.4	0	0	0	0	121.5
401	K	31.8	Very low	31.8	Very low	181 Å²	181	133.2 Å²	133.2	79%	0.787	71%	0.711	S	S	*	*			trans	79	121.7	177.1	-73.4	148.3	-171.9	-178.7	0	116
402	H	23.2	Very low	31.2	Very low	166 Å²	166	134 Å²	134	77%	0.769	71%	0.713	S	S	*	*				80.4	112.9	54.5	-79.9	-81.3	0	0	0	112.4
403	L	28.9	Very low	31.3	Very low	130 Å²	130	133.3 Å²	133.3	68%	0.681	71%	0.714	S	S	*	*				91.5	136.6	84.5	-155.5	78.7	0	0	0	109.1
404	L	29.3	Very low	31.5	Very low	142 Å²	142	134.2 Å²	134.2	74%	0.743	72%	0.719	S	S	*	*			cis	-131.8	171.7	28.2	-52.2	123.3	0	0	0	110.8
405	E	24.2	Very low	32.1	Very low	132 Å²	132	135 Å²	135	62%	0.617	72%	0.717	S	S	*	*			cis	64.6	161.9	32.3	-105.5	-152.9	169.4	0	0	115.1
406	P	44.7	Very low	30.9	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	71%	0.712	S	S	*	*			cis	-107.2	166	17.7	16.7	6.3	0	0	0	113.5
407	E	27.7	Very low	31.1	Very low	126 Å²	126	138 Å²	138	59%	0.589	73%	0.728	S	S	*	*			cis	-165.5	-169	-2.8	-116.4	-175.4	151.8	0	0	105.8
408	K	32.4	Very low	30.2	Very low	134 Å²	134	139.1 Å²	139.1	58%	0.583	73%	0.733	S	S	*	*			cis	-164.2	169.1	2.3	-124.9	-174	175.6	65.5	0	105.6
409	E	27.9	Very low	30.2	Very low	138 Å²	138	136.6 Å²	136.6	65%	0.645	74%	0.739	S	S	*	*			cis	-158.2	-155.4	-12.6	-150.3	-162.8	-75.8	0	0	109.7
410	Y	30.2	Very low	29.2	Very low	191 Å²	191	142.5 Å²	142.5	75%	0.749	75%	0.748	S	S	*	*			trans	18.5	87.5	171	53.9	-105.6	0	0	0	123.3
411	N	30.7	Very low	29.2	Very low	138 Å²	138	142.9 Å²	142.9	74%	0.738	75%	0.745	S	S	*	*				85.6	123.4	111.6	-78.3	-45.8	0	0	0	124.4
412	T	27.9	Very low	28.9	Very low	141 Å²	141	141.1 Å²	141.1	87%	0.865	75%	0.75	S	S	*	*			trans	66.9	130.3	147	43.7	0	0	0	0	120.9
413	G	26.4	Very low	29	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	75%	0.749	S	S	*	*			trans	-160.3	-81.3	180	0	0	0	0	0	116.9
414	V	29.4	Very low	29.2	Very low	149 Å²	149	136.5 Å²	136.5	90%	0.903	76%	0.756	S	S	*	*			trans	76	144.6	-172.8	169.7	0	0	0	0	114.6
415	P	41.3	Very low	29	Very low	107 Å²	107	134.7 Å²	134.7	70%	0.695	76%	0.755	S	S	*	*			trans	-135.1	170.5	-134.3	45.9	-32.3	0	0	0	119.7
416	V	26.8	Very low	29.1	Very low	122 Å²	122	136.6 Å²	136.6	74%	0.739	77%	0.768	S	S	*	*			trans	59.9	128.9	139.6	166.4	0	0	0	0	121.6
417	Q	27.2	Very low	28.7	Very low	194 Å²	194	138.8 Å²	138.8	91%	0.907	77%	0.769	S	S	*	*			trans	-154.2	174.7	131.4	-124.8	167.4	90	0	0	114.2
418	V	27.7	Very low	29	Very low	127 Å²	127	138.5 Å²	138.5	77%	0.77	78%	0.778	S	S	*	*			trans	-114.5	149.3	-156.1	175.4	0	0	0	0	112.6
419	V	26.6	Very low	28.7	Very low	143 Å²	143	138.5 Å²	138.5	87%	0.867	78%	0.784	S	S	*	*			trans	-137.9	120.8	172.7	-176.4	0	0	0	0	114.5
420	R	24.4	Very low	29.9	Very low	228 Å²	228	137.1 Å²	137.1	86%	0.86	79%	0.787	S	S	*	*			trans	-170	137.5	150.3	-98.7	-171.5	-179.6	171.5	0.3	104.4
421	N	25.7	Very low	29.8	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	78%	0.784	S	S	*	*			cis	-151.5	173.4	18.7	-81.3	-36	0	0	0	111.3
422	T	25.1	Very low	29.6	Very low	144 Å²	144	134.6 Å²	134.6	88%	0.883	79%	0.789	S	S	*	*			trans	67.1	145.1	150.8	42.6	0	0	0	0	121.4
423	G	23.9	Very low	29.7	Very low	72 Å²	72	136 Å²	136	74%	0.742	78%	0.783	S	S	*	*			trans	-87.9	-156.6	169.6	0	0	0	0	0	113.5
424	P	34.7	Very low	29.7	Very low	128 Å²	128	143.5 Å²	143.5	83%	0.831	79%	0.789	S	S	*	*			cis	-141	173.4	26.4	43	-25	0	0	0	118.1
425	S	23.5	Very low	29.5	Very low	104 Å²	104	143.7 Å²	143.7	73%	0.727	79%	0.79	S	S	*	*			trans	34	114.9	146.7	-172.3	0	0	0	0	121.9
426	L	26.8	Very low	28.8	Very low	171 Å²	171	141.6 Å²	141.6	90%	0.895	79%	0.788	S	S	*	*				-173	161.8	119.2	-100.5	165.2	0	0	0	113.7
427	Q	36.7	Very low	28.9	Very low	160 Å²	160	144.4 Å²	144.4	75%	0.748	80%	0.797	S	S	*	*			trans	-65.3	150.5	179.1	-84.5	-87.6	-19.6	0	0	113.5
428	P	33.9	Very low	28.8	Very low	119 Å²	119	141 Å²	141	77%	0.773	80%	0.795	S	S	*	*				-154.4	174.5	72.7	42.8	-23	0	0	0	119.4
429	N	27.2	Very low	28.7	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	79%	0.789	S	S	*	*			trans	-66.3	165.9	157.7	-109.2	-59.3	0	0	0	111.5
430	P	52.8	Low	28.8	Very low	109 Å²	109	138.9 Å²	138.9	71%	0.708	79%	0.79	S	S	*	*			cis	-150.9	162.7	36.2	42.2	-20.8	0	0	0	120.8
431	V	27	Very low	29	Very low	111 Å²	111	132.1 Å²	132.1	67%	0.673	78%	0.782	S	S	*	*			trans	41.4	126.6	136.4	-178.9	0	0	0	0	122.2
432	I	27.2	Very low	29.1	Very low	166 Å²	166	129.7 Å²	129.7	85%	0.851	79%	0.787	S	S	*	*				-173.8	167	129.8	-98.4	153.5	0	0	0	110.6
433	K	30	Very low	29.4	Very low	170 Å²	170	132 Å²	132	74%	0.739	79%	0.785	S	S	*	*				-170.3	143.6	-68.4	-156.8	172.2	-174.1	172.8	0	110.2
434	R	25.6	Very low	29.5	Very low	230 Å²	230	134.7 Å²	134.7	87%	0.868	78%	0.778	S	S	*	*			trans	83.3	128.7	165.5	-46.7	-172.1	-161.9	-151.9	6.8	120.1
435	V	26.6	Very low	29.4	Very low	153 Å²	153	136.7 Å²	136.7	93%	0.927	77%	0.774	S	S	*	*				-112.6	157.2	128.8	166.8	0	0	0	0	106.6
436	G	26.4	Very low	29.5	Very low	62 Å²	62	136.8 Å²	136.8	64%	0.639	78%	0.775	S	S	*	*			trans	154.1	117.6	155.8	0	0	0	0	0	116
437	L	28.8	Very low	29.4	Very low	181 Å²	181	133.8 Å²	133.8	95%	0.948	77%	0.766	S	S	*	*				178	114.7	124.9	-98.1	169	0	0	0	111.4
438	S	24.8	Very low	28.9	Very low	122 Å²	122	132.6 Å²	132.6	85%	0.853	77%	0.77	S	S	*	*			trans	-179.6	123.7	133.9	-161.9	0	0	0	0	109.7
439	G	25.7	Very low	28.6	Very low	63 Å²	63	131.4 Å²	131.4	65%	0.649	77%	0.765	S	S	*	*			trans	-93.5	-158	155.2	0	0	0	0	0	109.2
440	D	27.4	Very low	28.7	Very low	164 Å²	164	135.1 Å²	135.1	88%	0.877	77%	0.774	S	S	*	*			cis	-160.5	172.9	-11.2	-145.1	30.2	0	0	0	106.3
441	A	30.2	Very low	27.4	Very low	85 Å²	85	133.9 Å²	133.9	70%	0.702	77%	0.773	S	S	*	*			cis	-151.5	-172.1	9	0	0	0	0	0	110.1
442	G	26.9	Very low	27.5	Very low	76 Å²	76	137.4 Å²	137.4	78%	0.784	78%	0.782	S	S	*	*			trans	-153.5	144	173	0	0	0	0	0	114.7
443	K	31.2	Very low	27.5	Very low	192 Å²	192	134.8 Å²	134.8	84%	0.835	78%	0.778	S	S	*	*			trans	-152.6	139	-179.3	-141.8	-174.5	-178.6	-179.9	0	112.3
444	E	27	Very low	27.3	Very low	129 Å²	129	131.6 Å²	131.6	60%	0.603	78%	0.784	S	S	*	*			trans	66.5	114.8	161	-54.9	-131.4	133.5	0	0	122
445	K	31.3	Very low	27.3	Very low	170 Å²	170	124.5 Å²	124.5	74%	0.739	78%	0.782	S	S	*	*				67.5	157	126.8	-60.7	170.5	-170.8	154.9	0	122.3
446	S	26.2	Very low	27.6	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	78%	0.783	S	S	*	*			trans	103.7	98.2	142	-148.3	0	0	0	0	120.2
447	C	25.1	Very low	27.6	Very low	107 Å²	107	123.4 Å²	123.4	72%	0.723	79%	0.791	S	S	*	*				51.5	138.9	119.8	-58.2	0	0	0	0	123.6
448	V	24.7	Very low	27.7	Very low	136 Å²	136	119 Å²	119	82%	0.824	79%	0.79	S	S	*	*			trans	72	146.6	137.6	164.9	0	0	0	0	117.3
449	S	29.3	Very low	27.8	Very low	94 Å²	94	117 Å²	117	66%	0.657	79%	0.787	S	S	*	*			cis	-174.1	164	-25.4	-84.7	0	0	0	0	108.4
450	K	27.7	Very low	28.5	Very low	212 Å²	212	118.4 Å²	118.4	92%	0.922	80%	0.802	S	S	*	*			trans	66.9	165.1	161.5	-97.4	179.2	180	-176.7	0	114.9
451	A	26.5	Very low	28.5	Very low	82 Å²	82	114.1 Å²	114.1	68%	0.678	80%	0.797	S	S	*	*			cis	-144.5	179.4	-7.4	0	0	0	0	0	111.4
452	Q	28.1	Very low	28.9	Very low	186 Å²	186	118.2 Å²	118.2	87%	0.869	81%	0.806	S	S	*	*			trans	-52.9	151.8	170.5	-54.8	135.8	-32.8	0	0	113.4
453	S	27.1	Very low	29.6	Very low	110 Å²	110	119.8 Å²	119.8	77%	0.769	80%	0.803	S	S	*	*				161.8	138.8	101.8	-166.2	0	0	0	0	113.8
454	A	27.1	Very low	30.4	Very low	103 Å²	103	122.1 Å²	122.1	85%	0.851	81%	0.806	S	S	*	*			trans	53.6	165.9	150.9	0	0	0	0	0	121.6
455	G	26.2	Very low	31.3	Very low	81 Å²	81	121.5 Å²	121.5	84%	0.835	81%	0.807	S	S	*	*			trans	119.6	118.4	166.9	0	0	0	0	0	114.1
456	A	32.3	Very low	32.1	Very low	114 Å²	114	118 Å²	118	94%	0.942	80%	0.804	S	S	*	*			trans	-95.1	152.3	169.2	0	0	0	0	0	110.6
457	G	26.9	Very low	32.9	Very low	79 Å²	79	120.6 Å²	120.6	81%	0.814	80%	0.802	S	S	*	*			trans	172.2	133.5	175.2	0	0	0	0	0	111.1
458	G	30.7	Very low	33.9	Very low	89 Å²	89	122.2 Å²	122.2	92%	0.918	80%	0.799	S	S	*	*			trans	-81.1	155.3	-178.2	0	0	0	0	0	113.6
459	G	26.5	Very low	35	Very low	78 Å²	78	121.1 Å²	121.1	80%	0.804	79%	0.788	S	S	*	*			trans	178.8	117.5	172.9	0	0	0	0	0	110.5
460	G	39.9	Very low	36.2	Very low	93 Å²	93	119.7 Å²	119.7	96%	0.959	78%	0.778	S	S	*	*			trans	-74.1	140	-175.4	0	0	0	0	0	113.3
461	G	28.5	Very low	37.3	Very low	74 Å²	74	115.8 Å²	115.8	76%	0.763	76%	0.761	S	S	*	*			trans	-157.5	119.6	174.4	0	0	0	0	0	111.7
462	L	37.2	Very low	38.6	Very low	171 Å²	171	117.2 Å²	117.2	90%	0.895	75%	0.754	S	S	*	*			trans	-72.7	130.7	-178.1	-71.1	161.2	0	0	0	111.7	R464	L462-R464 PolarHBondContact O-N 3.02Å
463	P	43.1	Very low	40.4	Very low	110 Å²	110	112.7 Å²	112.7	71%	0.714	73%	0.733	S	S	*	*			trans	-78.1	107.8	173.9	30.3	-32.2	0	0	0	111.2	D465	P463-D465 PolarHBondContact O-N 3.48Å
464	R	47.8	Very low	42.6	Very low	240 Å²	240	114.6 Å²	114.6	91%	0.906	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	40.8	-174.8	-158.4	-176.9	-178.6	-90.9	3.4	113.9	L462	L462-R464 PolarHBondContact O-N 3.02Å
465	D	46.2	Very low	44.7	Very low	116 Å²	116	114.5 Å²	114.5	62%	0.62	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-5.4	-173.5	-72.6	-48.1	0	0	0	114.9	P463 F467	P463-D465 PolarHBondContact O-N 3.48Å; D465-F467 PolarHBondContact O-N 2.82Å; D465-F467 VanDerWaalsContact O-N 3.08Å
466	S	47.2	Very low	46.3	Very low	97 Å²	97	117.1 Å²	117.1	68%	0.678	70%	0.702	S	S	*	*	H	α-helix	trans	-60.7	-22.5	-175.2	-172.5	0	0	0	0	115.2	S470	S466-S470 PolarHBondContact O-N 2.85Å
467	F	44.1	Very low	48.2	Very low	161 Å²	161	119.2 Å²	119.2	71%	0.706	69%	0.686	S	S	*	*	H	α-helix	trans	-83.4	-43.8	-172	-137.5	-112.5	0	0	0	112.5	D465 L469 S470 F471	D465-F467 PolarHBondContact O-N 2.82Å; D465-F467 VanDerWaalsContact O-N 3.08Å; F467-L469 PolarHBondContact O-N 2.82Å; F467-S470 PolarHBondContact O-N 2.81Å; F467-F471 HydrophobicContact CD1-CD2 4.26Å; F467-F471 AromaticContact CD1-CE2 3.86Å; F467-F471 HydrophobicContact CD1-CE2 3.86Å; F467-F471 AromaticContact CE1-CE2 3.74Å; F467-F471 HydrophobicContact CE1-CE2 3.74Å; F467-F471 WeakPolarHBondContact O-CD2 3.22Å; F467-F471 PolarHBondContact O-N 2.81Å
468	E	45.9	Very low	50.1	Low	140 Å²	140	122.7 Å²	122.7	65%	0.654	67%	0.674	S	S	*	*	H	α-helix	trans	-66.5	-39.4	-180	-170	69	-167.5	0	0	111.1	S470 F471 Q472	E468-S470 VanDerWaalsContact C-N 3.35Å; E468-S470 PolarHBondContact O-N 2.94Å; E468-F471 PolarHBondContact O-N 2.98Å; E468-Q472 PolarHBondContact O-N 3.41Å
469	L	45.9	Very low	52	Low	114 Å²	114	122.3 Å²	122.3	60%	0.597	65%	0.649	S	S	*	*	H	α-helix	trans	-60.2	-42.8	174	-69.4	170.8	0	0	0	111.7	F467 F471 Q472 E473	F467-L469 PolarHBondContact O-N 2.82Å; L469-F471 PolarHBondContact O-N 2.79Å; L469-Q472 PolarHBondContact O-N 3.46Å; L469-E473 WeakPolarHBondContact O-CB 3.31Å; L469-E473 PolarHBondContact O-N 3.16Å
470	S	55.5	Low	54.3	Low	63 Å²	63	122.2 Å²	122.2	44%	0.441	64%	0.635	S	S	.	*	H	α-helix	trans	-63.2	-40.3	177.5	-173.4	0	0	0	0	112.5	S466 F467 E468 K474	S466-S470 PolarHBondContact O-N 2.85Å; F467-S470 PolarHBondContact O-N 2.81Å; E468-S470 VanDerWaalsContact C-N 3.35Å; E468-S470 PolarHBondContact O-N 2.94Å; S470-K474 WeakPolarHBondContact O-CB 3.43Å; S470-K474 PolarHBondContact O-N 3.36Å
471	F	50.1	Low	55.6	Low	130 Å²	130	123 Å²	123	57%	0.57	62%	0.617	S	S	*	*	H	α-helix	trans	-65.5	-40.1	173.8	-87.7	-78.8	0	0	0	112.7	F467 E468 L469 K474 L475	F467-F471 HydrophobicContact CD1-CD2 4.26Å; F467-F471 AromaticContact CD1-CE2 3.86Å; F467-F471 HydrophobicContact CD1-CE2 3.86Å; F467-F471 AromaticContact CE1-CE2 3.74Å; F467-F471 HydrophobicContact CE1-CE2 3.74Å; F467-F471 WeakPolarHBondContact O-CD2 3.22Å; F467-F471 PolarHBondContact O-N 2.81Å; E468-F471 PolarHBondContact O-N 2.98Å; L469-F471 PolarHBondContact O-N 2.79Å; F471-K474 PolarHBondContact O-N 2.9Å; F471-L475 WeakPolarHBondContact O-CB 3.33Å; F471-L475 PolarHBondContact O-N 3.09Å
472	Q	55.3	Low	58	Low	113 Å²	113	123.1 Å²	123.1	53%	0.528	60%	0.595	S	S	.	*	H	α-helix	trans	-68.8	-39.9	178.9	-171.1	155.9	99.3	0	0	112.1	E468 L469 L475 Q476	E468-Q472 PolarHBondContact O-N 3.41Å; L469-Q472 PolarHBondContact O-N 3.46Å; Q472-L475 PolarHBondContact O-N 2.92Å; Q472-Q476 WeakPolarHBondContact O-CG 3.45Å; Q472-Q476 PolarHBondContact O-N 3.09Å
473	E	65.7	Low	59.4	Low	90 Å²	90	120.7 Å²	120.7	42%	0.421	58%	0.578	S	S	.	*	H	α-helix	trans	-65.3	-45.2	172.5	-167.6	-165.1	162.2	0	0	111.5	L469 L475 Q476 R477	L469-E473 WeakPolarHBondContact O-CB 3.31Å; L469-E473 PolarHBondContact O-N 3.16Å; E473-L475 VanDerWaalsContact C-N 3.27Å; E473-L475 PolarHBondContact O-N 3.47Å; E473-Q476 PolarHBondContact O-N 2.88Å; E473-Q476 VanDerWaalsContact O-N 3.11Å; E473-R477 WeakPolarHBondContact O-CG 3.36Å; E473-R477 PolarHBondContact O-N 3.39Å; E473-R477 IonicContact OE1-CZ 2.69Å; E473-R477 IonicContact OE1-NE 3.97Å; E473-R477 PolarHBondContact OE1-NE 3.01Å; E473-R477 IonicContact OE1-NH2 3.27Å; E473-R477 PolarHBondContact OE1-NH2 2.72Å
474	K	72.9	Confident	61.1	Low	151 Å²	151	120.1 Å²	120.1	66%	0.657	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-33.1	178.8	-165.7	165.5	-172.6	169.6	0	112.2	S470 F471 W478	S470-K474 WeakPolarHBondContact O-CB 3.43Å; S470-K474 PolarHBondContact O-N 3.36Å; F471-K474 PolarHBondContact O-N 2.9Å; K474-W478 WeakPolarHBondContact O-CB 3.32Å; K474-W478 PolarHBondContact O-N 2.98Å
475	L	71	Confident	62.3	Low	100 Å²	100	113.6 Å²	113.6	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-68.9	-41.8	171.5	-174.4	64.5	0	0	0	112.1	F471 Q472 E473 W478 E479	F471-L475 WeakPolarHBondContact O-CB 3.33Å; F471-L475 PolarHBondContact O-N 3.09Å; Q472-L475 PolarHBondContact O-N 2.92Å; E473-L475 VanDerWaalsContact C-N 3.27Å; E473-L475 PolarHBondContact O-N 3.47Å; L475-W478 HydrophobicContact CD1-CE3 4.28Å; L475-W478 PolarHBondContact O-N 2.7Å; L475-E479 WeakPolarHBondContact O-CB 3.49Å; L475-E479 PolarHBondContact O-N 3.06Å
476	Q	59.9	Low	63.6	Low	136 Å²	136	112.9 Å²	112.9	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-65.1	-42.6	174.7	-75.1	-177.4	-1.3	0	0	112.2	Q472 E473 E479 C480	Q472-Q476 WeakPolarHBondContact O-CG 3.45Å; Q472-Q476 PolarHBondContact O-N 3.09Å; E473-Q476 PolarHBondContact O-N 2.88Å; E473-Q476 VanDerWaalsContact O-N 3.11Å; Q476-E479 PolarHBondContact O-N 3.49Å; Q476-C480 VanDerWaalsContact O-CB 3.23Å; Q476-C480 WeakPolarHBondContact O-CB 3.49Å; Q476-C480 PolarHBondContact O-N 2.87Å
477	R	71.6	Confident	64.8	Low	159 Å²	159	114 Å²	114	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-59.4	-45	172.9	-71.3	177.8	-179.4	-130.1	9.7	111.1	E473 C480 N481	E473-R477 WeakPolarHBondContact O-CG 3.36Å; E473-R477 PolarHBondContact O-N 3.39Å; E473-R477 IonicContact OE1-CZ 2.69Å; E473-R477 IonicContact OE1-NE 3.97Å; E473-R477 PolarHBondContact OE1-NE 3.01Å; E473-R477 IonicContact OE1-NH2 3.27Å; E473-R477 PolarHBondContact OE1-NH2 2.72Å; R477-C480 PolarHBondContact O-N 2.71Å; R477-N481 WeakPolarHBondContact O-CB 3.48Å; R477-N481 PolarHBondContact O-N 3.27Å; R477-N481 PolarHBondContact O-OD1 3.03Å; R477-N481 VanDerWaalsContact O-OD1 3.11Å
478	W	67.5	Low	66.6	Low	151 Å²	151	111.4 Å²	111.4	57%	0.572	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-43.8	176.2	-178.8	75.2	0	0	0	112.9	K474 L475 C480 N481 R482	K474-W478 WeakPolarHBondContact O-CB 3.32Å; K474-W478 PolarHBondContact O-N 2.98Å; L475-W478 HydrophobicContact CD1-CE3 4.28Å; L475-W478 PolarHBondContact O-N 2.7Å; W478-C480 VanDerWaalsContact C-N 3.28Å; W478-C480 PolarHBondContact O-N 2.92Å; W478-N481 PolarHBondContact O-N 3.41Å; W478-R482 WeakPolarHBondContact O-CB 3.4Å; W478-R482 PolarHBondContact O-N 3.46Å
479	E	70.8	Confident	67.7	Low	81 Å²	81	109.7 Å²	109.7	38%	0.379	53%	0.526	S	S	.	.	H	α-helix	trans	-69.3	-26.3	178.2	-168.7	124.3	-111.4	0	0	112.5	L475 Q476 R482 Q483	L475-E479 WeakPolarHBondContact O-CB 3.49Å; L475-E479 PolarHBondContact O-N 3.06Å; Q476-E479 PolarHBondContact O-N 3.49Å; E479-R482 IonicContact OE1-CZ 3.12Å; E479-R482 IonicContact OE1-NH1 2.63Å; E479-R482 PolarHBondContact OE1-NH1 3.4Å; E479-R482 IonicContact OE1-NH2 2.67Å; E479-R482 PolarHBondContact OE1-NH2 3.01Å; E479-Q483 VanDerWaalsContact O-CG 3.3Å; E479-Q483 WeakPolarHBondContact O-CG 3.44Å; E479-Q483 PolarHBondContact O-N 3.28Å; E479-Q483 PolarHBondContact O-NE2 3.48Å
480	C	73.3	Confident	69.3	Low	76 Å²	76	106 Å²	106	51%	0.514	52%	0.515	S	S	.	.	H	α-helix	trans	-74.9	-49.1	171.4	-169.6	0	0	0	0	111.8	Q476 R477 W478 R482 Q483 L484	Q476-C480 VanDerWaalsContact O-CB 3.23Å; Q476-C480 WeakPolarHBondContact O-CB 3.49Å; Q476-C480 PolarHBondContact O-N 2.87Å; R477-C480 PolarHBondContact O-N 2.71Å; W478-C480 VanDerWaalsContact C-N 3.28Å; W478-C480 PolarHBondContact O-N 2.92Å; C480-R482 VanDerWaalsContact C-N 3.3Å; C480-R482 PolarHBondContact O-N 3.17Å; C480-Q483 WeakPolarHBondContact O-CA 3.4Å; C480-Q483 WeakPolarHBondContact O-CB 3.49Å; C480-Q483 PolarHBondContact O-N 3.05Å; C480-L484 PolarHBondContact O-N 3.26Å
481	N	68.1	Low	70.3	Confident	109 Å²	109	106.3 Å²	106.3	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-58.2	-43.3	175.7	-75.9	28.6	0	0	0	111.1	R477 W478 Q483 L484 E485	R477-N481 WeakPolarHBondContact O-CB 3.48Å; R477-N481 PolarHBondContact O-N 3.27Å; R477-N481 PolarHBondContact O-OD1 3.03Å; R477-N481 VanDerWaalsContact O-OD1 3.11Å; W478-N481 PolarHBondContact O-N 3.41Å; N481-Q483 PolarHBondContact O-N 3.14Å; N481-L484 WeakPolarHBondContact O-CB 3.31Å; N481-L484 PolarHBondContact O-N 2.81Å; N481-L484 VanDerWaalsContact O-N 3.13Å; N481-E485 VanDerWaalsContact O-CB 3.31Å; N481-E485 WeakPolarHBondContact O-CB 3.39Å; N481-E485 PolarHBondContact O-N 3.45Å
482	R	77.9	Confident	71.1	Confident	78 Å²	78	107.2 Å²	107.2	29%	0.294	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-28.2	175.6	-160.4	-168.3	72.9	-127.6	-4.2	112.8	W478 E479 C480 N486	W478-R482 WeakPolarHBondContact O-CB 3.4Å; W478-R482 PolarHBondContact O-N 3.46Å; E479-R482 IonicContact OE1-CZ 3.12Å; E479-R482 IonicContact OE1-NH1 2.63Å; E479-R482 PolarHBondContact OE1-NH1 3.4Å; E479-R482 IonicContact OE1-NH2 2.67Å; E479-R482 PolarHBondContact OE1-NH2 3.01Å; C480-R482 VanDerWaalsContact C-N 3.3Å; C480-R482 PolarHBondContact O-N 3.17Å; R482-N486 WeakPolarHBondContact O-CB 3.43Å; R482-N486 PolarHBondContact O-N 3.12Å; R482-N486 PolarHBondContact O-ND2 2.86Å
483	Q	67.3	Low	72.1	Confident	119 Å²	119	107.3 Å²	107.3	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-76.1	-38.2	173.1	-78.5	167.8	62.3	0	0	111.9	E479 C480 N481 N486 M487	E479-Q483 VanDerWaalsContact O-CG 3.3Å; E479-Q483 WeakPolarHBondContact O-CG 3.44Å; E479-Q483 PolarHBondContact O-N 3.28Å; E479-Q483 PolarHBondContact O-NE2 3.48Å; C480-Q483 WeakPolarHBondContact O-CA 3.4Å; C480-Q483 WeakPolarHBondContact O-CB 3.49Å; C480-Q483 PolarHBondContact O-N 3.05Å; N481-Q483 PolarHBondContact O-N 3.14Å; Q483-N486 PolarHBondContact O-N 2.99Å; Q483-M487 PolarHBondContact O-N 3.13Å; Q483-M487 VanDerWaalsContact O-N 3.14Å
484	L	78.9	Confident	72.3	Confident	98 Å²	98	105.9 Å²	105.9	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-50	174.3	-168.5	70.6	0	0	0	110.9	C480 N481 N486 M487 E488	C480-L484 PolarHBondContact O-N 3.26Å; N481-L484 WeakPolarHBondContact O-CB 3.31Å; N481-L484 PolarHBondContact O-N 2.81Å; N481-L484 VanDerWaalsContact O-N 3.13Å; L484-N486 VanDerWaalsContact C-N 3.29Å; L484-N486 PolarHBondContact O-N 2.79Å; L484-M487 CarbonylContact O-C 3.53Å; L484-M487 WeakPolarHBondContact O-CA 3.49Å; L484-M487 WeakPolarHBondContact O-CB 3.48Å; L484-M487 PolarHBondContact O-N 3.17Å; L484-E488 WeakPolarHBondContact CG-OE1 3.26Å; L484-E488 WeakPolarHBondContact O-CG 3.26Å; L484-E488 PolarHBondContact O-N 2.87Å
485	E	73.7	Confident	72.3	Confident	104 Å²	104	104 Å²	104	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-52.4	-42.7	173.4	177.3	-173.4	-149	0	0	112.2	N481 M487 E488 L489	N481-E485 VanDerWaalsContact O-CB 3.31Å; N481-E485 WeakPolarHBondContact O-CB 3.39Å; N481-E485 PolarHBondContact O-N 3.45Å; E485-M487 VanDerWaalsContact C-N 3.32Å; E485-M487 PolarHBondContact O-N 3.48Å; E485-E488 PolarHBondContact O-N 2.84Å; E485-L489 HydrophobicContact CG-CD1 4.21Å; E485-L489 WeakPolarHBondContact O-CB 3.48Å; E485-L489 VanDerWaalsContact O-CG 3.24Å; E485-L489 WeakPolarHBondContact O-CG 3.31Å; E485-L489 PolarHBondContact O-N 2.94Å
486	N	73.9	Confident	72.6	Confident	101 Å²	101	104.8 Å²	104.8	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-72.2	-22.1	176.7	-85.5	-101.2	0	0	0	113.6	R482 Q483 L484 G490	R482-N486 WeakPolarHBondContact O-CB 3.43Å; R482-N486 PolarHBondContact O-N 3.12Å; R482-N486 PolarHBondContact O-ND2 2.86Å; Q483-N486 PolarHBondContact O-N 2.99Å; L484-N486 VanDerWaalsContact C-N 3.29Å; L484-N486 PolarHBondContact O-N 2.79Å; N486-G490 PolarHBondContact O-N 3Å
487	M	72	Confident	72.9	Confident	120 Å²	120	102.7 Å²	102.7	59%	0.591	50%	0.497	S	S	*	.	H	α-helix	trans	-80.7	-41.9	169.5	-72	-156.7	66.2	0	0	111.6	Q483 L484 E485 L489 G490 E491	Q483-M487 PolarHBondContact O-N 3.13Å; Q483-M487 VanDerWaalsContact O-N 3.14Å; L484-M487 CarbonylContact O-C 3.53Å; L484-M487 WeakPolarHBondContact O-CA 3.49Å; L484-M487 WeakPolarHBondContact O-CB 3.48Å; L484-M487 PolarHBondContact O-N 3.17Å; E485-M487 VanDerWaalsContact C-N 3.32Å; E485-M487 PolarHBondContact O-N 3.48Å; M487-L489 VanDerWaalsContact C-N 3.35Å; M487-L489 PolarHBondContact O-N 3.46Å; M487-G490 CarbonylContact O-C 3.5Å; M487-G490 PolarHBondContact O-N 3.48Å; M487-G490 VanDerWaalsContact O-N 3.13Å; M487-E491 WeakPolarHBondContact O-CG 3.3Å; M487-E491 PolarHBondContact O-N 2.86Å
488	E	80.3	Confident	72.5	Confident	106 Å²	106	95.6 Å²	95.6	50%	0.495	47%	0.473	S	S	.	.	H	α-helix	trans	-62	-41.3	176.7	-70.7	167.4	165.9	0	0	111.2	L484 E485 E491 F492	L484-E488 WeakPolarHBondContact CG-OE1 3.26Å; L484-E488 WeakPolarHBondContact O-CG 3.26Å; L484-E488 PolarHBondContact O-N 2.87Å; E485-E488 PolarHBondContact O-N 2.84Å; E488-E491 PolarHBondContact O-N 3.25Å; E488-F492 WeakPolarHBondContact O-CB 3.45Å; E488-F492 PolarHBondContact O-N 2.86Å
489	L	70.7	Confident	72.2	Confident	104 Å²	104	91.7 Å²	91.7	55%	0.545	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-40.7	171	-74.8	167.7	0	0	0	112.8	E485 M487 E491 F492 E493	E485-L489 HydrophobicContact CG-CD1 4.21Å; E485-L489 WeakPolarHBondContact O-CB 3.48Å; E485-L489 VanDerWaalsContact O-CG 3.24Å; E485-L489 WeakPolarHBondContact O-CG 3.31Å; E485-L489 PolarHBondContact O-N 2.94Å; M487-L489 VanDerWaalsContact C-N 3.35Å; M487-L489 PolarHBondContact O-N 3.46Å; L489-E491 VanDerWaalsContact C-N 3.32Å; L489-F492 PolarHBondContact O-N 2.78Å; L489-E493 WeakPolarHBondContact O-CB 3.28Å; L489-E493 PolarHBondContact O-N 3.49Å
490	G	79.4	Confident	71.8	Confident	37 Å²	37	95.1 Å²	95.1	38%	0.381	49%	0.488	S	S	.	.	H	α-helix	trans	-71.3	-25.1	176.5	0	0	0	0	0	113.8	N486 M487 L494	N486-G490 PolarHBondContact O-N 3Å; M487-G490 CarbonylContact O-C 3.5Å; M487-G490 PolarHBondContact O-N 3.48Å; M487-G490 VanDerWaalsContact O-N 3.13Å; G490-L494 PolarHBondContact O-N 3.24Å
491	E	76.4	Confident	71.2	Confident	70 Å²	70	97.7 Å²	97.7	33%	0.327	49%	0.493	S	S	.	.	H	α-helix	trans	-77.6	-36.2	169.6	-71.8	173.5	-133.5	0	0	111.1	M487 E488 L489 L494 L495 K521	M487-E491 WeakPolarHBondContact O-CG 3.3Å; M487-E491 PolarHBondContact O-N 2.86Å; E488-E491 PolarHBondContact O-N 3.25Å; L489-E491 VanDerWaalsContact C-N 3.32Å; E491-L494 WeakPolarHBondContact O-CB 3.4Å; E491-L494 PolarHBondContact O-N 3.23Å; E491-L495 WeakPolarHBondContact O-CD1 3.29Å; E491-L495 PolarHBondContact O-N 3.47Å; E491-K521 VanDerWaalsContact OE1-CE 3.3Å; E491-K521 WeakPolarHBondContact OE1-CE 3.39Å; E491-K521 IonicContact OE1-NZ 2.9Å; E491-K521 PolarHBondContact OE1-NZ 3.29Å; E491-K521 IonicContact OE2-NZ 2.78Å; E491-K521 PolarHBondContact OE2-NZ 3.33Å
492	F	66.7	Low	70.3	Confident	149 Å²	149	100.1 Å²	100.1	65%	0.654	51%	0.505	S	S	*	.	H	α-helix	trans	-66.3	-45.5	174.8	-149	-83	0	0	0	111.9	E488 L489 L494 L495 E496	E488-F492 WeakPolarHBondContact O-CB 3.45Å; E488-F492 PolarHBondContact O-N 2.86Å; L489-F492 PolarHBondContact O-N 2.78Å; F492-L494 PolarHBondContact O-N 3.32Å; F492-L495 PolarHBondContact O-N 2.92Å; F492-L495 VanDerWaalsContact O-N 3.1Å; F492-E496 WeakPolarHBondContact O-CB 3.18Å; F492-E496 PolarHBondContact O-N 3.28Å
493	E	76.3	Confident	69	Low	114 Å²	114	100.8 Å²	100.8	53%	0.533	52%	0.522	S	S	.	.	H	α-helix	trans	-58	-34.4	172.6	-177.8	-180	-171.2	0	0	111.5	L489 Q497	L489-E493 WeakPolarHBondContact O-CB 3.28Å; L489-E493 PolarHBondContact O-N 3.49Å; E493-Q497 WeakPolarHBondContact O-CB 3.44Å; E493-Q497 VanDerWaalsContact O-CG 3.24Å; E493-Q497 WeakPolarHBondContact O-CG 3.2Å; E493-Q497 PolarHBondContact O-N 2.85Å; E493-Q497 VanDerWaalsContact O-N 3.08Å
494	L	70	Confident	68.2	Low	60 Å²	60	102.4 Å²	102.4	31%	0.314	53%	0.527	S	S	.	.	H	α-helix	trans	-73.6	-35	176.1	-162.3	79.2	0	0	0	112.7	G490 E491 F492 A498 F510	G490-L494 PolarHBondContact O-N 3.24Å; E491-L494 WeakPolarHBondContact O-CB 3.4Å; E491-L494 PolarHBondContact O-N 3.23Å; F492-L494 PolarHBondContact O-N 3.32Å; L494-A498 WeakPolarHBondContact O-CB 3.35Å; L494-A498 PolarHBondContact O-N 3.12Å; L494-A498 VanDerWaalsContact O-N 3.09Å; L494-F510 HydrophobicContact CG-CZ 4.22Å
495	L	72.8	Confident	66.7	Low	111 Å²	111	101.4 Å²	101.4	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-73.8	-35	173.9	-94.4	78.1	0	0	0	112.2	E491 F492 A498 A499	E491-L495 WeakPolarHBondContact O-CD1 3.29Å; E491-L495 PolarHBondContact O-N 3.47Å; F492-L495 PolarHBondContact O-N 2.92Å; F492-L495 VanDerWaalsContact O-N 3.1Å; L495-A498 WeakPolarHBondContact O-CB 3.32Å; L495-A498 PolarHBondContact O-N 2.79Å; L495-A499 PolarHBondContact O-N 3.47Å
496	E	76.8	Confident	65.4	Low	118 Å²	118	102 Å²	102	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-63	-49.5	174.1	-172.4	168.9	-132.9	0	0	110.3	F492 A498 A499 E500	F492-E496 WeakPolarHBondContact O-CB 3.18Å; F492-E496 PolarHBondContact O-N 3.28Å; E496-A498 PolarHBondContact O-N 3.38Å; E496-A499 PolarHBondContact O-N 3.2Å; E496-E500 PolarHBondContact O-N 3.5Å
497	Q	67.5	Low	64.1	Low	91 Å²	91	104.9 Å²	104.9	43%	0.425	56%	0.559	S	S	.	*	H	α-helix	trans	-59.6	-33.1	172	-71.4	169.6	23	0	0	112.8	E493 E501	E493-Q497 WeakPolarHBondContact O-CB 3.44Å; E493-Q497 VanDerWaalsContact O-CG 3.24Å; E493-Q497 WeakPolarHBondContact O-CG 3.2Å; E493-Q497 PolarHBondContact O-N 2.85Å; E493-Q497 VanDerWaalsContact O-N 3.08Å; Q497-E501 PolarHBondContact O-N 3.44Å
498	A	61.3	Low	63.5	Low	11 Å²	11	100.9 Å²	100.9	9%	0.091	54%	0.543	C	S	.	.	H	α-helix	trans	-69.3	-33.8	174.5	0	0	0	0	0	112.9	L494 L495 E496 F504 F510	L494-A498 WeakPolarHBondContact O-CB 3.35Å; L494-A498 PolarHBondContact O-N 3.12Å; L494-A498 VanDerWaalsContact O-N 3.09Å; L495-A498 WeakPolarHBondContact O-CB 3.32Å; L495-A498 PolarHBondContact O-N 2.79Å; E496-A498 PolarHBondContact O-N 3.38Å; A498-F504 HydrophobicContact CB-CZ 4.44Å; A498-F504 VanDerWaalsContact O-CE2 3.26Å; A498-F504 WeakPolarHBondContact O-CE2 3.49Å; A498-F510 HydrophobicContact CB-CD1 4.37Å; A498-F510 HydrophobicContact CB-CE1 3.4Å; A498-F510 VanDerWaalsContact CB-CE1 3.4Å; A498-F510 HydrophobicContact CB-CZ 3.7Å
499	A	61.5	Low	62.4	Low	69 Å²	69	100.9 Å²	100.9	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-76.2	-30.1	178.1	0	0	0	0	0	112.5	L495 E496	L495-A499 PolarHBondContact O-N 3.47Å; E496-A499 PolarHBondContact O-N 3.2Å
500	E	62.5	Low	61.9	Low	152 Å²	152	98.3 Å²	98.3	71%	0.71	54%	0.54	S	S	*	.	H	α-helix	trans	-69.4	-31	172.4	-68	-169.1	148.6	0	0	112.8	E496 L502	E496-E500 PolarHBondContact O-N 3.5Å; E500-L502 PolarHBondContact O-N 3.4Å
501	E	61	Low	61.2	Low	131 Å²	131	98.6 Å²	98.6	61%	0.612	53%	0.534	S	S	*	.	S	Bend	trans	-78.8	84.1	174.2	-72.6	-164.6	177.6	0	0	112	Q497 S503	Q497-E501 PolarHBondContact O-N 3.44Å; E501-S503 PolarHBondContact O-N 2.7Å
502	L	50.4	Low	60.4	Low	159 Å²	159	101.3 Å²	101.3	83%	0.832	55%	0.548	S	S	*	.			trans	-64.3	59.3	177.7	-68.2	173.3	0	0	0	114.7	E500	E500-L502 PolarHBondContact O-N 3.4Å
503	S	48.9	Very low	60.3	Low	93 Å²	93	100.9 Å²	100.9	65%	0.65	55%	0.546	S	S	*	.			trans	-154	53.6	176.5	-78.1	0	0	0	0	112.9	E501 S505	E501-S503 PolarHBondContact O-N 2.7Å; S503-S505 VanDerWaalsContact C-N 3.27Å; S503-S505 PolarHBondContact O-N 2.69Å
504	F	50.5	Low	60	Low	153 Å²	153	98 Å²	98	67%	0.671	54%	0.536	S	S	*	.			trans	-67.6	80.7	168	-82.7	-90.8	0	0	0	111.9	A498 V511	A498-F504 HydrophobicContact CB-CZ 4.44Å; A498-F504 VanDerWaalsContact O-CE2 3.26Å; A498-F504 WeakPolarHBondContact O-CE2 3.49Å; F504-V511 HydrophobicContact CD1-CG2 4.34Å; F504-V511 HydrophobicContact CE1-CG2 4.34Å
505	S	47.8	Very low	59.7	Low	76 Å²	76	99.6 Å²	99.6	53%	0.531	54%	0.544	S	S	.	.			trans	-109.9	139	161.7	62.3	0	0	0	0	109.5	S503 N507 S508	S503-S505 VanDerWaalsContact C-N 3.27Å; S503-S505 PolarHBondContact O-N 2.69Å; S505-N507 PolarHBondContact O-N 2.96Å; S505-S508 PolarHBondContact O-N 2.9Å
506	S	45.8	Very low	59.3	Low	117 Å²	117	97.7 Å²	97.7	82%	0.818	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	3.3	-162.8	-48.4	0	0	0	0	116.7
507	N	48.2	Very low	58.6	Low	161 Å²	161	96.5 Å²	96.5	86%	0.861	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	7	175.4	-89.1	-14.2	0	0	0	113.6	S505 S509	S505-N507 PolarHBondContact O-N 2.96Å; N507-S509 PolarHBondContact O-N 2.84Å
508	S	59.3	Low	58.5	Low	36 Å²	36	94.8 Å²	94.8	25%	0.252	53%	0.53	S	S	.	.			trans	-64	134.7	176.9	90.2	0	0	0	0	110.9	S505 F510 V511 M512	S505-S508 PolarHBondContact O-N 2.9Å; S508-F510 PolarHBondContact O-N 2.79Å; S508-V511 PolarHBondContact O-N 2.96Å; S508-V511 PolarHBondContact OG-N 2.78Å; S508-M512 PolarHBondContact O-N 3.36Å
509	S	56.9	Low	58.5	Low	106 Å²	106	99.7 Å²	99.7	74%	0.741	55%	0.551	S	S	*	*	H	α-helix	trans	-64.1	-15.2	-179.7	53	0	0	0	0	113.1	N507 K513	N507-S509 PolarHBondContact O-N 2.84Å; S509-K513 VanDerWaalsContact O-CB 3.3Å; S509-K513 WeakPolarHBondContact O-CB 3.26Å; S509-K513 PolarHBondContact O-N 2.88Å
510	F	59.9	Low	58.3	Low	51 Å²	51	102.3 Å²	102.3	22%	0.224	55%	0.551	C	S	.	*	H	α-helix	trans	-71.2	-49.6	174.1	-170.9	-83	0	0	0	111.7	L494 A498 S508 M512 K513 V514	L494-F510 HydrophobicContact CG-CZ 4.22Å; A498-F510 HydrophobicContact CB-CD1 4.37Å; A498-F510 HydrophobicContact CB-CE1 3.4Å; A498-F510 VanDerWaalsContact CB-CE1 3.4Å; A498-F510 HydrophobicContact CB-CZ 3.7Å; S508-F510 PolarHBondContact O-N 2.79Å; F510-M512 VanDerWaalsContact C-N 3.3Å; F510-M512 PolarHBondContact O-N 3.05Å; F510-K513 WeakPolarHBondContact O-CA 3.38Å; F510-K513 WeakPolarHBondContact O-CB 3.42Å; F510-K513 PolarHBondContact O-N 2.67Å; F510-V514 HydrophobicContact CD1-CG2 3.86Å; F510-V514 HydrophobicContact CE1-CG2 3.45Å; F510-V514 VanDerWaalsContact CE1-CG2 3.45Å; F510-V514 HydrophobicContact CZ-CG2 4.11Å; F510-V514 PolarHBondContact O-N 3.12Å
511	V	64.6	Low	58.1	Low	43 Å²	43	100 Å²	100	26%	0.261	54%	0.539	S	S	.	.	H	α-helix	trans	-59.3	-43.1	178.2	173.2	0	0	0	0	110.8	F504 S508 K513 V514 L515	F504-V511 HydrophobicContact CD1-CG2 4.34Å; F504-V511 HydrophobicContact CE1-CG2 4.34Å; S508-V511 PolarHBondContact O-N 2.96Å; S508-V511 PolarHBondContact OG-N 2.78Å; V511-K513 VanDerWaalsContact C-N 3.27Å; V511-K513 PolarHBondContact O-N 2.63Å; V511-V514 PolarHBondContact O-N 3.04Å; V511-L515 HydrophobicContact CG1-CD1 3.97Å; V511-L515 WeakPolarHBondContact O-CB 3.46Å; V511-L515 WeakPolarHBondContact O-CG 3.43Å; V511-L515 PolarHBondContact O-N 3.23Å
512	M	60.3	Low	57.8	Low	126 Å²	126	100.7 Å²	100.7	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-61.5	-34.7	175	-166.3	60.7	62	0	0	112.6	S508 F510 C516	S508-M512 PolarHBondContact O-N 3.36Å; F510-M512 VanDerWaalsContact C-N 3.3Å; F510-M512 PolarHBondContact O-N 3.05Å; M512-C516 VanDerWaalsContact O-CB 3.24Å; M512-C516 WeakPolarHBondContact O-CB 3.3Å; M512-C516 PolarHBondContact O-N 3.28Å
513	K	64.6	Low	57.5	Low	141 Å²	141	99.3 Å²	99.3	61%	0.613	53%	0.525	S	S	*	.	H	α-helix	trans	-74.2	-39.5	178.9	-170.6	-178.2	179.4	-167.5	0	112.2	S509 F510 V511 C516 L517	S509-K513 VanDerWaalsContact O-CB 3.3Å; S509-K513 WeakPolarHBondContact O-CB 3.26Å; S509-K513 PolarHBondContact O-N 2.88Å; F510-K513 WeakPolarHBondContact O-CA 3.38Å; F510-K513 WeakPolarHBondContact O-CB 3.42Å; F510-K513 PolarHBondContact O-N 2.67Å; V511-K513 VanDerWaalsContact C-N 3.27Å; V511-K513 PolarHBondContact O-N 2.63Å; K513-C516 PolarHBondContact O-N 3.28Å; K513-L517 WeakPolarHBondContact O-CB 3.22Å; K513-L517 PolarHBondContact O-N 2.98Å
514	V	69.3	Low	57.4	Low	53 Å²	53	99.6 Å²	99.6	32%	0.321	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-49.2	172.5	173.8	0	0	0	0	110.4	F510 V511 C516 L517 D518	F510-V514 HydrophobicContact CD1-CG2 3.86Å; F510-V514 HydrophobicContact CE1-CG2 3.45Å; F510-V514 VanDerWaalsContact CE1-CG2 3.45Å; F510-V514 HydrophobicContact CZ-CG2 4.11Å; F510-V514 PolarHBondContact O-N 3.12Å; V511-V514 PolarHBondContact O-N 3.04Å; V514-C516 VanDerWaalsContact C-N 3.3Å; V514-C516 PolarHBondContact O-N 3.08Å; V514-L517 WeakPolarHBondContact O-CB 3.47Å; V514-L517 PolarHBondContact O-N 3.1Å; V514-D518 WeakPolarHBondContact O-CB 3.24Å; V514-D518 PolarHBondContact O-N 3.09Å
515	L	63.5	Low	57.1	Low	93 Å²	93	95.4 Å²	95.4	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-37.6	176	-71.9	170.1	0	0	0	112.5	V511 Q519	V511-L515 HydrophobicContact CG1-CD1 3.97Å; V511-L515 WeakPolarHBondContact O-CB 3.46Å; V511-L515 WeakPolarHBondContact O-CG 3.43Å; V511-L515 PolarHBondContact O-N 3.23Å; L515-Q519 VanDerWaalsContact O-CB 3.26Å; L515-Q519 WeakPolarHBondContact O-CB 3.36Å; L515-Q519 PolarHBondContact O-N 2.87Å
516	C	63.7	Low	56.9	Low	72 Å²	72	98.6 Å²	98.6	49%	0.486	53%	0.53	S	S	.	.	H	α-helix	trans	-69.4	-36.6	176.3	-169.7	0	0	0	0	112.7	M512 K513 V514 Q520	M512-C516 VanDerWaalsContact O-CB 3.24Å; M512-C516 WeakPolarHBondContact O-CB 3.3Å; M512-C516 PolarHBondContact O-N 3.28Å; K513-C516 PolarHBondContact O-N 3.28Å; V514-C516 VanDerWaalsContact C-N 3.3Å; V514-C516 PolarHBondContact O-N 3.08Å; C516-Q520 WeakPolarHBondContact O-CB 3.36Å; C516-Q520 PolarHBondContact O-N 2.84Å
517	L	63.7	Low	56.7	Low	92 Å²	92	96.3 Å²	96.3	48%	0.482	53%	0.526	S	S	.	.	H	α-helix	trans	-65.8	-46.4	173.4	-100.1	147.8	0	0	0	111.5	K513 V514 Q520 K521	K513-L517 WeakPolarHBondContact O-CB 3.22Å; K513-L517 PolarHBondContact O-N 2.98Å; V514-L517 WeakPolarHBondContact O-CB 3.47Å; V514-L517 PolarHBondContact O-N 3.1Å; L517-Q520 CarbonylContact O-C 3.54Å; L517-Q520 WeakPolarHBondContact O-CB 3.43Å; L517-Q520 PolarHBondContact O-N 3.38Å; L517-K521 PolarHBondContact O-N 2.92Å
518	D	63.8	Low	56	Low	56 Å²	56	96.4 Å²	96.4	30%	0.299	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-41.7	174.9	167.3	39.9	0	0	0	111.8	V514 K521 R522	V514-D518 WeakPolarHBondContact O-CB 3.24Å; V514-D518 PolarHBondContact O-N 3.09Å; D518-K521 WeakPolarHBondContact O-CB 3.46Å; D518-K521 PolarHBondContact O-N 3.22Å; D518-R522 VanDerWaalsContact CG-CZ 3.45Å; D518-R522 VanDerWaalsContact CG-NH2 3.3Å; D518-R522 WeakPolarHBondContact O-CG 3.3Å; D518-R522 PolarHBondContact O-N 2.82Å; D518-R522 PolarHBondContact O-NH1 3.37Å; D518-R522 IonicContact OD1-CZ 3.03Å; D518-R522 IonicContact OD1-NE 3.15Å; D518-R522 IonicContact OD1-NH1 2.79Å; D518-R522 PolarHBondContact OD1-NH1 2.88Å; D518-R522 IonicContact OD1-NH2 2.69Å; D518-R522 PolarHBondContact OD1-NH2 2.89Å; D518-R522 VanDerWaalsContact OD1-NH2 3.12Å; D518-R522 IonicContact OD2-CZ 3.89Å; D518-R522 IonicContact OD2-NH1 2.72Å; D518-R522 PolarHBondContact OD2-NH1 3.28Å; D518-R522 IonicContact OD2-NH2 3.21Å; D518-R522 PolarHBondContact OD2-NH2 3.27Å
519	Q	62.3	Low	54.8	Low	113 Å²	113	104.1 Å²	104.1	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-63.3	-40.8	171.4	-172.2	168.5	89.1	0	0	112.2	L515 K521 R522 H523	L515-Q519 VanDerWaalsContact O-CB 3.26Å; L515-Q519 WeakPolarHBondContact O-CB 3.36Å; L515-Q519 PolarHBondContact O-N 2.87Å; Q519-K521 VanDerWaalsContact C-N 3.33Å; Q519-K521 PolarHBondContact O-N 2.79Å; Q519-R522 PolarHBondContact O-N 2.87Å; Q519-H523 PolarHBondContact O-CD2 2.97Å; Q519-H523 PolarHBondContact O-N 2.94Å
520	Q	57.1	Low	53.8	Low	124 Å²	124	107.5 Å²	107.5	58%	0.579	56%	0.561	S	S	*	*	H	α-helix	trans	-66	-33.7	174.3	-169.4	172.4	10.7	0	0	112.3	C516 L517 H523 S524	C516-Q520 WeakPolarHBondContact O-CB 3.36Å; C516-Q520 PolarHBondContact O-N 2.84Å; L517-Q520 CarbonylContact O-C 3.54Å; L517-Q520 WeakPolarHBondContact O-CB 3.43Å; L517-Q520 PolarHBondContact O-N 3.38Å; Q520-H523 PolarHBondContact O-N 3.03Å; Q520-S524 WeakPolarHBondContact O-CB 2.85Å; Q520-S524 PolarHBondContact O-N 2.88Å; Q520-S524 PolarHBondContact O-OG 3.07Å
521	K	58.6	Low	52.3	Low	104 Å²	104	116.7 Å²	116.7	45%	0.452	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-46.4	171.9	-137.9	-179	-168.1	-175.7	0	110.7	E491 L517 D518 Q519 H523 S524 A525	E491-K521 VanDerWaalsContact OE1-CE 3.3Å; E491-K521 WeakPolarHBondContact OE1-CE 3.39Å; E491-K521 IonicContact OE1-NZ 2.9Å; E491-K521 PolarHBondContact OE1-NZ 3.29Å; E491-K521 IonicContact OE2-NZ 2.78Å; E491-K521 PolarHBondContact OE2-NZ 3.33Å; L517-K521 PolarHBondContact O-N 2.92Å; D518-K521 WeakPolarHBondContact O-CB 3.46Å; D518-K521 PolarHBondContact O-N 3.22Å; Q519-K521 VanDerWaalsContact C-N 3.33Å; Q519-K521 PolarHBondContact O-N 2.79Å; K521-H523 PolarHBondContact O-N 3.33Å; K521-S524 PolarHBondContact O-N 3.1Å; K521-S524 VanDerWaalsContact O-N 3.14Å; K521-A525 PolarHBondContact O-N 3.43Å; K521-A525 VanDerWaalsContact O-N 3.13Å
522	R	53.8	Low	51.1	Low	146 Å²	146	124.7 Å²	124.7	55%	0.551	62%	0.62	S	S	*	*	H	α-helix	trans	-59.6	-42.7	173.9	-67.8	-174.5	-167.4	87.5	0.4	112.9	D518 Q519 S524 A525	D518-R522 VanDerWaalsContact CG-CZ 3.45Å; D518-R522 VanDerWaalsContact CG-NH2 3.3Å; D518-R522 WeakPolarHBondContact O-CG 3.3Å; D518-R522 PolarHBondContact O-N 2.82Å; D518-R522 PolarHBondContact O-NH1 3.37Å; D518-R522 IonicContact OD1-CZ 3.03Å; D518-R522 IonicContact OD1-NE 3.15Å; D518-R522 IonicContact OD1-NH1 2.79Å; D518-R522 PolarHBondContact OD1-NH1 2.88Å; D518-R522 IonicContact OD1-NH2 2.69Å; D518-R522 PolarHBondContact OD1-NH2 2.89Å; D518-R522 VanDerWaalsContact OD1-NH2 3.12Å; D518-R522 IonicContact OD2-CZ 3.89Å; D518-R522 IonicContact OD2-NH1 2.72Å; D518-R522 PolarHBondContact OD2-NH1 3.28Å; D518-R522 IonicContact OD2-NH2 3.21Å; D518-R522 PolarHBondContact OD2-NH2 3.27Å; Q519-R522 PolarHBondContact O-N 2.87Å; R522-S524 VanDerWaalsContact C-N 3.28Å; R522-S524 PolarHBondContact O-N 3.48Å; R522-A525 PolarHBondContact O-N 3.17Å
523	H	45.8	Very low	49.6	Very low	129 Å²	129	126.3 Å²	126.3	60%	0.597	63%	0.63	S	S	*	*	H	α-helix	trans	-66.1	-29.5	175.9	-73.1	-59.4	0	0	0	113.3	Q519 Q520 K521 A525	Q519-H523 PolarHBondContact O-CD2 2.97Å; Q519-H523 PolarHBondContact O-N 2.94Å; Q520-H523 PolarHBondContact O-N 3.03Å; K521-H523 PolarHBondContact O-N 3.33Å; H523-A525 VanDerWaalsContact C-N 3.34Å
524	S	44.8	Very low	48	Very low	99 Å²	99	124.5 Å²	124.5	69%	0.692	64%	0.636	S	S	*	*	H	α-helix	trans	-79.4	-16.6	177.4	-53.6	0	0	0	0	113.3	Q520 K521 R522	Q520-S524 WeakPolarHBondContact O-CB 2.85Å; Q520-S524 PolarHBondContact O-N 2.88Å; Q520-S524 PolarHBondContact O-OG 3.07Å; K521-S524 PolarHBondContact O-N 3.1Å; K521-S524 VanDerWaalsContact O-N 3.14Å; R522-S524 VanDerWaalsContact C-N 3.28Å; R522-S524 PolarHBondContact O-N 3.48Å
525	A	45.2	Very low	46.3	Very low	66 Å²	66	127.1 Å²	127.1	55%	0.545	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.6	-1.4	179.6	0	0	0	0	0	114.2	K521 R522 H523 G527	K521-A525 PolarHBondContact O-N 3.43Å; K521-A525 VanDerWaalsContact O-N 3.13Å; R522-A525 PolarHBondContact O-N 3.17Å; H523-A525 VanDerWaalsContact C-N 3.34Å; A525-G527 VanDerWaalsContact C-N 3.25Å; A525-G527 PolarHBondContact O-N 3.49Å
526	I	44	Very low	44.9	Very low	142 Å²	142	128.9 Å²	128.9	73%	0.728	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	75.9	179.2	-51.3	177.6	0	0	0	109.4
527	G	42.3	Very low	43.5	Very low	70 Å²	70	131.5 Å²	131.5	72%	0.722	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-179	-15	179.9	0	0	0	0	0	116.9	A525	A525-G527 VanDerWaalsContact C-N 3.25Å; A525-G527 PolarHBondContact O-N 3.49Å
528	L	33.1	Very low	41.8	Very low	163 Å²	163	135.4 Å²	135.4	85%	0.853	71%	0.706	S	S	*	*	S	Bend	trans	-135.4	140.9	173.3	-70.4	173.3	0	0	0	109.9
529	H	33.1	Very low	40	Very low	198 Å²	198	142.2 Å²	142.2	92%	0.917	73%	0.733	S	S	*	*			trans	-75.7	156.8	-171.8	-82.4	-88.9	0	0	0	113.9
530	Q	36.2	Very low	38.4	Very low	177 Å²	177	142.2 Å²	142.2	83%	0.827	75%	0.746	S	S	*	*			trans	-72.3	144.2	-165.7	-60	160.9	-6.7	0	0	113.5
531	R	28.6	Very low	36.9	Very low	244 Å²	244	141.3 Å²	141.3	92%	0.921	76%	0.76	S	S	*	*			trans	-123.5	120.6	140.6	-153.1	176.9	-168	-159	1.8	107.1
532	R	39.9	Very low	35.3	Very low	210 Å²	210	142.2 Å²	142.2	79%	0.792	78%	0.779	S	S	*	*			trans	-104	129.1	-167.6	-176	-178.4	-179.9	-157.1	-1.5	109.5
533	L	29.1	Very low	34.1	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	79%	0.794	S	S	*	*			trans	-86.6	133.5	172	-67.3	174.8	0	0	0	110.6
534	S	31.1	Very low	33.2	Very low	104 Å²	104	143 Å²	143	73%	0.727	80%	0.801	S	S	*	*			trans	52.3	162.2	153.4	62.1	0	0	0	0	122.6
535	S	32.5	Very low	32.3	Very low	108 Å²	108	148 Å²	148	76%	0.755	81%	0.81	S	S	*	*			trans	77.7	138.1	167.3	71.7	0	0	0	0	119.7
536	T	33.9	Very low	31.5	Very low	130 Å²	130	150.8 Å²	150.8	80%	0.798	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-90.2	162.5	-179	37.2	0	0	0	0	112.3
537	P	34.3	Very low	30.7	Very low	127 Å²	127	153.4 Å²	153.4	83%	0.825	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.4	119.9	-174.4	32.7	-33	0	0	0	113
538	I	27.4	Very low	30	Very low	173 Å²	173	160 Å²	160	89%	0.887	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-87.7	137.1	164	-65.7	-179.3	0	0	0	109.8
539	K	27.6	Very low	29.5	Very low	199 Å²	199	156 Å²	156	87%	0.865	84%	0.839	S	S	*	*			trans	-107	96.2	-169	176.9	-174.2	176.5	-174.9	0	110.1
540	S	28.6	Very low	29.1	Very low	114 Å²	114	150.5 Å²	150.5	80%	0.797	84%	0.836	S	S	*	*			trans	-77	137.5	166	48	0	0	0	0	110.4
541	A	25.7	Very low	28.6	Very low	105 Å²	105	145.6 Å²	145.6	87%	0.868	83%	0.833	S	S	*	*			trans	-74.9	139.7	-179.6	0	0	0	0	0	111.2
542	S	25.3	Very low	28.5	Very low	123 Å²	123	139.9 Å²	139.9	86%	0.86	82%	0.824	S	S	*	*			trans	-89.9	109.9	174.9	58	0	0	0	0	110.8
543	E	27.2	Very low	27.8	Very low	185 Å²	185	137.5 Å²	137.5	86%	0.864	82%	0.823	S	S	*	*			trans	-84.1	145.9	167.1	-162.8	163.7	-138.8	0	0	111.2
544	S	27	Very low	27.8	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	82%	0.817	S	S	*	*			trans	4.6	113.5	179.9	62.9	0	0	0	0	120.2
545	K	25.6	Very low	27.5	Very low	204 Å²	204	137 Å²	137	89%	0.887	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-96.4	122.2	149.6	-102.1	-176.3	178.7	173.7	0	109.5
546	P	29.4	Very low	27.3	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-72.8	126.1	163.7	29.5	-31.7	0	0	0	109.6
547	Q	27.6	Very low	27	Very low	197 Å²	197	135.8 Å²	135.8	92%	0.921	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.4	143.5	174	-172	165.6	-17.6	0	0	111
548	K	26.3	Very low	26.8	Very low	209 Å²	209	137.3 Å²	137.3	91%	0.909	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-94.8	127	-169	-173.7	177.7	-175.3	175.2	0	112.5
549	G	23.9	Very low	26.8	Very low	79 Å²	79	135 Å²	135	81%	0.814	79%	0.794	S	S	*	*			trans	175	124	165.7	0	0	0	0	0	110.6
550	G	24.5	Very low	26.9	Very low	83 Å²	83	133.7 Å²	133.7	86%	0.856	78%	0.783	S	S	*	*			cis	-167.5	174.7	-7.8	0	0	0	0	0	109.6
551	G	24.3	Very low	26.8	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	78%	0.78	S	S	*	*			trans	148.4	97.5	176.7	0	0	0	0	0	115.9
552	V	26.6	Very low	26.9	Very low	124 Å²	124	134 Å²	134	75%	0.752	77%	0.772	S	S	*	*				38.4	113.9	121.2	-175.2	0	0	0	0	119.3
553	Q	26.3	Very low	26.9	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.752	77%	0.768	S	S	*	*			trans	82.5	123.2	147.1	-72.9	-177.2	75.4	0	0	123.6
554	L	28.1	Very low	26.8	Very low	136 Å²	136	131.6 Å²	131.6	71%	0.712	76%	0.763	S	S	*	*			trans	69.4	139.7	133.3	-92.1	75.5	0	0	0	124.1
555	T	26.6	Very low	26.8	Very low	117 Å²	117	133.7 Å²	133.7	72%	0.718	77%	0.765	S	S	*	*			trans	58.2	106.1	148.9	50.5	0	0	0	0	119.3
556	D	26.6	Very low	26.8	Very low	165 Å²	165	131.7 Å²	131.7	88%	0.882	76%	0.759	S	S	*	*				97.4	147.7	68.1	-172.9	32	0	0	0	112.3
557	G	27.8	Very low	26.8	Very low	48 Å²	48	130.7 Å²	130.7	50%	0.495	76%	0.755	S	S	.	*			trans	96.7	99.5	158	0	0	0	0	0	120
558	L	30.4	Very low	26.8	Very low	159 Å²	159	127.7 Å²	127.7	83%	0.832	75%	0.749	S	S	*	*			trans	62.5	165.7	134	-85.7	74.3	0	0	0	119.7
559	E	26.6	Very low	26.8	Very low	125 Å²	125	122 Å²	122	58%	0.584	74%	0.742	S	S	*	*			cis	-163	164.8	-40.6	-132.2	-174.5	-177.6	0	0	109.2
560	R	30.6	Very low	27	Very low	170 Å²	170	123.3 Å²	123.3	64%	0.642	74%	0.738	S	S	*	*			trans	71.3	135.1	150.5	-69.8	174.8	-158.5	-79.2	-17.2	123.6
561	E	26	Very low	27.1	Very low	156 Å²	156	128.5 Å²	128.5	73%	0.729	74%	0.74	S	S	*	*				37.2	135	117.7	-46.4	168.7	126.7	0	0	119.6
562	G	27.3	Very low	27.3	Very low	69 Å²	69	128.8 Å²	128.8	71%	0.711	74%	0.743	S	S	*	*			cis	144.4	170	-6.9	0	0	0	0	0	114.8
563	I	26.3	Very low	27.2	Very low	151 Å²	151	129.1 Å²	129.1	77%	0.774	75%	0.751	S	S	*	*			trans	72.4	108.1	151.8	-57.3	169.9	0	0	0	118.7
564	S	24.5	Very low	27.4	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	76%	0.756	S	S	*	*			trans	67.1	169.8	144.3	-66.1	0	0	0	0	119.3
565	L	27	Very low	27.5	Very low	149 Å²	149	135.4 Å²	135.4	78%	0.78	77%	0.768	S	S	*	*			cis	-143.4	-172	6.9	-136.4	153.6	0	0	0	111.2
566	E	26.3	Very low	27.6	Very low	163 Å²	163	132.6 Å²	132.6	76%	0.762	76%	0.762	S	S	*	*			trans	-94.9	163.9	-163.8	-56.3	159.3	79.8	0	0	116
567	S	29	Very low	27.8	Very low	102 Å²	102	133 Å²	133	71%	0.713	77%	0.765	S	S	*	*				98.9	136.3	129.6	76.3	0	0	0	0	123.3
568	V	27.4	Very low	28	Very low	134 Å²	134	134.9 Å²	134.9	81%	0.812	78%	0.775	S	S	*	*			trans	63.9	104.3	146.7	-64.7	0	0	0	0	124.5
569	A	27.4	Very low	28	Very low	90 Å²	90	134.2 Å²	134.2	74%	0.744	77%	0.772	S	S	*	*				83.9	127.8	109.1	0	0	0	0	0	124.2
570	S	28.5	Very low	28.1	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	78%	0.782	S	S	*	*			trans	79	114.3	137.3	-61.1	0	0	0	0	124.2
571	E	26.6	Very low	27.9	Very low	193 Å²	193	133.3 Å²	133.3	90%	0.902	79%	0.786	S	S	*	*			trans	65	114.9	131.4	-59	-169.1	136	0	0	123.7
572	G	27.9	Very low	27.9	Very low	79 Å²	79	134.3 Å²	134.3	81%	0.814	79%	0.791	S	S	*	*				107.9	121.6	112.3	0	0	0	0	0	120.8
573	S	25.1	Very low	27.9	Very low	130 Å²	130	136.7 Å²	136.7	91%	0.909	79%	0.792	S	S	*	*			trans	-169.2	167.3	143.6	-143.8	0	0	0	0	114
574	M	30.1	Very low	27.9	Very low	174 Å²	174	134.9 Å²	134.9	86%	0.857	79%	0.788	S	S	*	*			trans	-123.2	150.7	-174.6	-58.3	179.7	-176.5	0	0	115
575	R	29.8	Very low	28	Very low	255 Å²	255	138.5 Å²	138.5	96%	0.962	79%	0.793	S	S	*	*			trans	-177.8	147.6	142.2	-113.7	168.5	-109.6	-111	-2.5	110.8
576	G	28.8	Very low	27.9	Very low	59 Å²	59	135.6 Å²	135.6	61%	0.608	80%	0.799	S	S	*	*			cis	162.5	153.7	-9.7	0	0	0	0	0	112.7
577	N	31.2	Very low	27.9	Very low	174 Å²	174	130.9 Å²	130.9	93%	0.93	79%	0.793	S	S	*	*			trans	67.7	149.2	178.1	-51.3	-9.6	0	0	0	115.5
578	A	30.5	Very low	27.9	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	79%	0.793	S	S	*	*			cis	-168.9	-179.5	-23.3	0	0	0	0	0	106.7
579	L	31.4	Very low	27.9	Very low	145 Å²	145	134.7 Å²	134.7	76%	0.759	78%	0.783	S	S	*	*			cis	-149.3	-170.4	17.4	-98.5	-177.9	0	0	0	110.8
580	Q	27.8	Very low	28.1	Very low	172 Å²	172	133.2 Å²	133.2	80%	0.804	77%	0.767	S	S	*	*			trans	-12.1	147.2	155.7	-62.2	165.2	1.8	0	0	118.8
581	S	26.4	Very low	27.9	Very low	103 Å²	103	136 Å²	136	72%	0.72	77%	0.769	S	S	*	*			cis	-156.8	146.2	26.7	54.3	0	0	0	0	116.1
582	E	25.9	Very low	28.3	Very low	177 Å²	177	130.6 Å²	130.6	83%	0.827	76%	0.757	S	S	*	*			trans	47.7	134.5	145.1	-62.5	-165.5	132.9	0	0	122.7
583	V	27.1	Very low	28.8	Very low	120 Å²	120	131.5 Å²	131.5	73%	0.727	75%	0.749	S	S	*	*			cis	91.1	123.5	38	164.7	0	0	0	0	111.9
584	T	27.8	Very low	29	Very low	113 Å²	113	133 Å²	133	69%	0.693	74%	0.741	S	S	*	*			cis	-159.6	167.4	2.1	13.7	0	0	0	0	114
585	E	25.3	Very low	29	Very low	184 Å²	184	130.3 Å²	130.3	86%	0.86	73%	0.731	S	S	*	*			trans	53	123.2	147.5	-68.4	-178.2	147.1	0	0	123.8
586	G	25.1	Very low	28.9	Very low	88 Å²	88	125.1 Å²	125.1	91%	0.907	72%	0.722	S	S	*	*				82.4	126.6	107.5	0	0	0	0	0	122.5
587	G	27.7	Very low	28.9	Very low	63 Å²	63	130.3 Å²	130.3	65%	0.649	73%	0.73	S	S	*	*			trans	134.6	112.7	142	0	0	0	0	0	120.3
588	R	28	Very low	28.6	Very low	186 Å²	186	129 Å²	129	70%	0.702	72%	0.721	S	S	*	*			trans	64.9	119.4	133.3	-71.5	178	174.5	-88.4	-4.6	123.1
589	E	27.1	Very low	28.4	Very low	130 Å²	130	129.2 Å²	129.2	61%	0.607	72%	0.718	S	S	*	*				79.7	157.5	117.8	-67.3	165.4	155.1	0	0	124.5	Q171	Q171-E589 PolarHBondContact N-O 2.95Å
590	S	31.2	Very low	28.2	Very low	59 Å²	59	130.5 Å²	130.5	41%	0.413	72%	0.72	S	S	.	*			trans	83.3	105.7	155.4	-58.9	0	0	0	0	122.6	G169 A170	G169-S590 VanDerWaalsContact O-CB 3.24Å; G169-S590 WeakPolarHBondContact O-CB 3.17Å; G169-S590 PolarHBondContact O-OG 3.48Å; A170-S590 WeakPolarHBondContact CA-O 3.5Å
591	E	25.8	Very low	28	Very low	165 Å²	165	132.2 Å²	132.2	77%	0.771	73%	0.725	S	S	*	*				69.3	142.1	123.8	-60	-57.6	90.2	0	0	123.3
592	A	33.4	Very low	28	Very low	80 Å²	80	130.4 Å²	130.4	66%	0.661	72%	0.723	S	S	*	*			trans	-84.7	179.3	165.3	0	0	0	0	0	111.6
593	P	38.3	Very low	28.1	Very low	98 Å²	98	125.7 Å²	125.7	64%	0.636	72%	0.721	S	S	*	*				-140.1	157.7	87.7	15.5	8.6	0	0	0	116	L167	L167-P593 HydrophobicContact CD2-CG 4.38Å
594	Q	30.2	Very low	28.1	Very low	161 Å²	161	129.2 Å²	129.2	75%	0.752	73%	0.727	S	S	*	*				23.1	152.8	113.8	-75.7	-178.2	-87.4	0	0	120.4
595	D	29.6	Very low	27.9	Very low	118 Å²	118	132.4 Å²	132.4	63%	0.631	73%	0.734	S	S	*	*			cis	-156.7	-175.4	18.4	-116.6	-19.7	0	0	0	113.6
596	D	28.7	Very low	28.1	Very low	145 Å²	145	129.1 Å²	129.1	78%	0.775	73%	0.726	S	S	*	*			trans	73.8	144.8	160.8	-57.7	-27.1	0	0	0	121.6
597	E	28.7	Very low	28.1	Very low	168 Å²	168	131 Å²	131	79%	0.785	72%	0.72	S	S	*	*			cis	-165.9	-174.4	-45.2	-142.9	-150.1	169.1	0	0	110.1
598	I	25	Very low	28	Very low	146 Å²	146	133.8 Å²	133.8	75%	0.749	72%	0.724	S	S	*	*			trans	85.4	116.5	158.5	-44.1	-161.7	0	0	0	121.1
599	S	26.6	Very low	27.8	Very low	93 Å²	93	130.7 Å²	130.7	65%	0.65	73%	0.73	S	S	*	*			trans	77.2	99.6	143.6	-168.5	0	0	0	0	122.7
600	E	25.8	Very low	27.6	Very low	171 Å²	171	133.9 Å²	133.9	80%	0.799	74%	0.742	S	S	*	*				88.5	100.9	105.8	-151.7	164.7	173.1	0	0	122.9
601	F	23.5	Very low	27.3	Very low	209 Å²	209	136.6 Å²	136.6	92%	0.917	76%	0.761	S	S	*	*				67.4	131.4	128.1	-138.7	-94.2	0	0	0	122
602	G	27.1	Very low	27.1	Very low	64 Å²	64	133.4 Å²	133.4	66%	0.66	76%	0.763	S	S	*	*			trans	179.7	-80.5	152.9	0	0	0	0	0	120.9
603	G	28.4	Very low	27	Very low	78 Å²	78	135.7 Å²	135.7	80%	0.804	77%	0.771	S	S	*	*			trans	70.5	169.7	-170.6	0	0	0	0	0	115.5
604	K	27.6	Very low	26.5	Very low	194 Å²	194	136.4 Å²	136.4	84%	0.843	78%	0.778	S	S	*	*			cis	-159.4	154.4	-6	-110.9	177.5	-178.6	178.4	0	109
605	E	23.1	Very low	26.4	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	78%	0.783	S	S	*	*			trans	-126.5	130.3	-179.6	-109.2	-170.9	139.2	0	0	114.5
606	V	28.3	Very low	26.6	Very low	115 Å²	115	136.6 Å²	136.6	70%	0.697	79%	0.791	S	S	*	*				41	113.8	119.8	-175.8	0	0	0	0	121.2
607	T	25.8	Very low	26.5	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	79%	0.794	S	S	*	*			trans	64	144.5	140.6	-53.9	0	0	0	0	122.1
608	V	25	Very low	26.4	Very low	122 Å²	122	134.2 Å²	134.2	74%	0.739	78%	0.78	S	S	*	*			trans	167.3	159.9	130.1	157	0	0	0	0	112.2
609	C	24	Very low	26.4	Very low	121 Å²	121	134.7 Å²	134.7	82%	0.818	79%	0.785	S	S	*	*			trans	-68.4	169	-175.6	-49	0	0	0	0	116
610	F	24	Very low	26.4	Very low	197 Å²	197	136.5 Å²	136.5	86%	0.864	78%	0.781	S	S	*	*			trans	-134.8	151.5	176.1	-93.3	-85	0	0	0	114.4
611	S	23.5	Very low	26.6	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	78%	0.778	S	S	*	*			trans	-162.3	141.7	148.5	-81.5	0	0	0	0	110.9
612	A	22.7	Very low	26.7	Very low	98 Å²	98	133 Å²	133	81%	0.81	77%	0.772	S	S	*	*			trans	59.5	99.2	172.1	0	0	0	0	0	118.3
613	P	30.9	Very low	26.7	Very low	128 Å²	128	137.9 Å²	137.9	83%	0.831	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-83.5	150.8	167.3	34.5	-33.7	0	0	0	112.7
614	S	27.9	Very low	26.6	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-100.8	130.5	168.7	56.4	0	0	0	0	111.2	P616	S614-P616 WeakPolarHBondContact O-CD 3.41Å
615	N	28.3	Very low	26.6	Very low	160 Å²	160	136 Å²	136	86%	0.856	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71	129.5	176.3	-77.6	-10.1	0	0	0	112.4
616	P	33.6	Very low	27	Very low	123 Å²	123	135.3 Å²	135.3	80%	0.799	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-83.9	169.2	162.6	35.5	-33.7	0	0	0	111.8	S614	S614-P616 WeakPolarHBondContact O-CD 3.41Å
617	T	27.1	Very low	26.9	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-94.4	126.3	-176.4	48.2	0	0	0	0	114
618	Y	26	Very low	27	Very low	126 Å²	126	134.8 Å²	134.8	49%	0.494	73%	0.734	S	S	.	*			trans	25.9	123.7	131.9	-151.5	-89.2	0	0	0	119.3	K620	Y618-K620 HydrophobicContact CE1-CB 4.2Å; Y618-K620 HydrophobicContact CE1-CD 3.99Å; Y618-K620 HydrophobicContact CE1-CG 4.02Å; Y618-K620 WeakPolarHBondContact OH-CD 3.47Å; Y618-K620 VanDerWaalsContact OH-CE 3.28Å; Y618-K620 WeakPolarHBondContact OH-CE 3.48Å; Y618-K620 PolarHBondContact OH-NZ 3.15Å
619	D	26.1	Very low	26.9	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	74%	0.742	S	S	*	*			trans	-142.4	169	134.7	-158.3	9.7	0	0	0	111.4
620	K	26.7	Very low	27.1	Very low	132 Å²	132	135.3 Å²	135.3	57%	0.574	74%	0.743	S	S	*	*			trans	-146	139.1	-169.4	-101.3	-168.1	-175.9	166.6	0	113.7	Y618	Y618-K620 HydrophobicContact CE1-CB 4.2Å; Y618-K620 HydrophobicContact CE1-CD 3.99Å; Y618-K620 HydrophobicContact CE1-CG 4.02Å; Y618-K620 WeakPolarHBondContact OH-CD 3.47Å; Y618-K620 VanDerWaalsContact OH-CE 3.28Å; Y618-K620 WeakPolarHBondContact OH-CE 3.48Å; Y618-K620 PolarHBondContact OH-NZ 3.15Å
621	R	28.3	Very low	27	Very low	195 Å²	195	134.6 Å²	134.6	74%	0.736	74%	0.742	S	S	*	*			trans	88.7	107.1	160.3	-59.7	161.5	162.4	-80.9	-0.2	118.3	Y623	R621-Y623 HydrophobicContact CB-CD2 4.43Å
622	S	27.1	Very low	27.1	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	74%	0.742	S	S	*	*				-131.6	112.2	112	51.4	0	0	0	0	106.4
623	Y	27.1	Very low	27.3	Very low	165 Å²	165	137.1 Å²	137.1	65%	0.647	73%	0.731	S	S	*	*				75.6	115.8	88.4	-88.8	-116.7	0	0	0	111.9	R621	R621-Y623 HydrophobicContact CB-CD2 4.43Å
624	Q	26.2	Very low	27.3	Very low	121 Å²	121	140.1 Å²	140.1	57%	0.565	73%	0.734	S	S	*	*				75.7	138.6	66.7	-75.6	-152.2	-84.7	0	0	111.7
625	D	26.9	Very low	27.2	Very low	113 Å²	113	141.4 Å²	141.4	60%	0.604	73%	0.727	S	S	*	*			cis	-136.7	-170.3	-13	-74.4	-45.6	0	0	0	106.3
626	E	31.2	Very low	27.1	Very low	166 Å²	166	141.4 Å²	141.4	78%	0.776	73%	0.727	S	S	*	*			cis	-142.9	-162.3	16.9	-86.6	-69.8	-167	0	0	107.7
627	E	26.8	Very low	26.9	Very low	156 Å²	156	141 Å²	141	73%	0.729	72%	0.718	S	S	*	*			cis	-155.3	164.9	6.9	-146.9	-160.2	112	0	0	111.6
628	S	27	Very low	27.1	Very low	73 Å²	73	140.4 Å²	140.4	51%	0.51	71%	0.71	S	S	.	*			trans	40	122.7	143	-75	0	0	0	0	124.7
629	L	24.2	Very low	27.4	Very low	173 Å²	173	141.9 Å²	141.9	91%	0.906	72%	0.722	S	S	*	*				67.4	137.2	126.4	-57.3	170.7	0	0	0	120.7
630	G	26.5	Very low	27.7	Very low	82 Å²	82	141.3 Å²	141.3	85%	0.845	71%	0.714	S	S	*	*			trans	155.9	66.9	172.9	0	0	0	0	0	113.6
631	E	23.6	Very low	27.9	Very low	181 Å²	181	138.9 Å²	138.9	85%	0.846	71%	0.713	S	S	*	*			trans	-92.2	-177.2	170.1	-163.6	160.3	-157.3	0	0	109.8
632	E	24.9	Very low	27.8	Very low	174 Å²	174	136 Å²	136	81%	0.813	71%	0.713	S	S	*	*			trans	73.7	122.7	174	-57.5	166.9	-173.4	0	0	114.6
633	V	27.5	Very low	27.8	Very low	95 Å²	95	135.3 Å²	135.3	58%	0.576	71%	0.708	S	S	*	*			cis	84.7	115.7	28.4	-173.2	0	0	0	0	114.3	E635	V633-E635 HydrophobicContact CG1-CB 4.37Å; V633-E635 HydrophobicContact CG1-CG 3.49Å; V633-E635 VanDerWaalsContact CG1-CG 3.49Å; V633-E635 VanDerWaalsContact CG1-OE1 3.25Å; V633-E635 WeakPolarHBondContact CG1-OE1 3.45Å
634	E	29.8	Very low	27.7	Very low	190 Å²	190	136.8 Å²	136.8	89%	0.888	72%	0.718	S	S	*	*			trans	-159.5	102.1	160.3	-71.4	-80.6	148.8	0	0	103
635	E	27.1	Very low	27.7	Very low	139 Å²	139	134.4 Å²	134.4	65%	0.65	72%	0.719	S	S	*	*			cis	79.6	153.3	39.8	-73.9	-179.4	-176.6	0	0	116.2	V633	V633-E635 HydrophobicContact CG1-CB 4.37Å; V633-E635 HydrophobicContact CG1-CG 3.49Å; V633-E635 VanDerWaalsContact CG1-CG 3.49Å; V633-E635 VanDerWaalsContact CG1-OE1 3.25Å; V633-E635 WeakPolarHBondContact CG1-OE1 3.45Å
636	D	25.2	Very low	27.8	Very low	160 Å²	160	134.2 Å²	134.2	86%	0.856	73%	0.726	S	S	*	*			trans	133.5	81.6	-175.8	-89.5	-10	0	0	0	107.4
637	D	30	Very low	27.6	Very low	114 Å²	114	134 Å²	134	61%	0.61	73%	0.73	S	S	*	*			cis	53.7	152.3	22.6	-63.1	-46.7	0	0	0	115
638	D	31.4	Very low	27.6	Very low	125 Å²	125	130.1 Å²	130.1	67%	0.668	73%	0.725	S	S	*	*			cis	-130.1	-164.6	-3.4	-148.6	-35.9	0	0	0	108.8
639	E	31.9	Very low	27.7	Very low	158 Å²	158	134.9 Å²	134.9	74%	0.738	75%	0.745	S	S	*	*				-166.4	130.4	58.5	-90	-92.5	148	0	0	111
640	E	32.5	Very low	27.9	Very low	144 Å²	144	130.5 Å²	130.5	67%	0.673	74%	0.742	S	S	*	*				51.4	147.5	119.8	-79.6	-118.2	170.7	0	0	121.1
641	S	29.9	Very low	28	Very low	80 Å²	80	132 Å²	132	56%	0.559	74%	0.739	S	S	*	*			cis	-165.2	-179.6	5.6	-145.3	0	0	0	0	108.9
642	N	27.5	Very low	28.3	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	73%	0.734	S	S	*	*			cis	-170.9	153.6	29.5	-149.7	-55.9	0	0	0	113.3
643	S	26.4	Very low	28.4	Very low	96 Å²	96	128.1 Å²	128.1	67%	0.671	73%	0.734	S	S	*	*			trans	58.9	135.3	145.5	150.1	0	0	0	0	120.6
644	F	25.7	Very low	28.5	Very low	197 Å²	197	129.9 Å²	129.9	86%	0.864	74%	0.739	S	S	*	*				-159.4	158.7	56.2	-170.5	-106.4	0	0	0	114.6
645	A	25.6	Very low	28.6	Very low	71 Å²	71	129.3 Å²	129.3	59%	0.587	74%	0.736	S	S	*	*			trans	-93.6	173.5	-162.5	0	0	0	0	0	118.1
646	S	28.9	Very low	28.6	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	75%	0.748	S	S	*	*			trans	-171.9	121.4	132.2	26.9	0	0	0	0	116.2
647	N	26.4	Very low	28.8	Very low	160 Å²	160	126.4 Å²	126.4	86%	0.856	74%	0.741	S	S	*	*			trans	40.9	152.5	130.7	-53	-3.7	0	0	0	123.1
648	A	27.4	Very low	28.7	Very low	76 Å²	76	131.8 Å²	131.8	63%	0.628	75%	0.753	S	S	*	*			cis	-177.6	168.6	-19.4	0	0	0	0	0	111.3
649	D	29.8	Very low	28.9	Very low	172 Å²	172	132.4 Å²	132.4	92%	0.92	76%	0.756	S	S	*	*			trans	67	140.3	157.3	-58.1	-24.3	0	0	0	122.6
650	G	29.1	Very low	28.9	Very low	81 Å²	81	136.2 Å²	136.2	84%	0.835	76%	0.763	S	S	*	*			trans	157.4	46.6	159.7	0	0	0	0	0	123.4
651	S	26.9	Very low	28.9	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	77%	0.769	S	S	*	*			trans	-63.5	165.1	171.3	-53.7	0	0	0	0	114.2
652	T	30.1	Very low	28.8	Very low	122 Å²	122	144.7 Å²	144.7	75%	0.748	78%	0.784	S	S	*	*			cis	-168.7	150.9	18.6	-13.1	0	0	0	0	113.5
653	L	28.1	Very low	29	Very low	153 Å²	153	146.7 Å²	146.7	80%	0.801	79%	0.786	S	S	*	*			trans	71.5	145.8	136	-133.5	72.7	0	0	0	125.6
654	I	29.2	Very low	29.3	Very low	132 Å²	132	147.8 Å²	147.8	68%	0.677	79%	0.789	S	S	*	*			trans	89.6	97.2	157.6	-47.3	-173.6	0	0	0	120.6
655	E	30.6	Very low	29.5	Very low	177 Å²	177	144.6 Å²	144.6	83%	0.827	78%	0.779	S	S	*	*			trans	50.6	149	130.6	-59.5	-179.3	129.2	0	0	126.1
656	D	28.6	Very low	29.7	Very low	170 Å²	170	149.9 Å²	149.9	91%	0.909	79%	0.789	S	S	*	*			trans	73.5	121.6	155	-93.8	-2.4	0	0	0	123.5
657	G	28.9	Very low	30	Very low	68 Å²	68	152 Å²	152	70%	0.701	79%	0.792	S	S	*	*				124.4	63.9	126.6	0	0	0	0	0	122.4
658	R	28.1	Very low	30.7	Very low	228 Å²	228	148.7 Å²	148.7	86%	0.86	77%	0.774	S	S	*	*			trans	59.8	137.5	148	-91.1	-179.7	-74.2	-133.6	-5.1	122.6
659	D	35.1	Very low	31.5	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	78%	0.775	S	S	*	*			trans	59	110.7	145.5	-50.1	-31.2	0	0	0	122.5
660	R	31.1	Very low	31.9	Very low	238 Å²	238	150 Å²	150	90%	0.898	77%	0.771	S	S	*	*				-179.3	129.9	124.1	-102.2	163.6	-177.1	-148.5	-1.3	118
661	Q	33.2	Very low	32.6	Very low	168 Å²	168	152.3 Å²	152.3	79%	0.785	77%	0.769	S	S	*	*			trans	9.4	131.1	142.1	-58.4	175.9	-13.4	0	0	121.5
662	R	28.2	Very low	33.2	Very low	235 Å²	235	158.5 Å²	158.5	89%	0.887	78%	0.775	S	S	*	*				-179.6	124.2	122.2	-95.6	151.3	-171.7	-155.6	2	110.3
663	K	32.3	Very low	33.4	Very low	177 Å²	177	160.1 Å²	160.1	77%	0.77	78%	0.779	S	S	*	*				68.3	98.5	81.2	-171.2	-176.1	176.4	179.3	0	113.6
664	V	32.3	Very low	33.7	Very low	120 Å²	120	159.8 Å²	159.8	73%	0.727	78%	0.779	S	S	*	*			trans	-115.6	150.5	163.8	179.8	0	0	0	0	108.8	F666	V664-F666 HydrophobicContact CG1-CD2 4.47Å; V664-F666 HydrophobicContact CG1-CE2 4.27Å
665	I	30.4	Very low	34	Very low	129 Å²	129	161.5 Å²	161.5	66%	0.662	79%	0.788	S	S	*	*			trans	-121	134.2	174	-61.2	171	0	0	0	106.1
666	F	28.8	Very low	34.2	Very low	182 Å²	182	160 Å²	160	80%	0.798	79%	0.786	S	S	*	*			trans	-97.2	132.6	169.1	-85.4	-91.8	0	0	0	109.9	V664	V664-F666 HydrophobicContact CG1-CD2 4.47Å; V664-F666 HydrophobicContact CG1-CE2 4.27Å
667	D	35.7	Very low	34.4	Very low	153 Å²	153	157 Å²	157	82%	0.818	77%	0.77	S	S	*	*			trans	-88.7	142.3	165.9	-92.9	-41	0	0	0	109.7
668	D	41.6	Very low	34.5	Very low	91 Å²	91	159 Å²	159	49%	0.487	77%	0.769	S	S	.	*			trans	-130.7	84.9	-179.1	-83.1	-38.6	0	0	0	108.5	R1231	D668-R1231 IonicContact OD2-NH1 2.99Å
669	D	43.2	Very low	34.4	Very low	120 Å²	120	152.6 Å²	152.6	64%	0.642	76%	0.764	S	S	*	*			trans	-149.6	164.8	167.1	-81.4	-49.7	0	0	0	110.4	K1233	D669-K1233 IonicContact OD1-NZ 2.74Å; D669-K1233 PolarHBondContact OD1-NZ 3.36Å; D669-K1233 IonicContact OD2-NZ 2.77Å
670	D	38.2	Very low	34.1	Very low	155 Å²	155	151.1 Å²	151.1	83%	0.829	76%	0.76	S	S	*	*			trans	61.7	86	178.2	-65.4	-14.4	0	0	0	119.6
671	T	44.5	Very low	33.9	Very low	131 Å²	131	145.9 Å²	145.9	80%	0.804	75%	0.754	S	S	*	*			trans	-165.2	85.9	135.1	-65.2	0	0	0	0	110.1
672	W	39.8	Very low	33.6	Very low	242 Å²	242	145.6 Å²	145.6	92%	0.917	75%	0.753	S	S	*	*			trans	-164.7	96.8	159.7	-86.7	114.2	0	0	0	111.5
673	N	34.6	Very low	33.5	Very low	156 Å²	156	142.2 Å²	142.2	83%	0.834	75%	0.753	S	S	*	*			trans	158.9	110.7	154.5	-84.2	-16.8	0	0	0	106.7
674	D	34	Very low	33.2	Very low	147 Å²	147	139 Å²	139	79%	0.786	75%	0.752	S	S	*	*				93.8	126.5	67.7	-175.2	36.4	0	0	0	111.6
675	L	34.5	Very low	32.8	Very low	168 Å²	168	140 Å²	140	88%	0.88	75%	0.754	S	S	*	*			trans	-167.1	120.6	-177.8	-126.4	169.4	0	0	0	113.1
676	D	35.7	Very low	32.6	Very low	145 Å²	145	138.7 Å²	138.7	78%	0.775	76%	0.756	S	S	*	*			trans	-112.3	154.3	-177.7	-128.4	-16.1	0	0	0	112.7
677	D	32.2	Very low	32.4	Very low	107 Å²	107	141.7 Å²	141.7	57%	0.572	76%	0.762	S	S	*	*			trans	44.4	115.9	159.5	-100.7	-18.5	0	0	0	123.9	R845	D677-R845 IonicContact OD2-NH1 3.79Å
678	T	31.3	Very low	31.7	Very low	111 Å²	111	137.9 Å²	137.9	68%	0.681	76%	0.759	S	S	*	*			trans	75.3	128.2	139.5	67.7	0	0	0	0	124.1
679	A	26.7	Very low	30.9	Very low	93 Å²	93	140.7 Å²	140.7	77%	0.769	78%	0.779	S	S	*	*				162	104.7	95.1	0	0	0	0	0	117.7
680	V	28.1	Very low	30	Very low	106 Å²	106	140 Å²	140	64%	0.642	78%	0.784	S	S	*	*			trans	21.9	121.9	141.1	-172.1	0	0	0	0	122.7
681	T	26.9	Very low	29.7	Very low	127 Å²	127	138.5 Å²	138.5	78%	0.779	78%	0.783	S	S	*	*				-163.3	127.5	121.7	35.1	0	0	0	0	107
682	E	27.2	Very low	28.7	Very low	162 Å²	162	139.1 Å²	139.1	76%	0.757	79%	0.786	S	S	*	*				56.5	124	69.8	-63.7	-176.6	-177.1	0	0	111.3
683	D	26	Very low	28.6	Very low	165 Å²	165	132.7 Å²	132.7	88%	0.882	78%	0.775	S	S	*	*				-128.1	169.7	51.8	-85.2	-47.5	0	0	0	117.7
684	S	25.4	Very low	28.1	Very low	108 Å²	108	134.5 Å²	134.5	76%	0.755	78%	0.776	S	S	*	*			trans	-91.6	-169.6	166.9	-56.3	0	0	0	0	110.4
685	D	24.7	Very low	27.8	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	78%	0.775	S	S	*	*			cis	-171	157.9	23.8	-159.7	-10.1	0	0	0	112
686	S	26.6	Very low	27.4	Very low	102 Å²	102	133 Å²	133	71%	0.713	77%	0.772	S	S	*	*			trans	68	161.6	148.2	80.8	0	0	0	0	121.7
687	R	23.2	Very low	27.1	Very low	244 Å²	244	130.6 Å²	130.6	92%	0.921	77%	0.773	S	S	*	*			cis	-174.5	98.8	-32.4	-178.4	-176.9	-169.6	-167.3	5.4	113.2
688	G	22.4	Very low	26.9	Very low	73 Å²	73	128.7 Å²	128.7	75%	0.753	78%	0.778	S	S	*	*			trans	82.1	166.2	135.4	0	0	0	0	0	124.1
689	V	23.9	Very low	26.7	Very low	151 Å²	151	133.1 Å²	133.1	92%	0.915	78%	0.783	S	S	*	*			trans	89.3	128.1	159.6	-168.5	0	0	0	0	119.7
690	S	23.4	Very low	26.8	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	78%	0.775	S	S	*	*			trans	-75.4	170.4	-179	-33.3	0	0	0	0	114.7
691	P	32.3	Very low	26.8	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	77%	0.768	S	S	*	*				-151	170.8	79.8	39.1	-19.7	0	0	0	116.6
692	V	23	Very low	27.4	Very low	143 Å²	143	131.7 Å²	131.7	87%	0.867	77%	0.77	S	S	*	*			trans	-145.3	126.3	-178	178.7	0	0	0	0	113.6
693	P	38.2	Very low	27.4	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	76%	0.762	S	S	*	*			trans	-149.1	123.7	170.8	36.7	-16	0	0	0	119.3
694	K	24.8	Very low	27.5	Very low	195 Å²	195	129.5 Å²	129.5	85%	0.848	76%	0.757	S	S	*	*			trans	71.8	161.8	142	-67.8	175.8	174.9	175.6	0	121.5
695	L	26.5	Very low	27.6	Very low	148 Å²	148	131.5 Å²	131.5	78%	0.775	75%	0.752	S	S	*	*			cis	173	174.4	-42	-111.5	170.7	0	0	0	111.8
696	T	27.1	Very low	27.7	Very low	134 Å²	134	129.3 Å²	129.3	82%	0.822	75%	0.754	S	S	*	*			trans	75.1	153.3	162.7	67.9	0	0	0	0	118.5
697	A	28.7	Very low	27.6	Very low	96 Å²	96	130.2 Å²	130.2	79%	0.793	76%	0.755	S	S	*	*			cis	-172	172.2	-18.9	0	0	0	0	0	107.8
698	G	27.9	Very low	27.7	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	74%	0.743	S	S	*	*			cis	127.9	155	9.9	0	0	0	0	0	110.7
699	R	28.4	Very low	27.9	Very low	204 Å²	204	130.8 Å²	130.8	77%	0.77	74%	0.743	S	S	*	*			cis	-165.7	162.5	-0.4	84.7	-59.8	168.8	-88	-0.9	110.8
700	V	27.8	Very low	28	Very low	99 Å²	99	132.7 Å²	132.7	60%	0.6	74%	0.739	S	S	*	*			trans	-142	145.2	159.9	-172.2	0	0	0	0	110.4	L39	L39-V700 HydrophobicContact CD1-CG2 4.21Å
701	S	28.2	Very low	28.1	Very low	71 Å²	71	134.4 Å²	134.4	50%	0.497	75%	0.745	S	S	.	*			trans	-154	160.4	172.8	-48.1	0	0	0	0	108.7
702	P	39.7	Very low	27.7	Very low	127 Å²	127	132.2 Å²	132.2	83%	0.825	74%	0.738	S	S	*	*				-141.2	176.6	92.5	29.4	-11	0	0	0	113
703	L	27.8	Very low	27.9	Very low	114 Å²	114	132 Å²	132	60%	0.597	74%	0.736	S	S	*	*			cis	-180	152.3	-35.1	-144.8	71.7	0	0	0	103.7	K705	L703-K705 HydrophobicContact CD1-CD 3.83Å
704	E	28.2	Very low	27.4	Very low	167 Å²	167	131.4 Å²	131.4	78%	0.78	73%	0.734	S	S	*	*			cis	-136.4	138.7	15.8	-67.2	161	157.5	0	0	107.1
705	K	26.2	Very low	27.6	Very low	149 Å²	149	133.6 Å²	133.6	65%	0.648	74%	0.737	S	S	*	*			cis	64.8	94.8	45.5	-57.7	-174.7	-176.1	174.7	0	111.8	L703	L703-K705 HydrophobicContact CD1-CD 3.83Å
706	A	26.7	Very low	27.5	Very low	96 Å²	96	130.6 Å²	130.6	79%	0.793	73%	0.734	S	S	*	*				61	139.1	57.1	0	0	0	0	0	114.3
707	V	24.3	Very low	27.5	Very low	122 Å²	122	130.3 Å²	130.3	74%	0.739	73%	0.732	S	S	*	*			trans	172.1	135.2	145.7	144.2	0	0	0	0	113.8
708	L	26.8	Very low	27.6	Very low	127 Å²	127	133.5 Å²	133.5	67%	0.665	73%	0.73	S	S	*	*			trans	2.7	169.3	138.2	-41.8	167.7	0	0	0	119.4
709	R	25.2	Very low	28.7	Very low	202 Å²	202	135.7 Å²	135.7	76%	0.762	73%	0.732	S	S	*	*			cis	-174.3	174.3	38.8	-158.9	172.1	-103.8	118.2	-9.8	112.8
710	K	27.2	Very low	28.5	Very low	190 Å²	190	133.5 Å²	133.5	83%	0.826	74%	0.736	S	S	*	*			trans	-65.7	147.2	166.8	-59.5	-178.7	177.6	-175.4	0	113.8
711	V	25.8	Very low	28.6	Very low	141 Å²	141	137.2 Å²	137.2	86%	0.855	75%	0.747	S	S	*	*				10.9	133.9	128.2	-172.9	0	0	0	0	115.9
712	A	24.1	Very low	28.7	Very low	79 Å²	79	137.1 Å²	137.1	65%	0.653	76%	0.757	S	S	*	*			cis	-159.2	-178	17.2	0	0	0	0	0	114.3
713	V	25.5	Very low	28.8	Very low	138 Å²	138	135.9 Å²	135.9	84%	0.836	75%	0.749	S	S	*	*			trans	71.7	132.9	147.3	158.8	0	0	0	0	118
714	S	29.3	Very low	28.9	Very low	94 Å²	94	135.2 Å²	135.2	66%	0.657	74%	0.743	S	S	*	*			cis	-171.6	164.2	-9.6	60.3	0	0	0	0	112.8
715	R	27.8	Very low	29	Very low	242 Å²	242	130.5 Å²	130.5	91%	0.913	73%	0.728	S	S	*	*			trans	68.9	140	161.4	-84.4	-178.6	167	170.9	-4	117.4
716	A	24	Very low	29.1	Very low	85 Å²	85	128.4 Å²	128.4	70%	0.702	72%	0.721	S	S	*	*			cis	-164.8	162.8	-2.5	0	0	0	0	0	113.6
717	V	27.4	Very low	29.4	Very low	127 Å²	127	131.2 Å²	131.2	77%	0.77	72%	0.721	S	S	*	*			trans	72.1	98.5	160.4	-171.2	0	0	0	0	119.1
718	E	31.8	Very low	30	Very low	164 Å²	164	129.8 Å²	129.8	77%	0.766	72%	0.722	S	S	*	*				27.7	155	120	-50.5	-46.2	111.1	0	0	122.2
719	P	50	Low	30.9	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	73%	0.731	S	S	*	*			cis	-138.2	175.4	-34	39.4	-23.9	0	0	0	113.4
720	D	25.4	Very low	31.6	Very low	158 Å²	158	123.3 Å²	123.3	85%	0.845	72%	0.72	S	S	*	*				-167.6	165.4	120.9	-150.2	6.6	0	0	0	113.1
721	E	29.4	Very low	33.3	Very low	177 Å²	177	118.2 Å²	118.2	83%	0.827	71%	0.708	S	S	*	*			trans	-56.3	161.2	-171.6	-73.7	-75.9	136.7	0	0	120.2
722	G	30.4	Very low	34.8	Very low	69 Å²	69	118.9 Å²	118.9	71%	0.711	70%	0.702	S	S	*	*			trans	124.6	125.9	135.4	0	0	0	0	0	119.1
723	P	42.3	Very low	36.7	Very low	100 Å²	100	121.7 Å²	121.7	65%	0.649	71%	0.705	S	S	*	*			trans	-117.5	160.9	-176.9	41.7	-32.7	0	0	0	116.6
724	E	28.7	Very low	38.4	Very low	100 Å²	100	120.2 Å²	120.2	47%	0.467	69%	0.69	S	S	.	*			trans	50.8	142.8	137.9	-62.2	166.4	158.4	0	0	120.4	T799	E724-T799 HydrophobicContact CB-CG2 4.08Å; E724-T799 HydrophobicContact CG-CG2 4.2Å; E724-T799 WeakPolarHBondContact OE1-CB 3.5Å; E724-T799 WeakPolarHBondContact OE2-CB 3.46Å; E724-T799 PolarHBondContact OE2-OG1 3.36Å
725	S	31.2	Very low	40	Very low	68 Å²	68	120 Å²	120	48%	0.476	69%	0.685	S	S	.	*			cis	-155.8	162.9	5.9	-158.8	0	0	0	0	107.6	T799	S725-T799 WeakPolarHBondContact OG-CG2 3.23Å
726	E	27.8	Very low	41.8	Very low	105 Å²	105	118.2 Å²	118.2	49%	0.491	68%	0.679	S	S	.	*				173.4	164.2	79.4	-92.5	-145.6	112.2	0	0	112.5	N795	E726-N795 PolarHBondContact OE2-ND2 2.84Å
727	L	33.3	Very low	43.8	Very low	155 Å²	155	120.4 Å²	120.4	81%	0.812	68%	0.678	S	S	*	*			trans	57.7	121.4	155.3	-68.5	169.3	0	0	0	121.2
728	A	35.7	Very low	46	Very low	92 Å²	92	120.2 Å²	120.2	76%	0.76	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-85.4	152.9	164.2	0	0	0	0	0	111.8
729	P	47	Very low	47.2	Very low	129 Å²	129	117.5 Å²	117.5	84%	0.838	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-79.2	153.1	-170.2	31.3	-36.3	0	0	0	114.6
730	A	39.5	Very low	47.1	Very low	65 Å²	65	117.2 Å²	117.2	54%	0.537	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-65.9	149.8	176.1	0	0	0	0	0	113.4	M734	A730-M734 HydrophobicContact CB-CB 4.45Å; A730-M734 HydrophobicContact CB-CE 4.47Å; A730-M734 HydrophobicContact CB-SD 3.73Å
731	S	62.3	Low	48.4	Very low	83 Å²	83	116.4 Å²	116.4	58%	0.58	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-69.8	159.5	-173.5	67.8	0	0	0	0	114.2	L733 M734	S731-L733 PolarHBondContact O-N 3.32Å; S731-M734 WeakPolarHBondContact O-CB 3.42Å; S731-M734 PolarHBondContact O-N 3.08Å
732	Q	57.4	Low	49.6	Very low	155 Å²	155	116.6 Å²	116.6	72%	0.724	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-5.4	-164.6	-155.1	165.5	9.6	0	0	115.5	T735	Q732-T735 PolarHBondContact O-OG1 3.28Å
733	L	64.6	Low	50.2	Low	137 Å²	137	119.7 Å²	119.7	72%	0.717	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-41.4	168.3	-75	164.7	0	0	0	111.5	S731 T735 R736 L737	S731-L733 PolarHBondContact O-N 3.32Å; L733-T735 VanDerWaalsContact C-N 3.29Å; L733-T735 PolarHBondContact O-N 2.9Å; L733-R736 PolarHBondContact O-N 2.7Å; L733-L737 PolarHBondContact O-N 3.28Å
734	M	60.5	Low	49.9	Very low	107 Å²	107	124.9 Å²	124.9	53%	0.527	68%	0.677	S	S	.	*	H	α-helix	trans	-65.3	-34.8	-178	-163.7	176.5	-69.8	0	0	111.6	A730 S731 R736 L737 F738	A730-M734 HydrophobicContact CB-CB 4.45Å; A730-M734 HydrophobicContact CB-CE 4.47Å; A730-M734 HydrophobicContact CB-SD 3.73Å; S731-M734 WeakPolarHBondContact O-CB 3.42Å; S731-M734 PolarHBondContact O-N 3.08Å; M734-R736 VanDerWaalsContact C-N 3.27Å; M734-R736 PolarHBondContact O-N 3.19Å; M734-L737 PolarHBondContact O-N 2.84Å; M734-F738 PolarHBondContact O-N 3.48Å
735	T	63.3	Low	50.2	Low	90 Å²	90	124.7 Å²	124.7	55%	0.552	69%	0.693	S	S	*	*	H	α-helix	trans	-77.9	-3	174.6	47.4	0	0	0	0	114.7	Q732 L733	Q732-T735 PolarHBondContact O-OG1 3.28Å; L733-T735 VanDerWaalsContact C-N 3.29Å; L733-T735 PolarHBondContact O-N 2.9Å
736	R	65.8	Low	50.6	Low	204 Å²	204	130.6 Å²	130.6	77%	0.77	71%	0.713	S	S	*	*	H	α-helix	trans	-99.7	-26.9	169	-77.1	-170.4	169.4	-172.6	-1.6	113.6	L733 M734	L733-R736 PolarHBondContact O-N 2.7Å; M734-R736 VanDerWaalsContact C-N 3.27Å; M734-R736 PolarHBondContact O-N 3.19Å
737	L	65.9	Low	50.8	Low	132 Å²	132	131.7 Å²	131.7	69%	0.691	73%	0.732	S	S	*	*	H	α-helix	trans	-80.3	-22.5	176.1	-69	168.8	0	0	0	113.5	L733 M734	L733-L737 PolarHBondContact O-N 3.28Å; M734-L737 PolarHBondContact O-N 2.84Å
738	F	73.8	Confident	50.7	Low	123 Å²	123	128.7 Å²	128.7	54%	0.539	73%	0.73	S	S	.	*			trans	-128	84	-179.2	-59.2	-75	0	0	0	112.9	M734 S740	M734-F738 PolarHBondContact O-N 3.48Å; F738-S740 PolarHBondContact O-N 2.88Å; F738-S740 VanDerWaalsContact O-N 3.12Å
739	P	56.8	Low	51.8	Low	107 Å²	107	130 Å²	130	70%	0.695	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-13.4	-175.6	-23.9	35.2	0	0	0	116
740	S	47.6	Very low	52	Low	105 Å²	105	129.2 Å²	129.2	73%	0.734	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-13.6	-173.6	45.7	0	0	0	0	114.9	F738 K742	F738-S740 PolarHBondContact O-N 2.88Å; F738-S740 VanDerWaalsContact O-N 3.12Å; S740-K742 PolarHBondContact O-N 3.42Å
741	L	54.2	Low	52.3	Low	141 Å²	141	131.3 Å²	131.3	74%	0.738	73%	0.733	S	S	*	*			trans	-95.1	67.6	-175.3	-63.8	178.2	0	0	0	112.6
742	K	54.5	Low	50.9	Low	182 Å²	182	132.2 Å²	132.2	79%	0.791	75%	0.746	S	S	*	*			trans	-126.3	110.6	168.6	-73.8	-173.7	177.9	179.4	0	111.3	S740	S740-K742 PolarHBondContact O-N 3.42Å
743	P	41.1	Very low	49.8	Very low	134 Å²	134	129.1 Å²	129.1	87%	0.87	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-68.6	132.5	171.5	29.1	-33	0	0	0	109.9
744	K	36.9	Very low	49.2	Very low	208 Å²	208	128.3 Å²	128.3	90%	0.904	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-102.8	123.9	-179.9	-168.4	167	-177	175.3	0	110.5
745	A	34.9	Very low	47.9	Very low	97 Å²	97	128.1 Å²	128.1	80%	0.802	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-74.4	168.7	-178.5	0	0	0	0	0	113.5
746	Q	39.3	Very low	46.4	Very low	191 Å²	191	128.5 Å²	128.5	89%	0.893	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-77.1	152.9	-162.5	-57.9	165	-6.7	0	0	115.5
747	S	32.8	Very low	45.5	Very low	128 Å²	128	124.7 Å²	124.7	90%	0.895	78%	0.779	S	S	*	*				-177.3	160.7	128.3	39.4	0	0	0	0	111.7
748	A	30.8	Very low	44	Very low	93 Å²	93	123.1 Å²	123.1	77%	0.769	79%	0.785	S	S	*	*			trans	-134.2	-179	178.5	0	0	0	0	0	108.6
749	P	59.6	Low	42.2	Very low	119 Å²	119	121.4 Å²	121.4	77%	0.773	79%	0.794	S	S	*	*			cis	-120.4	-123.6	-2.8	35.1	-11.3	0	0	0	108.6
750	P	49.9	Very low	41.5	Very low	113 Å²	113	121.6 Å²	121.6	73%	0.734	80%	0.798	S	S	*	*			cis	-116.5	-93.7	-28	19	5.7	0	0	0	118.5
751	P	47.4	Very low	41.2	Very low	108 Å²	108	124.6 Å²	124.6	70%	0.701	80%	0.8	S	S	*	*			trans	-127.4	159	-135.6	40.4	-22.8	0	0	0	118.5
752	A	32.4	Very low	40.7	Very low	102 Å²	102	124.1 Å²	124.1	84%	0.843	80%	0.799	S	S	*	*			trans	39.7	141.9	141.8	0	0	0	0	0	120.9
753	A	34	Very low	40.1	Very low	90 Å²	90	124.9 Å²	124.9	74%	0.744	80%	0.797	S	S	*	*			cis	-153.9	-140.3	17.6	0	0	0	0	0	111.4
754	P	52.5	Low	40.3	Very low	120 Å²	120	129 Å²	129	78%	0.779	80%	0.801	S	S	*	*				-127.5	173.2	-90.4	37.8	-21.3	0	0	0	117.3
755	A	31.9	Very low	40.8	Very low	103 Å²	103	126.5 Å²	126.5	85%	0.851	79%	0.792	S	S	*	*			trans	66	119.2	144.3	0	0	0	0	0	122.6
756	A	32.8	Very low	41.5	Very low	99 Å²	99	125.4 Å²	125.4	82%	0.818	77%	0.773	S	S	*	*			trans	-147.4	153.1	137.6	0	0	0	0	0	109.3
757	P	46.5	Very low	42.2	Very low	123 Å²	123	122.5 Å²	122.5	80%	0.799	76%	0.764	S	S	*	*			trans	-121.5	157.6	-158.3	41	-29.9	0	0	0	118.2
758	A	35.3	Very low	43.4	Very low	99 Å²	99	121 Å²	121	82%	0.818	75%	0.749	S	S	*	*			trans	75.2	163	143.5	0	0	0	0	0	122.2
759	A	34.3	Very low	44.7	Very low	88 Å²	88	119 Å²	119	73%	0.727	73%	0.732	S	S	*	*			trans	79.6	69.8	161	0	0	0	0	0	121
760	S	42.6	Very low	44.7	Very low	110 Å²	110	118.9 Å²	118.9	77%	0.769	72%	0.722	S	S	*	*				68.2	145.1	114.6	63.4	0	0	0	0	124.5
761	E	42.2	Very low	45.4	Very low	168 Å²	168	120.2 Å²	120.2	79%	0.785	72%	0.718	S	S	*	*			trans	94.3	136.4	156.8	-58.7	-151.2	161.2	0	0	121.5
762	N	43.7	Very low	46.6	Very low	132 Å²	132	119.5 Å²	119.5	71%	0.706	71%	0.711	S	S	*	*			trans	56.6	92.4	159	-62.8	-43.5	0	0	0	120.4
763	R	41	Very low	48.6	Very low	198 Å²	198	120 Å²	120	75%	0.747	70%	0.696	S	S	*	*				-172.9	120.1	107.6	-97	158.6	-166.6	-130.8	1.1	113.1	D766	R763-D766 WeakPolarHBondContact CB-OD2 3.33Å
764	K	45	Very low	50.8	Low	220 Å²	220	118.3 Å²	118.3	96%	0.957	68%	0.679	S	S	*	*	S	Bend	trans	-98.8	66.7	165.5	-75.9	-173.9	177.3	178.3	0	110.2
765	Q	48.1	Very low	52.3	Low	155 Å²	155	120.4 Å²	120.4	72%	0.724	67%	0.671	S	S	*	*	S	Bend	trans	-144.2	-26.3	175.9	-110.4	167.7	-9.6	0	0	114.3
766	D	49.7	Very low	54.8	Low	75 Å²	75	120.8 Å²	120.8	40%	0.401	66%	0.655	S	S	.	*	H	α-helix	trans	-80.1	-23.7	-169.2	-52.4	-69.3	0	0	0	114.8	R763 T768 A769 Q770	R763-D766 WeakPolarHBondContact CB-OD2 3.33Å; D766-T768 VanDerWaalsContact C-N 3.35Å; D766-T768 PolarHBondContact O-N 2.83Å; D766-A769 PolarHBondContact O-N 3.13Å; D766-Q770 WeakPolarHBondContact O-CG 3.44Å; D766-Q770 PolarHBondContact O-N 2.89Å
767	N	53.5	Low	57.4	Low	130 Å²	130	121.4 Å²	121.4	70%	0.695	65%	0.645	S	S	*	*	H	α-helix	trans	-58.1	-40.6	-177.7	-78	-10.1	0	0	0	113.5	Q771	N767-Q771 WeakPolarHBondContact O-CB 3.36Å; N767-Q771 PolarHBondContact O-N 2.94Å
768	T	58.2	Low	59.3	Low	97 Å²	97	122.8 Å²	122.8	60%	0.595	63%	0.634	S	S	*	*	H	α-helix	trans	-71.5	-37.6	-178.9	-48	0	0	0	0	111.2	D766 Q771 V772	D766-T768 VanDerWaalsContact C-N 3.35Å; D766-T768 PolarHBondContact O-N 2.83Å; T768-Q771 PolarHBondContact O-N 3.45Å; T768-V772 WeakPolarHBondContact O-CG2 3.43Å; T768-V772 PolarHBondContact O-N 2.91Å
769	A	58.1	Low	61.8	Low	50 Å²	50	122.9 Å²	122.9	41%	0.413	62%	0.617	S	S	.	*	H	α-helix	trans	-64	-46.2	174.3	0	0	0	0	0	111.2	D766 Q771 V772 Q773	D766-A769 PolarHBondContact O-N 3.13Å; A769-Q771 VanDerWaalsContact C-N 3.34Å; A769-Q771 PolarHBondContact O-N 3.28Å; A769-V772 PolarHBondContact O-N 3.41Å; A769-Q773 WeakPolarHBondContact O-CB 3.33Å; A769-Q773 WeakPolarHBondContact O-CG 3.44Å; A769-Q773 PolarHBondContact O-N 3.22Å
770	Q	59.2	Low	64.5	Low	117 Å²	117	125.3 Å²	125.3	55%	0.547	61%	0.607	S	S	.	*	H	α-helix	trans	-62.8	-37.4	175.6	-70.4	-179.6	1.3	0	0	112.5	D766 Q773 S774	D766-Q770 WeakPolarHBondContact O-CG 3.44Å; D766-Q770 PolarHBondContact O-N 2.89Å; Q770-Q773 PolarHBondContact O-N 3.16Å; Q770-S774 WeakPolarHBondContact O-CB 3.42Å; Q770-S774 PolarHBondContact O-N 3.13Å
771	Q	65.5	Low	66.8	Low	141 Å²	141	124.6 Å²	124.6	66%	0.659	60%	0.595	S	S	*	*	H	α-helix	trans	-68.6	-37.6	177.1	-167.6	176.6	16.9	0	0	112.4	N767 T768 A769 R775	N767-Q771 WeakPolarHBondContact O-CB 3.36Å; N767-Q771 PolarHBondContact O-N 2.94Å; T768-Q771 PolarHBondContact O-N 3.45Å; A769-Q771 VanDerWaalsContact C-N 3.34Å; A769-Q771 PolarHBondContact O-N 3.28Å; Q771-R775 PolarHBondContact O-N 3.14Å
772	V	72.2	Confident	69.1	Low	92 Å²	92	118.7 Å²	118.7	56%	0.558	57%	0.574	S	S	*	*	H	α-helix	trans	-67.5	-45.8	173.5	171	0	0	0	0	110.9	T768 A769 S774 R775 Q776	T768-V772 WeakPolarHBondContact O-CG2 3.43Å; T768-V772 PolarHBondContact O-N 2.91Å; A769-V772 PolarHBondContact O-N 3.41Å; V772-S774 VanDerWaalsContact C-N 3.33Å; V772-S774 PolarHBondContact O-N 3.37Å; V772-R775 WeakPolarHBondContact O-CB 3.42Å; V772-R775 PolarHBondContact O-N 3.46Å; V772-R775 VanDerWaalsContact O-N 3.13Å; V772-Q776 PolarHBondContact O-N 2.9Å
773	Q	74.1	Confident	71.3	Confident	114 Å²	114	116.5 Å²	116.5	53%	0.533	56%	0.56	S	S	.	*	H	α-helix	trans	-60.8	-40.5	174.4	-71.4	170.6	-4.3	0	0	111.8	A769 Q770 R775 Q776 L777	A769-Q773 WeakPolarHBondContact O-CB 3.33Å; A769-Q773 WeakPolarHBondContact O-CG 3.44Å; A769-Q773 PolarHBondContact O-N 3.22Å; Q770-Q773 PolarHBondContact O-N 3.16Å; Q773-R775 VanDerWaalsContact C-N 3.33Å; Q773-R775 PolarHBondContact O-N 3.22Å; Q773-Q776 PolarHBondContact O-N 3.14Å; Q773-L777 WeakPolarHBondContact O-CB 3.5Å; Q773-L777 VanDerWaalsContact O-CG 3.3Å; Q773-L777 WeakPolarHBondContact O-CG 3.47Å; Q773-L777 PolarHBondContact O-N 3.12Å
774	S	80.8	Confident	73.8	Confident	54 Å²	54	112 Å²	112	38%	0.378	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-31.6	174.2	173.3	0	0	0	0	113.4	Q770 V772 R778	Q770-S774 WeakPolarHBondContact O-CB 3.42Å; Q770-S774 PolarHBondContact O-N 3.13Å; V772-S774 VanDerWaalsContact C-N 3.33Å; V772-S774 PolarHBondContact O-N 3.37Å; S774-R778 PolarHBondContact O-N 2.76Å; S774-R778 PolarHBondContact O-NE 2.85Å
775	R	83.9	Confident	76.1	Confident	163 Å²	163	107.5 Å²	107.5	62%	0.615	53%	0.533	S	S	*	.	H	α-helix	trans	-69.8	-51	170.4	177.5	178.8	170.1	167.1	-0.1	110.3	Q771 V772 Q773 L777 R778 E779	Q771-R775 PolarHBondContact O-N 3.14Å; V772-R775 WeakPolarHBondContact O-CB 3.42Å; V772-R775 PolarHBondContact O-N 3.46Å; V772-R775 VanDerWaalsContact O-N 3.13Å; Q773-R775 VanDerWaalsContact C-N 3.33Å; Q773-R775 PolarHBondContact O-N 3.22Å; R775-L777 VanDerWaalsContact C-N 3.3Å; R775-L777 PolarHBondContact O-N 3.33Å; R775-R778 PolarHBondContact O-N 3.1Å; R775-R778 VanDerWaalsContact O-N 3.07Å; R775-E779 WeakPolarHBondContact O-CB 3.47Å; R775-E779 PolarHBondContact O-N 3.48Å
776	Q	84.8	Confident	78.2	Confident	111 Å²	111	105.6 Å²	105.6	52%	0.519	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-38	-178.7	-165.3	174.7	25.5	0	0	112.1	V772 Q773 E779 R780	V772-Q776 PolarHBondContact O-N 2.9Å; Q773-Q776 PolarHBondContact O-N 3.14Å; Q776-E779 PolarHBondContact O-N 3.41Å; Q776-R780 WeakPolarHBondContact O-CG 3.35Å; Q776-R780 PolarHBondContact O-N 2.8Å
777	L	86.4	Confident	80.3	Confident	113 Å²	113	105.2 Å²	105.2	59%	0.592	52%	0.521	S	S	*	.	H	α-helix	trans	-63	-41	173.2	-78.3	165.2	0	0	0	112.5	Q773 R775 R780 L781	Q773-L777 WeakPolarHBondContact O-CB 3.5Å; Q773-L777 VanDerWaalsContact O-CG 3.3Å; Q773-L777 WeakPolarHBondContact O-CG 3.47Å; Q773-L777 PolarHBondContact O-N 3.12Å; R775-L777 VanDerWaalsContact C-N 3.3Å; R775-L777 PolarHBondContact O-N 3.33Å; L777-R780 PolarHBondContact O-N 3.03Å; L777-L781 WeakPolarHBondContact O-CB 3.38Å; L777-L781 VanDerWaalsContact O-CG 3.28Å; L777-L781 WeakPolarHBondContact O-CG 3.35Å; L777-L781 PolarHBondContact O-N 3.27Å
778	R	86.6	Confident	82.2	Confident	152 Å²	152	103.4 Å²	103.4	57%	0.574	51%	0.51	S	S	*	.	H	α-helix	trans	-70.6	-34.1	175.8	-76.9	177.1	-71.2	147.6	-5	112.7	S774 R775 L781 A782	S774-R778 PolarHBondContact O-N 2.76Å; S774-R778 PolarHBondContact O-NE 2.85Å; R775-R778 PolarHBondContact O-N 3.1Å; R775-R778 VanDerWaalsContact O-N 3.07Å; R778-L781 PolarHBondContact O-N 3.48Å; R778-A782 WeakPolarHBondContact O-CB 3.24Å; R778-A782 PolarHBondContact O-N 3.32Å
779	E	88.3	Confident	83.8	Confident	100 Å²	100	103.9 Å²	103.9	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-45.3	173.1	-162.6	156.7	-143.6	0	0	110.4	R775 Q776 L781 A782 E783	R775-E779 WeakPolarHBondContact O-CB 3.47Å; R775-E779 PolarHBondContact O-N 3.48Å; Q776-E779 PolarHBondContact O-N 3.41Å; E779-L781 PolarHBondContact O-N 2.69Å; E779-A782 PolarHBondContact O-N 2.89Å; E779-E783 WeakPolarHBondContact O-CG 3.34Å; E779-E783 PolarHBondContact O-N 3.26Å
780	R	90.8	Very high	85.5	Confident	139 Å²	139	107.4 Å²	107.4	53%	0.525	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-34.2	172	-67.9	-47.6	-163	146.4	-4	114.3	Q776 L777 E783 L784	Q776-R780 WeakPolarHBondContact O-CG 3.35Å; Q776-R780 PolarHBondContact O-N 2.8Å; L777-R780 PolarHBondContact O-N 3.03Å; R780-E783 WeakPolarHBondContact CD-OE2 3.33Å; R780-E783 IonicContact CZ-OE2 2.62Å; R780-E783 IonicContact NE-OE1 3.6Å; R780-E783 IonicContact NE-OE2 2.92Å; R780-E783 IonicContact NH1-OE2 2.88Å; R780-E783 PolarHBondContact NH1-OE2 3.12Å; R780-L784 WeakPolarHBondContact O-CB 3.24Å; R780-L784 VanDerWaalsContact O-CG 3.27Å; R780-L784 WeakPolarHBondContact O-CG 3.24Å; R780-L784 PolarHBondContact O-N 3.14Å
781	L	91.8	Very high	87.3	Confident	95 Å²	95	107.1 Å²	107.1	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-43.2	173	-75	167.4	0	0	0	110.9	L777 R778 E779 L784 E785	L777-L781 WeakPolarHBondContact O-CB 3.38Å; L777-L781 VanDerWaalsContact O-CG 3.28Å; L777-L781 WeakPolarHBondContact O-CG 3.35Å; L777-L781 PolarHBondContact O-N 3.27Å; R778-L781 PolarHBondContact O-N 3.48Å; E779-L781 PolarHBondContact O-N 2.69Å; L781-L784 CarbonylContact O-C 3.53Å; L781-L784 PolarHBondContact O-N 3.4Å; L781-E785 WeakPolarHBondContact O-CB 3.14Å; L781-E785 VanDerWaalsContact O-CG 3.28Å; L781-E785 WeakPolarHBondContact O-CG 3.3Å; L781-E785 PolarHBondContact O-N 2.77Å
782	A	89.9	Confident	88.8	Confident	44 Å²	44	107 Å²	107	36%	0.364	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-38.9	174.6	0	0	0	0	0	112.7	R778 E779 E785 M786	R778-A782 WeakPolarHBondContact O-CB 3.24Å; R778-A782 PolarHBondContact O-N 3.32Å; E779-A782 PolarHBondContact O-N 2.89Å; A782-E785 PolarHBondContact O-N 2.76Å; A782-M786 WeakPolarHBondContact O-CB 3.41Å; A782-M786 WeakPolarHBondContact O-CG 3.32Å; A782-M786 PolarHBondContact O-N 2.83Å
783	E	90.2	Very high	89.9	Confident	87 Å²	87	108.8 Å²	108.8	41%	0.407	50%	0.503	S	S	.	.	H	α-helix	trans	-56.4	-48.1	170	-75.5	171.7	-156.9	0	0	111.3	E779 R780 M786 E787	E779-E783 WeakPolarHBondContact O-CG 3.34Å; E779-E783 PolarHBondContact O-N 3.26Å; R780-E783 WeakPolarHBondContact CD-OE2 3.33Å; R780-E783 IonicContact CZ-OE2 2.62Å; R780-E783 IonicContact NE-OE1 3.6Å; R780-E783 IonicContact NE-OE2 2.92Å; R780-E783 IonicContact NH1-OE2 2.88Å; R780-E783 PolarHBondContact NH1-OE2 3.12Å; E783-M786 PolarHBondContact O-N 3.39Å; E783-E787 WeakPolarHBondContact O-CB 3.17Å; E783-E787 PolarHBondContact O-N 2.86Å
784	L	93.4	Very high	90.9	Very high	104 Å²	104	108.5 Å²	108.5	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-69.6	-34.9	179.7	-71.6	168.8	0	0	0	112.9	R780 L781 E787 I788	R780-L784 WeakPolarHBondContact O-CB 3.24Å; R780-L784 VanDerWaalsContact O-CG 3.27Å; R780-L784 WeakPolarHBondContact O-CG 3.24Å; R780-L784 PolarHBondContact O-N 3.14Å; L781-L784 CarbonylContact O-C 3.53Å; L781-L784 PolarHBondContact O-N 3.4Å; L784-E787 PolarHBondContact O-N 2.67Å; L784-I788 WeakPolarHBondContact O-CB 3.36Å; L784-I788 WeakPolarHBondContact O-CD1 3.35Å; L784-I788 VanDerWaalsContact O-CG1 3.23Å; L784-I788 WeakPolarHBondContact O-CG1 3.26Å; L784-I788 PolarHBondContact O-N 2.83Å
785	E	92.5	Very high	91.5	Very high	124 Å²	124	107.6 Å²	107.6	58%	0.579	49%	0.493	S	S	*	.	H	α-helix	trans	-65.5	-43.7	173.9	-75.2	166.2	-177.4	0	0	110.9	L781 A782 E787 I788 E789	L781-E785 WeakPolarHBondContact O-CB 3.14Å; L781-E785 VanDerWaalsContact O-CG 3.28Å; L781-E785 WeakPolarHBondContact O-CG 3.3Å; L781-E785 PolarHBondContact O-N 2.77Å; A782-E785 PolarHBondContact O-N 2.76Å; E785-E787 VanDerWaalsContact C-N 3.31Å; E785-E787 PolarHBondContact O-N 3.15Å; E785-I788 PolarHBondContact O-N 3Å; E785-E789 PolarHBondContact O-N 2.82Å
786	M	92.8	Very high	92.1	Very high	115 Å²	115	101.9 Å²	101.9	57%	0.567	48%	0.481	S	S	*	.	H	α-helix	trans	-63	-35.2	171.7	-73.3	-178.8	66.4	0	0	112.6	A782 E783 E789 R790	A782-M786 WeakPolarHBondContact O-CB 3.41Å; A782-M786 WeakPolarHBondContact O-CG 3.32Å; A782-M786 PolarHBondContact O-N 2.83Å; E783-M786 PolarHBondContact O-N 3.39Å; M786-E789 PolarHBondContact O-N 2.92Å; M786-R790 PolarHBondContact O-N 2.87Å
787	E	93.3	Very high	92.7	Very high	68 Å²	68	99.3 Å²	99.3	32%	0.318	48%	0.478	S	S	.	.	H	α-helix	trans	-72	-40.6	176.4	-156.5	61.8	-116.2	0	0	112.1	E783 L784 E785 E789 R790 F791	E783-E787 WeakPolarHBondContact O-CB 3.17Å; E783-E787 PolarHBondContact O-N 2.86Å; L784-E787 PolarHBondContact O-N 2.67Å; E785-E787 VanDerWaalsContact C-N 3.31Å; E785-E787 PolarHBondContact O-N 3.15Å; E787-E789 VanDerWaalsContact C-N 3.26Å; E787-E789 PolarHBondContact O-N 3.27Å; E787-R790 VanDerWaalsContact CD-NE 3.33Å; E787-R790 WeakPolarHBondContact O-CA 3.4Å; E787-R790 WeakPolarHBondContact O-CB 3.18Å; E787-R790 PolarHBondContact O-N 2.99Å; E787-R790 VanDerWaalsContact O-N 3.08Å; E787-R790 IonicContact OE1-CZ 3.93Å; E787-R790 IonicContact OE1-NE 3.91Å; E787-R790 PolarHBondContact OE1-NE 3.01Å; E787-R790 IonicContact OE1-NH2 3.97Å; E787-R790 IonicContact OE2-CZ 3.71Å; E787-R790 VanDerWaalsContact OE2-CZ 3.28Å; E787-R790 IonicContact OE2-NE 3.87Å; E787-R790 PolarHBondContact OE2-NE 3.14Å; E787-R790 VanDerWaalsContact OE2-NE 3.09Å; E787-R790 IonicContact OE2-NH2 3.41Å; E787-R790 PolarHBondContact OE2-NH2 3.21Å; E787-F791 HydrophobicContact CG-CD2 4.02Å; E787-F791 HydrophobicContact CG-CE2 3.75Å; E787-F791 VanDerWaalsContact O-CD2 3.31Å; E787-F791 WeakPolarHBondContact O-CD2 3.3Å; E787-F791 PolarHBondContact O-N 2.94Å
788	I	92.8	Very high	93.1	Very high	91 Å²	91	97.2 Å²	97.2	47%	0.467	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-36.2	171.9	-70.8	162.9	0	0	0	110.5	L784 E785 K792	L784-I788 WeakPolarHBondContact O-CB 3.36Å; L784-I788 WeakPolarHBondContact O-CD1 3.35Å; L784-I788 VanDerWaalsContact O-CG1 3.23Å; L784-I788 WeakPolarHBondContact O-CG1 3.26Å; L784-I788 PolarHBondContact O-N 2.83Å; E785-I788 PolarHBondContact O-N 3Å; I788-K792 HydrophobicContact CG2-CD 4.09Å; I788-K792 WeakPolarHBondContact O-CB 3.3Å; I788-K792 VanDerWaalsContact O-CG 3.23Å; I788-K792 WeakPolarHBondContact O-CG 3.45Å; I788-K792 PolarHBondContact O-N 3.05Å
789	E	93.4	Very high	93.5	Very high	107 Å²	107	90.3 Å²	90.3	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-66.6	-37.6	170.4	-86.5	-160.1	-154.3	0	0	113.3	E785 M786 E787 K793	E785-E789 PolarHBondContact O-N 2.82Å; M786-E789 PolarHBondContact O-N 2.92Å; E787-E789 VanDerWaalsContact C-N 3.26Å; E787-E789 PolarHBondContact O-N 3.27Å; E789-K793 WeakPolarHBondContact O-CB 3.3Å; E789-K793 VanDerWaalsContact O-CD 3.31Å; E789-K793 WeakPolarHBondContact O-CD 3.45Å; E789-K793 WeakPolarHBondContact O-CG 3.39Å; E789-K793 PolarHBondContact O-N 2.99Å; E789-K793 IonicContact OE2-NZ 3.56Å; E789-K793 PolarHBondContact OE2-NZ 2.88Å
790	R	94	Very high	93.9	Very high	124 Å²	124	92 Å²	92	47%	0.468	45%	0.448	S	S	.	.	H	α-helix	trans	-62.2	-54.1	172.6	-83	-169.7	-81.4	-95.4	0.5	110.8	M786 E787 K792 K793 E794	M786-R790 PolarHBondContact O-N 2.87Å; E787-R790 VanDerWaalsContact CD-NE 3.33Å; E787-R790 WeakPolarHBondContact O-CA 3.4Å; E787-R790 WeakPolarHBondContact O-CB 3.18Å; E787-R790 PolarHBondContact O-N 2.99Å; E787-R790 VanDerWaalsContact O-N 3.08Å; E787-R790 IonicContact OE1-CZ 3.93Å; E787-R790 IonicContact OE1-NE 3.91Å; E787-R790 PolarHBondContact OE1-NE 3.01Å; E787-R790 IonicContact OE1-NH2 3.97Å; E787-R790 IonicContact OE2-CZ 3.71Å; E787-R790 VanDerWaalsContact OE2-CZ 3.28Å; E787-R790 IonicContact OE2-NE 3.87Å; E787-R790 PolarHBondContact OE2-NE 3.14Å; E787-R790 VanDerWaalsContact OE2-NE 3.09Å; E787-R790 IonicContact OE2-NH2 3.41Å; E787-R790 PolarHBondContact OE2-NH2 3.21Å; R790-K792 VanDerWaalsContact C-N 3.3Å; R790-K792 PolarHBondContact O-N 2.93Å; R790-K793 PolarHBondContact O-N 2.94Å; R790-E794 WeakPolarHBondContact O-CB 3.42Å; R790-E794 PolarHBondContact O-N 2.94Å
791	F	96.3	Very high	94.2	Very high	111 Å²	111	89.4 Å²	89.4	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-57.6	-39	177.2	-78.7	-62	0	0	0	112.9	E787 E794 N795	E787-F791 HydrophobicContact CG-CD2 4.02Å; E787-F791 HydrophobicContact CG-CE2 3.75Å; E787-F791 VanDerWaalsContact O-CD2 3.31Å; E787-F791 WeakPolarHBondContact O-CD2 3.3Å; E787-F791 PolarHBondContact O-N 2.94Å; F791-E794 PolarHBondContact O-N 2.85Å; F791-N795 WeakPolarHBondContact O-CB 3.39Å; F791-N795 PolarHBondContact O-N 2.89Å; F791-N795 PolarHBondContact O-OD1 3.4Å
792	K	95.9	Very high	94.3	Very high	140 Å²	140	92.2 Å²	92.2	61%	0.609	45%	0.448	S	S	*	.	H	α-helix	trans	-64.1	-41.7	174.1	-77.1	171	179.8	176.8	0	112.9	I788 R790 A796	I788-K792 HydrophobicContact CG2-CD 4.09Å; I788-K792 WeakPolarHBondContact O-CB 3.3Å; I788-K792 VanDerWaalsContact O-CG 3.23Å; I788-K792 WeakPolarHBondContact O-CG 3.45Å; I788-K792 PolarHBondContact O-N 3.05Å; R790-K792 VanDerWaalsContact C-N 3.3Å; R790-K792 PolarHBondContact O-N 2.93Å; K792-A796 WeakPolarHBondContact O-CB 3.38Å; K792-A796 PolarHBondContact O-N 3.12Å
793	K	96.1	Very high	94.6	Very high	128 Å²	128	93.7 Å²	93.7	56%	0.557	45%	0.447	S	S	*	.	H	α-helix	trans	-69.5	-38.4	178	-70.6	162.1	-166.2	165.1	0	111.5	E789 R790 A797	E789-K793 WeakPolarHBondContact O-CB 3.3Å; E789-K793 VanDerWaalsContact O-CD 3.31Å; E789-K793 WeakPolarHBondContact O-CD 3.45Å; E789-K793 WeakPolarHBondContact O-CG 3.39Å; E789-K793 PolarHBondContact O-N 2.99Å; E789-K793 IonicContact OE2-NZ 3.56Å; E789-K793 PolarHBondContact OE2-NZ 2.88Å; R790-K793 PolarHBondContact O-N 2.94Å; K793-A797 WeakPolarHBondContact O-CB 3.44Å; K793-A797 PolarHBondContact O-N 3.3Å; K793-A797 VanDerWaalsContact O-N 3.08Å
794	E	95.9	Very high	94.9	Very high	108 Å²	108	93.7 Å²	93.7	51%	0.505	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-47.5	174.6	-173.5	171.1	179.5	0	0	111.5	R790 F791 A796 A797 L798	R790-E794 WeakPolarHBondContact O-CB 3.42Å; R790-E794 PolarHBondContact O-N 2.94Å; F791-E794 PolarHBondContact O-N 2.85Å; E794-A796 VanDerWaalsContact C-N 3.33Å; E794-A796 PolarHBondContact O-N 3.47Å; E794-A797 CarbonylContact O-C 3.59Å; E794-A797 WeakPolarHBondContact O-CA 3.24Å; E794-A797 WeakPolarHBondContact O-CB 3.46Å; E794-A797 PolarHBondContact O-N 3.11Å; E794-L798 HydrophobicContact CG-CD1 4.16Å; E794-L798 HydrophobicContact CG-CG 4.39Å; E794-L798 WeakPolarHBondContact O-CG 3.22Å; E794-L798 PolarHBondContact O-N 2.85Å
795	N	93.3	Very high	94.9	Very high	35 Å²	35	91.9 Å²	91.9	19%	0.187	44%	0.438	C	S	.	.	H	α-helix	trans	-60	-41.6	176.9	-73.2	-1.8	0	0	0	111.9	E726 F791 A797 L798 T799	E726-N795 PolarHBondContact OE2-ND2 2.84Å; F791-N795 WeakPolarHBondContact O-CB 3.39Å; F791-N795 PolarHBondContact O-N 2.89Å; F791-N795 PolarHBondContact O-OD1 3.4Å; N795-A797 VanDerWaalsContact C-N 3.27Å; N795-A797 PolarHBondContact O-N 3.38Å; N795-L798 PolarHBondContact O-N 2.79Å; N795-T799 WeakPolarHBondContact O-CG2 3.47Å; N795-T799 PolarHBondContact O-N 2.86Å; N795-T799 PolarHBondContact O-OG1 3.43Å
796	A	96.3	Very high	95	Very high	44 Å²	44	92.1 Å²	92.1	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-69.8	-19.1	174.1	0	0	0	0	0	114	K792 E794 T799 K800	K792-A796 WeakPolarHBondContact O-CB 3.38Å; K792-A796 PolarHBondContact O-N 3.12Å; E794-A796 VanDerWaalsContact C-N 3.33Å; E794-A796 PolarHBondContact O-N 3.47Å; A796-T799 PolarHBondContact O-OG1 2.9Å; A796-K800 WeakPolarHBondContact O-CD 3.42Å; A796-K800 VanDerWaalsContact O-CG 3.28Å; A796-K800 WeakPolarHBondContact O-CG 3.32Å
797	A	96.1	Very high	95.2	Very high	57 Å²	57	93.4 Å²	93.4	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-82.9	-40	169.2	0	0	0	0	0	111.3	K793 E794 N795 K800 L801	K793-A797 WeakPolarHBondContact O-CB 3.44Å; K793-A797 PolarHBondContact O-N 3.3Å; K793-A797 VanDerWaalsContact O-N 3.08Å; E794-A797 CarbonylContact O-C 3.59Å; E794-A797 WeakPolarHBondContact O-CA 3.24Å; E794-A797 WeakPolarHBondContact O-CB 3.46Å; E794-A797 PolarHBondContact O-N 3.11Å; N795-A797 VanDerWaalsContact C-N 3.27Å; N795-A797 PolarHBondContact O-N 3.38Å; A797-K800 PolarHBondContact O-N 3.01Å; A797-L801 WeakPolarHBondContact O-CB 3.43Å; A797-L801 PolarHBondContact O-N 3.44Å
798	L	95.3	Very high	95.3	Very high	69 Å²	69	95.5 Å²	95.5	36%	0.361	44%	0.443	S	S	.	.	H	α-helix	trans	-62.8	-39.5	176	-72.6	171.6	0	0	0	112	E794 N795 L801 R802	E794-L798 HydrophobicContact CG-CD1 4.16Å; E794-L798 HydrophobicContact CG-CG 4.39Å; E794-L798 WeakPolarHBondContact O-CG 3.22Å; E794-L798 PolarHBondContact O-N 2.85Å; N795-L798 PolarHBondContact O-N 2.79Å; L798-L801 PolarHBondContact O-N 3.34Å; L798-R802 VanDerWaalsContact O-CG 3.3Å; L798-R802 WeakPolarHBondContact O-CG 3.42Å; L798-R802 PolarHBondContact O-N 2.92Å
799	T	95.5	Very high	95.1	Very high	7 Å²	7	96.2 Å²	96.2	4%	0.043	44%	0.444	C	S	.	.	H	α-helix	trans	-70.2	-42.7	175.6	54.1	0	0	0	0	112.7	E724 S725 N795 A796 L801 R802 Q803	E724-T799 HydrophobicContact CB-CG2 4.08Å; E724-T799 HydrophobicContact CG-CG2 4.2Å; E724-T799 WeakPolarHBondContact OE1-CB 3.5Å; E724-T799 WeakPolarHBondContact OE2-CB 3.46Å; E724-T799 PolarHBondContact OE2-OG1 3.36Å; S725-T799 WeakPolarHBondContact OG-CG2 3.23Å; N795-T799 WeakPolarHBondContact O-CG2 3.47Å; N795-T799 PolarHBondContact O-N 2.86Å; N795-T799 PolarHBondContact O-OG1 3.43Å; A796-T799 PolarHBondContact O-OG1 2.9Å; T799-L801 VanDerWaalsContact C-N 3.28Å; T799-L801 PolarHBondContact O-N 3.42Å; T799-R802 WeakPolarHBondContact O-CB 3.31Å; T799-R802 PolarHBondContact O-N 3.33Å; T799-R802 VanDerWaalsContact O-N 3.09Å; T799-Q803 PolarHBondContact O-N 2.73Å
800	K	96.9	Very high	95.3	Very high	136 Å²	136	94.9 Å²	94.9	59%	0.591	44%	0.438	S	S	*	.	H	α-helix	trans	-56.8	-42.2	170.3	-73.7	176.4	-178.2	-179.2	0	112	A796 A797 Q803 E804	A796-K800 WeakPolarHBondContact O-CD 3.42Å; A796-K800 VanDerWaalsContact O-CG 3.28Å; A796-K800 WeakPolarHBondContact O-CG 3.32Å; A797-K800 PolarHBondContact O-N 3.01Å; K800-Q803 PolarHBondContact O-N 2.73Å; K800-E804 VanDerWaalsContact O-CB 3.29Å; K800-E804 WeakPolarHBondContact O-CB 3.37Å; K800-E804 PolarHBondContact O-N 3.28Å
801	L	96.6	Very high	95.3	Very high	84 Å²	84	93.1 Å²	93.1	44%	0.44	44%	0.438	S	S	.	.	H	α-helix	trans	-67.4	-33.9	176.2	-175.1	61.6	0	0	0	112.6	A797 L798 T799 N805	A797-L801 WeakPolarHBondContact O-CB 3.43Å; A797-L801 PolarHBondContact O-N 3.44Å; L798-L801 PolarHBondContact O-N 3.34Å; T799-L801 VanDerWaalsContact C-N 3.28Å; T799-L801 PolarHBondContact O-N 3.42Å; L801-N805 VanDerWaalsContact O-CB 3.31Å; L801-N805 WeakPolarHBondContact O-CB 3.17Å; L801-N805 PolarHBondContact O-N 2.81Å; L801-N805 PolarHBondContact O-ND2 3.13Å; L801-N805 VanDerWaalsContact O-ND2 3.09Å
802	R	93.3	Very high	95.2	Very high	153 Å²	153	92.9 Å²	92.9	58%	0.577	44%	0.441	S	S	*	.	H	α-helix	trans	-63.7	-50.6	170.4	-73.3	169	-173.4	163.8	5.7	111.1	L798 T799 E804 N805 E806	L798-R802 VanDerWaalsContact O-CG 3.3Å; L798-R802 WeakPolarHBondContact O-CG 3.42Å; L798-R802 PolarHBondContact O-N 2.92Å; T799-R802 WeakPolarHBondContact O-CB 3.31Å; T799-R802 PolarHBondContact O-N 3.33Å; T799-R802 VanDerWaalsContact O-N 3.09Å; R802-E804 VanDerWaalsContact C-N 3.33Å; R802-E804 PolarHBondContact O-N 2.75Å; R802-N805 PolarHBondContact O-N 3.05Å; R802-E806 WeakPolarHBondContact O-CB 3.46Å; R802-E806 PolarHBondContact O-N 3.3Å
803	Q	96.7	Very high	95.1	Very high	76 Å²	76	91.5 Å²	91.5	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-39.1	178.2	-176	-178.2	87.1	0	0	112.2	T799 K800 E806 R807	T799-Q803 PolarHBondContact O-N 2.73Å; K800-Q803 PolarHBondContact O-N 2.73Å; Q803-E806 PolarHBondContact O-N 3.16Å; Q803-R807 WeakPolarHBondContact O-CG 3.48Å; Q803-R807 PolarHBondContact O-N 2.94Å; Q803-R807 VanDerWaalsContact OE1-CZ 3.29Å
804	E	95.9	Very high	95.2	Very high	86 Å²	86	90 Å²	90	40%	0.402	43%	0.425	S	S	.	.	H	α-helix	trans	-67.3	-40.2	176.5	-163.3	-167.5	-151.8	0	0	111.6	K800 R802 R807 R808	K800-E804 VanDerWaalsContact O-CB 3.29Å; K800-E804 WeakPolarHBondContact O-CB 3.37Å; K800-E804 PolarHBondContact O-N 3.28Å; R802-E804 VanDerWaalsContact C-N 3.33Å; R802-E804 PolarHBondContact O-N 2.75Å; E804-R807 PolarHBondContact O-N 3.4Å; E804-R808 WeakPolarHBondContact O-CG 3.23Å; E804-R808 PolarHBondContact O-N 3.39Å; E804-R808 IonicContact OE1-CZ 3.55Å; E804-R808 IonicContact OE1-NH1 2.68Å; E804-R808 IonicContact OE1-NH2 3.58Å; E804-R808 PolarHBondContact OE1-NH2 3.39Å; E804-R808 IonicContact OE2-CZ 2.78Å; E804-R808 IonicContact OE2-NH1 3.81Å; E804-R808 PolarHBondContact OE2-NH1 3.16Å; E804-R808 IonicContact OE2-NH2 3.9Å; E804-R808 PolarHBondContact OE2-NH2 2.81Å
805	N	93.6	Very high	95.1	Very high	67 Å²	67	91 Å²	91	36%	0.358	43%	0.43	S	S	.	.	H	α-helix	trans	-69.9	-33.3	174.7	-73.7	-29.4	0	0	0	113	L801 R802 R808 Q809	L801-N805 VanDerWaalsContact O-CB 3.31Å; L801-N805 WeakPolarHBondContact O-CB 3.17Å; L801-N805 PolarHBondContact O-N 2.81Å; L801-N805 PolarHBondContact O-ND2 3.13Å; L801-N805 VanDerWaalsContact O-ND2 3.09Å; R802-N805 PolarHBondContact O-N 3.05Å; N805-R808 PolarHBondContact O-N 3.23Å; N805-R808 PolarHBondContact OD1-NH1 3.05Å; N805-Q809 WeakPolarHBondContact O-CG 3.48Å; N805-Q809 PolarHBondContact O-N 3.21Å
806	E	95.8	Very high	94.9	Very high	129 Å²	129	97.5 Å²	97.5	60%	0.603	45%	0.452	S	S	*	.	H	α-helix	trans	-62.9	-45.6	171	-177.7	175.3	-141.7	0	0	111.2	R802 Q803 Q809 E810	R802-E806 WeakPolarHBondContact O-CB 3.46Å; R802-E806 PolarHBondContact O-N 3.3Å; Q803-E806 PolarHBondContact O-N 3.16Å; E806-Q809 PolarHBondContact O-N 2.99Å; E806-E810 WeakPolarHBondContact O-CB 3.39Å; E806-E810 PolarHBondContact O-N 2.83Å
807	R	96.8	Very high	94.9	Very high	141 Å²	141	100.1 Å²	100.1	53%	0.532	46%	0.459	S	S	.	.	H	α-helix	trans	-58.9	-49.1	172.5	-71.9	175	-176	147.7	7.8	111.9	Q803 E804 Q809 E810 D811	Q803-R807 WeakPolarHBondContact O-CG 3.48Å; Q803-R807 PolarHBondContact O-N 2.94Å; Q803-R807 VanDerWaalsContact OE1-CZ 3.29Å; E804-R807 PolarHBondContact O-N 3.4Å; R807-Q809 VanDerWaalsContact C-N 3.31Å; R807-Q809 PolarHBondContact O-N 2.84Å; R807-E810 PolarHBondContact O-N 2.91Å; R807-D811 PolarHBondContact O-N 2.82Å
808	R	95.1	Very high	94.8	Very high	113 Å²	113	103.4 Å²	103.4	43%	0.426	47%	0.466	S	S	.	.	H	α-helix	trans	-55.4	-44	175.5	-74.2	178.4	-178.4	111.4	9.7	112.3	E804 N805 E810 L812	E804-R808 WeakPolarHBondContact O-CG 3.23Å; E804-R808 PolarHBondContact O-N 3.39Å; E804-R808 IonicContact OE1-CZ 3.55Å; E804-R808 IonicContact OE1-NH1 2.68Å; E804-R808 IonicContact OE1-NH2 3.58Å; E804-R808 PolarHBondContact OE1-NH2 3.39Å; E804-R808 IonicContact OE2-CZ 2.78Å; E804-R808 IonicContact OE2-NH1 3.81Å; E804-R808 PolarHBondContact OE2-NH1 3.16Å; E804-R808 IonicContact OE2-NH2 3.9Å; E804-R808 PolarHBondContact OE2-NH2 2.81Å; N805-R808 PolarHBondContact O-N 3.23Å; N805-R808 PolarHBondContact OD1-NH1 3.05Å; R808-E810 VanDerWaalsContact C-N 3.33Å; R808-L812 WeakPolarHBondContact O-CB 3.44Å; R808-L812 WeakPolarHBondContact O-CD1 3.4Å; R808-L812 VanDerWaalsContact O-CG 3.24Å; R808-L812 WeakPolarHBondContact O-CG 3.47Å; R808-L812 PolarHBondContact O-N 2.77Å
809	Q	88.8	Confident	94.8	Very high	106 Å²	106	107.1 Å²	107.1	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-40.6	175.8	-74.9	-179.4	19.9	0	0	112.1	N805 E806 R807 L812 R813	N805-Q809 WeakPolarHBondContact O-CG 3.48Å; N805-Q809 PolarHBondContact O-N 3.21Å; E806-Q809 PolarHBondContact O-N 2.99Å; R807-Q809 VanDerWaalsContact C-N 3.31Å; R807-Q809 PolarHBondContact O-N 2.84Å; Q809-L812 PolarHBondContact O-N 2.97Å; Q809-R813 WeakPolarHBondContact O-CG 3.33Å; Q809-R813 PolarHBondContact O-N 2.88Å
810	E	96.3	Very high	94.5	Very high	79 Å²	79	112.5 Å²	112.5	37%	0.369	51%	0.505	S	S	.	.	H	α-helix	trans	-71.9	-34.5	-178.1	-173.5	50.8	-151.4	0	0	112.5	E806 R807 R808 R813 K814	E806-E810 WeakPolarHBondContact O-CB 3.39Å; E806-E810 PolarHBondContact O-N 2.83Å; R807-E810 PolarHBondContact O-N 2.91Å; R808-E810 VanDerWaalsContact C-N 3.33Å; E810-R813 PolarHBondContact O-N 2.77Å; E810-R813 WeakPolarHBondContact OE2-CD 3.49Å; E810-R813 IonicContact OE2-CZ 2.74Å; E810-R813 IonicContact OE2-NH1 3.33Å; E810-R813 PolarHBondContact OE2-NH1 2.88Å; E810-K814 WeakPolarHBondContact O-CE 3.38Å; E810-K814 WeakPolarHBondContact O-CG 3.39Å; E810-K814 PolarHBondContact O-N 3.16Å; E810-K814 VanDerWaalsContact O-N 3.12Å
811	D	94.8	Very high	94.4	Very high	86 Å²	86	112.2 Å²	112.2	46%	0.46	51%	0.505	S	S	.	.	H	α-helix	trans	-71.2	-38	172.6	-63.3	-31.5	0	0	0	111.4	R807 R813 K814 E815	R807-D811 PolarHBondContact O-N 2.82Å; D811-R813 VanDerWaalsContact C-N 3.29Å; D811-R813 PolarHBondContact O-N 2.7Å; D811-K814 PolarHBondContact O-N 2.78Å; D811-K814 IonicContact OD1-NZ 2.76Å; D811-K814 PolarHBondContact OD1-NZ 2.74Å; D811-E815 WeakPolarHBondContact O-CB 3.33Å; D811-E815 PolarHBondContact O-N 2.78Å
812	L	94.4	Very high	94.3	Very high	106 Å²	106	110.3 Å²	110.3	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-64	-27.9	169.8	-73.6	167.9	0	0	0	113.5	R808 Q809 R816	R808-L812 WeakPolarHBondContact O-CB 3.44Å; R808-L812 WeakPolarHBondContact O-CD1 3.4Å; R808-L812 VanDerWaalsContact O-CG 3.24Å; R808-L812 WeakPolarHBondContact O-CG 3.47Å; R808-L812 PolarHBondContact O-N 2.77Å; Q809-L812 PolarHBondContact O-N 2.97Å; L812-R816 WeakPolarHBondContact O-CB 3.22Å; L812-R816 PolarHBondContact O-N 3.37Å; L812-R816 VanDerWaalsContact O-N 3.16Å
813	R	94.6	Very high	94.3	Very high	112 Å²	112	109 Å²	109	42%	0.423	50%	0.5	S	S	.	.	H	α-helix	trans	-70.5	-43.6	171.3	-74.1	177.5	-159	106.9	10.9	111.2	Q809 E810 D811 R816 L817	Q809-R813 WeakPolarHBondContact O-CG 3.33Å; Q809-R813 PolarHBondContact O-N 2.88Å; E810-R813 PolarHBondContact O-N 2.77Å; E810-R813 WeakPolarHBondContact OE2-CD 3.49Å; E810-R813 IonicContact OE2-CZ 2.74Å; E810-R813 IonicContact OE2-NH1 3.33Å; E810-R813 PolarHBondContact OE2-NH1 2.88Å; D811-R813 VanDerWaalsContact C-N 3.29Å; D811-R813 PolarHBondContact O-N 2.7Å; R813-R816 PolarHBondContact O-N 2.91Å; R813-L817 WeakPolarHBondContact O-CG 3.01Å; R813-L817 PolarHBondContact O-N 2.88Å; R813-L817 VanDerWaalsContact O-N 3.07Å
814	K	96.8	Very high	94.1	Very high	96 Å²	96	108 Å²	108	42%	0.417	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-45.2	176	-64.6	163.1	-153.5	153.5	0	111.4	E810 D811 R816 L817 M818	E810-K814 WeakPolarHBondContact O-CE 3.38Å; E810-K814 WeakPolarHBondContact O-CG 3.39Å; E810-K814 PolarHBondContact O-N 3.16Å; E810-K814 VanDerWaalsContact O-N 3.12Å; D811-K814 PolarHBondContact O-N 2.78Å; D811-K814 IonicContact OD1-NZ 2.76Å; D811-K814 PolarHBondContact OD1-NZ 2.74Å; K814-R816 VanDerWaalsContact C-N 3.32Å; K814-R816 PolarHBondContact O-N 3.09Å; K814-L817 PolarHBondContact O-N 2.79Å; K814-M818 WeakPolarHBondContact O-CB 3.5Å; K814-M818 VanDerWaalsContact O-CG 3.25Å; K814-M818 WeakPolarHBondContact O-CG 3.39Å; K814-M818 PolarHBondContact O-N 2.81Å
815	E	95.1	Very high	94	Very high	128 Å²	128	110 Å²	110	60%	0.598	52%	0.515	S	S	*	.	H	α-helix	trans	-58.9	-43.5	177.5	-174.6	174.3	-155.7	0	0	111.4	D811 M818 F819	D811-E815 WeakPolarHBondContact O-CB 3.33Å; D811-E815 PolarHBondContact O-N 2.78Å; E815-M818 PolarHBondContact O-N 2.92Å; E815-F819 WeakPolarHBondContact O-CB 3.3Å; E815-F819 PolarHBondContact O-N 2.82Å
816	R	88.3	Confident	93.9	Very high	173 Å²	173	113.7 Å²	113.7	65%	0.653	53%	0.53	S	S	*	.	H	α-helix	trans	-58.4	-48.5	172.8	-179.4	-177.3	-60	-93.9	-6.8	112.7	L812 R813 K814 F819 E820	L812-R816 WeakPolarHBondContact O-CB 3.22Å; L812-R816 PolarHBondContact O-N 3.37Å; L812-R816 VanDerWaalsContact O-N 3.16Å; R813-R816 PolarHBondContact O-N 2.91Å; K814-R816 VanDerWaalsContact C-N 3.32Å; K814-R816 PolarHBondContact O-N 3.09Å; R816-F819 PolarHBondContact O-N 2.81Å; R816-E820 WeakPolarHBondContact O-CB 3.3Å; R816-E820 PolarHBondContact O-N 2.87Å
817	L	96.4	Very high	93.4	Very high	98 Å²	98	112.3 Å²	112.3	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-43.8	179.2	-71	170.1	0	0	0	111.7	R813 K814 F819 E820 E821	R813-L817 WeakPolarHBondContact O-CG 3.01Å; R813-L817 PolarHBondContact O-N 2.88Å; R813-L817 VanDerWaalsContact O-N 3.07Å; K814-L817 PolarHBondContact O-N 2.79Å; L817-F819 VanDerWaalsContact C-N 3.31Å; L817-F819 PolarHBondContact O-N 2.78Å; L817-E820 PolarHBondContact O-N 2.79Å; L817-E821 WeakPolarHBondContact O-CB 3.4Å; L817-E821 WeakPolarHBondContact O-CG 3.46Å; L817-E821 PolarHBondContact O-N 2.94Å
818	M	94.8	Very high	93.3	Very high	126 Å²	126	108 Å²	108	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-61	-38.9	175.4	-70.7	-66.2	-52.9	0	0	112	K814 E815 A822	K814-M818 WeakPolarHBondContact O-CB 3.5Å; K814-M818 VanDerWaalsContact O-CG 3.25Å; K814-M818 WeakPolarHBondContact O-CG 3.39Å; K814-M818 PolarHBondContact O-N 2.81Å; E815-M818 PolarHBondContact O-N 2.92Å; M818-A822 VanDerWaalsContact O-CB 3.25Å; M818-A822 WeakPolarHBondContact O-CB 3.3Å; M818-A822 PolarHBondContact O-N 2.88Å
819	F	94.8	Very high	93	Very high	147 Å²	147	106.9 Å²	106.9	65%	0.645	52%	0.523	S	S	*	.	H	α-helix	trans	-69.4	-38.6	175.7	-179.2	-96.8	0	0	0	112.2	E815 R816 L817 A822 K823	E815-F819 WeakPolarHBondContact O-CB 3.3Å; E815-F819 PolarHBondContact O-N 2.82Å; R816-F819 PolarHBondContact O-N 2.81Å; L817-F819 VanDerWaalsContact C-N 3.31Å; L817-F819 PolarHBondContact O-N 2.78Å; F819-A822 PolarHBondContact O-N 2.91Å; F819-K823 VanDerWaalsContact O-CB 3.28Å; F819-K823 WeakPolarHBondContact O-CB 3.28Å; F819-K823 PolarHBondContact O-N 2.77Å
820	E	88.7	Confident	93.2	Very high	120 Å²	120	108.2 Å²	108.2	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-43	175.9	-172.8	163.8	-156.1	0	0	111.9	R816 L817 K823 A824	R816-E820 WeakPolarHBondContact O-CB 3.3Å; R816-E820 PolarHBondContact O-N 2.87Å; L817-E820 PolarHBondContact O-N 2.79Å; E820-K823 PolarHBondContact O-N 2.71Å; E820-A824 WeakPolarHBondContact O-CB 3.35Å; E820-A824 PolarHBondContact O-N 2.67Å
821	E	95.9	Very high	92.8	Very high	130 Å²	130	110.1 Å²	110.1	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-61.9	-44.7	171.8	-74.3	-178.2	-173.2	0	0	111.9	L817 A824 Q825	L817-E821 WeakPolarHBondContact O-CB 3.4Å; L817-E821 WeakPolarHBondContact O-CG 3.46Å; L817-E821 PolarHBondContact O-N 2.94Å; E821-A824 PolarHBondContact O-N 2.84Å; E821-Q825 WeakPolarHBondContact O-CB 3.31Å; E821-Q825 PolarHBondContact O-N 3.46Å
822	A	94.3	Very high	92.7	Very high	45 Å²	45	111.4 Å²	111.4	37%	0.372	54%	0.539	S	S	.	.	H	α-helix	trans	-62.5	-46.2	176.8	0	0	0	0	0	111.9	M818 F819 A824 Q825 E826	M818-A822 VanDerWaalsContact O-CB 3.25Å; M818-A822 WeakPolarHBondContact O-CB 3.3Å; M818-A822 PolarHBondContact O-N 2.88Å; F819-A822 PolarHBondContact O-N 2.91Å; A822-A824 VanDerWaalsContact C-N 3.34Å; A822-A824 PolarHBondContact O-N 3.27Å; A822-Q825 WeakPolarHBondContact O-CB 3.36Å; A822-Q825 PolarHBondContact O-N 3.4Å; A822-Q825 VanDerWaalsContact O-N 3.14Å; A822-E826 PolarHBondContact O-N 3.5Å
823	K	92.1	Very high	92.7	Very high	125 Å²	125	113.1 Å²	113.1	54%	0.543	54%	0.54	S	S	.	.	H	α-helix	trans	-60.3	-42.2	175.7	-178.1	-176.3	176.8	-172.5	0	111.9	F819 E820 Q825 E826 L827	F819-K823 VanDerWaalsContact O-CB 3.28Å; F819-K823 WeakPolarHBondContact O-CB 3.28Å; F819-K823 PolarHBondContact O-N 2.77Å; E820-K823 PolarHBondContact O-N 2.71Å; K823-Q825 VanDerWaalsContact C-N 3.34Å; K823-E826 PolarHBondContact O-N 2.71Å; K823-L827 HydrophobicContact CG-CD1 4.41Å; K823-L827 WeakPolarHBondContact O-CG 3.27Å; K823-L827 PolarHBondContact O-N 2.87Å; K823-L827 VanDerWaalsContact O-N 3.08Å
824	A	92.6	Very high	92.7	Very high	56 Å²	56	113.8 Å²	113.8	46%	0.463	55%	0.545	S	S	.	.	H	α-helix	trans	-64.6	-38.6	175.1	0	0	0	0	0	111.9	E820 E821 A822 A828	E820-A824 WeakPolarHBondContact O-CB 3.35Å; E820-A824 PolarHBondContact O-N 2.67Å; E821-A824 PolarHBondContact O-N 2.84Å; A822-A824 VanDerWaalsContact C-N 3.34Å; A822-A824 PolarHBondContact O-N 3.27Å; A824-A828 WeakPolarHBondContact O-CB 3.3Å; A824-A828 PolarHBondContact O-N 3.11Å
825	Q	94	Very high	92.5	Very high	128 Å²	128	115.5 Å²	115.5	60%	0.598	55%	0.55	S	S	*	.	H	α-helix	trans	-66.5	-41.4	175.9	-170.3	177.2	10.7	0	0	112.3	E821 A822 K823 A828 N829	E821-Q825 WeakPolarHBondContact O-CB 3.31Å; E821-Q825 PolarHBondContact O-N 3.46Å; A822-Q825 WeakPolarHBondContact O-CB 3.36Å; A822-Q825 PolarHBondContact O-N 3.4Å; A822-Q825 VanDerWaalsContact O-N 3.14Å; K823-Q825 VanDerWaalsContact C-N 3.34Å; Q825-A828 PolarHBondContact O-N 2.98Å; Q825-N829 WeakPolarHBondContact O-CB 3.41Å; Q825-N829 PolarHBondContact O-N 3.38Å; Q825-N829 PolarHBondContact O-ND2 3.45Å
826	E	92.6	Very high	92.4	Very high	143 Å²	143	112.3 Å²	112.3	67%	0.668	53%	0.534	S	S	*	.	H	α-helix	trans	-64.3	-41.5	175.7	-73	-171.2	154.8	0	0	112.3	A822 K823 N829 F830	A822-E826 PolarHBondContact O-N 3.5Å; K823-E826 PolarHBondContact O-N 2.71Å; E826-N829 PolarHBondContact O-N 3.48Å; E826-F830 WeakPolarHBondContact O-CB 3.5Å; E826-F830 PolarHBondContact O-N 2.86Å
827	L	83.9	Confident	92.7	Very high	100 Å²	100	106.5 Å²	106.5	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-46.1	173	-72	168.5	0	0	0	111.6	K823 N829 F830 E831	K823-L827 HydrophobicContact CG-CD1 4.41Å; K823-L827 WeakPolarHBondContact O-CG 3.27Å; K823-L827 PolarHBondContact O-N 2.87Å; K823-L827 VanDerWaalsContact O-N 3.08Å; L827-N829 PolarHBondContact O-N 3.37Å; L827-F830 PolarHBondContact O-N 2.85Å; L827-E831 PolarHBondContact O-N 3.35Å
828	A	94.7	Very high	92	Very high	50 Å²	50	105.5 Å²	105.5	41%	0.413	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-38.9	176.9	0	0	0	0	0	112.8	A824 Q825 E831 E832	A824-A828 WeakPolarHBondContact O-CB 3.3Å; A824-A828 PolarHBondContact O-N 3.11Å; Q825-A828 PolarHBondContact O-N 2.98Å; A828-E831 PolarHBondContact O-N 2.88Å; A828-E832 PolarHBondContact O-N 3.02Å
829	N	90.1	Very high	92	Very high	91 Å²	91	105.7 Å²	105.7	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-41.2	173.9	-70.2	-24.6	0	0	0	111.5	Q825 E826 L827 E832 Y833	Q825-N829 WeakPolarHBondContact O-CB 3.41Å; Q825-N829 PolarHBondContact O-N 3.38Å; Q825-N829 PolarHBondContact O-ND2 3.45Å; E826-N829 PolarHBondContact O-N 3.48Å; L827-N829 PolarHBondContact O-N 3.37Å; N829-E832 PolarHBondContact O-N 2.96Å; N829-Y833 WeakPolarHBondContact O-CB 3.36Å; N829-Y833 PolarHBondContact O-N 3.23Å
830	F	92.9	Very high	92	Very high	133 Å²	133	102.4 Å²	102.4	58%	0.583	49%	0.489	S	S	*	.	H	α-helix	trans	-67.1	-40.4	176.8	-178.3	-99.8	0	0	0	112	E826 L827 Y833 K834	E826-F830 WeakPolarHBondContact O-CB 3.5Å; E826-F830 PolarHBondContact O-N 2.86Å; L827-F830 PolarHBondContact O-N 2.85Å; F830-Y833 PolarHBondContact O-N 3.24Å; F830-K834 VanDerWaalsContact O-CB 3.31Å; F830-K834 WeakPolarHBondContact O-CB 3.43Å; F830-K834 PolarHBondContact O-N 3.46Å
831	E	87.1	Confident	92.1	Very high	120 Å²	120	101.6 Å²	101.6	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-62.8	-39.4	171.7	-74.8	-172.8	-179.7	0	0	112.6	L827 A828 K834 R835	L827-E831 PolarHBondContact O-N 3.35Å; A828-E831 PolarHBondContact O-N 2.88Å; E831-K834 PolarHBondContact O-N 3.34Å; E831-R835 WeakPolarHBondContact O-CB 3.34Å; E831-R835 VanDerWaalsContact O-CG 3.3Å; E831-R835 WeakPolarHBondContact O-CG 3.48Å; E831-R835 PolarHBondContact O-N 2.97Å; E831-R835 PolarHBondContact O-NE 3.49Å
832	E	93.8	Very high	91.8	Very high	112 Å²	112	100.7 Å²	100.7	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-44.7	174.1	-177.7	129.5	-96.5	0	0	112.1	A828 N829 R835 E836	A828-E832 PolarHBondContact O-N 3.02Å; N829-E832 PolarHBondContact O-N 2.96Å; E832-R835 VanDerWaalsContact CA-CZ 3.45Å; E832-R835 PolarHBondContact O-N 3.01Å; E832-R835 IonicContact OE1-CZ 3.72Å; E832-R835 IonicContact OE1-NH1 2.71Å; E832-R835 PolarHBondContact OE1-NH1 2.85Å; E832-R835 IonicContact OE1-NH2 2.72Å; E832-E836 PolarHBondContact O-N 3.3Å
833	Y	93.2	Very high	91.7	Very high	142 Å²	142	103.5 Å²	103.5	56%	0.557	49%	0.488	S	S	*	.	H	α-helix	trans	-59.5	-47.9	173.9	-178.2	-109.1	0	0	0	111.5	N829 F830 R835 E836 E837	N829-Y833 WeakPolarHBondContact O-CB 3.36Å; N829-Y833 PolarHBondContact O-N 3.23Å; F830-Y833 PolarHBondContact O-N 3.24Å; Y833-R835 VanDerWaalsContact C-N 3.32Å; Y833-R835 PolarHBondContact O-N 3.21Å; Y833-E836 PolarHBondContact O-N 3.11Å; Y833-E837 HydrophobicContact CD1-CG 4.35Å; Y833-E837 HydrophobicContact CD2-CG 4.23Å; Y833-E837 HydrophobicContact CE1-CG 3.82Å; Y833-E837 HydrophobicContact CE2-CG 3.67Å; Y833-E837 WeakPolarHBondContact CE2-OE1 3.5Å; Y833-E837 VanDerWaalsContact CZ-CG 3.42Å; Y833-E837 PolarHBondContact O-N 2.77Å; Y833-E837 PolarHBondContact OH-OE1 3.02Å
834	K	94.1	Very high	91.7	Very high	126 Å²	126	102.5 Å²	102.5	55%	0.548	49%	0.485	S	S	.	.	H	α-helix	trans	-58.4	-40.7	175.2	-176.1	178.7	178.5	-178.3	0	112	F830 E831 N838	F830-K834 VanDerWaalsContact O-CB 3.31Å; F830-K834 WeakPolarHBondContact O-CB 3.43Å; F830-K834 PolarHBondContact O-N 3.46Å; E831-K834 PolarHBondContact O-N 3.34Å; K834-N838 WeakPolarHBondContact O-CB 3.4Å; K834-N838 PolarHBondContact O-N 2.82Å; K834-N838 VanDerWaalsContact O-N 3.12Å; K834-N838 PolarHBondContact O-ND2 2.74Å
835	R	92.6	Very high	91.6	Very high	133 Å²	133	107.7 Å²	107.7	50%	0.502	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-44.7	174.4	-79	-178	-80.7	109.2	-8.6	111.9	E831 E832 Y833 R839	E831-R835 WeakPolarHBondContact O-CB 3.34Å; E831-R835 VanDerWaalsContact O-CG 3.3Å; E831-R835 WeakPolarHBondContact O-CG 3.48Å; E831-R835 PolarHBondContact O-N 2.97Å; E831-R835 PolarHBondContact O-NE 3.49Å; E832-R835 VanDerWaalsContact CA-CZ 3.45Å; E832-R835 PolarHBondContact O-N 3.01Å; E832-R835 IonicContact OE1-CZ 3.72Å; E832-R835 IonicContact OE1-NH1 2.71Å; E832-R835 PolarHBondContact OE1-NH1 2.85Å; E832-R835 IonicContact OE1-NH2 2.72Å; Y833-R835 VanDerWaalsContact C-N 3.32Å; Y833-R835 PolarHBondContact O-N 3.21Å; R835-R839 WeakPolarHBondContact O-CB 3.39Å; R835-R839 PolarHBondContact O-N 2.78Å
836	E	92.9	Very high	91.5	Very high	60 Å²	60	106.5 Å²	106.5	28%	0.28	49%	0.485	S	S	.	.	H	α-helix	trans	-71.4	-39.5	-178.7	-179.3	55.7	-159.8	0	0	112.9	E832 Y833 R839 K840	E832-E836 PolarHBondContact O-N 3.3Å; Y833-E836 PolarHBondContact O-N 3.11Å; E836-R839 CarbonylContact O-C 3.54Å; E836-R839 WeakPolarHBondContact O-CB 3.41Å; E836-R839 PolarHBondContact O-N 3.27Å; E836-R839 IonicContact OE1-CZ 3.9Å; E836-R839 IonicContact OE1-NE 2.7Å; E836-R839 IonicContact OE1-NH2 3.09Å; E836-R839 PolarHBondContact OE1-NH2 3.49Å; E836-R839 IonicContact OE2-CZ 2.66Å; E836-R839 IonicContact OE2-NE 3.42Å; E836-R839 PolarHBondContact OE2-NE 2.66Å; E836-R839 IonicContact OE2-NH2 3.99Å; E836-R839 PolarHBondContact OE2-NH2 2.9Å; E836-K840 WeakPolarHBondContact O-CG 3.35Å; E836-K840 PolarHBondContact O-N 2.65Å
837	E	94.9	Very high	91.5	Very high	52 Å²	52	104.3 Å²	104.3	24%	0.243	48%	0.478	C	S	.	.	H	α-helix	trans	-63.9	-43.7	173.1	-67.6	-53.6	143.6	0	0	111.4	Y833 R839 K840 L841	Y833-E837 HydrophobicContact CD1-CG 4.35Å; Y833-E837 HydrophobicContact CD2-CG 4.23Å; Y833-E837 HydrophobicContact CE1-CG 3.82Å; Y833-E837 HydrophobicContact CE2-CG 3.67Å; Y833-E837 WeakPolarHBondContact CE2-OE1 3.5Å; Y833-E837 VanDerWaalsContact CZ-CG 3.42Å; Y833-E837 PolarHBondContact O-N 2.77Å; Y833-E837 PolarHBondContact OH-OE1 3.02Å; E837-R839 VanDerWaalsContact C-N 3.26Å; E837-R839 PolarHBondContact O-N 2.84Å; E837-K840 WeakPolarHBondContact O-CA 3.4Å; E837-K840 WeakPolarHBondContact O-CB 3.35Å; E837-K840 PolarHBondContact O-N 3.13Å; E837-K840 IonicContact OE1-NZ 2.66Å; E837-K840 PolarHBondContact OE1-NZ 2.79Å; E837-K840 WeakPolarHBondContact OE2-CD 3.48Å; E837-K840 IonicContact OE2-NZ 3.28Å; E837-L841 WeakPolarHBondContact O-CG 3.38Å; E837-L841 PolarHBondContact O-N 2.7Å
838	N	82	Confident	91.7	Very high	76 Å²	76	106 Å²	106	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-59.2	-38.7	171.5	-85.3	-79.7	0	0	0	111.8	K834 K840 L841 Q842	K834-N838 WeakPolarHBondContact O-CB 3.4Å; K834-N838 PolarHBondContact O-N 2.82Å; K834-N838 VanDerWaalsContact O-N 3.12Å; K834-N838 PolarHBondContact O-ND2 2.74Å; N838-K840 VanDerWaalsContact C-N 3.28Å; N838-K840 PolarHBondContact O-N 2.84Å; N838-L841 PolarHBondContact O-N 2.91Å; N838-Q842 WeakPolarHBondContact O-CB 3.13Å; N838-Q842 VanDerWaalsContact O-CG 3.28Å; N838-Q842 WeakPolarHBondContact O-CG 3.35Å; N838-Q842 PolarHBondContact O-N 2.9Å
839	R	95.1	Very high	91.6	Very high	130 Å²	130	108.2 Å²	108.2	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-24.9	174.9	-159.7	-176.3	66.8	138.2	-2.5	113	R835 E836 E837 K843	R835-R839 WeakPolarHBondContact O-CB 3.39Å; R835-R839 PolarHBondContact O-N 2.78Å; E836-R839 CarbonylContact O-C 3.54Å; E836-R839 WeakPolarHBondContact O-CB 3.41Å; E836-R839 PolarHBondContact O-N 3.27Å; E836-R839 IonicContact OE1-CZ 3.9Å; E836-R839 IonicContact OE1-NE 2.7Å; E836-R839 IonicContact OE1-NH2 3.09Å; E836-R839 PolarHBondContact OE1-NH2 3.49Å; E836-R839 IonicContact OE2-CZ 2.66Å; E836-R839 IonicContact OE2-NE 3.42Å; E836-R839 PolarHBondContact OE2-NE 2.66Å; E836-R839 IonicContact OE2-NH2 3.99Å; E836-R839 PolarHBondContact OE2-NH2 2.9Å; E837-R839 VanDerWaalsContact C-N 3.26Å; E837-R839 PolarHBondContact O-N 2.84Å; R839-K843 WeakPolarHBondContact O-CD 3.44Å; R839-K843 WeakPolarHBondContact O-CE 3.35Å; R839-K843 WeakPolarHBondContact O-CG 3.45Å
840	K	94.8	Very high	91.6	Very high	79 Å²	79	110.9 Å²	110.9	34%	0.343	49%	0.49	S	S	.	.	H	α-helix	trans	-76.2	-51.8	170	-67.9	166.2	-171.8	168.4	0	110.8	E836 E837 N838 Q842 K843 E844	E836-K840 WeakPolarHBondContact O-CG 3.35Å; E836-K840 PolarHBondContact O-N 2.65Å; E837-K840 WeakPolarHBondContact O-CA 3.4Å; E837-K840 WeakPolarHBondContact O-CB 3.35Å; E837-K840 PolarHBondContact O-N 3.13Å; E837-K840 IonicContact OE1-NZ 2.66Å; E837-K840 PolarHBondContact OE1-NZ 2.79Å; E837-K840 WeakPolarHBondContact OE2-CD 3.48Å; E837-K840 IonicContact OE2-NZ 3.28Å; N838-K840 VanDerWaalsContact C-N 3.28Å; N838-K840 PolarHBondContact O-N 2.84Å; K840-Q842 VanDerWaalsContact C-N 3.26Å; K840-Q842 PolarHBondContact O-N 2.85Å; K840-K843 WeakPolarHBondContact O-CA 3.38Å; K840-K843 WeakPolarHBondContact O-CB 3.47Å; K840-K843 PolarHBondContact O-N 2.72Å; K840-E844 PolarHBondContact O-N 2.88Å
841	L	90.8	Very high	91.4	Very high	102 Å²	102	110 Å²	110	53%	0.534	49%	0.488	S	S	.	.	H	α-helix	trans	-56.4	-38.1	178	-66.5	173.2	0	0	0	112.3	E837 N838 E844 R845	E837-L841 WeakPolarHBondContact O-CG 3.38Å; E837-L841 PolarHBondContact O-N 2.7Å; N838-L841 PolarHBondContact O-N 2.91Å; L841-E844 PolarHBondContact O-N 2.77Å; L841-R845 WeakPolarHBondContact O-CB 3.23Å; L841-R845 PolarHBondContact O-N 2.85Å
842	Q	89.4	Confident	91.6	Very high	112 Å²	112	107.6 Å²	107.6	52%	0.523	48%	0.481	S	S	.	.	H	α-helix	trans	-65.7	-37.2	172.8	-74.9	178.3	7.7	0	0	113.4	N838 K840 K846	N838-Q842 WeakPolarHBondContact O-CB 3.13Å; N838-Q842 VanDerWaalsContact O-CG 3.28Å; N838-Q842 WeakPolarHBondContact O-CG 3.35Å; N838-Q842 PolarHBondContact O-N 2.9Å; K840-Q842 VanDerWaalsContact C-N 3.26Å; K840-Q842 PolarHBondContact O-N 2.85Å; Q842-K846 WeakPolarHBondContact O-CB 3.37Å; Q842-K846 VanDerWaalsContact O-CG 3.28Å; Q842-K846 WeakPolarHBondContact O-CG 3.37Å; Q842-K846 PolarHBondContact O-N 3.07Å
843	K	92.8	Very high	91.2	Very high	103 Å²	103	105.2 Å²	105.2	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-39.2	174.7	-69.8	161	-169	156.4	0	110.8	R839 K840 L847	R839-K843 WeakPolarHBondContact O-CD 3.44Å; R839-K843 WeakPolarHBondContact O-CE 3.35Å; R839-K843 WeakPolarHBondContact O-CG 3.45Å; K840-K843 WeakPolarHBondContact O-CA 3.38Å; K840-K843 WeakPolarHBondContact O-CB 3.47Å; K840-K843 PolarHBondContact O-N 2.72Å; K843-L847 WeakPolarHBondContact O-CB 3.33Å; K843-L847 PolarHBondContact O-N 2.97Å
844	E	91.1	Very high	90.8	Very high	104 Å²	104	101.1 Å²	101.1	49%	0.486	47%	0.472	S	S	.	.	H	α-helix	trans	-69.3	-45.9	177	-69.1	-176	177.6	0	0	111.5	K840 L841 K846 L847 F848	K840-E844 PolarHBondContact O-N 2.88Å; L841-E844 PolarHBondContact O-N 2.77Å; E844-K846 VanDerWaalsContact C-N 3.34Å; E844-K846 PolarHBondContact O-N 2.78Å; E844-L847 CarbonylContact O-C 3.47Å; E844-L847 WeakPolarHBondContact O-CA 3.49Å; E844-L847 WeakPolarHBondContact O-CB 3.43Å; E844-L847 PolarHBondContact O-N 2.71Å; E844-F848 HydrophobicContact CB-CD2 4.43Å; E844-F848 HydrophobicContact CB-CE2 4.37Å; E844-F848 WeakPolarHBondContact O-CD2 3.42Å; E844-F848 PolarHBondContact O-N 3.18Å
845	R	91.9	Very high	90.1	Very high	166 Å²	166	98 Å²	98	63%	0.626	47%	0.47	S	S	*	.	H	α-helix	trans	-52.7	-51.4	171.1	-174.4	-173.4	-110.8	-129.8	4.9	110.4	D677 L841 L847 F848 E849	D677-R845 IonicContact OD2-NH1 3.79Å; L841-R845 WeakPolarHBondContact O-CB 3.23Å; L841-R845 PolarHBondContact O-N 2.85Å; R845-L847 PolarHBondContact O-N 2.74Å; R845-F848 PolarHBondContact O-N 3.33Å; R845-E849 WeakPolarHBondContact O-CB 3.34Å; R845-E849 PolarHBondContact O-N 3.17Å
846	K	91.7	Very high	89.6	Confident	103 Å²	103	101.7 Å²	101.7	45%	0.448	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-19.7	177	-73.4	175.2	178	179.4	0	114	Q842 E844 K850	Q842-K846 WeakPolarHBondContact O-CB 3.37Å; Q842-K846 VanDerWaalsContact O-CG 3.28Å; Q842-K846 WeakPolarHBondContact O-CG 3.37Å; Q842-K846 PolarHBondContact O-N 3.07Å; E844-K846 VanDerWaalsContact C-N 3.34Å; E844-K846 PolarHBondContact O-N 2.78Å; K846-K850 VanDerWaalsContact O-CD 3.25Å; K846-K850 WeakPolarHBondContact O-CD 3.27Å; K846-K850 WeakPolarHBondContact O-CG 3.39Å
847	L	92.1	Very high	88.7	Confident	96 Å²	96	102.5 Å²	102.5	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-83.6	-48.2	173.4	-173.2	69.9	0	0	0	110.8	K843 E844 R845 K850 H851	K843-L847 WeakPolarHBondContact O-CB 3.33Å; K843-L847 PolarHBondContact O-N 2.97Å; E844-L847 CarbonylContact O-C 3.47Å; E844-L847 WeakPolarHBondContact O-CA 3.49Å; E844-L847 WeakPolarHBondContact O-CB 3.43Å; E844-L847 PolarHBondContact O-N 2.71Å; R845-L847 PolarHBondContact O-N 2.74Å; L847-K850 PolarHBondContact O-N 3.48Å; L847-H851 PolarHBondContact O-CD2 3Å; L847-H851 PolarHBondContact O-N 3.23Å
848	F	88.8	Confident	87.8	Confident	136 Å²	136	105 Å²	105	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-60.5	-44.3	174.9	-76.8	-65.6	0	0	0	111.9	E844 R845 K850 H851 V852	E844-F848 HydrophobicContact CB-CD2 4.43Å; E844-F848 HydrophobicContact CB-CE2 4.37Å; E844-F848 WeakPolarHBondContact O-CD2 3.42Å; E844-F848 PolarHBondContact O-N 3.18Å; R845-F848 PolarHBondContact O-N 3.33Å; F848-K850 VanDerWaalsContact C-N 3.3Å; F848-K850 PolarHBondContact O-N 3.48Å; F848-H851 CarbonylContact O-C 3.52Å; F848-H851 WeakPolarHBondContact O-CA 3.23Å; F848-H851 WeakPolarHBondContact O-CB 3.2Å; F848-H851 PolarHBondContact O-N 2.87Å; F848-V852 WeakPolarHBondContact O-CG2 3.45Å; F848-V852 PolarHBondContact O-N 3.48Å
849	E	91.5	Very high	87.4	Confident	96 Å²	96	103.9 Å²	103.9	45%	0.449	51%	0.512	S	S	.	.	H	α-helix	trans	-57.3	-41.6	174.3	-175.4	-166.2	169	0	0	111.8	R845 V852 S853	R845-E849 WeakPolarHBondContact O-CB 3.34Å; R845-E849 PolarHBondContact O-N 3.17Å; E849-V852 PolarHBondContact O-N 2.8Å; E849-S853 WeakPolarHBondContact O-CB 3.39Å; E849-S853 PolarHBondContact O-N 2.9Å; E849-S853 PolarHBondContact O-OG 3.5Å
850	K	90.7	Very high	86.2	Confident	147 Å²	147	101.6 Å²	101.6	64%	0.639	51%	0.509	S	S	*	.	H	α-helix	trans	-67.4	-37	173.5	-76.1	172.3	-172.3	176.8	0	112.3	K846 L847 F848 A854	K846-K850 VanDerWaalsContact O-CD 3.25Å; K846-K850 WeakPolarHBondContact O-CD 3.27Å; K846-K850 WeakPolarHBondContact O-CG 3.39Å; L847-K850 PolarHBondContact O-N 3.48Å; F848-K850 VanDerWaalsContact C-N 3.3Å; F848-K850 PolarHBondContact O-N 3.48Å; K850-A854 WeakPolarHBondContact O-CB 3.48Å; K850-A854 PolarHBondContact O-N 3.17Å
851	H	89.1	Confident	85.5	Confident	115 Å²	115	104.5 Å²	104.5	53%	0.532	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-42.6	173.6	-73.7	-59.4	0	0	0	112.4	L847 F848 A854 A855	L847-H851 PolarHBondContact O-CD2 3Å; L847-H851 PolarHBondContact O-N 3.23Å; F848-H851 CarbonylContact O-C 3.52Å; F848-H851 WeakPolarHBondContact O-CA 3.23Å; F848-H851 WeakPolarHBondContact O-CB 3.2Å; F848-H851 PolarHBondContact O-N 2.87Å; H851-A854 PolarHBondContact O-N 3.26Å; H851-A855 WeakPolarHBondContact O-CB 3.43Å; H851-A855 PolarHBondContact O-N 3.47Å
852	V	90.1	Very high	85	Confident	70 Å²	70	107.4 Å²	107.4	42%	0.424	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-44.4	175.3	171.1	0	0	0	0	110.7	F848 E849 A855 R856	F848-V852 WeakPolarHBondContact O-CG2 3.45Å; F848-V852 PolarHBondContact O-N 3.48Å; E849-V852 PolarHBondContact O-N 2.8Å; V852-A855 PolarHBondContact O-N 3.32Å; V852-R856 HydrophobicContact CG1-CG 4.49Å; V852-R856 WeakPolarHBondContact O-CB 3.31Å; V852-R856 WeakPolarHBondContact O-CG 3.24Å; V852-R856 PolarHBondContact O-N 3.08Å
853	S	85.7	Confident	84.8	Confident	62 Å²	62	106.7 Å²	106.7	43%	0.434	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-42	176.9	-61.3	0	0	0	0	111.9	E849 A855 R856 A857	E849-S853 WeakPolarHBondContact O-CB 3.39Å; E849-S853 PolarHBondContact O-N 2.9Å; E849-S853 PolarHBondContact O-OG 3.5Å; S853-A855 VanDerWaalsContact C-N 3.33Å; S853-A855 PolarHBondContact O-N 3.02Å; S853-R856 PolarHBondContact O-N 2.96Å; S853-A857 VanDerWaalsContact O-CB 3.23Å; S853-A857 WeakPolarHBondContact O-CB 3.28Å; S853-A857 PolarHBondContact O-N 2.89Å
854	A	84.2	Confident	84.3	Confident	55 Å²	55	107.3 Å²	107.3	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-34.7	173.7	0	0	0	0	0	112.5	K850 H851 A857 I858	K850-A854 WeakPolarHBondContact O-CB 3.48Å; K850-A854 PolarHBondContact O-N 3.17Å; H851-A854 PolarHBondContact O-N 3.26Å; A854-A857 PolarHBondContact O-N 3.44Å; A854-I858 WeakPolarHBondContact O-CG1 3.33Å; A854-I858 PolarHBondContact O-N 2.6Å
855	A	80.2	Confident	84.1	Confident	61 Å²	61	107.4 Å²	107.4	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-69.2	-42.8	173.9	0	0	0	0	0	112.1	H851 V852 S853 A857 I858	H851-A855 WeakPolarHBondContact O-CB 3.43Å; H851-A855 PolarHBondContact O-N 3.47Å; V852-A855 PolarHBondContact O-N 3.32Å; S853-A855 VanDerWaalsContact C-N 3.33Å; S853-A855 PolarHBondContact O-N 3.02Å; A855-A857 VanDerWaalsContact C-N 3.29Å; A855-A857 PolarHBondContact O-N 3.07Å; A855-I858 WeakPolarHBondContact O-CB 2.99Å; A855-I858 PolarHBondContact O-N 3.45Å
856	R	81	Confident	84	Confident	210 Å²	210	105.1 Å²	105.1	79%	0.792	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-31.1	173.4	-71.1	175.1	178.4	179.6	-0.5	112.5	V852 S853 I858	V852-R856 HydrophobicContact CG1-CG 4.49Å; V852-R856 WeakPolarHBondContact O-CB 3.31Å; V852-R856 WeakPolarHBondContact O-CG 3.24Å; V852-R856 PolarHBondContact O-N 3.08Å; S853-R856 PolarHBondContact O-N 2.96Å; R856-I858 VanDerWaalsContact C-N 3.26Å; R856-I858 PolarHBondContact O-N 2.88Å
857	A	75.6	Confident	83.8	Confident	77 Å²	77	103.8 Å²	103.8	64%	0.636	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	3.8	177.1	0	0	0	0	0	114.5	S853 A854 A855 P859	S853-A857 VanDerWaalsContact O-CB 3.23Å; S853-A857 WeakPolarHBondContact O-CB 3.28Å; S853-A857 PolarHBondContact O-N 2.89Å; A854-A857 PolarHBondContact O-N 3.44Å; A855-A857 VanDerWaalsContact C-N 3.29Å; A855-A857 PolarHBondContact O-N 3.07Å; A857-P859 WeakPolarHBondContact O-CD 3.12Å
858	I	76.3	Confident	83.7	Confident	106 Å²	106	105.5 Å²	105.5	54%	0.544	53%	0.525	S	S	.	.	S	Bend	trans	-93.8	106.3	168.1	-72.1	168	0	0	0	106.3	A854 A855 R856 D860	A854-I858 WeakPolarHBondContact O-CG1 3.33Å; A854-I858 PolarHBondContact O-N 2.6Å; A855-I858 WeakPolarHBondContact O-CB 2.99Å; A855-I858 PolarHBondContact O-N 3.45Å; R856-I858 VanDerWaalsContact C-N 3.26Å; R856-I858 PolarHBondContact O-N 2.88Å; I858-D860 PolarHBondContact O-N 2.92Å
859	P	72.2	Confident	84	Confident	52 Å²	52	104 Å²	104	34%	0.338	52%	0.523	S	S	.	.			trans	-56.8	141.1	177.9	-26.2	35.2	0	0	0	110.5	A857 E863 R864	A857-P859 WeakPolarHBondContact O-CD 3.12Å; P859-E863 WeakPolarHBondContact CA-OE2 3.47Å; P859-E863 HydrophobicContact CB-CB 4.22Å; P859-E863 WeakPolarHBondContact CB-OE2 3.4Å; P859-R864 HydrophobicContact CB-CG 4.27Å; P859-R864 PolarHBondContact O-NE 2.78Å; P859-R864 PolarHBondContact O-NH2 2.81Å
860	D	71.1	Confident	84	Confident	82 Å²	82	103.2 Å²	103.2	44%	0.439	52%	0.522	S	S	.	.			trans	-61.5	158.3	-177.1	179.3	43.4	0	0	0	110.7	I858 K862 E863 R864	I858-D860 PolarHBondContact O-N 2.92Å; D860-K862 PolarHBondContact O-N 2.82Å; D860-K862 WeakPolarHBondContact OD2-CB 3.46Å; D860-K862 WeakPolarHBondContact OD2-CG 3.36Å; D860-K862 PolarHBondContact OD2-N 2.88Å; D860-K862 VanDerWaalsContact OD2-N 3.16Å; D860-E863 HydrophobicContact CB-CG 4.17Å; D860-E863 PolarHBondContact N-OE2 3.23Å; D860-E863 PolarHBondContact O-N 2.99Å; D860-E863 VanDerWaalsContact O-N 3.14Å; D860-R864 WeakPolarHBondContact O-CG 3.31Å; D860-R864 PolarHBondContact O-N 2.94Å
861	K	80.3	Confident	84.1	Confident	140 Å²	140	102.8 Å²	102.8	61%	0.609	52%	0.52	S	S	*	.	H	α-helix	trans	-52.8	-40.4	175.4	-174.3	-175.7	165.6	-169.8	0	111.7	R864 E865	K861-R864 PolarHBondContact O-N 2.87Å; K861-E865 WeakPolarHBondContact CE-OE1 3.33Å; K861-E865 IonicContact NZ-OE1 3.77Å; K861-E865 WeakPolarHBondContact O-CG 3.29Å; K861-E865 PolarHBondContact O-N 2.9Å; K861-E865 VanDerWaalsContact O-N 3.1Å
862	K	80.1	Confident	84.4	Confident	162 Å²	162	103.4 Å²	103.4	70%	0.704	52%	0.523	S	S	*	.	H	α-helix	trans	-63.6	-48.4	177.3	-63.4	169.4	-174	167	0	111.3	D860 R864 E865 E866	D860-K862 PolarHBondContact O-N 2.82Å; D860-K862 WeakPolarHBondContact OD2-CB 3.46Å; D860-K862 WeakPolarHBondContact OD2-CG 3.36Å; D860-K862 PolarHBondContact OD2-N 2.88Å; D860-K862 VanDerWaalsContact OD2-N 3.16Å; K862-R864 VanDerWaalsContact C-N 3.3Å; K862-R864 PolarHBondContact O-N 2.89Å; K862-E865 PolarHBondContact O-N 2.82Å; K862-E865 VanDerWaalsContact O-N 3.12Å; K862-E866 PolarHBondContact O-N 2.88Å
863	E	83.8	Confident	84.6	Confident	98 Å²	98	104.8 Å²	104.8	46%	0.458	53%	0.525	S	S	.	.	H	α-helix	trans	-60.7	-38.7	177.7	-59.5	175.7	153.2	0	0	111.7	P859 D860 E865 E866 I867	P859-E863 WeakPolarHBondContact CA-OE2 3.47Å; P859-E863 HydrophobicContact CB-CB 4.22Å; P859-E863 WeakPolarHBondContact CB-OE2 3.4Å; D860-E863 HydrophobicContact CB-CG 4.17Å; D860-E863 PolarHBondContact N-OE2 3.23Å; D860-E863 PolarHBondContact O-N 2.99Å; D860-E863 VanDerWaalsContact O-N 3.14Å; E863-E865 VanDerWaalsContact C-N 3.34Å; E863-E865 PolarHBondContact O-N 2.82Å; E863-E866 PolarHBondContact O-N 2.84Å; E863-I867 VanDerWaalsContact O-CB 3.24Å; E863-I867 WeakPolarHBondContact O-CB 3.37Å; E863-I867 WeakPolarHBondContact O-CD1 3.35Å; E863-I867 WeakPolarHBondContact O-CG1 3.32Å; E863-I867 PolarHBondContact O-N 2.81Å
864	R	82.7	Confident	85	Confident	116 Å²	116	107.2 Å²	107.2	44%	0.438	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-35.4	175.4	-69.5	174.5	-170.1	-111.3	-12	113.1	P859 D860 K861 K862 Q868	P859-R864 HydrophobicContact CB-CG 4.27Å; P859-R864 PolarHBondContact O-NE 2.78Å; P859-R864 PolarHBondContact O-NH2 2.81Å; D860-R864 WeakPolarHBondContact O-CG 3.31Å; D860-R864 PolarHBondContact O-N 2.94Å; K861-R864 PolarHBondContact O-N 2.87Å; K862-R864 VanDerWaalsContact C-N 3.3Å; K862-R864 PolarHBondContact O-N 2.89Å; R864-Q868 VanDerWaalsContact O-CG 3.32Å; R864-Q868 WeakPolarHBondContact O-CG 3.03Å; R864-Q868 PolarHBondContact O-N 2.81Å; R864-Q868 PolarHBondContact O-NE2 2.75Å
865	E	87.4	Confident	85.5	Confident	106 Å²	106	107.6 Å²	107.6	50%	0.495	53%	0.531	S	S	.	.	H	α-helix	trans	-75.1	-40.3	177	-73.2	172.5	-178.3	0	0	110.4	K861 K862 E863 Q868 L869	K861-E865 WeakPolarHBondContact CE-OE1 3.33Å; K861-E865 IonicContact NZ-OE1 3.77Å; K861-E865 WeakPolarHBondContact O-CG 3.29Å; K861-E865 PolarHBondContact O-N 2.9Å; K861-E865 VanDerWaalsContact O-N 3.1Å; K862-E865 PolarHBondContact O-N 2.82Å; K862-E865 VanDerWaalsContact O-N 3.12Å; E863-E865 VanDerWaalsContact C-N 3.34Å; E863-E865 PolarHBondContact O-N 2.82Å; E865-Q868 PolarHBondContact O-N 2.87Å; E865-L869 PolarHBondContact O-N 2.85Å
866	E	90.5	Very high	86.2	Confident	118 Å²	118	108 Å²	108	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-47	173.1	-177	171	-175.3	0	0	112.5	K862 E863 Q868 L869 L870	K862-E866 PolarHBondContact O-N 2.88Å; E863-E866 PolarHBondContact O-N 2.84Å; E866-Q868 PolarHBondContact O-N 2.78Å; E866-L869 PolarHBondContact O-N 2.8Å; E866-L869 VanDerWaalsContact O-N 3.07Å; E866-L870 HydrophobicContact CG-CD1 3.9Å; E866-L870 HydrophobicContact CG-CG 4.21Å; E866-L870 WeakPolarHBondContact O-CB 3.46Å; E866-L870 WeakPolarHBondContact O-CG 3.2Å; E866-L870 PolarHBondContact O-N 2.82Å
867	I	87.6	Confident	86.9	Confident	75 Å²	75	102.8 Å²	102.8	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-32.2	175.2	-72.3	164.7	0	0	0	111.2	E863 K871	E863-I867 VanDerWaalsContact O-CB 3.24Å; E863-I867 WeakPolarHBondContact O-CB 3.37Å; E863-I867 WeakPolarHBondContact O-CD1 3.35Å; E863-I867 WeakPolarHBondContact O-CG1 3.32Å; E863-I867 PolarHBondContact O-N 2.81Å; I867-K871 HydrophobicContact CG2-CD 4.09Å; I867-K871 WeakPolarHBondContact O-CB 3.44Å; I867-K871 WeakPolarHBondContact O-CD 3.37Å; I867-K871 WeakPolarHBondContact O-CG 3.17Å; I867-K871 PolarHBondContact O-N 2.87Å; I867-K871 VanDerWaalsContact O-N 3.12Å
868	Q	90.1	Very high	87.7	Confident	131 Å²	131	103.6 Å²	103.6	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-72.9	-43.9	172.8	-79.8	173.8	71.9	0	0	112.2	R864 E865 E866 K871 Q872	R864-Q868 VanDerWaalsContact O-CG 3.32Å; R864-Q868 WeakPolarHBondContact O-CG 3.03Å; R864-Q868 PolarHBondContact O-N 2.81Å; R864-Q868 PolarHBondContact O-NE2 2.75Å; E865-Q868 PolarHBondContact O-N 2.87Å; E866-Q868 PolarHBondContact O-N 2.78Å; Q868-K871 PolarHBondContact O-N 2.87Å; Q868-Q872 PolarHBondContact O-N 2.8Å
869	L	93.9	Very high	88.6	Confident	105 Å²	105	103.1 Å²	103.1	55%	0.55	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-44.8	176.8	-175.3	64.8	0	0	0	111.7	E865 E866 K871 Q872 Q873	E865-L869 PolarHBondContact O-N 2.85Å; E866-L869 PolarHBondContact O-N 2.8Å; E866-L869 VanDerWaalsContact O-N 3.07Å; L869-K871 PolarHBondContact O-N 2.8Å; L869-Q872 CarbonylContact O-C 3.56Å; L869-Q872 WeakPolarHBondContact O-CB 3.31Å; L869-Q872 PolarHBondContact O-N 2.77Å; L869-Q872 VanDerWaalsContact O-N 3.17Å; L869-Q873 WeakPolarHBondContact O-CB 3.44Å; L869-Q873 PolarHBondContact O-N 3.24Å
870	L	92.6	Very high	89.8	Confident	80 Å²	80	104.6 Å²	104.6	42%	0.419	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-39.6	174.9	-69.1	173.6	0	0	0	111.7	E866 Q873 L874	E866-L870 HydrophobicContact CG-CD1 3.9Å; E866-L870 HydrophobicContact CG-CG 4.21Å; E866-L870 WeakPolarHBondContact O-CB 3.46Å; E866-L870 WeakPolarHBondContact O-CG 3.2Å; E866-L870 PolarHBondContact O-N 2.82Å; L870-Q873 PolarHBondContact O-N 3.47Å; L870-L874 WeakPolarHBondContact O-CB 3.37Å; L870-L874 VanDerWaalsContact O-CG 3.3Å; L870-L874 WeakPolarHBondContact O-CG 3.47Å; L870-L874 PolarHBondContact O-N 2.79Å
871	K	92.3	Very high	90.9	Very high	137 Å²	137	104.6 Å²	104.6	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-64.8	-36.8	172.6	-78.3	169.2	-177.4	171.2	0	112.5	I867 Q868 L869 S875	I867-K871 HydrophobicContact CG2-CD 4.09Å; I867-K871 WeakPolarHBondContact O-CB 3.44Å; I867-K871 WeakPolarHBondContact O-CD 3.37Å; I867-K871 WeakPolarHBondContact O-CG 3.17Å; I867-K871 PolarHBondContact O-N 2.87Å; I867-K871 VanDerWaalsContact O-N 3.12Å; Q868-K871 PolarHBondContact O-N 2.87Å; L869-K871 PolarHBondContact O-N 2.8Å; K871-S875 PolarHBondContact O-N 3.1Å; K871-S875 PolarHBondContact O-OG 2.93Å
872	Q	94.2	Very high	91.6	Very high	128 Å²	128	104 Å²	104	60%	0.598	50%	0.501	S	S	*	.	H	α-helix	trans	-69.7	-37	174.2	-171.4	179.3	12.9	0	0	112	Q868 L869 S875 S876	Q868-Q872 PolarHBondContact O-N 2.8Å; L869-Q872 CarbonylContact O-C 3.56Å; L869-Q872 WeakPolarHBondContact O-CB 3.31Å; L869-Q872 PolarHBondContact O-N 2.77Å; L869-Q872 VanDerWaalsContact O-N 3.17Å; Q872-S875 PolarHBondContact O-OG 2.81Å; Q872-S876 VanDerWaalsContact O-CB 3.26Å; Q872-S876 WeakPolarHBondContact O-CB 3.44Å; Q872-S876 PolarHBondContact O-N 2.88Å
873	Q	96.1	Very high	92.3	Very high	99 Å²	99	102.4 Å²	102.4	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-66.7	-44.8	174.3	-177.9	173.3	-22.8	0	0	111.3	L869 L870 S876 Q877	L869-Q873 WeakPolarHBondContact O-CB 3.44Å; L869-Q873 PolarHBondContact O-N 3.24Å; L870-Q873 PolarHBondContact O-N 3.47Å; Q873-S876 PolarHBondContact O-N 2.68Å; Q873-Q877 WeakPolarHBondContact O-CB 3.09Å; Q873-Q877 WeakPolarHBondContact O-CG 3.15Å; Q873-Q877 PolarHBondContact O-N 2.83Å
874	L	93.6	Very high	92.9	Very high	114 Å²	114	102.9 Å²	102.9	60%	0.597	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-43.1	175.3	-74.6	170.3	0	0	0	112	L870 Q877 Q878	L870-L874 WeakPolarHBondContact O-CB 3.37Å; L870-L874 VanDerWaalsContact O-CG 3.3Å; L870-L874 WeakPolarHBondContact O-CG 3.47Å; L870-L874 PolarHBondContact O-N 2.79Å; L874-Q877 PolarHBondContact O-N 3.32Å; L874-Q878 VanDerWaalsContact O-CB 3.23Å; L874-Q878 WeakPolarHBondContact O-CB 3.48Å; L874-Q878 PolarHBondContact O-N 3.09Å
875	S	93.9	Very high	93.5	Very high	62 Å²	62	102.2 Å²	102.2	43%	0.434	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-42.5	176	67.9	0	0	0	0	111.8	K871 Q872 Q877 Q878 E879	K871-S875 PolarHBondContact O-N 3.1Å; K871-S875 PolarHBondContact O-OG 2.93Å; Q872-S875 PolarHBondContact O-OG 2.81Å; S875-Q877 PolarHBondContact O-N 2.84Å; S875-Q878 PolarHBondContact O-N 2.88Å; S875-E879 WeakPolarHBondContact O-CG 3.33Å; S875-E879 PolarHBondContact O-N 2.93Å
876	S	95.2	Very high	93.8	Very high	70 Å²	70	100.6 Å²	100.6	49%	0.49	49%	0.49	S	S	.	.	H	α-helix	trans	-60	-45.1	175.2	-174.3	0	0	0	0	112.3	Q872 Q873 E879 E880	Q872-S876 VanDerWaalsContact O-CB 3.26Å; Q872-S876 WeakPolarHBondContact O-CB 3.44Å; Q872-S876 PolarHBondContact O-N 2.88Å; Q873-S876 PolarHBondContact O-N 2.68Å; S876-E879 PolarHBondContact O-N 2.99Å; S876-E880 PolarHBondContact O-N 2.89Å
877	Q	95.4	Very high	94.1	Very high	100 Å²	100	103.1 Å²	103.1	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-40.7	176	-74.1	-174.2	-9.3	0	0	111.9	Q873 L874 S875 E879 E880 L881	Q873-Q877 WeakPolarHBondContact O-CB 3.09Å; Q873-Q877 WeakPolarHBondContact O-CG 3.15Å; Q873-Q877 PolarHBondContact O-N 2.83Å; L874-Q877 PolarHBondContact O-N 3.32Å; S875-Q877 PolarHBondContact O-N 2.84Å; Q877-E879 VanDerWaalsContact C-N 3.33Å; Q877-E879 PolarHBondContact O-N 3.36Å; Q877-E880 PolarHBondContact O-N 3.26Å; Q877-E880 VanDerWaalsContact O-N 3.12Å; Q877-L881 WeakPolarHBondContact O-CG 3.3Å; Q877-L881 PolarHBondContact O-N 3.48Å
878	Q	93.4	Very high	94.4	Very high	94 Å²	94	108 Å²	108	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-35.8	176.9	-175.2	61.5	80.8	0	0	112.5	L874 S875 K882	L874-Q878 VanDerWaalsContact O-CB 3.23Å; L874-Q878 WeakPolarHBondContact O-CB 3.48Å; L874-Q878 PolarHBondContact O-N 3.09Å; S875-Q878 PolarHBondContact O-N 2.88Å; Q878-K882 WeakPolarHBondContact O-CG 3.41Å; Q878-K882 PolarHBondContact O-N 2.95Å; Q878-K882 VanDerWaalsContact O-N 3.1Å
879	E	95	Very high	94.7	Very high	96 Å²	96	104.8 Å²	104.8	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-69.6	-37.4	169.7	-69.5	-172.9	173.8	0	0	112.4	S875 S876 Q877 K882 R883	S875-E879 WeakPolarHBondContact O-CG 3.33Å; S875-E879 PolarHBondContact O-N 2.93Å; S876-E879 PolarHBondContact O-N 2.99Å; Q877-E879 VanDerWaalsContact C-N 3.33Å; Q877-E879 PolarHBondContact O-N 3.36Å; E879-K882 PolarHBondContact O-N 2.9Å; E879-R883 WeakPolarHBondContact O-CB 3.2Å; E879-R883 VanDerWaalsContact O-CG 3.26Å; E879-R883 WeakPolarHBondContact O-CG 3.47Å; E879-R883 PolarHBondContact O-N 3.06Å; E879-R883 IonicContact OE2-CZ 3.06Å; E879-R883 IonicContact OE2-NH1 3.16Å; E879-R883 PolarHBondContact OE2-NH1 3.48Å; E879-R883 IonicContact OE2-NH2 2.71Å; E879-R883 PolarHBondContact OE2-NH2 2.82Å
880	E	95.8	Very high	94.7	Very high	84 Å²	84	103.6 Å²	103.6	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-39.7	176.9	-146.5	-145.3	144.4	0	0	111.6	S876 Q877 R883 R884	S876-E880 PolarHBondContact O-N 2.89Å; Q877-E880 PolarHBondContact O-N 3.26Å; Q877-E880 VanDerWaalsContact O-N 3.12Å; E880-R883 PolarHBondContact O-N 2.97Å; E880-R884 VanDerWaalsContact O-CG 3.31Å; E880-R884 WeakPolarHBondContact O-CG 3.07Å; E880-R884 PolarHBondContact O-N 2.78Å; E880-R884 IonicContact OE1-CZ 3.86Å; E880-R884 IonicContact OE1-NE 3.73Å; E880-R884 PolarHBondContact OE1-NE 3.06Å; E880-R884 IonicContact OE1-NH2 2.74Å; E880-R884 PolarHBondContact OE1-NH2 2.94Å; E880-R884 IonicContact OE2-CZ 2.72Å; E880-R884 IonicContact OE2-NE 2.72Å; E880-R884 IonicContact OE2-NH2 3.82Å; E880-R884 PolarHBondContact OE2-NH2 3.24Å
881	L	95.1	Very high	94.8	Very high	82 Å²	82	103 Å²	103	43%	0.429	51%	0.505	S	S	.	.	H	α-helix	trans	-57.4	-51.1	169.7	-71.8	175.4	0	0	0	110.7	Q877 R883 R884 E885	Q877-L881 WeakPolarHBondContact O-CG 3.3Å; Q877-L881 PolarHBondContact O-N 3.48Å; L881-R883 VanDerWaalsContact C-N 3.27Å; L881-R883 PolarHBondContact O-N 3.13Å; L881-R884 CarbonylContact O-C 3.54Å; L881-R884 WeakPolarHBondContact O-CA 3.48Å; L881-R884 WeakPolarHBondContact O-CB 3.36Å; L881-R884 PolarHBondContact O-N 2.81Å; L881-E885 WeakPolarHBondContact O-CB 3.49Å; L881-E885 VanDerWaalsContact O-CG 3.31Å; L881-E885 WeakPolarHBondContact O-CG 3.41Å; L881-E885 PolarHBondContact O-N 2.98Å
882	K	95.6	Very high	94.9	Very high	127 Å²	127	102.1 Å²	102.1	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-58.2	-35.9	175.6	-73.6	172.2	179.2	179.3	0	113.2	Q878 E879 S886	Q878-K882 WeakPolarHBondContact O-CG 3.41Å; Q878-K882 PolarHBondContact O-N 2.95Å; Q878-K882 VanDerWaalsContact O-N 3.1Å; E879-K882 PolarHBondContact O-N 2.9Å; K882-S886 WeakPolarHBondContact O-CB 3.17Å; K882-S886 PolarHBondContact O-N 2.83Å
883	R	95	Very high	95	Very high	128 Å²	128	97.4 Å²	97.4	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-68.7	-37.9	173.8	-72.1	168.7	-177	116.6	9	112.1	E879 E880 L881 R887	E879-R883 WeakPolarHBondContact O-CB 3.2Å; E879-R883 VanDerWaalsContact O-CG 3.26Å; E879-R883 WeakPolarHBondContact O-CG 3.47Å; E879-R883 PolarHBondContact O-N 3.06Å; E879-R883 IonicContact OE2-CZ 3.06Å; E879-R883 IonicContact OE2-NH1 3.16Å; E879-R883 PolarHBondContact OE2-NH1 3.48Å; E879-R883 IonicContact OE2-NH2 2.71Å; E879-R883 PolarHBondContact OE2-NH2 2.82Å; E880-R883 PolarHBondContact O-N 2.97Å; L881-R883 VanDerWaalsContact C-N 3.27Å; L881-R883 PolarHBondContact O-N 3.13Å; R883-R887 WeakPolarHBondContact O-CD 3.23Å; R883-R887 VanDerWaalsContact O-CG 3.22Å; R883-R887 WeakPolarHBondContact O-CG 3.27Å; R883-R887 PolarHBondContact O-N 3.3Å; R883-R887 VanDerWaalsContact O-N 3.12Å
884	R	95.6	Very high	95	Very high	108 Å²	108	99.6 Å²	99.6	41%	0.408	49%	0.493	S	S	.	.	H	α-helix	trans	-69.9	-47.4	175.2	-69.7	172.5	-175.1	-168.5	7.6	111.2	E880 L881 S886 R887 W888	E880-R884 VanDerWaalsContact O-CG 3.31Å; E880-R884 WeakPolarHBondContact O-CG 3.07Å; E880-R884 PolarHBondContact O-N 2.78Å; E880-R884 IonicContact OE1-CZ 3.86Å; E880-R884 IonicContact OE1-NE 3.73Å; E880-R884 PolarHBondContact OE1-NE 3.06Å; E880-R884 IonicContact OE1-NH2 2.74Å; E880-R884 PolarHBondContact OE1-NH2 2.94Å; E880-R884 IonicContact OE2-CZ 2.72Å; E880-R884 IonicContact OE2-NE 2.72Å; E880-R884 IonicContact OE2-NH2 3.82Å; E880-R884 PolarHBondContact OE2-NH2 3.24Å; L881-R884 CarbonylContact O-C 3.54Å; L881-R884 WeakPolarHBondContact O-CA 3.48Å; L881-R884 WeakPolarHBondContact O-CB 3.36Å; L881-R884 PolarHBondContact O-N 2.81Å; R884-S886 PolarHBondContact O-N 3.11Å; R884-R887 PolarHBondContact O-N 3.25Å; R884-W888 WeakPolarHBondContact O-CB 3.48Å; R884-W888 VanDerWaalsContact O-CG 3.31Å; R884-W888 PolarHBondContact O-N 3.45Å
885	E	95.6	Very high	95.1	Very high	103 Å²	103	97.9 Å²	97.9	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-55.4	-48.1	173.1	-71.9	165.7	178.9	0	0	111.6	L881 R887 W888 A889	L881-E885 WeakPolarHBondContact O-CB 3.49Å; L881-E885 VanDerWaalsContact O-CG 3.31Å; L881-E885 WeakPolarHBondContact O-CG 3.41Å; L881-E885 PolarHBondContact O-N 2.98Å; E885-R887 PolarHBondContact O-N 3.31Å; E885-W888 PolarHBondContact O-N 3.38Å; E885-A889 VanDerWaalsContact O-CB 3.3Å; E885-A889 WeakPolarHBondContact O-CB 3.19Å; E885-A889 PolarHBondContact O-N 3.22Å
886	S	94.1	Very high	95.2	Very high	72 Å²	72	101.4 Å²	101.4	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-59.2	-47.1	176.3	174.7	0	0	0	0	112	K882 R884 W888 A889 S890	K882-S886 WeakPolarHBondContact O-CB 3.17Å; K882-S886 PolarHBondContact O-N 2.83Å; R884-S886 PolarHBondContact O-N 3.11Å; S886-W888 PolarHBondContact O-N 3.18Å; S886-A889 PolarHBondContact O-N 3.2Å; S886-S890 PolarHBondContact O-N 2.99Å; S886-S890 PolarHBondContact O-OG 2.96Å
887	R	95.4	Very high	95.3	Very high	170 Å²	170	104.7 Å²	104.7	64%	0.642	50%	0.495	S	S	*	.	H	α-helix	trans	-60.2	-46	175.2	-73.2	166.8	179.3	179.3	0.3	111.7	R883 R884 E885 S890 T891	R883-R887 WeakPolarHBondContact O-CD 3.23Å; R883-R887 VanDerWaalsContact O-CG 3.22Å; R883-R887 WeakPolarHBondContact O-CG 3.27Å; R883-R887 PolarHBondContact O-N 3.3Å; R883-R887 VanDerWaalsContact O-N 3.12Å; R884-R887 PolarHBondContact O-N 3.25Å; E885-R887 PolarHBondContact O-N 3.31Å; R887-S890 PolarHBondContact O-N 2.9Å; R887-T891 PolarHBondContact O-N 3.01Å; R887-T891 PolarHBondContact O-OG1 2.92Å
888	W	94.7	Very high	95.3	Very high	177 Å²	177	104.9 Å²	104.9	67%	0.67	50%	0.496	S	S	*	.	H	α-helix	trans	-63	-44.1	178.1	-70.8	-18.2	0	0	0	111.8	R884 E885 S886 S890 T891 H892	R884-W888 WeakPolarHBondContact O-CB 3.48Å; R884-W888 VanDerWaalsContact O-CG 3.31Å; R884-W888 PolarHBondContact O-N 3.45Å; E885-W888 PolarHBondContact O-N 3.38Å; S886-W888 PolarHBondContact O-N 3.18Å; W888-S890 PolarHBondContact O-N 2.88Å; W888-T891 WeakPolarHBondContact CA-OG1 3.19Å; W888-T891 PolarHBondContact O-N 2.62Å; W888-T891 PolarHBondContact O-OG1 2.88Å; W888-H892 VanDerWaalsContact O-CB 3.28Å; W888-H892 WeakPolarHBondContact O-CB 3.3Å; W888-H892 PolarHBondContact O-N 2.9Å
889	A	95.4	Very high	95.5	Very high	64 Å²	64	104.3 Å²	104.3	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-44	174.7	0	0	0	0	0	111.9	E885 S886 H892 G893	E885-A889 VanDerWaalsContact O-CB 3.3Å; E885-A889 WeakPolarHBondContact O-CB 3.19Å; E885-A889 PolarHBondContact O-N 3.22Å; S886-A889 PolarHBondContact O-N 3.2Å; A889-H892 PolarHBondContact O-N 3.17Å; A889-G893 PolarHBondContact O-N 3.46Å
890	S	94.8	Very high	95.5	Very high	81 Å²	81	103.6 Å²	103.6	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-42.7	173.7	-60.6	0	0	0	0	112.6	S886 R887 W888 R894	S886-S890 PolarHBondContact O-N 2.99Å; S886-S890 PolarHBondContact O-OG 2.96Å; R887-S890 PolarHBondContact O-N 2.9Å; W888-S890 PolarHBondContact O-N 2.88Å; S890-R894 PolarHBondContact O-N 2.86Å
891	T	94.4	Very high	95.6	Very high	67 Å²	67	102.2 Å²	102.2	41%	0.411	49%	0.494	S	S	.	.	H	α-helix	trans	-67.7	-37.4	176.2	52.6	0	0	0	0	112.8	R887 W888 R894 L895	R887-T891 PolarHBondContact O-N 3.01Å; R887-T891 PolarHBondContact O-OG1 2.92Å; W888-T891 WeakPolarHBondContact CA-OG1 3.19Å; W888-T891 PolarHBondContact O-N 2.62Å; W888-T891 PolarHBondContact O-OG1 2.88Å; T891-R894 PolarHBondContact O-N 2.66Å; T891-L895 WeakPolarHBondContact O-CB 3.16Å; T891-L895 WeakPolarHBondContact O-CG 3.2Å; T891-L895 PolarHBondContact O-N 3.37Å
892	H	94.8	Very high	95.6	Very high	118 Å²	118	102 Å²	102	55%	0.546	49%	0.493	S	S	.	.	H	α-helix	trans	-69.7	-39.9	178	-168.7	47.7	0	0	0	111.1	W888 A889 L895 R896	W888-H892 VanDerWaalsContact O-CB 3.28Å; W888-H892 WeakPolarHBondContact O-CB 3.3Å; W888-H892 PolarHBondContact O-N 2.9Å; A889-H892 PolarHBondContact O-N 3.17Å; H892-L895 PolarHBondContact O-N 3.05Å; H892-R896 PolarHBondContact CD2-NE 3.17Å; H892-R896 WeakPolarHBondContact O-CB 3.47Å; H892-R896 VanDerWaalsContact O-CG 3.29Å; H892-R896 WeakPolarHBondContact O-CG 3.19Å; H892-R896 PolarHBondContact O-N 3.37Å
893	G	96.1	Very high	95.7	Very high	30 Å²	30	101.2 Å²	101.2	31%	0.309	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-47.3	171.2	0	0	0	0	0	112.4	A889 L895 R896 Q897	A889-G893 PolarHBondContact O-N 3.46Å; G893-L895 PolarHBondContact O-N 2.97Å; G893-R896 PolarHBondContact O-N 2.82Å; G893-Q897 WeakPolarHBondContact O-CB 3.43Å; G893-Q897 WeakPolarHBondContact O-CG 3.15Å; G893-Q897 PolarHBondContact O-N 2.82Å
894	R	96.4	Very high	95.7	Very high	145 Å²	145	101.8 Å²	101.8	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-62.6	-41.5	176.4	-172.4	178.6	65.6	77.2	-2.1	112.7	S890 T891 Q898	S890-R894 PolarHBondContact O-N 2.86Å; T891-R894 PolarHBondContact O-N 2.66Å; R894-Q898 PolarHBondContact O-N 3.49Å
895	L	96.1	Very high	95.7	Very high	78 Å²	78	101.1 Å²	101.1	41%	0.408	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-37.9	177.2	-72.4	171.1	0	0	0	112	T891 H892 G893 Q898 I899	T891-L895 WeakPolarHBondContact O-CB 3.16Å; T891-L895 WeakPolarHBondContact O-CG 3.2Å; T891-L895 PolarHBondContact O-N 3.37Å; H892-L895 PolarHBondContact O-N 3.05Å; G893-L895 PolarHBondContact O-N 2.97Å; L895-Q898 PolarHBondContact O-N 3.47Å; L895-I899 VanDerWaalsContact O-CG1 3.3Å; L895-I899 WeakPolarHBondContact O-CG1 3.44Å; L895-I899 PolarHBondContact O-N 2.69Å
896	R	96.1	Very high	95.7	Very high	136 Å²	136	100 Å²	100	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-60.7	-51.9	171.3	-76.7	172.4	175.9	-87.6	3.9	111.2	H892 G893 Q898 I899 D900	H892-R896 PolarHBondContact CD2-NE 3.17Å; H892-R896 WeakPolarHBondContact O-CB 3.47Å; H892-R896 VanDerWaalsContact O-CG 3.29Å; H892-R896 WeakPolarHBondContact O-CG 3.19Å; H892-R896 PolarHBondContact O-N 3.37Å; G893-R896 PolarHBondContact O-N 2.82Å; R896-Q898 PolarHBondContact O-N 2.79Å; R896-I899 CarbonylContact O-C 3.56Å; R896-I899 WeakPolarHBondContact O-CA 3.43Å; R896-I899 WeakPolarHBondContact O-CB 3.3Å; R896-I899 PolarHBondContact O-N 2.92Å; R896-D900 WeakPolarHBondContact O-CB 3.23Å; R896-D900 PolarHBondContact O-N 2.89Å; R896-D900 VanDerWaalsContact O-OD2 3.08Å
897	Q	96.4	Very high	95.8	Very high	139 Å²	139	100.1 Å²	100.1	65%	0.65	49%	0.493	S	S	*	.	H	α-helix	trans	-54.6	-37.9	175.9	-73.5	170.2	-23.3	0	0	112.9	G893 D900 S901	G893-Q897 WeakPolarHBondContact O-CB 3.43Å; G893-Q897 WeakPolarHBondContact O-CG 3.15Å; G893-Q897 PolarHBondContact O-N 2.82Å; Q897-D900 PolarHBondContact O-N 2.81Å; Q897-S901 WeakPolarHBondContact O-CB 3.43Å; Q897-S901 PolarHBondContact O-N 2.78Å
898	Q	96.4	Very high	95.8	Very high	103 Å²	103	95 Å²	95	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-68.3	-41.6	174.5	-174.1	176.5	-7.1	0	0	112.4	R894 L895 R896 L902	R894-Q898 PolarHBondContact O-N 3.49Å; L895-Q898 PolarHBondContact O-N 3.47Å; R896-Q898 PolarHBondContact O-N 2.79Å; Q898-L902 HydrophobicContact CG-CD1 4.19Å; Q898-L902 WeakPolarHBondContact O-CB 3.43Å; Q898-L902 VanDerWaalsContact O-CG 3.27Å; Q898-L902 WeakPolarHBondContact O-CG 3.49Å; Q898-L902 PolarHBondContact O-N 2.92Å
899	I	95.9	Very high	95.8	Very high	83 Å²	83	91 Å²	91	43%	0.426	48%	0.478	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173.5	-69.2	162.3	0	0	0	110.6	L895 R896 L902 H903	L895-I899 VanDerWaalsContact O-CG1 3.3Å; L895-I899 WeakPolarHBondContact O-CG1 3.44Å; L895-I899 PolarHBondContact O-N 2.69Å; R896-I899 CarbonylContact O-C 3.56Å; R896-I899 WeakPolarHBondContact O-CA 3.43Å; R896-I899 WeakPolarHBondContact O-CB 3.3Å; R896-I899 PolarHBondContact O-N 2.92Å; I899-L902 PolarHBondContact O-N 2.91Å; I899-H903 VanDerWaalsContact CG2-CE1 3.44Å; I899-H903 WeakPolarHBondContact CG2-CE1 3.4Å; I899-H903 WeakPolarHBondContact O-CB 3.44Å; I899-H903 VanDerWaalsContact O-CG 3.29Å; I899-H903 PolarHBondContact O-N 3.11Å
900	D	96.5	Very high	95.8	Very high	81 Å²	81	94.6 Å²	94.6	43%	0.433	48%	0.478	S	S	.	.	H	α-helix	trans	-69.1	-34.3	-178.9	-60.6	-34.6	0	0	0	111.9	R896 Q897 Q904	R896-D900 WeakPolarHBondContact O-CB 3.23Å; R896-D900 PolarHBondContact O-N 2.89Å; R896-D900 VanDerWaalsContact O-OD2 3.08Å; Q897-D900 PolarHBondContact O-N 2.81Å; D900-Q904 WeakPolarHBondContact O-CG 3.17Å; D900-Q904 PolarHBondContact O-N 2.92Å; D900-Q904 PolarHBondContact O-NE2 2.84Å
901	S	96.8	Very high	95.8	Very high	55 Å²	55	94.3 Å²	94.3	39%	0.385	47%	0.47	S	S	.	.	H	α-helix	trans	-65.3	-52.2	169.4	-166	0	0	0	0	110.8	Q897 H903 Q904 E905	Q897-S901 WeakPolarHBondContact O-CB 3.43Å; Q897-S901 PolarHBondContact O-N 2.78Å; S901-H903 VanDerWaalsContact C-N 3.25Å; S901-H903 PolarHBondContact O-N 2.82Å; S901-Q904 WeakPolarHBondContact O-CB 3.47Å; S901-Q904 PolarHBondContact O-N 3.04Å; S901-E905 WeakPolarHBondContact O-CG 3.42Å; S901-E905 PolarHBondContact O-N 2.96Å; S901-E905 PolarHBondContact OG-OE1 2.92Å
902	L	96.1	Very high	95.9	Very high	78 Å²	78	96.3 Å²	96.3	41%	0.408	47%	0.474	S	S	.	.	H	α-helix	trans	-62	-32	179.3	-71.2	170.5	0	0	0	112.4	Q898 I899 N906	Q898-L902 HydrophobicContact CG-CD1 4.19Å; Q898-L902 WeakPolarHBondContact O-CB 3.43Å; Q898-L902 VanDerWaalsContact O-CG 3.27Å; Q898-L902 WeakPolarHBondContact O-CG 3.49Å; Q898-L902 PolarHBondContact O-N 2.92Å; I899-L902 PolarHBondContact O-N 2.91Å; L902-N906 VanDerWaalsContact O-CB 3.31Å; L902-N906 WeakPolarHBondContact O-CB 3.27Å; L902-N906 PolarHBondContact O-N 2.79Å; L902-N906 PolarHBondContact O-ND2 2.82Å
903	H	96.3	Very high	95.8	Very high	109 Å²	109	95 Å²	95	51%	0.505	47%	0.471	S	S	.	.	H	α-helix	trans	-68.5	-45.5	171.2	-75.9	162.1	0	0	0	112	I899 S901 E905 N906 D907	I899-H903 VanDerWaalsContact CG2-CE1 3.44Å; I899-H903 WeakPolarHBondContact CG2-CE1 3.4Å; I899-H903 WeakPolarHBondContact O-CB 3.44Å; I899-H903 VanDerWaalsContact O-CG 3.29Å; I899-H903 PolarHBondContact O-N 3.11Å; S901-H903 VanDerWaalsContact C-N 3.25Å; S901-H903 PolarHBondContact O-N 2.82Å; H903-E905 VanDerWaalsContact C-N 3.31Å; H903-E905 PolarHBondContact O-N 3.05Å; H903-N906 PolarHBondContact O-N 2.83Å; H903-D907 WeakPolarHBondContact O-CB 3.45Å; H903-D907 PolarHBondContact O-N 3.45Å
904	Q	96.5	Very high	95.8	Very high	141 Å²	141	99.4 Å²	99.4	66%	0.659	48%	0.478	S	S	*	.	H	α-helix	trans	-60.6	-40.7	174.6	-76.5	166.8	73.3	0	0	112	D900 S901 D907 A908	D900-Q904 WeakPolarHBondContact O-CG 3.17Å; D900-Q904 PolarHBondContact O-N 2.92Å; D900-Q904 PolarHBondContact O-NE2 2.84Å; S901-Q904 WeakPolarHBondContact O-CB 3.47Å; S901-Q904 PolarHBondContact O-N 3.04Å; Q904-D907 PolarHBondContact O-N 2.84Å; Q904-A908 VanDerWaalsContact O-CB 3.23Å; Q904-A908 WeakPolarHBondContact O-CB 3.4Å; Q904-A908 PolarHBondContact O-N 2.78Å
905	E	95.8	Very high	95.6	Very high	94 Å²	94	95.8 Å²	95.8	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-64	-44.2	173.8	-69.2	160.3	-127.5	0	0	111.5	S901 H903 A908 L909	S901-E905 WeakPolarHBondContact O-CG 3.42Å; S901-E905 PolarHBondContact O-N 2.96Å; S901-E905 PolarHBondContact OG-OE1 2.92Å; H903-E905 VanDerWaalsContact C-N 3.31Å; H903-E905 PolarHBondContact O-N 3.05Å; E905-A908 PolarHBondContact O-N 2.8Å; E905-L909 WeakPolarHBondContact O-CB 3.32Å; E905-L909 VanDerWaalsContact O-CG 3.25Å; E905-L909 WeakPolarHBondContact O-CG 3.4Å; E905-L909 PolarHBondContact O-N 3.45Å
906	N	95.3	Very high	95.5	Very high	79 Å²	79	96.6 Å²	96.6	42%	0.422	48%	0.476	S	S	.	.	H	α-helix	trans	-65.5	-39.2	176.1	-89.7	-92.8	0	0	0	112.7	L902 H903 L909 R910	L902-N906 VanDerWaalsContact O-CB 3.31Å; L902-N906 WeakPolarHBondContact O-CB 3.27Å; L902-N906 PolarHBondContact O-N 2.79Å; L902-N906 PolarHBondContact O-ND2 2.82Å; H903-N906 PolarHBondContact O-N 2.83Å; N906-L909 PolarHBondContact O-N 2.78Å; N906-R910 WeakPolarHBondContact O-CB 3.23Å; N906-R910 WeakPolarHBondContact O-CD 3.31Å; N906-R910 WeakPolarHBondContact O-CG 3.35Å; N906-R910 PolarHBondContact O-N 2.84Å
907	D	95.7	Very high	95.3	Very high	75 Å²	75	95.4 Å²	95.4	40%	0.401	48%	0.477	S	S	.	.	H	α-helix	trans	-74.2	-34.3	178	-76.1	-28	0	0	0	112	H903 Q904 R910 D911	H903-D907 WeakPolarHBondContact O-CB 3.45Å; H903-D907 PolarHBondContact O-N 3.45Å; Q904-D907 PolarHBondContact O-N 2.84Å; D907-R910 PolarHBondContact O-N 3.21Å; D907-R910 WeakPolarHBondContact OD1-CD 3.39Å; D907-R910 IonicContact OD1-CZ 3.1Å; D907-R910 IonicContact OD1-NE 2.7Å; D907-R910 IonicContact OD1-NH1 3.95Å; D907-R910 PolarHBondContact OD1-NH1 3.27Å; D907-D911 PolarHBondContact O-N 2.96Å
908	A	95.6	Very high	95.1	Very high	62 Å²	62	95.5 Å²	95.5	51%	0.512	48%	0.475	S	S	.	.	H	α-helix	trans	-62.8	-44	168	0	0	0	0	0	112.1	Q904 E905 D911 E912	Q904-A908 VanDerWaalsContact O-CB 3.23Å; Q904-A908 WeakPolarHBondContact O-CB 3.4Å; Q904-A908 PolarHBondContact O-N 2.78Å; E905-A908 PolarHBondContact O-N 2.8Å; A908-D911 PolarHBondContact O-N 2.99Å; A908-E912 PolarHBondContact O-N 3.38Å
909	L	95.5	Very high	94.9	Very high	92 Å²	92	95.6 Å²	95.6	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-37	174	-73.9	168	0	0	0	112.1	E905 N906 D911 E912 I913	E905-L909 WeakPolarHBondContact O-CB 3.32Å; E905-L909 VanDerWaalsContact O-CG 3.25Å; E905-L909 WeakPolarHBondContact O-CG 3.4Å; E905-L909 PolarHBondContact O-N 3.45Å; N906-L909 PolarHBondContact O-N 2.78Å; L909-D911 VanDerWaalsContact C-N 3.35Å; L909-E912 PolarHBondContact O-N 3.04Å; L909-I913 WeakPolarHBondContact O-CB 3.43Å; L909-I913 WeakPolarHBondContact O-CD1 3.28Å; L909-I913 VanDerWaalsContact O-CG1 3.24Å; L909-I913 WeakPolarHBondContact O-CG1 3.4Å; L909-I913 PolarHBondContact O-N 3.38Å
910	R	95.1	Very high	94.7	Very high	141 Å²	141	100.1 Å²	100.1	53%	0.532	49%	0.49	S	S	.	.	H	α-helix	trans	-64	-39.3	171.5	-75.2	159	172.2	176.6	-0.6	111.4	N906 D907 I913 R914	N906-R910 WeakPolarHBondContact O-CB 3.23Å; N906-R910 WeakPolarHBondContact O-CD 3.31Å; N906-R910 WeakPolarHBondContact O-CG 3.35Å; N906-R910 PolarHBondContact O-N 2.84Å; D907-R910 PolarHBondContact O-N 3.21Å; D907-R910 WeakPolarHBondContact OD1-CD 3.39Å; D907-R910 IonicContact OD1-CZ 3.1Å; D907-R910 IonicContact OD1-NE 2.7Å; D907-R910 IonicContact OD1-NH1 3.95Å; D907-R910 PolarHBondContact OD1-NH1 3.27Å; R910-I913 PolarHBondContact O-N 3.23Å; R910-R914 WeakPolarHBondContact O-CB 3.38Å; R910-R914 VanDerWaalsContact O-CG 3.3Å; R910-R914 WeakPolarHBondContact O-CG 3.13Å; R910-R914 PolarHBondContact O-N 3.35Å
911	D	94.9	Very high	94.3	Very high	74 Å²	74	101.6 Å²	101.6	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-70.6	-37.2	174.7	-93.5	-43	0	0	0	112.9	D907 A908 L909 R914 T915	D907-D911 PolarHBondContact O-N 2.96Å; A908-D911 PolarHBondContact O-N 2.99Å; L909-D911 VanDerWaalsContact C-N 3.35Å; D911-R914 CarbonylContact O-C 3.59Å; D911-R914 PolarHBondContact O-N 2.92Å; D911-R914 IonicContact OD1-CZ 2.7Å; D911-R914 IonicContact OD1-NE 3.19Å; D911-R914 PolarHBondContact OD1-NE 3.41Å; D911-R914 IonicContact OD1-NH2 3.64Å; D911-R914 PolarHBondContact OD1-NH2 2.64Å; D911-R914 IonicContact OD2-CZ 3.84Å; D911-R914 IonicContact OD2-NH2 2.84Å; D911-R914 PolarHBondContact OD2-NH2 3.46Å; D911-T915 WeakPolarHBondContact O-CG2 3.41Å; D911-T915 PolarHBondContact O-N 2.73Å; D911-T915 PolarHBondContact O-OG1 2.9Å
912	E	95.6	Very high	93.7	Very high	109 Å²	109	101.5 Å²	101.5	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-58.1	-50.5	169.7	-173.4	173.8	-168.4	0	0	110.2	A908 L909 R914 T915 L916	A908-E912 PolarHBondContact O-N 3.38Å; L909-E912 PolarHBondContact O-N 3.04Å; E912-R914 PolarHBondContact O-N 3.49Å; E912-T915 CarbonylContact O-C 3.59Å; E912-T915 WeakPolarHBondContact O-CA 3.31Å; E912-T915 PolarHBondContact O-N 2.81Å; E912-T915 PolarHBondContact O-OG1 3.15Å; E912-L916 HydrophobicContact CG-CD1 4Å; E912-L916 HydrophobicContact CG-CG 4.35Å; E912-L916 WeakPolarHBondContact O-CG 3.22Å; E912-L916 PolarHBondContact O-N 3.06Å
913	I	92.9	Very high	93	Very high	92 Å²	92	100.3 Å²	100.3	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-55	-48	173	-69.3	163.2	0	0	0	110.9	L909 R910 T915 L916 E917	L909-I913 WeakPolarHBondContact O-CB 3.43Å; L909-I913 WeakPolarHBondContact O-CD1 3.28Å; L909-I913 VanDerWaalsContact O-CG1 3.24Å; L909-I913 WeakPolarHBondContact O-CG1 3.4Å; L909-I913 PolarHBondContact O-N 3.38Å; R910-I913 PolarHBondContact O-N 3.23Å; I913-T915 VanDerWaalsContact C-N 3.27Å; I913-T915 PolarHBondContact O-N 3.1Å; I913-L916 PolarHBondContact O-N 2.94Å; I913-E917 HydrophobicContact CG2-CG 4.31Å; I913-E917 WeakPolarHBondContact O-CB 3.23Å; I913-E917 WeakPolarHBondContact O-CG 3.42Å; I913-E917 PolarHBondContact O-N 3.34Å
914	R	95.4	Very high	92.2	Very high	122 Å²	122	102.8 Å²	102.8	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-33	176.2	-73.8	-169.5	-69.8	-137.9	4.2	112.5	R910 D911 E912 K918	R910-R914 WeakPolarHBondContact O-CB 3.38Å; R910-R914 VanDerWaalsContact O-CG 3.3Å; R910-R914 WeakPolarHBondContact O-CG 3.13Å; R910-R914 PolarHBondContact O-N 3.35Å; D911-R914 CarbonylContact O-C 3.59Å; D911-R914 PolarHBondContact O-N 2.92Å; D911-R914 IonicContact OD1-CZ 2.7Å; D911-R914 IonicContact OD1-NE 3.19Å; D911-R914 PolarHBondContact OD1-NE 3.41Å; D911-R914 IonicContact OD1-NH2 3.64Å; D911-R914 PolarHBondContact OD1-NH2 2.64Å; D911-R914 IonicContact OD2-CZ 3.84Å; D911-R914 IonicContact OD2-NH2 2.84Å; D911-R914 PolarHBondContact OD2-NH2 3.46Å; E912-R914 PolarHBondContact O-N 3.49Å; R914-K918 WeakPolarHBondContact O-CB 3.34Å; R914-K918 VanDerWaalsContact O-CD 3.31Å; R914-K918 WeakPolarHBondContact O-CD 3.44Å; R914-K918 WeakPolarHBondContact O-CG 3.39Å; R914-K918 PolarHBondContact O-N 3.19Å; R914-K918 VanDerWaalsContact O-N 3.11Å
915	T	93.5	Very high	91.5	Very high	68 Å²	68	103.8 Å²	103.8	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-75.9	-40.9	174.4	63.6	0	0	0	0	112.4	D911 E912 I913 E917 K918 L919	D911-T915 WeakPolarHBondContact O-CG2 3.41Å; D911-T915 PolarHBondContact O-N 2.73Å; D911-T915 PolarHBondContact O-OG1 2.9Å; E912-T915 CarbonylContact O-C 3.59Å; E912-T915 WeakPolarHBondContact O-CA 3.31Å; E912-T915 PolarHBondContact O-N 2.81Å; E912-T915 PolarHBondContact O-OG1 3.15Å; I913-T915 VanDerWaalsContact C-N 3.27Å; I913-T915 PolarHBondContact O-N 3.1Å; T915-E917 VanDerWaalsContact C-N 3.34Å; T915-E917 PolarHBondContact O-N 2.89Å; T915-K918 PolarHBondContact O-N 3.06Å; T915-L919 WeakPolarHBondContact O-CB 3.35Å; T915-L919 VanDerWaalsContact O-CG 3.29Å; T915-L919 WeakPolarHBondContact O-CG 3.43Å; T915-L919 PolarHBondContact O-N 3.28Å
916	L	92.6	Very high	90.5	Very high	95 Å²	95	106.8 Å²	106.8	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-37	175.8	-68.3	173.3	0	0	0	111.6	E912 I913 L919 R920	E912-L916 HydrophobicContact CG-CD1 4Å; E912-L916 HydrophobicContact CG-CG 4.35Å; E912-L916 WeakPolarHBondContact O-CG 3.22Å; E912-L916 PolarHBondContact O-N 3.06Å; I913-L916 PolarHBondContact O-N 2.94Å; L916-L919 PolarHBondContact O-N 2.72Å; L916-R920 VanDerWaalsContact O-CB 3.28Å; L916-R920 WeakPolarHBondContact O-CB 3.25Å; L916-R920 PolarHBondContact O-N 2.64Å
917	E	92.1	Very high	89	Confident	112 Å²	112	106 Å²	106	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-45.7	171.2	-75	-174.5	153.6	0	0	112	I913 T915 L919 R920 L921	I913-E917 HydrophobicContact CG2-CG 4.31Å; I913-E917 WeakPolarHBondContact O-CB 3.23Å; I913-E917 WeakPolarHBondContact O-CG 3.42Å; I913-E917 PolarHBondContact O-N 3.34Å; T915-E917 VanDerWaalsContact C-N 3.34Å; T915-E917 PolarHBondContact O-N 2.89Å; E917-L919 VanDerWaalsContact C-N 3.3Å; E917-L919 PolarHBondContact O-N 3.15Å; E917-R920 PolarHBondContact O-N 2.54Å; E917-L921 WeakPolarHBondContact O-CB 3.26Å; E917-L921 VanDerWaalsContact O-CG 3.3Å; E917-L921 WeakPolarHBondContact O-CG 3.45Å; E917-L921 PolarHBondContact O-N 2.87Å
918	K	92.1	Very high	87.3	Confident	140 Å²	140	104.9 Å²	104.9	61%	0.609	52%	0.516	S	S	*	.	H	α-helix	trans	-59.3	-41.4	173.2	-75.4	165.3	-172.5	170.5	0	111.5	R914 T915 S922	R914-K918 WeakPolarHBondContact O-CB 3.34Å; R914-K918 VanDerWaalsContact O-CD 3.31Å; R914-K918 WeakPolarHBondContact O-CD 3.44Å; R914-K918 WeakPolarHBondContact O-CG 3.39Å; R914-K918 PolarHBondContact O-N 3.19Å; R914-K918 VanDerWaalsContact O-N 3.11Å; T915-K918 PolarHBondContact O-N 3.06Å; K918-S922 VanDerWaalsContact O-CB 3.28Å; K918-S922 WeakPolarHBondContact O-CB 3.37Å; K918-S922 PolarHBondContact O-N 3.49Å; K918-S922 PolarHBondContact O-OG 3.21Å
919	L	92.1	Very high	85.4	Confident	106 Å²	106	105.6 Å²	105.6	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-49.3	175	-74.7	168.5	0	0	0	110.9	T915 L916 E917 L921 S922 A923	T915-L919 WeakPolarHBondContact O-CB 3.35Å; T915-L919 VanDerWaalsContact O-CG 3.29Å; T915-L919 WeakPolarHBondContact O-CG 3.43Å; T915-L919 PolarHBondContact O-N 3.28Å; L916-L919 PolarHBondContact O-N 2.72Å; E917-L919 VanDerWaalsContact C-N 3.3Å; E917-L919 PolarHBondContact O-N 3.15Å; L919-L921 PolarHBondContact O-N 2.91Å; L919-S922 PolarHBondContact O-N 2.79Å; L919-S922 VanDerWaalsContact O-N 3.16Å; L919-S922 PolarHBondContact O-OG 3.01Å; L919-A923 WeakPolarHBondContact O-CB 3.27Å; L919-A923 PolarHBondContact O-N 3.08Å
920	R	92.8	Very high	83.3	Confident	178 Å²	178	105.4 Å²	105.4	67%	0.672	53%	0.528	S	S	*	.	H	α-helix	trans	-57.6	-45	175.7	-177.8	-179.9	178.5	-178	0.2	112.2	L916 E917 A923 W924	L916-R920 VanDerWaalsContact O-CB 3.28Å; L916-R920 WeakPolarHBondContact O-CB 3.25Å; L916-R920 PolarHBondContact O-N 2.64Å; E917-R920 PolarHBondContact O-N 2.54Å; R920-A923 PolarHBondContact O-N 2.76Å; R920-W924 WeakPolarHBondContact O-CB 3.24Å; R920-W924 PolarHBondContact O-N 3.03Å
921	L	88.4	Confident	81.1	Confident	111 Å²	111	101.8 Å²	101.8	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-34.4	176.7	-70.8	171.4	0	0	0	112.1	E917 L919 K925	E917-L921 WeakPolarHBondContact O-CB 3.26Å; E917-L921 VanDerWaalsContact O-CG 3.3Å; E917-L921 WeakPolarHBondContact O-CG 3.45Å; E917-L921 PolarHBondContact O-N 2.87Å; L919-L921 PolarHBondContact O-N 2.91Å; L921-K925 VanDerWaalsContact O-CB 3.26Å; L921-K925 WeakPolarHBondContact O-CB 3.3Å; L921-K925 PolarHBondContact O-N 3.32Å
922	S	84.1	Confident	78.7	Confident	54 Å²	54	106.7 Å²	106.7	38%	0.378	55%	0.549	S	S	.	.	H	α-helix	trans	-70.7	-35.8	173.6	81.4	0	0	0	0	112.3	K918 L919 K926	K918-S922 VanDerWaalsContact O-CB 3.28Å; K918-S922 WeakPolarHBondContact O-CB 3.37Å; K918-S922 PolarHBondContact O-N 3.49Å; K918-S922 PolarHBondContact O-OG 3.21Å; L919-S922 PolarHBondContact O-N 2.79Å; L919-S922 VanDerWaalsContact O-N 3.16Å; L919-S922 PolarHBondContact O-OG 3.01Å; S922-K926 WeakPolarHBondContact O-CB 3.37Å; S922-K926 VanDerWaalsContact O-CG 3.31Å; S922-K926 WeakPolarHBondContact O-CG 3.27Å; S922-K926 PolarHBondContact O-N 2.72Å
923	A	81.4	Confident	76	Confident	53 Å²	53	111.2 Å²	111.2	44%	0.438	57%	0.566	S	S	.	*	H	α-helix	trans	-68.7	-43.4	174.1	0	0	0	0	0	110.7	L919 R920 K926 S927	L919-A923 WeakPolarHBondContact O-CB 3.27Å; L919-A923 PolarHBondContact O-N 3.08Å; R920-A923 PolarHBondContact O-N 2.76Å; A923-K926 PolarHBondContact O-N 2.88Å; A923-S927 WeakPolarHBondContact O-CB 3.47Å; A923-S927 PolarHBondContact O-N 2.85Å; A923-S927 PolarHBondContact O-OG 3.37Å
924	W	79.1	Confident	73.3	Confident	161 Å²	161	109.9 Å²	109.9	61%	0.61	58%	0.576	S	S	*	*	H	α-helix	trans	-60.8	-48.5	172	-164.4	-26.7	0	0	0	110.7	R920 K926 S927 S928	R920-W924 WeakPolarHBondContact O-CB 3.24Å; R920-W924 PolarHBondContact O-N 3.03Å; W924-K926 VanDerWaalsContact C-N 3.27Å; W924-K926 PolarHBondContact O-N 2.79Å; W924-S927 WeakPolarHBondContact CA-OG 3.43Å; W924-S927 CarbonylContact O-C 3.57Å; W924-S927 PolarHBondContact O-N 3Å; W924-S927 PolarHBondContact O-OG 2.92Å; W924-S928 WeakPolarHBondContact O-CB 3.45Å; W924-S928 PolarHBondContact O-N 3.37Å; W924-S928 PolarHBondContact O-OG 2.86Å
925	K	81.3	Confident	70.7	Confident	161 Å²	161	110.7 Å²	110.7	70%	0.7	59%	0.594	S	S	*	*	H	α-helix	trans	-63.5	-32.4	179.1	-170	170.1	-177.3	175.4	0	112.6	L921 S928 A929	L921-K925 VanDerWaalsContact O-CB 3.26Å; L921-K925 WeakPolarHBondContact O-CB 3.3Å; L921-K925 PolarHBondContact O-N 3.32Å; K925-S928 PolarHBondContact O-OG 3.39Å; K925-A929 WeakPolarHBondContact O-CB 3.3Å; K925-A929 PolarHBondContact O-N 3.09Å; K925-A929 VanDerWaalsContact O-N 3.15Å
926	K	75.8	Confident	67.7	Low	157 Å²	157	115.9 Å²	115.9	68%	0.683	61%	0.613	S	S	*	*	H	α-helix	trans	-68	-47.5	168.8	-77.3	173.8	177.8	178.9	0	111.4	S922 A923 W924 S928 A929 S930	S922-K926 WeakPolarHBondContact O-CB 3.37Å; S922-K926 VanDerWaalsContact O-CG 3.31Å; S922-K926 WeakPolarHBondContact O-CG 3.27Å; S922-K926 PolarHBondContact O-N 2.72Å; A923-K926 PolarHBondContact O-N 2.88Å; W924-K926 VanDerWaalsContact C-N 3.27Å; W924-K926 PolarHBondContact O-N 2.79Å; K926-S928 PolarHBondContact O-N 2.96Å; K926-A929 PolarHBondContact O-N 2.91Å; K926-S930 PolarHBondContact O-N 2.89Å; K926-S930 PolarHBondContact O-OG 3.23Å
927	S	64	Low	65	Low	63 Å²	63	118.3 Å²	118.3	44%	0.441	63%	0.633	S	S	.	*	H	α-helix	trans	-67.6	-35	-177.5	71.3	0	0	0	0	112.5	A923 W924 S930 A931	A923-S927 WeakPolarHBondContact O-CB 3.47Å; A923-S927 PolarHBondContact O-N 2.85Å; A923-S927 PolarHBondContact O-OG 3.37Å; W924-S927 WeakPolarHBondContact CA-OG 3.43Å; W924-S927 CarbonylContact O-C 3.57Å; W924-S927 PolarHBondContact O-N 3Å; W924-S927 PolarHBondContact O-OG 2.92Å; S927-S930 VanDerWaalsContact CA-OG 3.31Å; S927-S930 WeakPolarHBondContact CA-OG 3.22Å; S927-S930 CarbonylContact O-C 3.59Å; S927-S930 PolarHBondContact O-N 2.92Å; S927-S930 PolarHBondContact O-OG 3.24Å; S927-A931 WeakPolarHBondContact O-CB 3.27Å; S927-A931 PolarHBondContact O-N 2.88Å
928	S	58.9	Low	62.3	Low	52 Å²	52	121.7 Å²	121.7	36%	0.364	65%	0.646	S	S	.	*	H	α-helix	trans	-70.3	-42	173.2	66.7	0	0	0	0	111.7	W924 K925 K926 S930 A931 E932	W924-S928 WeakPolarHBondContact O-CB 3.45Å; W924-S928 PolarHBondContact O-N 3.37Å; W924-S928 PolarHBondContact O-OG 2.86Å; K925-S928 PolarHBondContact O-OG 3.39Å; K926-S928 PolarHBondContact O-N 2.96Å; S928-S930 PolarHBondContact O-N 3.45Å; S928-A931 PolarHBondContact O-N 3.42Å; S928-E932 PolarHBondContact O-N 3.44Å
929	A	55.1	Low	59.4	Low	77 Å²	77	122.5 Å²	122.5	64%	0.636	66%	0.657	S	S	*	*	H	α-helix	trans	-63.8	-23.3	173.4	0	0	0	0	0	113.2	K925 K926	K925-A929 WeakPolarHBondContact O-CB 3.3Å; K925-A929 PolarHBondContact O-N 3.09Å; K925-A929 VanDerWaalsContact O-N 3.15Å; K926-A929 PolarHBondContact O-N 2.91Å
930	S	53	Low	56.6	Low	88 Å²	88	120.8 Å²	120.8	62%	0.615	66%	0.664	S	S	*	*	H	α-helix	trans	-88.7	-14.8	167.6	57.2	0	0	0	0	114.7	K926 S927 S928	K926-S930 PolarHBondContact O-N 2.89Å; K926-S930 PolarHBondContact O-OG 3.23Å; S927-S930 VanDerWaalsContact CA-OG 3.31Å; S927-S930 WeakPolarHBondContact CA-OG 3.22Å; S927-S930 CarbonylContact O-C 3.59Å; S927-S930 PolarHBondContact O-N 2.92Å; S927-S930 PolarHBondContact O-OG 3.24Å; S928-S930 PolarHBondContact O-N 3.45Å
931	A	49.1	Very low	54.4	Low	64 Å²	64	118 Å²	118	53%	0.529	67%	0.669	S	S	.	*	H	α-helix	trans	-92.7	-17.2	-176.2	0	0	0	0	0	114.1	S927 S928 K933	S927-A931 WeakPolarHBondContact O-CB 3.27Å; S927-A931 PolarHBondContact O-N 2.88Å; S928-A931 PolarHBondContact O-N 3.42Å; A931-K933 PolarHBondContact O-N 2.85Å
932	E	43.8	Very low	51.6	Low	178 Å²	178	123.7 Å²	123.7	83%	0.832	68%	0.683	S	S	*	*	S	Bend	trans	-70.8	24.5	173.2	-67.6	-166.1	140.3	0	0	114.2	S928	S928-E932 PolarHBondContact O-N 3.44Å
933	K	37.9	Very low	49.3	Very low	203 Å²	203	127.6 Å²	127.6	88%	0.883	70%	0.704	S	S	*	*	S	Bend	trans	-137.5	60.8	166.8	-70.6	-169.4	175.7	-177.5	0	110.9	A931	A931-K933 PolarHBondContact O-N 2.85Å
934	G	36.6	Very low	47.1	Very low	65 Å²	65	128.8 Å²	128.8	67%	0.67	71%	0.709	S	S	*	*			trans	-156.5	65.2	-172.5	0	0	0	0	0	116.2
935	V	40.4	Very low	44.8	Very low	139 Å²	139	129.4 Å²	129.4	84%	0.842	72%	0.719	S	S	*	*			trans	7.7	129	161.1	-175.9	0	0	0	0	120.4
936	Q	32	Very low	42.6	Very low	176 Å²	176	126 Å²	126	82%	0.822	72%	0.715	S	S	*	*			trans	-27	147.7	160.3	-50.5	166.9	18.7	0	0	118.5
937	T	35.8	Very low	40.6	Very low	147 Å²	147	123 Å²	123	90%	0.902	71%	0.714	S	S	*	*				-163.8	171.1	128.9	5.8	0	0	0	0	111.5
938	K	35	Very low	39.2	Very low	183 Å²	183	127.4 Å²	127.4	80%	0.796	73%	0.732	S	S	*	*			trans	-106.3	151.4	-178.8	-55.3	174.4	179.4	175.6	0	111.4
939	D	32	Very low	38.1	Very low	157 Å²	157	128.7 Å²	128.7	84%	0.84	75%	0.746	S	S	*	*				171.2	169.9	106.9	-87.1	-26.3	0	0	0	111.5
940	G	31.8	Very low	37.4	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	76%	0.76	S	S	*	*			trans	-106.9	-161.5	170.3	0	0	0	0	0	112
941	P	47.1	Very low	36.5	Very low	121 Å²	121	134.3 Å²	134.3	79%	0.786	76%	0.764	S	S	*	*			cis	-137.9	-172.7	10.5	43.6	-25.5	0	0	0	115.5
942	R	30.1	Very low	35.8	Very low	230 Å²	230	137.5 Å²	137.5	87%	0.868	78%	0.777	S	S	*	*			trans	21.5	162.9	149.8	-66.2	-178.5	172	-172.6	-2	122.9
943	V	35.4	Very low	35.5	Very low	135 Å²	135	134.1 Å²	134.1	82%	0.818	77%	0.769	S	S	*	*			trans	82.5	130.9	163.6	-176.2	0	0	0	0	114
944	S	35.6	Very low	35.1	Very low	79 Å²	79	133.8 Å²	133.8	55%	0.552	77%	0.768	S	S	*	*			cis	-161.3	162.8	-13	-116.4	0	0	0	0	112.7
945	E	30.2	Very low	34.9	Very low	174 Å²	174	134.8 Å²	134.8	81%	0.813	77%	0.77	S	S	*	*			trans	36.8	152	132.9	-65.1	163.9	117.2	0	0	123.2
946	S	35.7	Very low	34.8	Very low	88 Å²	88	134.5 Å²	134.5	62%	0.615	77%	0.768	S	S	*	*			cis	-171.1	165.2	-15.3	61.4	0	0	0	0	112.3
947	S	34.3	Very low	35.6	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	76%	0.762	S	S	*	*			trans	58.8	161.5	136.5	78.4	0	0	0	0	120.4
948	L	33.8	Very low	35.5	Very low	155 Å²	155	131.4 Å²	131.4	81%	0.812	76%	0.757	S	S	*	*			cis	-121.1	141.1	1.4	-66.8	155.4	0	0	0	108.6
949	A	34.9	Very low	35.3	Very low	79 Å²	79	128.6 Å²	128.6	65%	0.653	75%	0.751	S	S	*	*			cis	95.6	141.7	32.5	0	0	0	0	0	114.7
950	K	41.3	Very low	35.4	Very low	214 Å²	214	125.9 Å²	125.9	93%	0.93	74%	0.744	S	S	*	*			trans	78.7	116	-176.9	-51.7	174.1	-176.5	177.8	0	115.4
951	G	32.9	Very low	35.6	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	76%	0.756	S	S	*	*			cis	142.6	167.3	-14.9	0	0	0	0	0	114.6
952	V	34.9	Very low	34.8	Very low	131 Å²	131	132.9 Å²	132.9	79%	0.794	76%	0.758	S	S	*	*			trans	63.8	89.7	161.1	-172.5	0	0	0	0	114.8
953	T	37.4	Very low	35.1	Very low	108 Å²	108	127.7 Å²	127.7	66%	0.663	76%	0.757	S	S	*	*				66.6	155.9	81.4	69.8	0	0	0	0	114.1
954	F	30.3	Very low	35.2	Very low	196 Å²	196	126.7 Å²	126.7	86%	0.86	76%	0.756	S	S	*	*			cis	-151.9	176	23.3	-118.8	-64	0	0	0	113.2
955	A	32.4	Very low	35.3	Very low	86 Å²	86	128.5 Å²	128.5	71%	0.711	77%	0.769	S	S	*	*			trans	75.8	90.6	148.3	0	0	0	0	0	121.3
956	T	39	Very low	35.6	Very low	133 Å²	133	125.5 Å²	125.5	82%	0.816	77%	0.767	S	S	*	*				-67.3	171.6	125.3	42.4	0	0	0	0	110
957	P	47.4	Very low	36.1	Very low	107 Å²	107	127.1 Å²	127.1	70%	0.695	78%	0.775	S	S	*	*			cis	-152.3	173.5	30.1	45.5	-24.5	0	0	0	120.9
958	L	33.8	Very low	37.3	Very low	150 Å²	150	128.1 Å²	128.1	79%	0.785	78%	0.779	S	S	*	*			trans	68.9	138.7	142.1	-75.8	163.1	0	0	0	124.6
959	D	31.3	Very low	37.1	Very low	125 Å²	125	129.2 Å²	129.2	67%	0.668	79%	0.785	S	S	*	*			trans	83.3	96.5	141.8	-82.7	-49.1	0	0	0	125.2
960	S	34.9	Very low	37.1	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	80%	0.795	S	S	*	*				80.4	135.7	111.4	-72.2	0	0	0	0	123.4
961	R	35.2	Very low	36.8	Very low	257 Å²	257	126.4 Å²	126.4	97%	0.97	79%	0.788	S	S	*	*			trans	72.8	131.7	167.7	-71.6	178.2	152.2	-163.1	-6.2	119
962	G	29.4	Very low	36.9	Very low	79 Å²	79	127.8 Å²	127.8	81%	0.814	79%	0.792	S	S	*	*			trans	155.7	140	168.9	0	0	0	0	0	111.8
963	S	36.7	Very low	37	Very low	121 Å²	121	132.3 Å²	132.3	85%	0.846	80%	0.795	S	S	*	*			trans	-124.2	150.6	-173.4	-70.3	0	0	0	0	114.2
964	S	38.6	Very low	37	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	80%	0.801	S	S	*	*			trans	85	160.1	149.5	81.1	0	0	0	0	121.4
965	S	36.2	Very low	37.3	Very low	118 Å²	118	134.3 Å²	134.3	83%	0.825	80%	0.795	S	S	*	*			trans	80.1	171.1	176	79.9	0	0	0	0	118.2
966	S	36.3	Very low	37.3	Very low	111 Å²	111	136.3 Å²	136.3	78%	0.776	80%	0.804	S	S	*	*			trans	-138.5	-162.3	-146.4	-50.5	0	0	0	0	113.6
967	P	48	Very low	37.3	Very low	122 Å²	122	138.8 Å²	138.8	79%	0.792	80%	0.803	S	S	*	*				-125.8	-143	-106.4	43.8	-22.4	0	0	0	114.3
968	P	59.2	Low	36.8	Very low	115 Å²	115	138.9 Å²	138.9	75%	0.747	80%	0.798	S	S	*	*				-134.7	175.4	-117.9	40.3	-19.2	0	0	0	117.9
969	L	29.5	Very low	36.7	Very low	179 Å²	179	138.8 Å²	138.8	94%	0.937	80%	0.798	S	S	*	*			trans	-153.1	152.4	158.3	-89.7	-174.9	0	0	0	113
970	S	34.3	Very low	36.6	Very low	123 Å²	123	136 Å²	136	86%	0.86	80%	0.799	S	S	*	*			trans	-156.7	-171.2	172	70.1	0	0	0	0	113.3
971	S	36.1	Very low	36.4	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	81%	0.81	S	S	*	*			trans	-137.9	157.7	-145.8	58.8	0	0	0	0	119.4
972	A	34.5	Very low	36	Very low	97 Å²	97	133.1 Å²	133.1	80%	0.802	80%	0.802	S	S	*	*			trans	64.7	178.4	142.6	0	0	0	0	0	123.3
973	R	36.1	Very low	36	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.857	80%	0.803	S	S	*	*				-171.3	154.2	-64.6	-152.3	177.6	-177.2	178.7	0.8	112.7
974	R	38.3	Very low	35.8	Very low	208 Å²	208	133.6 Å²	133.6	79%	0.785	81%	0.806	S	S	*	*			trans	77.1	154.3	163.6	-54.6	-168.9	122.2	170.1	1.2	117.4
975	N	35.9	Very low	35.4	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	80%	0.804	S	S	*	*			cis	-167.3	151.4	-13.3	-110.9	28.4	0	0	0	110.9
976	S	32.2	Very low	35	Very low	127 Å²	127	134.3 Å²	134.3	89%	0.888	81%	0.805	S	S	*	*			trans	163.5	178	135.1	-156.8	0	0	0	0	114.1
977	K	40	Very low	34.8	Very low	185 Å²	185	138.2 Å²	138.2	80%	0.804	81%	0.808	S	S	*	*			trans	-123	176.2	-172.4	-89.6	-174.5	158.1	-148.6	0	112.4
978	D	36	Very low	33.9	Very low	110 Å²	110	137.8 Å²	137.8	59%	0.588	81%	0.808	S	S	*	*			cis	-155.5	164.8	19.1	-153.9	39.2	0	0	0	113.8
979	N	31.9	Very low	32.8	Very low	147 Å²	147	136.9 Å²	136.9	79%	0.786	81%	0.805	S	S	*	*			trans	34.7	137.1	161.2	-81.6	-50.6	0	0	0	122.9
980	G	30	Very low	32.8	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	80%	0.798	S	S	*	*			cis	174.6	-176.8	-1.3	0	0	0	0	0	115.3
981	Q	30.8	Very low	32.7	Very low	201 Å²	201	141.6 Å²	141.6	94%	0.939	80%	0.802	S	S	*	*			trans	78.6	134.3	177.9	-71.4	-163.5	-3	0	0	122.2
982	A	26.3	Very low	32.4	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	80%	0.804	S	S	*	*			trans	83.4	128.1	150.3	0	0	0	0	0	123.5
983	A	28.6	Very low	32	Very low	102 Å²	102	146.2 Å²	146.2	84%	0.843	79%	0.794	S	S	*	*			trans	71.4	132	151.4	0	0	0	0	0	122.6
984	A	32.2	Very low	31.5	Very low	109 Å²	109	142.6 Å²	142.6	90%	0.901	80%	0.797	S	S	*	*			trans	28.4	136.4	155.8	0	0	0	0	0	122.2
985	G	31.2	Very low	31	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	80%	0.795	S	S	*	*			cis	159.1	30.7	2	0	0	0	0	0	118
986	M	28.4	Very low	30.7	Very low	171 Å²	171	135.4 Å²	135.4	84%	0.842	80%	0.801	S	S	*	*			trans	-142	122.4	173.8	-77.2	-158.3	173.8	0	0	114.8
987	K	30.4	Very low	30.5	Very low	194 Å²	194	133.9 Å²	133.9	84%	0.843	79%	0.791	S	S	*	*			trans	39.3	131.5	140.6	-54.1	179.5	-176.6	-178.5	0	118.7
988	S	29.2	Very low	29.9	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	79%	0.794	S	S	*	*			cis	-147.8	-134.4	4	51.6	0	0	0	0	110.1
989	S	36.4	Very low	29.6	Very low	97 Å²	97	133.1 Å²	133.1	68%	0.678	80%	0.803	S	S	*	*			cis	-167	-170.9	13.5	-146.2	0	0	0	0	111.5
990	L	29.3	Very low	29.4	Very low	152 Å²	152	131.4 Å²	131.4	80%	0.796	80%	0.802	S	S	*	*			trans	80.9	140.3	173.2	-54.9	163.6	0	0	0	115.7
991	R	32.6	Very low	29.2	Very low	248 Å²	248	133.5 Å²	133.5	94%	0.936	81%	0.807	S	S	*	*			cis	-113.7	169.5	18.2	-72.7	-172.7	174.1	-147.6	1.4	116.2
992	R	29.9	Very low	28.9	Very low	221 Å²	221	128.4 Å²	128.4	83%	0.834	79%	0.793	S	S	*	*			trans	-61.1	162.3	174.7	-75.2	177.1	-177.2	-107.5	-1.5	114.4
993	S	26.7	Very low	28.9	Very low	84 Å²	84	129.2 Å²	129.2	59%	0.587	79%	0.789	S	S	*	*			cis	-176.9	150.1	-16.7	51.8	0	0	0	0	112.4
994	V	26.2	Very low	28.8	Very low	151 Å²	151	133.8 Å²	133.8	92%	0.915	79%	0.79	S	S	*	*			trans	54.7	141.3	160.9	-65.5	0	0	0	0	119.3
995	G	27.2	Very low	28.4	Very low	73 Å²	73	134.4 Å²	134.4	75%	0.753	79%	0.788	S	S	*	*			trans	-172.9	-49	179.2	0	0	0	0	0	115
996	S	29.6	Very low	28	Very low	122 Å²	122	134.5 Å²	134.5	85%	0.853	79%	0.789	S	S	*	*			trans	82.6	170.3	176.3	-150.1	0	0	0	0	118.2
997	S	27.5	Very low	28	Very low	96 Å²	96	136.3 Å²	136.3	67%	0.671	79%	0.786	S	S	*	*			trans	63.9	91.1	165.7	38.8	0	0	0	0	121.8
998	L	28.4	Very low	27.9	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	78%	0.782	S	S	*	*				74.2	158.2	117.6	-71.3	170.3	0	0	0	123.4
999	S	28.6	Very low	27.8	Very low	111 Å²	111	137 Å²	137	78%	0.776	78%	0.779	S	S	*	*			trans	68.3	144	170.8	-59.7	0	0	0	0	118.3
1000	S	28.2	Very low	27.3	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	79%	0.785	S	S	*	*			cis	169.1	148.6	-42.3	48.4	0	0	0	0	106.3
1001	S	24.6	Very low	27.1	Very low	112 Å²	112	140.1 Å²	140.1	78%	0.783	78%	0.779	S	S	*	*			trans	-157.6	152.4	179.4	51.4	0	0	0	0	115.8
1002	S	25.8	Very low	26.9	Very low	93 Å²	93	135.5 Å²	135.5	65%	0.65	77%	0.766	S	S	*	*			trans	60.6	106.7	148.3	64.5	0	0	0	0	121.8
1003	T	26.5	Very low	27.1	Very low	113 Å²	113	130.2 Å²	130.2	69%	0.693	76%	0.76	S	S	*	*				69.2	107.2	123.2	63	0	0	0	0	123.2
1004	F	25.5	Very low	27.1	Very low	197 Å²	197	137.1 Å²	137.1	86%	0.864	77%	0.774	S	S	*	*				71	142.1	122.4	-74.1	-66.9	0	0	0	125.3
1005	S	23.5	Very low	27.4	Very low	123 Å²	123	134.9 Å²	134.9	86%	0.86	76%	0.762	S	S	*	*			trans	81.9	135.6	152.2	-61.7	0	0	0	0	119.6
1006	G	23.4	Very low	27.5	Very low	77 Å²	77	138 Å²	138	79%	0.794	77%	0.766	S	S	*	*			trans	-167.9	-32.1	178	0	0	0	0	0	123.5
1007	R	27.7	Very low	27.4	Very low	209 Å²	209	137.5 Å²	137.5	79%	0.789	76%	0.763	S	S	*	*			trans	57	104	157.1	-166.4	-174.9	-155.4	-94.7	6.9	121.3
1008	R	29.1	Very low	27.3	Very low	201 Å²	201	141.2 Å²	141.2	76%	0.758	76%	0.763	S	S	*	*			trans	73.8	169.4	141.1	-65	-179.9	179.7	-134.2	-2.1	121
1009	T	26.6	Very low	27.5	Very low	118 Å²	118	138 Å²	138	72%	0.724	75%	0.754	S	S	*	*			cis	174.6	130	-38.3	-74.9	0	0	0	0	109.7
1010	E	25.8	Very low	27.6	Very low	172 Å²	172	138.6 Å²	138.6	80%	0.804	75%	0.745	S	S	*	*			trans	-175.1	128.2	136.2	-103.7	-175.5	155.5	0	0	109.8
1011	E	25.1	Very low	27.6	Very low	143 Å²	143	140.3 Å²	140.3	67%	0.668	74%	0.74	S	S	*	*				55.1	134.2	103.4	-70.6	-134.9	138.3	0	0	115.3
1012	K	29.6	Very low	27.6	Very low	151 Å²	151	144.1 Å²	144.1	66%	0.657	74%	0.743	S	S	*	*			cis	164.2	171.7	11.7	166.9	166.6	175.9	173	0	108.9
1013	P	34.3	Very low	28.4	Very low	111 Å²	111	145.6 Å²	145.6	72%	0.721	75%	0.75	S	S	*	*			cis	-110.1	-137.3	-8.7	24.9	1.1	0	0	0	110.2
1014	R	25.2	Very low	28.4	Very low	229 Å²	229	144.6 Å²	144.6	86%	0.864	75%	0.748	S	S	*	*			cis	-158.6	156.5	2.3	-159.6	169.3	-176.2	160.9	2.9	111.8
1015	P	33.3	Very low	28.4	Very low	103 Å²	103	141.5 Å²	141.5	67%	0.669	74%	0.74	S	S	*	*			trans	-133.4	-169.3	-163.8	44.8	-29.1	0	0	0	117.6
1016	T	28.8	Very low	28.7	Very low	138 Å²	138	144.1 Å²	144.1	85%	0.847	74%	0.739	S	S	*	*			trans	74.2	156.8	158.8	57.8	0	0	0	0	119.3
1017	S	27	Very low	28.8	Very low	113 Å²	113	149.7 Å²	149.7	79%	0.79	74%	0.741	S	S	*	*			cis	-143.2	-164	6.3	52.3	0	0	0	0	109.8
1018	R	27.2	Very low	29.9	Very low	174 Å²	174	144.4 Å²	144.4	66%	0.657	73%	0.734	S	S	*	*			cis	-159.5	136.6	11.8	179.9	177.7	-179.4	-154.2	-7.3	107.8	E1021	R1018-E1021 IonicContact NH2-OE2 2.8Å
1019	S	31.9	Very low	29.7	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	74%	0.737	S	S	*	*				58.3	161	88	-19.5	0	0	0	0	116.9
1020	Q	31.3	Very low	29.7	Very low	124 Å²	124	145 Å²	145	58%	0.579	74%	0.737	S	S	*	*			cis	-150.8	-154.3	15.1	-131.2	153.1	-61.2	0	0	109.9
1021	E	27.6	Very low	29.5	Very low	145 Å²	145	143.7 Å²	143.7	68%	0.678	73%	0.731	S	S	*	*			cis	-153.6	-122.4	15.7	-157.3	65.5	-95	0	0	113.4	R1018	R1018-E1021 IonicContact NH2-OE2 2.8Å
1022	K	24.6	Very low	29.6	Very low	193 Å²	193	144.8 Å²	144.8	84%	0.839	74%	0.736	S	S	*	*			trans	-164.8	171.8	-176.1	-123.7	178.2	-174.5	-179.5	0	113.3
1023	P	43	Very low	29.4	Very low	124 Å²	124	144.5 Å²	144.5	81%	0.805	74%	0.741	S	S	*	*				-150.2	-120.8	65	41.4	-16.5	0	0	0	117.9
1024	S	26.2	Very low	28.8	Very low	91 Å²	91	145 Å²	145	64%	0.636	75%	0.747	S	S	*	*			trans	-178.8	158.9	-152.6	56.1	0	0	0	0	118.3
1025	N	24.5	Very low	29	Very low	133 Å²	133	139.8 Å²	139.8	71%	0.711	75%	0.745	S	S	*	*			trans	71.7	160.3	148.6	-69.7	23.3	0	0	0	121
1026	Q	30	Very low	29.5	Very low	178 Å²	178	140.9 Å²	140.9	83%	0.832	75%	0.752	S	S	*	*			cis	-162.2	-168.8	-5.3	-119.6	169.5	-44.4	0	0	115.6
1027	K	26.4	Very low	29.8	Very low	194 Å²	194	144.1 Å²	144.1	84%	0.843	75%	0.749	S	S	*	*			trans	-73.5	-179.5	178.5	-120.9	-155.3	177.3	-172.9	0	114.6
1028	P	50.6	Low	29.9	Very low	97 Å²	97	146.1 Å²	146.1	63%	0.63	75%	0.749	S	S	*	*			cis	-145.5	175.6	15.1	46.3	-25.8	0	0	0	121.2
1029	E	24.9	Very low	30.1	Very low	176 Å²	176	143.6 Å²	143.6	82%	0.822	75%	0.748	S	S	*	*			trans	72.8	169.7	159.1	-35.6	-150.1	79.3	0	0	118.7
1030	Q	26.3	Very low	30	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	76%	0.757	S	S	*	*			cis	-157.2	162.8	12.4	-167	174.7	-13.4	0	0	113.7
1031	E	22.8	Very low	29.9	Very low	144 Å²	144	149.4 Å²	149.4	67%	0.673	77%	0.769	S	S	*	*			trans	23.7	128.8	164	-72.5	168.1	-120.6	0	0	126.5
1032	H	26	Very low	30.3	Very low	166 Å²	166	148 Å²	148	77%	0.769	77%	0.773	S	S	*	*			trans	38.7	141.2	147.9	-59.4	-73.1	0	0	0	122.6
1033	D	24.8	Very low	30.4	Very low	145 Å²	145	147.5 Å²	147.5	78%	0.775	77%	0.773	S	S	*	*			cis	-154.7	-179.3	9.3	-151.5	-11.1	0	0	0	112.8
1034	C	22.2	Very low	29.9	Very low	123 Å²	123	150.6 Å²	150.6	83%	0.831	78%	0.777	S	S	*	*			trans	86.1	148.2	169.6	-72.8	0	0	0	0	121
1035	S	29.7	Very low	30.1	Very low	119 Å²	119	154.3 Å²	154.3	83%	0.832	79%	0.789	S	S	*	*			trans	-106.7	179.3	-172.5	-81.1	0	0	0	0	112
1036	P	43.6	Very low	30.3	Very low	125 Å²	125	153.5 Å²	153.5	81%	0.812	78%	0.781	S	S	*	*			cis	-136.9	-172.8	17.9	43	-23.6	0	0	0	117.6
1037	R	36.4	Very low	30	Very low	206 Å²	206	151 Å²	151	78%	0.777	78%	0.783	S	S	*	*			trans	-110.4	167	170.8	-48.5	177.5	-171.7	164.9	0	111.1	D1039	R1037-D1039 WeakPolarHBondContact CD-OD2 3.35Å; R1037-D1039 IonicContact NH1-OD2 3.45Å
1038	I	28.5	Very low	29.9	Very low	155 Å²	155	147 Å²	147	80%	0.795	78%	0.778	S	S	*	*			trans	-135.6	134.5	138.5	-62.4	-175.1	0	0	0	107.7
1039	D	30.4	Very low	28.8	Very low	121 Å²	121	148.7 Å²	148.7	65%	0.647	78%	0.777	S	S	*	*			trans	-117.9	157.2	168	-58.9	-74.7	0	0	0	107	R1037	R1037-D1039 WeakPolarHBondContact CD-OD2 3.35Å; R1037-D1039 IonicContact NH1-OD2 3.45Å
1040	L	31.2	Very low	28.9	Very low	170 Å²	170	147.3 Å²	147.3	89%	0.89	78%	0.782	S	S	*	*			trans	-136.4	126.6	170.1	-78.5	179.2	0	0	0	112.8
1041	E	28.3	Very low	29.4	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	77%	0.773	S	S	*	*			trans	-98.1	164.2	174.2	-81.2	-94.2	133.6	0	0	111.1
1042	P	35.9	Very low	29.8	Very low	115 Å²	115	147 Å²	147	75%	0.747	78%	0.778	S	S	*	*			trans	-89.4	100.2	165.6	34.3	-28.9	0	0	0	111.7	Q1044	P1042-Q1044 PolarHBondContact O-N 2.92Å
1043	E	27.3	Very low	30.7	Very low	182 Å²	182	144.6 Å²	144.6	85%	0.85	78%	0.777	S	S	*	*			trans	-69.2	127.3	172.4	-77	-165.9	149.4	0	0	112.6
1044	Q	32.1	Very low	31.7	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	76%	0.758	S	S	*	*			trans	-105.1	141.4	152.7	-69.9	-167.7	-60.4	0	0	109.5	P1042 E1046	P1042-Q1044 PolarHBondContact O-N 2.92Å; Q1044-E1046 PolarHBondContact O-N 2.82Å
1045	L	30.4	Very low	33	Very low	169 Å²	169	142.9 Å²	142.9	89%	0.885	76%	0.757	S	S	*	*			trans	-78.5	81.6	-177.8	-70.4	165.9	0	0	0	112.2
1046	E	28.5	Very low	34.3	Very low	116 Å²	116	139.8 Å²	139.8	54%	0.542	73%	0.734	S	S	.	*			trans	-89.1	109.9	145.5	-81.5	-161.7	146.2	0	0	107.9	Q1044 C1048 K1096 Q1106	Q1044-E1046 PolarHBondContact O-N 2.82Å; E1046-C1048 PolarHBondContact O-N 2.8Å; E1046-K1096 IonicContact OE1-NZ 3.64Å; E1046-K1096 PolarHBondContact OE1-NZ 3.02Å; E1046-K1096 IonicContact OE2-NZ 3.49Å; E1046-K1096 PolarHBondContact OE2-NZ 3.43Å; E1046-Q1106 PolarHBondContact OE1-NE2 3.44Å; E1046-Q1106 PolarHBondContact OE1-OE1 2.92Å
1047	S	23.9	Very low	35.1	Very low	126 Å²	126	140.3 Å²	140.3	88%	0.881	73%	0.725	S	S	*	*			trans	-77.3	69.1	177.6	61.2	0	0	0	0	111.5
1048	C	23.9	Very low	36.8	Very low	109 Å²	109	136.2 Å²	136.2	74%	0.736	72%	0.715	S	S	*	*			trans	-94.2	111.7	168	-162.1	0	0	0	0	108.5	E1046 T1050	E1046-C1048 PolarHBondContact O-N 2.8Å; C1048-T1050 PolarHBondContact O-N 3.32Å
1049	E	26.8	Very low	39.5	Very low	133 Å²	133	132.3 Å²	132.3	62%	0.621	70%	0.699	S	S	*	*			trans	-59.7	122.1	172.1	-66.9	-174.1	135.7	0	0	109.1	R1051	E1049-R1051 HydrophobicContact CB-CG 3.95Å; E1049-R1051 PolarHBondContact O-N 3.27Å; E1049-R1051 IonicContact OE2-CZ 3.84Å; E1049-R1051 IonicContact OE2-NE 2.71Å; E1049-R1051 PolarHBondContact OE2-NE 2.81Å; E1049-R1051 IonicContact OE2-NH2 3.7Å; E1049-R1051 PolarHBondContact OE2-NH2 3.01Å
1050	T	27.3	Very low	42.1	Very low	148 Å²	148	129.8 Å²	129.8	91%	0.908	68%	0.684	S	S	*	*			trans	-72.2	70.3	164.8	-49.1	0	0	0	0	108.8	C1048	C1048-T1050 PolarHBondContact O-N 3.32Å
1051	R	36.5	Very low	44.7	Very low	147 Å²	147	126.4 Å²	126.4	56%	0.555	67%	0.671	S	S	*	*			trans	-61.3	144.3	165.8	-62.3	-164.3	176.6	-164.3	0.4	108.3	E1049 E1054	E1049-R1051 HydrophobicContact CB-CG 3.95Å; E1049-R1051 PolarHBondContact O-N 3.27Å; E1049-R1051 IonicContact OE2-CZ 3.84Å; E1049-R1051 IonicContact OE2-NE 2.71Å; E1049-R1051 PolarHBondContact OE2-NE 2.81Å; E1049-R1051 IonicContact OE2-NH2 3.7Å; E1049-R1051 PolarHBondContact OE2-NH2 3.01Å; R1051-E1054 VanDerWaalsContact CD-OE1 3.26Å; R1051-E1054 WeakPolarHBondContact CD-OE1 3.44Å; R1051-E1054 IonicContact CZ-OE1 2.66Å; R1051-E1054 IonicContact NE-OE1 3.56Å; R1051-E1054 IonicContact NH1-OE1 2.63Å; R1051-E1054 PolarHBondContact NH1-OE1 3.42Å; R1051-E1054 IonicContact NH1-OE2 2.94Å
1052	D	31.9	Very low	47.4	Very low	145 Å²	145	120.5 Å²	120.5	78%	0.775	64%	0.643	S	S	*	*			trans	-47.8	152.1	155.9	-86	-60.5	0	0	0	109.5	E1054	D1052-E1054 VanDerWaalsContact C-N 3.28Å; D1052-E1054 PolarHBondContact O-N 3.38Å
1053	P	44.7	Very low	49.4	Very low	116 Å²	116	122 Å²	122	75%	0.753	65%	0.652	S	S	*	*			trans	-64	88.7	-177.8	26.8	-35.3	0	0	0	111	L1055	P1053-L1055 PolarHBondContact O-N 2.88Å; P1053-L1055 VanDerWaalsContact O-N 3.13Å
1054	E	46.6	Very low	52.1	Low	77 Å²	77	118.2 Å²	118.2	36%	0.36	64%	0.638	S	S	.	*	P	Polyproline II helix	trans	-50.6	120.9	171.5	-77	-175.2	175.1	0	0	107.6	R1051 D1052	R1051-E1054 VanDerWaalsContact CD-OE1 3.26Å; R1051-E1054 WeakPolarHBondContact CD-OE1 3.44Å; R1051-E1054 IonicContact CZ-OE1 2.66Å; R1051-E1054 IonicContact NE-OE1 3.56Å; R1051-E1054 IonicContact NH1-OE1 2.63Å; R1051-E1054 PolarHBondContact NH1-OE1 3.42Å; R1051-E1054 IonicContact NH1-OE2 2.94Å; D1052-E1054 VanDerWaalsContact C-N 3.28Å; D1052-E1054 PolarHBondContact O-N 3.38Å
1055	L	50	Low	54.6	Low	155 Å²	155	111.1 Å²	111.1	81%	0.812	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-56.9	125	-171.2	-70	165.9	0	0	0	108.4	P1053 Q1057	P1053-L1055 PolarHBondContact O-N 2.88Å; P1053-L1055 VanDerWaalsContact O-N 3.13Å; L1055-Q1057 PolarHBondContact O-N 2.83Å
1056	P	55.3	Low	57.5	Low	54 Å²	54	104.6 Å²	104.6	35%	0.351	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-60.3	116.8	-173	24.5	-34.2	0	0	0	108.7	E1058 V1059 K1069	P1056-E1058 VanDerWaalsContact C-N 3.26Å; P1056-E1058 PolarHBondContact O-N 3.38Å; P1056-V1059 HydrophobicContact CB-CG2 3.81Å; P1056-V1059 HydrophobicContact CG-CG2 3.79Å; P1056-K1069 HydrophobicContact CB-CB 4.36Å; P1056-K1069 HydrophobicContact CB-CD 4.25Å
1057	Q	61.3	Low	60.5	Low	136 Å²	136	101.1 Å²	101.1	64%	0.636	57%	0.567	S	S	*	*	S	Bend	trans	-64.7	-37.3	-168.9	-172.6	170.7	-3.3	0	0	110.6	L1055 V1070	L1055-Q1057 PolarHBondContact O-N 2.83Å; Q1057-V1070 PolarHBondContact N-O 3.08Å; Q1057-V1070 VanDerWaalsContact N-O 3.08Å
1058	E	71.9	Confident	63.7	Low	120 Å²	120	96 Å²	96	56%	0.561	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	144	167.9	-62.5	-169.8	163.9	0	0	111.1	P1056 K1069 V1070	P1056-E1058 VanDerWaalsContact C-N 3.26Å; P1056-E1058 PolarHBondContact O-N 3.38Å; E1058-K1069 WeakPolarHBondContact O-CA 3.39Å; E1058-V1070 PolarHBondContact O-N 3.17Å
1059	V	84.6	Confident	66.9	Low	74 Å²	74	94.8 Å²	94.8	45%	0.448	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	93.9	174.4	-176.6	0	0	0	0	108.7	P1056 T1061 V1067 E1068 K1069	P1056-V1059 HydrophobicContact CB-CG2 3.81Å; P1056-V1059 HydrophobicContact CG-CG2 3.79Å; V1059-T1061 PolarHBondContact O-N 3.44Å; V1059-V1067 HydrophobicContact CG1-CG1 3.72Å; V1059-E1068 CarbonylContact C-O 3.48Å; V1059-K1069 HydrophobicContact CG1-CG 4.34Å; V1059-K1069 HydrophobicContact CG2-CG 4.26Å
1060	I	85.3	Confident	70	Confident	67 Å²	67	89.8 Å²	89.8	34%	0.344	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.7	-179.4	-55.4	173.2	0	0	0	108.1	E1068	I1060-E1068 HydrophobicContact CB-CB 4.36Å; I1060-E1068 PolarHBondContact N-O 2.89Å; I1060-E1068 PolarHBondContact O-N 2.84Å
1061	T	85.5	Confident	72.9	Confident	99 Å²	99	85.4 Å²	85.4	61%	0.607	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	113.2	172.2	-55.9	0	0	0	0	108.8	V1059 V1067	V1059-T1061 PolarHBondContact O-N 3.44Å; T1061-V1067 HydrophobicContact CG2-CG2 4.38Å
1062	H	85.9	Confident	75.1	Confident	54 Å²	54	81.2 Å²	81.2	25%	0.25	46%	0.457	C	S	.	.			trans	-82.7	153.3	180	-65.6	-89.7	0	0	0	110.6	D1064 G1065 K1066 E1068	H1062-D1064 WeakPolarHBondContact CB-OD1 3.28Å; H1062-D1064 PolarHBondContact O-N 3.37Å; H1062-G1065 PolarHBondContact O-N 3.47Å; H1062-K1066 HydrophobicContact CB-CB 4.18Å; H1062-K1066 WeakPolarHBondContact CB-O 3.41Å; H1062-K1066 PolarHBondContact CD2-NZ 3.38Å; H1062-K1066 PolarHBondContact N-O 2.94Å; H1062-K1066 PolarHBondContact NE2-NZ 2.77Å; H1062-K1066 VanDerWaalsContact NE2-NZ 3.1Å; H1062-E1068 IonicContact CD2-OE2 3.64Å; H1062-E1068 IonicContact CE1-OE2 3.37Å; H1062-E1068 IonicContact NE2-OE2 3.19Å; H1062-E1068 PolarHBondContact NE2-OE2 3.45Å
1063	P	78.5	Confident	77.4	Confident	145 Å²	145	76.9 Å²	76.9	94%	0.942	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-10.8	-174.1	28.5	-36.5	0	0	0	114.7	G1065	P1063-G1065 VanDerWaalsContact C-N 3.28Å
1064	D	83.7	Confident	79.4	Confident	103 Å²	103	72.7 Å²	72.7	55%	0.551	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-4.4	170.2	65.2	-13.7	0	0	0	113.2	H1062 K1066	H1062-D1064 WeakPolarHBondContact CB-OD1 3.28Å; H1062-D1064 PolarHBondContact O-N 3.37Å; D1064-K1066 WeakPolarHBondContact OD1-CB 3.44Å; D1064-K1066 PolarHBondContact OD1-N 3.02Å
1065	G	83.9	Confident	81.4	Confident	40 Å²	40	72 Å²	72	41%	0.412	42%	0.423	S	S	.	.	S	Bend	trans	87.2	2.1	-175.7	0	0	0	0	0	114.7	H1062 P1063	H1062-G1065 PolarHBondContact O-N 3.47Å; P1063-G1065 VanDerWaalsContact C-N 3.28Å
1066	K	91.7	Very high	83.4	Confident	33 Å²	33	70.7 Å²	70.7	14%	0.143	41%	0.408	C	S	.	.			trans	-68.3	131.6	170.5	173.2	-163.7	159.5	-136.9	0	109.4	H1062 D1064 E1068 I1078 F1080	H1062-K1066 HydrophobicContact CB-CB 4.18Å; H1062-K1066 WeakPolarHBondContact CB-O 3.41Å; H1062-K1066 PolarHBondContact CD2-NZ 3.38Å; H1062-K1066 PolarHBondContact N-O 2.94Å; H1062-K1066 PolarHBondContact NE2-NZ 2.77Å; H1062-K1066 VanDerWaalsContact NE2-NZ 3.1Å; D1064-K1066 WeakPolarHBondContact OD1-CB 3.44Å; D1064-K1066 PolarHBondContact OD1-N 3.02Å; K1066-E1068 WeakPolarHBondContact CE-OE2 3.49Å; K1066-E1068 IonicContact NZ-OE2 2.92Å; K1066-E1068 PolarHBondContact NZ-OE2 2.88Å; K1066-I1078 HydrophobicContact CD-CG2 3.99Å; K1066-I1078 VanDerWaalsContact CE-CG2 3.42Å; K1066-I1078 HydrophobicContact CG-CG2 3.76Å; K1066-F1080 HydrophobicContact CD-CE1 4.25Å; K1066-F1080 HydrophobicContact CG-CD1 4.31Å; K1066-F1080 HydrophobicContact CG-CE1 4.32Å
1067	V	91.6	Very high	85.2	Confident	42 Å²	42	69.3 Å²	69.3	26%	0.255	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.1	174.9	-179.3	0	0	0	0	108.7	V1059 T1061 K1069 V1079	V1059-V1067 HydrophobicContact CG1-CG1 3.72Å; T1061-V1067 HydrophobicContact CG2-CG2 4.38Å; V1067-K1069 HydrophobicContact CG1-CG 4.46Å; V1067-V1079 PolarHBondContact N-O 3.17Å; V1067-V1079 PolarHBondContact O-N 3.18Å
1068	E	91.4	Very high	86.8	Confident	19 Å²	19	63.8 Å²	63.8	9%	0.089	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.6	177.7	-179.9	168.6	174.2	0	0	109	V1059 I1060 H1062 K1066 R1076 I1078	V1059-E1068 CarbonylContact C-O 3.48Å; I1060-E1068 HydrophobicContact CB-CB 4.36Å; I1060-E1068 PolarHBondContact N-O 2.89Å; I1060-E1068 PolarHBondContact O-N 2.84Å; H1062-E1068 IonicContact CD2-OE2 3.64Å; H1062-E1068 IonicContact CE1-OE2 3.37Å; H1062-E1068 IonicContact NE2-OE2 3.19Å; H1062-E1068 PolarHBondContact NE2-OE2 3.45Å; K1066-E1068 WeakPolarHBondContact CE-OE2 3.49Å; K1066-E1068 IonicContact NZ-OE2 2.92Å; K1066-E1068 PolarHBondContact NZ-OE2 2.88Å; E1068-R1076 IonicContact OE1-NH1 2.67Å; E1068-I1078 HydrophobicContact CB-CG1 4.21Å; E1068-I1078 HydrophobicContact CG-CG1 3.86Å
1069	K	91.3	Very high	87.8	Confident	83 Å²	83	59.7 Å²	59.7	36%	0.361	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.6	176.5	-58.9	-172.6	176.3	-172.8	0	109.5	P1056 E1058 V1059 V1067 R1076 V1077	P1056-K1069 HydrophobicContact CB-CB 4.36Å; P1056-K1069 HydrophobicContact CB-CD 4.25Å; E1058-K1069 WeakPolarHBondContact O-CA 3.39Å; V1059-K1069 HydrophobicContact CG1-CG 4.34Å; V1059-K1069 HydrophobicContact CG2-CG 4.26Å; V1067-K1069 HydrophobicContact CG1-CG 4.46Å; K1069-R1076 WeakPolarHBondContact O-CA 3.45Å; K1069-V1077 HydrophobicContact CB-CB 4.44Å; K1069-V1077 PolarHBondContact N-O 2.89Å; K1069-V1077 PolarHBondContact O-N 2.62Å
1070	V	90.6	Very high	88.3	Confident	28 Å²	28	59.6 Å²	59.6	17%	0.17	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.9	170.4	-172.6	0	0	0	0	108.2	Q1057 E1058	Q1057-V1070 PolarHBondContact N-O 3.08Å; Q1057-V1070 VanDerWaalsContact N-O 3.08Å; E1058-V1070 PolarHBondContact O-N 3.17Å
1071	L	88.9	Confident	88.6	Confident	56 Å²	56	61.1 Å²	61.1	29%	0.293	36%	0.364	S	S	.	.			trans	-84.1	158.4	174.8	-66.1	169.2	0	0	0	109.8	G1073 G1074 D1075 V1077	L1071-G1073 PolarHBondContact O-N 3.34Å; L1071-G1074 PolarHBondContact O-N 3.01Å; L1071-D1075 HydrophobicContact CB-CB 4.34Å; L1071-D1075 HydrophobicContact CD1-CB 4.05Å; L1071-D1075 PolarHBondContact N-O 3.12Å; L1071-V1077 HydrophobicContact CD1-CG2 3.79Å; L1071-V1077 HydrophobicContact CG-CG2 4.29Å
1072	A	81.8	Confident	88.9	Confident	59 Å²	59	60.7 Å²	60.7	49%	0.488	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.1	-175.6	0	0	0	0	0	113.7	G1074	A1072-G1074 VanDerWaalsContact C-N 3.26Å; A1072-G1074 PolarHBondContact O-N 2.82Å
1073	G	81.8	Confident	89.1	Confident	54 Å²	54	60 Å²	60	56%	0.557	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-6.4	169.5	0	0	0	0	0	115.3	L1071 A1090	L1071-G1073 PolarHBondContact O-N 3.34Å; G1073-A1090 WeakPolarHBondContact O-CB 3.34Å
1074	G	85.4	Confident	89.8	Confident	28 Å²	28	53.6 Å²	53.6	29%	0.289	32%	0.324	S	S	.	.	S	Bend	trans	92.5	-11.1	-175	0	0	0	0	0	114.6	L1071 A1072	L1071-G1074 PolarHBondContact O-N 3.01Å; A1072-G1074 VanDerWaalsContact C-N 3.26Å; A1072-G1074 PolarHBondContact O-N 2.82Å
1075	D	89.8	Confident	90.3	Very high	62 Å²	62	54.5 Å²	54.5	33%	0.332	32%	0.319	S	S	.	.			trans	-62.3	149.3	175.5	-55.1	-46	0	0	0	111.7	L1071 V1088 S1089 A1090	L1071-D1075 HydrophobicContact CB-CB 4.34Å; L1071-D1075 HydrophobicContact CD1-CB 4.05Å; L1071-D1075 PolarHBondContact N-O 3.12Å; D1075-V1088 WeakPolarHBondContact CA-O 3.49Å; D1075-S1089 VanDerWaalsContact OD1-CA 3.22Å; D1075-S1089 WeakPolarHBondContact OD1-CA 3.29Å; D1075-A1090 PolarHBondContact OD1-N 2.82Å
1076	R	91.5	Very high	90.9	Very high	129 Å²	129	56.1 Å²	56.1	49%	0.487	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.7	-173	-53.7	-170.2	-169.5	-161.1	4.9	112	E1068 K1069 E1087 V1088	E1068-R1076 IonicContact OE1-NH1 2.67Å; K1069-R1076 WeakPolarHBondContact O-CA 3.45Å; R1076-E1087 CarbonylContact O-C 3.55Å; R1076-E1087 WeakPolarHBondContact O-CA 3.4Å; R1076-V1088 PolarHBondContact N-O 3.27Å; R1076-V1088 PolarHBondContact O-N 3.39Å
1077	V	93.9	Very high	91.1	Very high	25 Å²	25	57.9 Å²	57.9	15%	0.152	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102.8	176.7	-173.9	0	0	0	0	109.3	K1069 L1071 V1079 E1087	K1069-V1077 HydrophobicContact CB-CB 4.44Å; K1069-V1077 PolarHBondContact N-O 2.89Å; K1069-V1077 PolarHBondContact O-N 2.62Å; L1071-V1077 HydrophobicContact CD1-CG2 3.79Å; L1071-V1077 HydrophobicContact CG-CG2 4.29Å; V1077-V1079 HydrophobicContact CG1-CG2 4.35Å; V1077-E1087 HydrophobicContact CG1-CG 4.24Å; V1077-E1087 HydrophobicContact CG2-CG 3.96Å
1078	I	93.4	Very high	91.2	Very high	19 Å²	19	57.4 Å²	57.4	10%	0.097	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.8	175.3	-64.9	166.4	0	0	0	109	K1066 E1068 F1080 R1085 K1086	K1066-I1078 HydrophobicContact CD-CG2 3.99Å; K1066-I1078 VanDerWaalsContact CE-CG2 3.42Å; K1066-I1078 HydrophobicContact CG-CG2 3.76Å; E1068-I1078 HydrophobicContact CB-CG1 4.21Å; E1068-I1078 HydrophobicContact CG-CG1 3.86Å; I1078-F1080 HydrophobicContact CG2-CD2 4.07Å; I1078-F1080 HydrophobicContact CG2-CE1 4.12Å; I1078-F1080 HydrophobicContact CG2-CE2 3.59Å; I1078-F1080 HydrophobicContact CG2-CZ 3.63Å; I1078-R1085 CarbonylContact O-C 3.57Å; I1078-R1085 VanDerWaalsContact O-CA 3.31Å; I1078-R1085 WeakPolarHBondContact O-CA 3.21Å; I1078-K1086 HydrophobicContact CB-CB 4.27Å; I1078-K1086 PolarHBondContact N-O 2.94Å; I1078-K1086 PolarHBondContact O-N 2.82Å
1079	V	94.3	Very high	91.3	Very high	34 Å²	34	57.6 Å²	57.6	21%	0.206	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.2	173.5	-172.6	0	0	0	0	108.8	V1067 V1077 R1085	V1067-V1079 PolarHBondContact N-O 3.17Å; V1067-V1079 PolarHBondContact O-N 3.18Å; V1077-V1079 HydrophobicContact CG1-CG2 4.35Å; V1079-R1085 HydrophobicContact CG2-CG 4.45Å
1080	F	93.9	Very high	91.3	Very high	73 Å²	73	56.6 Å²	56.6	32%	0.32	33%	0.331	S	S	.	.			trans	-91.8	155.1	179.4	-65.9	-83.7	0	0	0	111.5	K1066 I1078 N1082 G1083 T1084 K1086	K1066-F1080 HydrophobicContact CD-CE1 4.25Å; K1066-F1080 HydrophobicContact CG-CD1 4.31Å; K1066-F1080 HydrophobicContact CG-CE1 4.32Å; I1078-F1080 HydrophobicContact CG2-CD2 4.07Å; I1078-F1080 HydrophobicContact CG2-CE1 4.12Å; I1078-F1080 HydrophobicContact CG2-CE2 3.59Å; I1078-F1080 HydrophobicContact CG2-CZ 3.63Å; F1080-N1082 VanDerWaalsContact CB-OD1 3.27Å; F1080-N1082 WeakPolarHBondContact CB-OD1 3.33Å; F1080-N1082 PolarHBondContact O-N 2.68Å; F1080-G1083 PolarHBondContact O-N 2.94Å; F1080-T1084 HydrophobicContact CD2-CG2 3.98Å; F1080-T1084 HydrophobicContact CE2-CG2 4.48Å; F1080-T1084 PolarHBondContact N-O 3.18Å; F1080-K1086 HydrophobicContact CE2-CB 4.22Å
1081	P	92.2	Very high	91.3	Very high	98 Å²	98	60.1 Å²	60.1	64%	0.636	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.1	179.4	-28.1	35	0	0	0	115.7	G1083	P1081-G1083 VanDerWaalsContact C-N 3.27Å; P1081-G1083 PolarHBondContact O-N 2.86Å
1082	N	91.6	Very high	91.3	Very high	90 Å²	90	59.9 Å²	59.9	48%	0.481	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.1	177.3	70.4	-14.5	0	0	0	113.9	F1080 T1084 F1100	F1080-N1082 VanDerWaalsContact CB-OD1 3.27Å; F1080-N1082 WeakPolarHBondContact CB-OD1 3.33Å; F1080-N1082 PolarHBondContact O-N 2.68Å; N1082-T1084 PolarHBondContact ND2-OG1 2.81Å; N1082-T1084 VanDerWaalsContact ND2-OG1 3.17Å; N1082-T1084 VanDerWaalsContact OD1-CB 3.23Å; N1082-T1084 WeakPolarHBondContact OD1-CB 3.21Å; N1082-T1084 PolarHBondContact OD1-N 3.44Å; N1082-T1084 PolarHBondContact OD1-OG1 3.15Å; N1082-F1100 VanDerWaalsContact O-CB 3.3Å; N1082-F1100 WeakPolarHBondContact O-CB 3.47Å
1083	G	89.9	Confident	91.7	Very high	41 Å²	41	62 Å²	62	42%	0.423	36%	0.364	S	S	.	.	S	Bend	trans	88.8	-6.1	-176.9	0	0	0	0	0	115.2	F1080 P1081	F1080-G1083 PolarHBondContact O-N 2.94Å; P1081-G1083 VanDerWaalsContact C-N 3.27Å; P1081-G1083 PolarHBondContact O-N 2.86Å
1084	T	93.8	Very high	92.2	Very high	9 Å²	9	61.6 Å²	61.6	6%	0.055	35%	0.352	C	S	.	.			trans	-61.9	139.8	170.8	-65	0	0	0	0	110.1	F1080 N1082 V1097 T1098 F1099	F1080-T1084 HydrophobicContact CD2-CG2 3.98Å; F1080-T1084 HydrophobicContact CE2-CG2 4.48Å; F1080-T1084 PolarHBondContact N-O 3.18Å; N1082-T1084 PolarHBondContact ND2-OG1 2.81Å; N1082-T1084 VanDerWaalsContact ND2-OG1 3.17Å; N1082-T1084 VanDerWaalsContact OD1-CB 3.23Å; N1082-T1084 WeakPolarHBondContact OD1-CB 3.21Å; N1082-T1084 PolarHBondContact OD1-N 3.44Å; N1082-T1084 PolarHBondContact OD1-OG1 3.15Å; T1084-V1097 HydrophobicContact CG2-CG1 3.99Å; T1084-T1098 CarbonylContact C-O 3.47Å; T1084-T1098 WeakPolarHBondContact CA-O 3.21Å; T1084-F1099 HydrophobicContact CG2-CD1 4.11Å
1085	R	94.4	Very high	92.7	Very high	122 Å²	122	60.9 Å²	60.9	46%	0.46	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	144.3	175.3	-58.7	172.2	-173.8	-93.8	-5.5	109.1	I1078 V1079 V1097 T1098	I1078-R1085 CarbonylContact O-C 3.57Å; I1078-R1085 VanDerWaalsContact O-CA 3.31Å; I1078-R1085 WeakPolarHBondContact O-CA 3.21Å; V1079-R1085 HydrophobicContact CG2-CG 4.45Å; R1085-V1097 CarbonylContact O-C 3.54Å; R1085-V1097 VanDerWaalsContact O-CA 3.31Å; R1085-V1097 WeakPolarHBondContact O-CA 3.28Å; R1085-T1098 PolarHBondContact N-O 2.78Å; R1085-T1098 PolarHBondContact O-N 3.2Å
1086	K	95.8	Very high	93	Very high	75 Å²	75	60.6 Å²	60.6	33%	0.326	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	106.8	169.7	170.6	171.8	176.8	179.7	0	108.2	I1078 F1080 V1088 K1096 V1097	I1078-K1086 HydrophobicContact CB-CB 4.27Å; I1078-K1086 PolarHBondContact N-O 2.94Å; I1078-K1086 PolarHBondContact O-N 2.82Å; F1080-K1086 HydrophobicContact CE2-CB 4.22Å; K1086-V1088 HydrophobicContact CD-CG2 4.2Å; K1086-V1088 HydrophobicContact CG-CG2 3.89Å; K1086-K1096 WeakPolarHBondContact CA-O 3.46Å; K1086-V1097 HydrophobicContact CB-CG2 4.12Å; K1086-V1097 HydrophobicContact CD-CG2 4.06Å; K1086-V1097 HydrophobicContact CG-CG2 3.92Å
1087	E	94.8	Very high	93.2	Very high	70 Å²	70	55.6 Å²	55.6	33%	0.327	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	143.5	163.9	-70.6	116.6	-134.7	0	0	109.6	R1076 V1077 A1095 K1096	R1076-E1087 CarbonylContact O-C 3.55Å; R1076-E1087 WeakPolarHBondContact O-CA 3.4Å; V1077-E1087 HydrophobicContact CG1-CG 4.24Å; V1077-E1087 HydrophobicContact CG2-CG 3.96Å; E1087-A1095 CarbonylContact O-C 3.54Å; E1087-A1095 VanDerWaalsContact O-CA 3.23Å; E1087-A1095 WeakPolarHBondContact O-CA 3.41Å; E1087-K1096 HydrophobicContact CB-CB 4.37Å; E1087-K1096 PolarHBondContact N-O 2.88Å; E1087-K1096 PolarHBondContact O-N 3.11Å
1088	V	95.1	Very high	93.4	Very high	31 Å²	31	56.5 Å²	56.5	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	131	175.2	-170.9	0	0	0	0	107.8	D1075 R1076 K1086 A1095	D1075-V1088 WeakPolarHBondContact CA-O 3.49Å; R1076-V1088 PolarHBondContact N-O 3.27Å; R1076-V1088 PolarHBondContact O-N 3.39Å; K1086-V1088 HydrophobicContact CD-CG2 4.2Å; K1086-V1088 HydrophobicContact CG-CG2 3.89Å; V1088-A1095 HydrophobicContact CG2-CB 4.25Å
1089	S	93.3	Very high	93.6	Very high	23 Å²	23	58.3 Å²	58.3	16%	0.161	34%	0.336	C	S	.	.			trans	-68.5	156	177.1	48.6	0	0	0	0	112	D1075 D1091 G1092 S1094	D1075-S1089 VanDerWaalsContact OD1-CA 3.22Å; D1075-S1089 WeakPolarHBondContact OD1-CA 3.29Å; S1089-D1091 VanDerWaalsContact CB-OD1 3.27Å; S1089-D1091 WeakPolarHBondContact CB-OD1 3.49Å; S1089-D1091 PolarHBondContact O-N 3.22Å; S1089-D1091 VanDerWaalsContact O-N 3.15Å; S1089-D1091 PolarHBondContact OG-OD1 2.82Å; S1089-G1092 PolarHBondContact O-N 3.18Å; S1089-S1094 VanDerWaalsContact CB-OG 3.3Å; S1089-S1094 WeakPolarHBondContact CB-OG 3.4Å; S1089-S1094 PolarHBondContact N-O 3.49Å; S1089-S1094 PolarHBondContact OG-N 3.13Å; S1089-S1094 VanDerWaalsContact OG-N 3.08Å; S1089-S1094 PolarHBondContact OG-O 2.88Å; S1089-S1094 PolarHBondContact OG-OG 3.01Å
1090	A	91.3	Very high	93.6	Very high	62 Å²	62	63.7 Å²	63.7	51%	0.512	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.1	-178.5	0	0	0	0	0	114	G1073 D1075	G1073-A1090 WeakPolarHBondContact O-CB 3.34Å; D1075-A1090 PolarHBondContact OD1-N 2.82Å
1091	D	90.4	Very high	93.6	Very high	102 Å²	102	63.7 Å²	63.7	55%	0.545	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.6	175.5	64.2	3.6	0	0	0	114.1	S1089 L1093	S1089-D1091 VanDerWaalsContact CB-OD1 3.27Å; S1089-D1091 WeakPolarHBondContact CB-OD1 3.49Å; S1089-D1091 PolarHBondContact O-N 3.22Å; S1089-D1091 VanDerWaalsContact O-N 3.15Å; S1089-D1091 PolarHBondContact OG-OD1 2.82Å; D1091-L1093 HydrophobicContact CB-CD1 4.39Å; D1091-L1093 HydrophobicContact CB-CG 4.1Å; D1091-L1093 PolarHBondContact O-N 3.18Å; D1091-L1093 PolarHBondContact OD1-N 3.39Å
1092	G	88.1	Confident	93.6	Very high	52 Å²	52	60.8 Å²	60.8	54%	0.536	35%	0.348	S	S	.	.	S	Bend	trans	70.2	2.3	-173.6	0	0	0	0	0	115.6	S1089	S1089-G1092 PolarHBondContact O-N 3.18Å
1093	L	90.1	Very high	93.9	Very high	104 Å²	104	57 Å²	57	55%	0.545	33%	0.328	S	S	.	.	S	Bend	trans	-79.8	-22.7	-176.3	-60.5	-178	0	0	0	112.9	D1091 A1109	D1091-L1093 HydrophobicContact CB-CD1 4.39Å; D1091-L1093 HydrophobicContact CB-CG 4.1Å; D1091-L1093 PolarHBondContact O-N 3.18Å; D1091-L1093 PolarHBondContact OD1-N 3.39Å; L1093-A1109 HydrophobicContact CB-CB 3.96Å
1094	S	92.9	Very high	94.3	Very high	45 Å²	45	56.6 Å²	56.6	32%	0.315	32%	0.317	S	S	.	.			trans	-125	148.4	175.5	81.1	0	0	0	0	112.4	S1089 I1107	S1089-S1094 VanDerWaalsContact CB-OG 3.3Å; S1089-S1094 WeakPolarHBondContact CB-OG 3.4Å; S1089-S1094 PolarHBondContact N-O 3.49Å; S1089-S1094 PolarHBondContact OG-N 3.13Å; S1089-S1094 VanDerWaalsContact OG-N 3.08Å; S1089-S1094 PolarHBondContact OG-O 2.88Å; S1089-S1094 PolarHBondContact OG-OG 3.01Å; S1094-I1107 VanDerWaalsContact CA-O 3.27Å; S1094-I1107 WeakPolarHBondContact CA-O 3.37Å; S1094-I1107 WeakPolarHBondContact CB-O 3.4Å
1095	A	95.1	Very high	94.4	Very high	12 Å²	12	59.7 Å²	59.7	10%	0.099	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	127.5	176.3	0	0	0	0	0	111.8	E1087 V1088 Q1106 I1107	E1087-A1095 CarbonylContact O-C 3.54Å; E1087-A1095 VanDerWaalsContact O-CA 3.23Å; E1087-A1095 WeakPolarHBondContact O-CA 3.41Å; V1088-A1095 HydrophobicContact CG2-CB 4.25Å; A1095-Q1106 CarbonylContact O-C 3.58Å; A1095-Q1106 WeakPolarHBondContact O-CA 3.36Å; A1095-I1107 PolarHBondContact N-O 3.34Å; A1095-I1107 PolarHBondContact O-N 2.95Å
1096	K	96.3	Very high	94.6	Very high	56 Å²	56	55.8 Å²	55.8	24%	0.243	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	110.4	-178.7	-161.5	163.8	-174.6	148.4	0	109	E1046 K1086 E1087 Q1106	E1046-K1096 IonicContact OE1-NZ 3.64Å; E1046-K1096 PolarHBondContact OE1-NZ 3.02Å; E1046-K1096 IonicContact OE2-NZ 3.49Å; E1046-K1096 PolarHBondContact OE2-NZ 3.43Å; K1086-K1096 WeakPolarHBondContact CA-O 3.46Å; E1087-K1096 HydrophobicContact CB-CB 4.37Å; E1087-K1096 PolarHBondContact N-O 2.88Å; E1087-K1096 PolarHBondContact O-N 3.11Å; K1096-Q1106 HydrophobicContact CG-CB 4.35Å; K1096-Q1106 HydrophobicContact CG-CG 4.4Å
1097	V	97.4	Very high	94.6	Very high	25 Å²	25	55.3 Å²	55.3	15%	0.152	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.7	179.4	-175.3	0	0	0	0	109	T1084 R1085 K1086 F1099 T1104 K1105	T1084-V1097 HydrophobicContact CG2-CG1 3.99Å; R1085-V1097 CarbonylContact O-C 3.54Å; R1085-V1097 VanDerWaalsContact O-CA 3.31Å; R1085-V1097 WeakPolarHBondContact O-CA 3.28Å; K1086-V1097 HydrophobicContact CB-CG2 4.12Å; K1086-V1097 HydrophobicContact CD-CG2 4.06Å; K1086-V1097 HydrophobicContact CG-CG2 3.92Å; V1097-F1099 HydrophobicContact CB-CE2 4.4Å; V1097-F1099 HydrophobicContact CB-CZ 4.34Å; V1097-F1099 HydrophobicContact CG1-CD1 4.18Å; V1097-F1099 HydrophobicContact CG1-CD2 4.4Å; V1097-F1099 HydrophobicContact CG1-CE1 3.76Å; V1097-F1099 HydrophobicContact CG1-CE2 4.01Å; V1097-F1099 HydrophobicContact CG1-CG 4.49Å; V1097-F1099 HydrophobicContact CG1-CZ 3.66Å; V1097-T1104 CarbonylContact O-C 3.57Å; V1097-T1104 VanDerWaalsContact O-CA 3.23Å; V1097-T1104 WeakPolarHBondContact O-CA 3.41Å; V1097-K1105 HydrophobicContact CB-CB 4.38Å; V1097-K1105 PolarHBondContact N-O 3.37Å; V1097-K1105 PolarHBondContact O-N 3.25Å
1098	T	97.4	Very high	94.6	Very high	44 Å²	44	53.3 Å²	53.3	27%	0.27	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.9	175.3	-60.6	0	0	0	0	108.7	T1084 R1085 T1104	T1084-T1098 CarbonylContact C-O 3.47Å; T1084-T1098 WeakPolarHBondContact CA-O 3.21Å; R1085-T1098 PolarHBondContact N-O 2.78Å; R1085-T1098 PolarHBondContact O-N 3.2Å; T1098-T1104 HydrophobicContact CG2-CG2 4.25Å
1099	F	96.3	Very high	94.5	Very high	57 Å²	57	55 Å²	55	25%	0.25	33%	0.327	C	S	.	.			trans	-80.6	158.4	-176.6	-62.8	-81.3	0	0	0	112.3	T1084 V1097 N1101 G1102 D1103 K1105 Y1115	T1084-F1099 HydrophobicContact CG2-CD1 4.11Å; V1097-F1099 HydrophobicContact CB-CE2 4.4Å; V1097-F1099 HydrophobicContact CB-CZ 4.34Å; V1097-F1099 HydrophobicContact CG1-CD1 4.18Å; V1097-F1099 HydrophobicContact CG1-CD2 4.4Å; V1097-F1099 HydrophobicContact CG1-CE1 3.76Å; V1097-F1099 HydrophobicContact CG1-CE2 4.01Å; V1097-F1099 HydrophobicContact CG1-CG 4.49Å; V1097-F1099 HydrophobicContact CG1-CZ 3.66Å; F1099-N1101 WeakPolarHBondContact CB-OD1 3.33Å; F1099-N1101 PolarHBondContact O-N 3.13Å; F1099-N1101 VanDerWaalsContact O-N 3.13Å; F1099-G1102 PolarHBondContact O-N 2.68Å; F1099-D1103 HydrophobicContact CB-CB 4.29Å; F1099-D1103 HydrophobicContact CD2-CB 3.96Å; F1099-D1103 WeakPolarHBondContact CD2-O 3.24Å; F1099-D1103 PolarHBondContact N-O 3.45Å; F1099-K1105 HydrophobicContact CE2-CB 3.81Å; F1099-K1105 HydrophobicContact CZ-CB 4.39Å; F1099-Y1115 AromaticContact CE2-CE2 3.79Å; F1099-Y1115 HydrophobicContact CE2-CE2 3.79Å; F1099-Y1115 HydrophobicContact CZ-CE2 4.47Å
1100	F	94.8	Very high	94.4	Very high	147 Å²	147	57.5 Å²	57.5	65%	0.645	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.2	-177.8	67	-92.8	0	0	0	114.5	N1082	N1082-F1100 VanDerWaalsContact O-CB 3.3Å; N1082-F1100 WeakPolarHBondContact O-CB 3.47Å
1101	N	93.8	Very high	94.5	Very high	72 Å²	72	61.7 Å²	61.7	39%	0.385	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	2	174.3	64.8	-45	0	0	0	113.5	F1099 D1103	F1099-N1101 WeakPolarHBondContact CB-OD1 3.33Å; F1099-N1101 PolarHBondContact O-N 3.13Å; F1099-N1101 VanDerWaalsContact O-N 3.13Å; N1101-D1103 PolarHBondContact ND2-OD1 2.86Å; N1101-D1103 PolarHBondContact ND2-OD2 3.37Å
1102	G	93.2	Very high	94.7	Very high	37 Å²	37	61 Å²	61	38%	0.381	34%	0.337	S	S	.	.	S	Bend	trans	93.9	-15.6	-179.4	0	0	0	0	0	114.7	F1099 A1118	F1099-G1102 PolarHBondContact O-N 2.68Å; G1102-A1118 VanDerWaalsContact C-CB 3.4Å; G1102-A1118 WeakPolarHBondContact O-CB 3.47Å
1103	D	98	Very high	95.1	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.064	32%	0.322	C	S	.	.			trans	-57.4	148.8	173.6	-68.3	-5.4	0	0	0	111	F1099 N1101 Y1115 Y1116 Y1117 A1118	F1099-D1103 HydrophobicContact CB-CB 4.29Å; F1099-D1103 HydrophobicContact CD2-CB 3.96Å; F1099-D1103 WeakPolarHBondContact CD2-O 3.24Å; F1099-D1103 PolarHBondContact N-O 3.45Å; N1101-D1103 PolarHBondContact ND2-OD1 2.86Å; N1101-D1103 PolarHBondContact ND2-OD2 3.37Å; D1103-Y1115 HydrophobicContact CB-CE1 3.76Å; D1103-Y1115 WeakPolarHBondContact CB-OH 3.45Å; D1103-Y1115 PolarHBondContact OD2-OH 2.88Å; D1103-Y1116 CarbonylContact C-O 3.48Å; D1103-Y1116 WeakPolarHBondContact CA-O 3.36Å; D1103-Y1116 WeakPolarHBondContact CB-O 3.35Å; D1103-Y1117 WeakPolarHBondContact OD1-CA 3.46Å; D1103-A1118 PolarHBondContact OD1-N 3.44Å
1104	T	97.1	Very high	95.5	Very high	31 Å²	31	57.5 Å²	57.5	19%	0.19	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.7	170.6	72.5	0	0	0	0	111.5	V1097 T1098 Y1115 Y1116	V1097-T1104 CarbonylContact O-C 3.57Å; V1097-T1104 VanDerWaalsContact O-CA 3.23Å; V1097-T1104 WeakPolarHBondContact O-CA 3.41Å; T1098-T1104 HydrophobicContact CG2-CG2 4.25Å; T1104-Y1115 CarbonylContact O-C 3.57Å; T1104-Y1115 WeakPolarHBondContact O-CA 3.4Å; T1104-Y1116 PolarHBondContact N-O 3.19Å; T1104-Y1116 PolarHBondContact O-N 2.85Å
1105	K	97.6	Very high	95.8	Very high	75 Å²	75	57.6 Å²	57.6	33%	0.326	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	107.6	170.3	178.6	178.5	179.9	167.3	0	109.1	V1097 F1099 V1113 I1114 Y1115	V1097-K1105 HydrophobicContact CB-CB 4.38Å; V1097-K1105 PolarHBondContact N-O 3.37Å; V1097-K1105 PolarHBondContact O-N 3.25Å; F1099-K1105 HydrophobicContact CE2-CB 3.81Å; F1099-K1105 HydrophobicContact CZ-CB 4.39Å; K1105-V1113 HydrophobicContact CD-CG1 4.34Å; K1105-V1113 HydrophobicContact CG-CG1 4.17Å; K1105-I1114 CarbonylContact C-O 3.44Å; K1105-I1114 WeakPolarHBondContact CA-O 3.43Å; K1105-Y1115 HydrophobicContact CB-CD2 3.75Å; K1105-Y1115 HydrophobicContact CB-CE2 4.06Å; K1105-Y1115 HydrophobicContact CD-CD2 4.13Å; K1105-Y1115 HydrophobicContact CG-CD2 4.03Å
1106	Q	97.1	Very high	95.9	Very high	39 Å²	39	60.9 Å²	60.9	18%	0.182	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.2	177.5	-174.6	163.1	-22.1	0	0	109.2	E1046 A1095 K1096 T1108 I1114	E1046-Q1106 PolarHBondContact OE1-NE2 3.44Å; E1046-Q1106 PolarHBondContact OE1-OE1 2.92Å; A1095-Q1106 CarbonylContact O-C 3.58Å; A1095-Q1106 WeakPolarHBondContact O-CA 3.36Å; K1096-Q1106 HydrophobicContact CG-CB 4.35Å; K1096-Q1106 HydrophobicContact CG-CG 4.4Å; Q1106-T1108 HydrophobicContact CG-CG2 4.24Å; Q1106-I1114 HydrophobicContact CB-CB 4.38Å; Q1106-I1114 PolarHBondContact N-O 2.84Å; Q1106-I1114 PolarHBondContact O-N 3.49Å
1107	I	95.8	Very high	96	Very high	66 Å²	66	62.4 Å²	62.4	34%	0.338	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.1	167.2	-55.6	177.8	0	0	0	106.1	S1094 A1095 V1113	S1094-I1107 VanDerWaalsContact CA-O 3.27Å; S1094-I1107 WeakPolarHBondContact CA-O 3.37Å; S1094-I1107 WeakPolarHBondContact CB-O 3.4Å; A1095-I1107 PolarHBondContact N-O 3.34Å; A1095-I1107 PolarHBondContact O-N 2.95Å; I1107-V1113 HydrophobicContact CG1-CG2 4.46Å
1108	T	94.6	Very high	95.9	Very high	28 Å²	28	62.7 Å²	62.7	17%	0.172	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-100.6	159.9	-179.1	49.7	0	0	0	0	111.4	Q1106 D1110 Q1111 R1112 I1114	Q1106-T1108 HydrophobicContact CG-CG2 4.24Å; T1108-D1110 WeakPolarHBondContact CB-OD1 3.31Å; T1108-D1110 PolarHBondContact O-N 2.88Å; T1108-D1110 VanDerWaalsContact O-N 3.15Å; T1108-D1110 PolarHBondContact OG1-OD1 2.87Å; T1108-Q1111 WeakPolarHBondContact O-CA 3.14Å; T1108-Q1111 PolarHBondContact O-N 2.85Å; T1108-R1112 PolarHBondContact N-O 3.36Å; T1108-R1112 WeakPolarHBondContact OG1-CB 3.45Å; T1108-R1112 PolarHBondContact OG1-O 3.44Å; T1108-I1114 HydrophobicContact CG2-CD1 4.09Å
1109	A	93	Very high	95.9	Very high	66 Å²	66	69.2 Å²	69.2	55%	0.545	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.4	-176	0	0	0	0	0	114.1	L1093 Q1111	L1093-A1109 HydrophobicContact CB-CB 3.96Å; A1109-Q1111 PolarHBondContact O-N 3.43Å
1110	D	92.1	Very high	95.9	Very high	76 Å²	76	69 Å²	69	41%	0.406	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	17.8	170.8	72.5	-19.8	0	0	0	113.4	T1108 R1112	T1108-D1110 WeakPolarHBondContact CB-OD1 3.31Å; T1108-D1110 PolarHBondContact O-N 2.88Å; T1108-D1110 VanDerWaalsContact O-N 3.15Å; T1108-D1110 PolarHBondContact OG1-OD1 2.87Å; D1110-R1112 PolarHBondContact O-N 2.79Å; D1110-R1112 IonicContact OD1-NE 2.9Å; D1110-R1112 IonicContact OD2-CZ 3.71Å; D1110-R1112 IonicContact OD2-NE 2.89Å; D1110-R1112 PolarHBondContact OD2-NE 3.48Å; D1110-R1112 IonicContact OD2-NH2 2.65Å; D1110-R1112 PolarHBondContact OD2-NH2 2.88Å
1111	Q	92.6	Very high	96	Very high	150 Å²	150	67.8 Å²	67.8	70%	0.701	35%	0.354	S	S	*	.	S	Bend	trans	66.3	7.2	175.5	-55.3	174.9	55.1	0	0	115.7	T1108 A1109 P1128	T1108-Q1111 WeakPolarHBondContact O-CA 3.14Å; T1108-Q1111 PolarHBondContact O-N 2.85Å; A1109-Q1111 PolarHBondContact O-N 3.43Å; Q1111-P1128 HydrophobicContact CB-CB 4.3Å
1112	R	95	Very high	96.2	Very high	86 Å²	86	64.8 Å²	64.8	33%	0.325	34%	0.338	S	S	.	.			trans	-68.1	148.1	168.8	-66.1	-174.7	-117.9	-157.6	-2.7	111.1	T1108 D1110 I1125 T1126 Y1127	T1108-R1112 PolarHBondContact N-O 3.36Å; T1108-R1112 WeakPolarHBondContact OG1-CB 3.45Å; T1108-R1112 PolarHBondContact OG1-O 3.44Å; D1110-R1112 PolarHBondContact O-N 2.79Å; D1110-R1112 IonicContact OD1-NE 2.9Å; D1110-R1112 IonicContact OD2-CZ 3.71Å; D1110-R1112 IonicContact OD2-NE 2.89Å; D1110-R1112 PolarHBondContact OD2-NE 3.48Å; D1110-R1112 IonicContact OD2-NH2 2.65Å; D1110-R1112 PolarHBondContact OD2-NH2 2.88Å; R1112-I1125 HydrophobicContact CB-CG2 4.44Å; R1112-T1126 WeakPolarHBondContact CA-O 3.34Å; R1112-Y1127 HydrophobicContact CG-CD1 4.21Å; R1112-Y1127 HydrophobicContact CG-CG 4.36Å; R1112-Y1127 PolarHBondContact NH1-OH 3Å
1113	V	97.9	Very high	96.5	Very high	36 Å²	36	65 Å²	65	22%	0.218	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	105.4	177	-179.6	0	0	0	0	108.3	K1105 I1107 I1125 T1126	K1105-V1113 HydrophobicContact CD-CG1 4.34Å; K1105-V1113 HydrophobicContact CG-CG1 4.17Å; I1107-V1113 HydrophobicContact CG1-CG2 4.46Å; V1113-I1125 CarbonylContact O-C 3.58Å; V1113-I1125 WeakPolarHBondContact O-CA 3.49Å; V1113-T1126 PolarHBondContact N-O 3.26Å; V1113-T1126 PolarHBondContact O-N 2.76Å
1114	I	98	Very high	96.5	Very high	48 Å²	48	65.7 Å²	65.7	25%	0.246	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	114.9	178.2	-56.8	169.3	0	0	0	107.7	K1105 Q1106 T1108 T1123 I1125	K1105-I1114 CarbonylContact C-O 3.44Å; K1105-I1114 WeakPolarHBondContact CA-O 3.43Å; Q1106-I1114 HydrophobicContact CB-CB 4.38Å; Q1106-I1114 PolarHBondContact N-O 2.84Å; Q1106-I1114 PolarHBondContact O-N 3.49Å; T1108-I1114 HydrophobicContact CG2-CD1 4.09Å; I1114-T1123 HydrophobicContact CG2-CG2 3.78Å; I1114-I1125 HydrophobicContact CG1-CG1 4.27Å; I1114-I1125 HydrophobicContact CG1-CG2 4.11Å; I1114-I1125 HydrophobicContact CG2-CG1 4.39Å
1115	Y	98.4	Very high	96.5	Very high	46 Å²	46	65.3 Å²	65.3	18%	0.18	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.9	173.7	-161.5	-69.2	0	0	0	109.7	F1099 D1103 T1104 K1105 Y1117 T1123 H1124	F1099-Y1115 AromaticContact CE2-CE2 3.79Å; F1099-Y1115 HydrophobicContact CE2-CE2 3.79Å; F1099-Y1115 HydrophobicContact CZ-CE2 4.47Å; D1103-Y1115 HydrophobicContact CB-CE1 3.76Å; D1103-Y1115 WeakPolarHBondContact CB-OH 3.45Å; D1103-Y1115 PolarHBondContact OD2-OH 2.88Å; T1104-Y1115 CarbonylContact O-C 3.57Å; T1104-Y1115 WeakPolarHBondContact O-CA 3.4Å; K1105-Y1115 HydrophobicContact CB-CD2 3.75Å; K1105-Y1115 HydrophobicContact CB-CE2 4.06Å; K1105-Y1115 HydrophobicContact CD-CD2 4.13Å; K1105-Y1115 HydrophobicContact CG-CD2 4.03Å; Y1115-Y1117 AromaticContact CD1-CD1 3.73Å; Y1115-Y1117 HydrophobicContact CD1-CD1 3.73Å; Y1115-Y1117 HydrophobicContact CD1-CD2 4.01Å; Y1115-Y1117 AromaticContact CD1-CE1 3.48Å; Y1115-Y1117 HydrophobicContact CD1-CE1 3.48Å; Y1115-Y1117 VanDerWaalsContact CD1-CE1 3.48Å; Y1115-Y1117 AromaticContact CD1-CE2 3.78Å; Y1115-Y1117 HydrophobicContact CD1-CE2 3.78Å; Y1115-Y1117 AromaticContact CD1-CG 3.98Å; Y1115-Y1117 HydrophobicContact CD1-CG 3.98Å; Y1115-Y1117 AromaticContact CD1-CZ 3.5Å; Y1115-Y1117 VanDerWaalsContact CD1-CZ 3.5Å; Y1115-Y1117 AromaticContact CE1-CD1 3.35Å; Y1115-Y1117 HydrophobicContact CE1-CD1 3.35Å; Y1115-Y1117 HydrophobicContact CE1-CD2 4.47Å; Y1115-Y1117 AromaticContact CE1-CE1 3.21Å; Y1115-Y1117 HydrophobicContact CE1-CE1 3.21Å; Y1115-Y1117 HydrophobicContact CE1-CE2 4.37Å; Y1115-Y1117 HydrophobicContact CE1-CG 4Å; Y1115-Y1117 AromaticContact CE1-CZ 3.77Å; Y1115-Y1117 HydrophobicContact CG-CE1 4.45Å; Y1115-Y1117 AromaticContact CZ-CE1 3.99Å; Y1115-T1123 CarbonylContact O-C 3.53Å; Y1115-T1123 WeakPolarHBondContact O-CA 3.3Å; Y1115-H1124 PolarHBondContact N-O 3.41Å; Y1115-H1124 PolarHBondContact O-N 3.01Å
1116	Y	98.1	Very high	96.5	Very high	82 Å²	82	63.8 Å²	63.8	32%	0.322	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.7	173	177.2	-107.9	0	0	0	110	D1103 T1104 A1118	D1103-Y1116 CarbonylContact C-O 3.48Å; D1103-Y1116 WeakPolarHBondContact CA-O 3.36Å; D1103-Y1116 WeakPolarHBondContact CB-O 3.35Å; T1104-Y1116 PolarHBondContact N-O 3.19Å; T1104-Y1116 PolarHBondContact O-N 2.85Å; Y1116-A1118 HydrophobicContact CD1-CB 4.32Å; Y1116-A1118 HydrophobicContact CE1-CB 3.93Å
1117	Y	97.7	Very high	96.5	Very high	87 Å²	87	64.7 Å²	64.7	34%	0.341	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	106.7	173.6	-62.8	-76.5	0	0	0	109.5	D1103 Y1115 E1119 A1120 Q1121 T1122 H1124	D1103-Y1117 WeakPolarHBondContact OD1-CA 3.46Å; Y1115-Y1117 AromaticContact CD1-CD1 3.73Å; Y1115-Y1117 HydrophobicContact CD1-CD1 3.73Å; Y1115-Y1117 HydrophobicContact CD1-CD2 4.01Å; Y1115-Y1117 AromaticContact CD1-CE1 3.48Å; Y1115-Y1117 HydrophobicContact CD1-CE1 3.48Å; Y1115-Y1117 VanDerWaalsContact CD1-CE1 3.48Å; Y1115-Y1117 AromaticContact CD1-CE2 3.78Å; Y1115-Y1117 HydrophobicContact CD1-CE2 3.78Å; Y1115-Y1117 AromaticContact CD1-CG 3.98Å; Y1115-Y1117 HydrophobicContact CD1-CG 3.98Å; Y1115-Y1117 AromaticContact CD1-CZ 3.5Å; Y1115-Y1117 VanDerWaalsContact CD1-CZ 3.5Å; Y1115-Y1117 AromaticContact CE1-CD1 3.35Å; Y1115-Y1117 HydrophobicContact CE1-CD1 3.35Å; Y1115-Y1117 HydrophobicContact CE1-CD2 4.47Å; Y1115-Y1117 AromaticContact CE1-CE1 3.21Å; Y1115-Y1117 HydrophobicContact CE1-CE1 3.21Å; Y1115-Y1117 HydrophobicContact CE1-CE2 4.37Å; Y1115-Y1117 HydrophobicContact CE1-CG 4Å; Y1115-Y1117 AromaticContact CE1-CZ 3.77Å; Y1115-Y1117 HydrophobicContact CG-CE1 4.45Å; Y1115-Y1117 AromaticContact CZ-CE1 3.99Å; Y1117-E1119 PolarHBondContact O-N 3.33Å; Y1117-A1120 CarbonylContact O-C 3.59Å; Y1117-A1120 PolarHBondContact O-N 3.43Å; Y1117-Q1121 WeakPolarHBondContact O-CA 3.45Å; Y1117-Q1121 PolarHBondContact O-N 2.87Å; Y1117-T1122 HydrophobicContact CD2-CG2 4.49Å; Y1117-T1122 PolarHBondContact N-O 2.86Å; Y1117-T1122 PolarHBondContact O-N 2.97Å; Y1117-H1124 HydrophobicContact CE2-CB 3.86Å
1118	A	96.4	Very high	96.5	Very high	31 Å²	31	65.8 Å²	65.8	26%	0.256	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-33.1	-171.1	0	0	0	0	0	113.4	G1102 D1103 Y1116	G1102-A1118 VanDerWaalsContact C-CB 3.4Å; G1102-A1118 WeakPolarHBondContact O-CB 3.47Å; D1103-A1118 PolarHBondContact OD1-N 3.44Å; Y1116-A1118 HydrophobicContact CD1-CB 4.32Å; Y1116-A1118 HydrophobicContact CE1-CB 3.93Å
1119	E	96.6	Very high	96.5	Very high	182 Å²	182	69.3 Å²	69.3	85%	0.85	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-32.5	176.5	-174.5	169.7	-157.2	0	0	112.2	Y1117	Y1117-E1119 PolarHBondContact O-N 3.33Å
1120	A	96.1	Very high	96.6	Very high	53 Å²	53	68 Å²	68	44%	0.438	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-2	-179.3	0	0	0	0	0	114	Y1117 T1122	Y1117-A1120 CarbonylContact O-C 3.59Å; Y1117-A1120 PolarHBondContact O-N 3.43Å; A1120-T1122 PolarHBondContact O-N 2.89Å; A1120-T1122 VanDerWaalsContact O-N 3.09Å; A1120-T1122 PolarHBondContact O-OG1 3.32Å
1121	Q	97.5	Very high	96.8	Very high	120 Å²	120	66 Å²	66	56%	0.561	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	37.8	-174.7	-59.9	179.6	-3.4	0	0	113.3	Y1117 P1137	Y1117-Q1121 WeakPolarHBondContact O-CA 3.45Å; Y1117-Q1121 PolarHBondContact O-N 2.87Å; Q1121-P1137 HydrophobicContact CB-CB 3.94Å; Q1121-P1137 HydrophobicContact CB-CG 4.14Å
1122	T	97.8	Very high	97	Very high	10 Å²	10	62.2 Å²	62.2	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.9	-169.2	-63.1	0	0	0	0	110.1	Y1117 A1120 H1135 F1136	Y1117-T1122 HydrophobicContact CD2-CG2 4.49Å; Y1117-T1122 PolarHBondContact N-O 2.86Å; Y1117-T1122 PolarHBondContact O-N 2.97Å; A1120-T1122 PolarHBondContact O-N 2.89Å; A1120-T1122 VanDerWaalsContact O-N 3.09Å; A1120-T1122 PolarHBondContact O-OG1 3.32Å; T1122-H1135 CarbonylContact C-O 3.52Å; T1122-H1135 VanDerWaalsContact CA-O 3.3Å; T1122-H1135 WeakPolarHBondContact CA-O 3.36Å; T1122-H1135 WeakPolarHBondContact CG2-O 3.3Å; T1122-F1136 HydrophobicContact CG2-CD1 3.73Å; T1122-F1136 HydrophobicContact CG2-CE1 3.79Å; T1122-F1136 HydrophobicContact CG2-CG 4.38Å; T1122-F1136 HydrophobicContact CG2-CZ 4.46Å
1123	T	98.2	Very high	97.2	Very high	40 Å²	40	58.7 Å²	58.7	25%	0.245	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115.9	179.3	-53.4	0	0	0	0	110.6	I1114 Y1115 I1125 L1134 H1135	I1114-T1123 HydrophobicContact CG2-CG2 3.78Å; Y1115-T1123 CarbonylContact O-C 3.53Å; Y1115-T1123 WeakPolarHBondContact O-CA 3.3Å; T1123-I1125 HydrophobicContact CG2-CG1 4.12Å; T1123-L1134 CarbonylContact O-C 3.45Å; T1123-L1134 WeakPolarHBondContact O-CA 3.38Å; T1123-H1135 PolarHBondContact N-O 3.38Å; T1123-H1135 PolarHBondContact O-N 2.83Å; T1123-H1135 PolarHBondContact O-ND1 2.89Å
1124	H	98.3	Very high	97.2	Very high	28 Å²	28	58.3 Å²	58.3	13%	0.13	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.3	178	176	-145.3	0	0	0	109.8	Y1115 Y1117 E1132 V1133 L1134	Y1115-H1124 PolarHBondContact N-O 3.41Å; Y1115-H1124 PolarHBondContact O-N 3.01Å; Y1117-H1124 HydrophobicContact CE2-CB 3.86Å; H1124-E1132 IonicContact CD2-OE2 2.84Å; H1124-E1132 IonicContact CE1-OE2 2.64Å; H1124-E1132 PolarHBondContact CE1-OE2 2.91Å; H1124-E1132 VanDerWaalsContact NE2-CD 3.34Å; H1124-E1132 IonicContact NE2-OE2 3.81Å; H1124-E1132 PolarHBondContact NE2-OE2 3.34Å; H1124-V1133 CarbonylContact C-O 3.48Å; H1124-V1133 WeakPolarHBondContact CA-O 3.37Å; H1124-L1134 HydrophobicContact CB-CG 4.33Å
1125	I	98.1	Very high	97.2	Very high	23 Å²	23	59.5 Å²	59.5	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	110.9	-177	-50.7	-179.9	0	0	0	108.7	R1112 V1113 I1114 T1123 Y1127 E1132 V1133	R1112-I1125 HydrophobicContact CB-CG2 4.44Å; V1113-I1125 CarbonylContact O-C 3.58Å; V1113-I1125 WeakPolarHBondContact O-CA 3.49Å; I1114-I1125 HydrophobicContact CG1-CG1 4.27Å; I1114-I1125 HydrophobicContact CG1-CG2 4.11Å; I1114-I1125 HydrophobicContact CG2-CG1 4.39Å; T1123-I1125 HydrophobicContact CG2-CG1 4.12Å; I1125-Y1127 HydrophobicContact CB-CE2 4.05Å; I1125-Y1127 HydrophobicContact CG2-CD2 3.89Å; I1125-Y1127 HydrophobicContact CG2-CE2 3.49Å; I1125-Y1127 VanDerWaalsContact CG2-CE2 3.49Å; I1125-E1132 CarbonylContact O-C 3.53Å; I1125-E1132 WeakPolarHBondContact O-CA 3.37Å; I1125-V1133 PolarHBondContact N-O 2.75Å; I1125-V1133 PolarHBondContact O-N 2.78Å
1126	T	98.1	Very high	97.2	Very high	43 Å²	43	60.1 Å²	60.1	26%	0.264	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.3	168.5	-46.6	0	0	0	0	109.5	R1112 V1113 E1132	R1112-T1126 WeakPolarHBondContact CA-O 3.34Å; V1113-T1126 PolarHBondContact N-O 3.26Å; V1113-T1126 PolarHBondContact O-N 2.76Å; T1126-E1132 HydrophobicContact CG2-CG 4.11Å
1127	Y	97.1	Very high	97.1	Very high	57 Å²	57	59.9 Å²	59.9	22%	0.224	33%	0.325	C	S	.	.			trans	-93.9	155.6	176.4	-75.4	-114.1	0	0	0	110.9	R1112 I1125 D1129 G1130 M1131 V1133	R1112-Y1127 HydrophobicContact CG-CD1 4.21Å; R1112-Y1127 HydrophobicContact CG-CG 4.36Å; R1112-Y1127 PolarHBondContact NH1-OH 3Å; I1125-Y1127 HydrophobicContact CB-CE2 4.05Å; I1125-Y1127 HydrophobicContact CG2-CD2 3.89Å; I1125-Y1127 HydrophobicContact CG2-CE2 3.49Å; I1125-Y1127 VanDerWaalsContact CG2-CE2 3.49Å; Y1127-D1129 WeakPolarHBondContact CB-OD1 3.42Å; Y1127-D1129 PolarHBondContact O-N 3.36Å; Y1127-G1130 PolarHBondContact O-N 3.21Å; Y1127-M1131 WeakPolarHBondContact CB-O 3.5Å; Y1127-M1131 HydrophobicContact CD1-CE 3.87Å; Y1127-M1131 HydrophobicContact CD2-CE 4.03Å; Y1127-M1131 HydrophobicContact CE1-CE 4.05Å; Y1127-M1131 HydrophobicContact CE2-CE 4.24Å; Y1127-M1131 HydrophobicContact CG-CE 3.88Å; Y1127-M1131 PolarHBondContact N-O 2.9Å; Y1127-V1133 HydrophobicContact CD2-CG2 4.23Å; Y1127-V1133 HydrophobicContact CE2-CB 4.34Å; Y1127-V1133 HydrophobicContact CE2-CG2 3.72Å
1128	P	96.1	Very high	97	Very high	89 Å²	89	59.3 Å²	59.3	58%	0.578	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13	-178.5	27.5	-35.7	0	0	0	114.5	Q1111 G1130	Q1111-P1128 HydrophobicContact CB-CB 4.3Å; P1128-G1130 VanDerWaalsContact C-N 3.3Å
1129	D	94.4	Very high	96.8	Very high	103 Å²	103	64.4 Å²	64.4	55%	0.551	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.5	169.8	59.8	5.3	0	0	0	113.3	Y1127 M1131 P1146	Y1127-D1129 WeakPolarHBondContact CB-OD1 3.42Å; Y1127-D1129 PolarHBondContact O-N 3.36Å; D1129-M1131 VanDerWaalsContact OD1-CB 3.29Å; D1129-M1131 WeakPolarHBondContact OD1-CB 3.37Å; D1129-M1131 PolarHBondContact OD1-N 3.45Å; D1129-P1146 WeakPolarHBondContact O-CG 3.42Å
1130	G	93.3	Very high	96.8	Very high	39 Å²	39	57.4 Å²	57.4	40%	0.402	32%	0.318	S	S	.	.	S	Bend	trans	88.9	2.7	-176	0	0	0	0	0	114.9	Y1127 P1128	Y1127-G1130 PolarHBondContact O-N 3.21Å; P1128-G1130 VanDerWaalsContact C-N 3.3Å
1131	M	96.9	Very high	96.9	Very high	34 Å²	34	56.4 Å²	56.4	17%	0.167	31%	0.307	C	S	.	.			trans	-69.7	136.7	170.2	179.4	177.3	53.8	0	0	110	Y1127 D1129 V1133 F1145	Y1127-M1131 WeakPolarHBondContact CB-O 3.5Å; Y1127-M1131 HydrophobicContact CD1-CE 3.87Å; Y1127-M1131 HydrophobicContact CD2-CE 4.03Å; Y1127-M1131 HydrophobicContact CE1-CE 4.05Å; Y1127-M1131 HydrophobicContact CE2-CE 4.24Å; Y1127-M1131 HydrophobicContact CG-CE 3.88Å; Y1127-M1131 PolarHBondContact N-O 2.9Å; D1129-M1131 VanDerWaalsContact OD1-CB 3.29Å; D1129-M1131 WeakPolarHBondContact OD1-CB 3.37Å; D1129-M1131 PolarHBondContact OD1-N 3.45Å; M1131-V1133 HydrophobicContact CG-CG2 4.22Å; M1131-V1133 HydrophobicContact SD-CG2 4.35Å; M1131-F1145 HydrophobicContact CG-CD1 4.49Å; M1131-F1145 HydrophobicContact SD-CD1 4.29Å; M1131-F1145 HydrophobicContact SD-CE1 3.98Å
1132	E	97.8	Very high	96.9	Very high	70 Å²	70	52.2 Å²	52.2	33%	0.327	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.4	174.5	-68.3	-174.7	-172.7	0	0	110.2	H1124 I1125 T1126 K1143 H1144	H1124-E1132 IonicContact CD2-OE2 2.84Å; H1124-E1132 IonicContact CE1-OE2 2.64Å; H1124-E1132 PolarHBondContact CE1-OE2 2.91Å; H1124-E1132 VanDerWaalsContact NE2-CD 3.34Å; H1124-E1132 IonicContact NE2-OE2 3.81Å; H1124-E1132 PolarHBondContact NE2-OE2 3.34Å; I1125-E1132 CarbonylContact O-C 3.53Å; I1125-E1132 WeakPolarHBondContact O-CA 3.37Å; T1126-E1132 HydrophobicContact CG2-CG 4.11Å; E1132-K1143 CarbonylContact O-C 3.56Å; E1132-K1143 WeakPolarHBondContact O-CA 3.46Å; E1132-H1144 HydrophobicContact CB-CB 4.42Å; E1132-H1144 PolarHBondContact N-O 3.44Å; E1132-H1144 PolarHBondContact O-N 3.08Å
1133	V	98.2	Very high	96.9	Very high	12 Å²	12	54.8 Å²	54.8	7%	0.073	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.2	178.9	-171.1	0	0	0	0	110.6	H1124 I1125 Y1127 M1131 H1135 E1142 K1143	H1124-V1133 CarbonylContact C-O 3.48Å; H1124-V1133 WeakPolarHBondContact CA-O 3.37Å; I1125-V1133 PolarHBondContact N-O 2.75Å; I1125-V1133 PolarHBondContact O-N 2.78Å; Y1127-V1133 HydrophobicContact CD2-CG2 4.23Å; Y1127-V1133 HydrophobicContact CE2-CB 4.34Å; Y1127-V1133 HydrophobicContact CE2-CG2 3.72Å; M1131-V1133 HydrophobicContact CG-CG2 4.22Å; M1131-V1133 HydrophobicContact SD-CG2 4.35Å; V1133-H1135 VanDerWaalsContact CG1-CE1 3.49Å; V1133-H1135 WeakPolarHBondContact CG1-CE1 3.29Å; V1133-E1142 CarbonylContact C-O 3.49Å; V1133-E1142 VanDerWaalsContact CA-O 3.32Å; V1133-E1142 WeakPolarHBondContact CA-O 3.3Å; V1133-K1143 HydrophobicContact CG1-CG 4.22Å; V1133-K1143 HydrophobicContact CG2-CG 4.21Å
1134	L	98.2	Very high	96.9	Very high	27 Å²	27	54.6 Å²	54.6	14%	0.141	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.1	176.2	-65.7	83.6	0	0	0	109.9	T1123 H1124 F1136 T1141 E1142	T1123-L1134 CarbonylContact O-C 3.45Å; T1123-L1134 WeakPolarHBondContact O-CA 3.38Å; H1124-L1134 HydrophobicContact CB-CG 4.33Å; L1134-F1136 HydrophobicContact CB-CD2 4.43Å; L1134-F1136 HydrophobicContact CB-CE2 3.74Å; L1134-F1136 HydrophobicContact CB-CZ 4.03Å; L1134-F1136 HydrophobicContact CD2-CE2 4.33Å; L1134-F1136 HydrophobicContact CD2-CZ 3.79Å; L1134-T1141 CarbonylContact O-C 3.54Å; L1134-T1141 WeakPolarHBondContact O-CA 3.24Å; L1134-E1142 HydrophobicContact CB-CB 4.42Å; L1134-E1142 PolarHBondContact N-O 3.47Å; L1134-E1142 PolarHBondContact O-N 3.49Å
1135	H	97.8	Very high	96.8	Very high	74 Å²	74	56.5 Å²	56.5	34%	0.343	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.6	172.8	-56.9	71.1	0	0	0	108.3	T1122 T1123 V1133 T1141	T1122-H1135 CarbonylContact C-O 3.52Å; T1122-H1135 VanDerWaalsContact CA-O 3.3Å; T1122-H1135 WeakPolarHBondContact CA-O 3.36Å; T1122-H1135 WeakPolarHBondContact CG2-O 3.3Å; T1123-H1135 PolarHBondContact N-O 3.38Å; T1123-H1135 PolarHBondContact O-N 2.83Å; T1123-H1135 PolarHBondContact O-ND1 2.89Å; V1133-H1135 VanDerWaalsContact CG1-CE1 3.49Å; V1133-H1135 WeakPolarHBondContact CG1-CE1 3.29Å; H1135-T1141 HydrophobicContact CB-CG2 4.39Å
1136	F	97.9	Very high	96.8	Very high	58 Å²	58	59.8 Å²	59.8	25%	0.254	33%	0.325	S	S	.	.			trans	-102.5	154.6	-176.3	-66.9	-82.6	0	0	0	111.5	T1122 L1134 N1138 N1139 Q1140 E1142	T1122-F1136 HydrophobicContact CG2-CD1 3.73Å; T1122-F1136 HydrophobicContact CG2-CE1 3.79Å; T1122-F1136 HydrophobicContact CG2-CG 4.38Å; T1122-F1136 HydrophobicContact CG2-CZ 4.46Å; L1134-F1136 HydrophobicContact CB-CD2 4.43Å; L1134-F1136 HydrophobicContact CB-CE2 3.74Å; L1134-F1136 HydrophobicContact CB-CZ 4.03Å; L1134-F1136 HydrophobicContact CD2-CE2 4.33Å; L1134-F1136 HydrophobicContact CD2-CZ 3.79Å; F1136-N1138 WeakPolarHBondContact CB-OD1 3.2Å; F1136-N1138 PolarHBondContact O-N 2.84Å; F1136-N1139 PolarHBondContact O-N 2.83Å; F1136-Q1140 HydrophobicContact CB-CB 4.33Å; F1136-Q1140 HydrophobicContact CD2-CB 4.39Å; F1136-Q1140 HydrophobicContact CD2-CG 4.31Å; F1136-Q1140 PolarHBondContact N-O 2.78Å; F1136-E1142 HydrophobicContact CE2-CB 4.39Å; F1136-E1142 HydrophobicContact CE2-CG 3.86Å
1137	P	97.3	Very high	96.6	Very high	78 Å²	78	61.7 Å²	61.7	51%	0.506	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-6.3	-174.8	28	-36.6	0	0	0	114.9	Q1121 N1139	Q1121-P1137 HydrophobicContact CB-CB 3.94Å; Q1121-P1137 HydrophobicContact CB-CG 4.14Å; P1137-N1139 VanDerWaalsContact C-N 3.33Å
1138	N	94.4	Very high	96.4	Very high	75 Å²	75	61 Å²	61	40%	0.401	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4.6	170.1	65.2	-20.2	0	0	0	113.3	F1136 Q1140 P1155	F1136-N1138 WeakPolarHBondContact CB-OD1 3.2Å; F1136-N1138 PolarHBondContact O-N 2.84Å; N1138-Q1140 VanDerWaalsContact C-N 3.25Å; N1138-Q1140 PolarHBondContact ND2-OE1 3.39Å; N1138-Q1140 PolarHBondContact O-N 3.2Å; N1138-Q1140 WeakPolarHBondContact OD1-CB 3.26Å; N1138-Q1140 PolarHBondContact OD1-N 2.64Å; N1138-P1155 HydrophobicContact CB-CG 4.42Å; N1138-P1155 WeakPolarHBondContact O-CB 3.2Å; N1138-P1155 WeakPolarHBondContact O-CG 3.32Å
1139	N	92.8	Very high	96.3	Very high	138 Å²	138	62.3 Å²	62.3	74%	0.738	34%	0.337	S	S	*	.	S	Bend	trans	67.6	11.6	-168.8	-51.1	-52.9	0	0	0	115.5	F1136 P1137	F1136-N1139 PolarHBondContact O-N 2.83Å; P1137-N1139 VanDerWaalsContact C-N 3.33Å
1140	Q	97.1	Very high	96.5	Very high	34 Å²	34	61.2 Å²	61.2	16%	0.159	33%	0.327	C	S	.	.			trans	-69.4	140.2	164.7	179.4	-179.5	-31.5	0	0	108.9	F1136 N1138 E1142 I1152 T1153 F1154 P1155	F1136-Q1140 HydrophobicContact CB-CB 4.33Å; F1136-Q1140 HydrophobicContact CD2-CB 4.39Å; F1136-Q1140 HydrophobicContact CD2-CG 4.31Å; F1136-Q1140 PolarHBondContact N-O 2.78Å; N1138-Q1140 VanDerWaalsContact C-N 3.25Å; N1138-Q1140 PolarHBondContact ND2-OE1 3.39Å; N1138-Q1140 PolarHBondContact O-N 3.2Å; N1138-Q1140 WeakPolarHBondContact OD1-CB 3.26Å; N1138-Q1140 PolarHBondContact OD1-N 2.64Å; Q1140-E1142 PolarHBondContact NE2-OE1 3.12Å; Q1140-I1152 HydrophobicContact CG-CG2 4.02Å; Q1140-T1153 WeakPolarHBondContact CA-O 3.32Å; Q1140-F1154 HydrophobicContact CG-CD1 4.41Å; Q1140-P1155 HydrophobicContact CB-CG 4.32Å
1141	T	97.5	Very high	96.7	Very high	32 Å²	32	61 Å²	61	20%	0.196	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	146.8	169	67.3	0	0	0	0	110.5	L1134 H1135 I1152 T1153	L1134-T1141 CarbonylContact O-C 3.54Å; L1134-T1141 WeakPolarHBondContact O-CA 3.24Å; H1135-T1141 HydrophobicContact CB-CG2 4.39Å; T1141-I1152 CarbonylContact O-C 3.58Å; T1141-I1152 WeakPolarHBondContact O-CA 3.32Å; T1141-T1153 PolarHBondContact N-O 2.93Å; T1141-T1153 PolarHBondContact O-N 3.5Å
1142	E	97.9	Very high	96.7	Very high	32 Å²	32	60.4 Å²	60.4	15%	0.15	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.7	176.2	-63.6	-174.3	-166.5	0	0	110.2	V1133 L1134 F1136 Q1140 H1144 E1151 I1152	V1133-E1142 CarbonylContact C-O 3.49Å; V1133-E1142 VanDerWaalsContact CA-O 3.32Å; V1133-E1142 WeakPolarHBondContact CA-O 3.3Å; L1134-E1142 HydrophobicContact CB-CB 4.42Å; L1134-E1142 PolarHBondContact N-O 3.47Å; L1134-E1142 PolarHBondContact O-N 3.49Å; F1136-E1142 HydrophobicContact CE2-CB 4.39Å; F1136-E1142 HydrophobicContact CE2-CG 3.86Å; Q1140-E1142 PolarHBondContact NE2-OE1 3.12Å; E1142-H1144 IonicContact OE2-CD2 2.7Å; E1142-H1144 IonicContact OE2-CE1 3.66Å; E1142-H1144 IonicContact OE2-NE2 2.77Å; E1142-H1144 PolarHBondContact OE2-NE2 3.47Å; E1142-E1151 CarbonylContact C-O 3.59Å; E1142-E1151 VanDerWaalsContact CA-O 3.31Å; E1142-E1151 WeakPolarHBondContact CA-O 3.36Å; E1142-I1152 HydrophobicContact CG-CB 4.35Å; E1142-I1152 HydrophobicContact CG-CD1 4.47Å; E1142-I1152 HydrophobicContact CG-CG1 3.98Å; E1142-I1152 HydrophobicContact CG-CG2 4.04Å
1143	K	98	Very high	96.7	Very high	64 Å²	64	58 Å²	58	28%	0.278	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.3	168.7	-48.5	176.7	-157.9	153.2	0	108	E1132 V1133 F1145 K1150 E1151	E1132-K1143 CarbonylContact O-C 3.56Å; E1132-K1143 WeakPolarHBondContact O-CA 3.46Å; V1133-K1143 HydrophobicContact CG1-CG 4.22Å; V1133-K1143 HydrophobicContact CG2-CG 4.21Å; K1143-F1145 HydrophobicContact CB-CE2 3.98Å; K1143-F1145 HydrophobicContact CB-CZ 4.05Å; K1143-F1145 HydrophobicContact CD-CZ 4.2Å; K1143-K1150 CarbonylContact O-C 3.51Å; K1143-K1150 VanDerWaalsContact O-CA 3.27Å; K1143-K1150 WeakPolarHBondContact O-CA 3.2Å; K1143-E1151 HydrophobicContact CB-CB 4.32Å; K1143-E1151 WeakPolarHBondContact CD-OE2 3.49Å; K1143-E1151 VanDerWaalsContact CE-OE1 3.3Å; K1143-E1151 WeakPolarHBondContact CE-OE1 3.4Å; K1143-E1151 PolarHBondContact N-O 3.43Å; K1143-E1151 IonicContact NZ-OE1 2.71Å; K1143-E1151 PolarHBondContact NZ-OE1 3.35Å; K1143-E1151 IonicContact NZ-OE2 2.71Å; K1143-E1151 PolarHBondContact NZ-OE2 2.94Å; K1143-E1151 PolarHBondContact O-N 2.91Å
1144	H	97.6	Very high	96.7	Very high	36 Å²	36	60.5 Å²	60.5	17%	0.167	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.7	172.8	-57.3	178.5	0	0	0	107.1	E1132 E1142 K1150	E1132-H1144 HydrophobicContact CB-CB 4.42Å; E1132-H1144 PolarHBondContact N-O 3.44Å; E1132-H1144 PolarHBondContact O-N 3.08Å; E1142-H1144 IonicContact OE2-CD2 2.7Å; E1142-H1144 IonicContact OE2-CE1 3.66Å; E1142-H1144 IonicContact OE2-NE2 2.77Å; E1142-H1144 PolarHBondContact OE2-NE2 3.47Å; H1144-K1150 HydrophobicContact CB-CG 4.32Å; H1144-K1150 PolarHBondContact CE1-NZ 2.93Å; H1144-K1150 PolarHBondContact ND1-NZ 3.45Å
1145	F	97.6	Very high	96.6	Very high	68 Å²	68	62.5 Å²	62.5	30%	0.298	33%	0.328	S	S	.	.			trans	-93	154.7	-173.3	-65.3	-87.2	0	0	0	111.9	M1131 K1143 D1147 G1148 R1149 E1151	M1131-F1145 HydrophobicContact CG-CD1 4.49Å; M1131-F1145 HydrophobicContact SD-CD1 4.29Å; M1131-F1145 HydrophobicContact SD-CE1 3.98Å; K1143-F1145 HydrophobicContact CB-CE2 3.98Å; K1143-F1145 HydrophobicContact CB-CZ 4.05Å; K1143-F1145 HydrophobicContact CD-CZ 4.2Å; F1145-D1147 WeakPolarHBondContact CB-OD1 3.46Å; F1145-D1147 PolarHBondContact O-N 2.89Å; F1145-D1147 VanDerWaalsContact O-N 3.13Å; F1145-G1148 PolarHBondContact O-N 2.88Å; F1145-R1149 HydrophobicContact CB-CB 4.25Å; F1145-R1149 HydrophobicContact CD2-CB 3.9Å; F1145-R1149 HydrophobicContact CG-CB 4.44Å; F1145-R1149 PolarHBondContact N-O 2.91Å; F1145-E1151 HydrophobicContact CE2-CB 3.85Å
1146	P	96.3	Very high	96.4	Very high	92 Å²	92	63.6 Å²	63.6	60%	0.597	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.8	178.9	-25.8	34.1	0	0	0	115.3	D1129 G1148	D1129-P1146 WeakPolarHBondContact O-CG 3.42Å; P1146-G1148 VanDerWaalsContact C-N 3.26Å
1147	D	94.1	Very high	96.2	Very high	83 Å²	83	67 Å²	67	44%	0.444	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.7	176.4	78.9	-20.6	0	0	0	113.5	F1145 R1149 P1164	F1145-D1147 WeakPolarHBondContact CB-OD1 3.46Å; F1145-D1147 PolarHBondContact O-N 2.89Å; F1145-D1147 VanDerWaalsContact O-N 3.13Å; D1147-R1149 WeakPolarHBondContact OD1-CB 3.18Å; D1147-R1149 WeakPolarHBondContact OD1-CG 3.31Å; D1147-R1149 PolarHBondContact OD1-N 3.14Å; D1147-R1149 IonicContact OD1-NE 3.19Å; D1147-R1149 IonicContact OD2-CZ 3.83Å; D1147-R1149 IonicContact OD2-NE 2.82Å; D1147-R1149 PolarHBondContact OD2-NE 3.22Å; D1147-R1149 IonicContact OD2-NH2 3.19Å; D1147-R1149 PolarHBondContact OD2-NH2 2.92Å; D1147-P1164 WeakPolarHBondContact O-CG 3.25Å
1148	G	92.4	Very high	96.2	Very high	43 Å²	43	63.9 Å²	63.9	44%	0.443	33%	0.333	S	S	.	.	S	Bend	trans	93.7	-3.3	179.7	0	0	0	0	0	115	F1145 P1146	F1145-G1148 PolarHBondContact O-N 2.88Å; P1146-G1148 VanDerWaalsContact C-N 3.26Å
1149	R	95.3	Very high	96.3	Very high	116 Å²	116	62.1 Å²	62.1	44%	0.438	33%	0.325	S	S	.	.			trans	-62.8	153.4	170.2	-69	179.2	-144	-151.6	2	111	F1145 D1147 L1162 F1163 P1164	F1145-R1149 HydrophobicContact CB-CB 4.25Å; F1145-R1149 HydrophobicContact CD2-CB 3.9Å; F1145-R1149 HydrophobicContact CG-CB 4.44Å; F1145-R1149 PolarHBondContact N-O 2.91Å; D1147-R1149 WeakPolarHBondContact OD1-CB 3.18Å; D1147-R1149 WeakPolarHBondContact OD1-CG 3.31Å; D1147-R1149 PolarHBondContact OD1-N 3.14Å; D1147-R1149 IonicContact OD1-NE 3.19Å; D1147-R1149 IonicContact OD2-CZ 3.83Å; D1147-R1149 IonicContact OD2-NE 2.82Å; D1147-R1149 PolarHBondContact OD2-NE 3.22Å; D1147-R1149 IonicContact OD2-NH2 3.19Å; D1147-R1149 PolarHBondContact OD2-NH2 2.92Å; R1149-L1162 CarbonylContact C-O 3.58Å; R1149-L1162 WeakPolarHBondContact CA-O 3.35Å; R1149-F1163 HydrophobicContact CG-CD1 3.9Å; R1149-F1163 HydrophobicContact CG-CE1 4.44Å; R1149-P1164 HydrophobicContact CG-CG 4.48Å
1150	K	97.4	Very high	96.6	Very high	81 Å²	81	57.4 Å²	57.4	35%	0.352	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.5	169.1	-59.8	178.5	-178.4	-105.3	0	110	K1143 H1144 N1161 L1162	K1143-K1150 CarbonylContact O-C 3.51Å; K1143-K1150 VanDerWaalsContact O-CA 3.27Å; K1143-K1150 WeakPolarHBondContact O-CA 3.2Å; H1144-K1150 HydrophobicContact CB-CG 4.32Å; H1144-K1150 PolarHBondContact CE1-NZ 2.93Å; H1144-K1150 PolarHBondContact ND1-NZ 3.45Å; K1150-N1161 CarbonylContact O-C 3.58Å; K1150-N1161 WeakPolarHBondContact O-CA 3.47Å; K1150-L1162 HydrophobicContact CB-CB 4.44Å; K1150-L1162 HydrophobicContact CB-CD1 4.36Å; K1150-L1162 PolarHBondContact N-O 3.35Å; K1150-L1162 PolarHBondContact O-N 3.44Å
1151	E	97.9	Very high	96.6	Very high	34 Å²	34	57.6 Å²	57.6	16%	0.159	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.7	170.6	-179.5	-162.7	140.7	0	0	107.6	E1142 K1143 F1145 V1159	E1142-E1151 CarbonylContact C-O 3.59Å; E1142-E1151 VanDerWaalsContact CA-O 3.31Å; E1142-E1151 WeakPolarHBondContact CA-O 3.36Å; K1143-E1151 HydrophobicContact CB-CB 4.32Å; K1143-E1151 WeakPolarHBondContact CD-OE2 3.49Å; K1143-E1151 VanDerWaalsContact CE-OE1 3.3Å; K1143-E1151 WeakPolarHBondContact CE-OE1 3.4Å; K1143-E1151 PolarHBondContact N-O 3.43Å; K1143-E1151 IonicContact NZ-OE1 2.71Å; K1143-E1151 PolarHBondContact NZ-OE1 3.35Å; K1143-E1151 IonicContact NZ-OE2 2.71Å; K1143-E1151 PolarHBondContact NZ-OE2 2.94Å; K1143-E1151 PolarHBondContact O-N 2.91Å; F1145-E1151 HydrophobicContact CE2-CB 3.85Å; E1151-V1159 HydrophobicContact CG-CG1 3.59Å
1152	I	97.9	Very high	96.5	Very high	22 Å²	22	58.2 Å²	58.2	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	109.3	177.7	-51.5	-173.2	0	0	0	108.1	Q1140 T1141 E1142 F1154 V1159 K1160 L1162	Q1140-I1152 HydrophobicContact CG-CG2 4.02Å; T1141-I1152 CarbonylContact O-C 3.58Å; T1141-I1152 WeakPolarHBondContact O-CA 3.32Å; E1142-I1152 HydrophobicContact CG-CB 4.35Å; E1142-I1152 HydrophobicContact CG-CD1 4.47Å; E1142-I1152 HydrophobicContact CG-CG1 3.98Å; E1142-I1152 HydrophobicContact CG-CG2 4.04Å; I1152-F1154 HydrophobicContact CB-CE2 4.37Å; I1152-F1154 HydrophobicContact CB-CZ 4.39Å; I1152-F1154 HydrophobicContact CG2-CD1 4.08Å; I1152-F1154 HydrophobicContact CG2-CD2 4.26Å; I1152-F1154 HydrophobicContact CG2-CE1 3.74Å; I1152-F1154 HydrophobicContact CG2-CE2 3.96Å; I1152-F1154 HydrophobicContact CG2-CG 4.33Å; I1152-F1154 HydrophobicContact CG2-CZ 3.68Å; I1152-V1159 CarbonylContact O-C 3.58Å; I1152-V1159 WeakPolarHBondContact O-CA 3.22Å; I1152-K1160 HydrophobicContact CB-CB 4.46Å; I1152-K1160 PolarHBondContact N-O 2.84Å; I1152-K1160 PolarHBondContact O-N 3.41Å; I1152-L1162 HydrophobicContact CD1-CD1 3.61Å; I1152-L1162 HydrophobicContact CG1-CD1 3.77Å
1153	T	97.9	Very high	96.5	Very high	20 Å²	20	58.6 Å²	58.6	12%	0.123	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114	167.8	-44.8	0	0	0	0	108.4	Q1140 T1141 V1159	Q1140-T1153 WeakPolarHBondContact CA-O 3.32Å; T1141-T1153 PolarHBondContact N-O 2.93Å; T1141-T1153 PolarHBondContact O-N 3.5Å; T1153-V1159 HydrophobicContact CG2-CG2 4.22Å
1154	F	97.4	Very high	96.4	Very high	63 Å²	63	59.7 Å²	59.7	28%	0.276	32%	0.316	S	S	.	.			trans	-81.5	163.6	177.9	-71.1	-71.2	0	0	0	112	Q1140 I1152 D1156 Q1157 T1158 K1160	Q1140-F1154 HydrophobicContact CG-CD1 4.41Å; I1152-F1154 HydrophobicContact CB-CE2 4.37Å; I1152-F1154 HydrophobicContact CB-CZ 4.39Å; I1152-F1154 HydrophobicContact CG2-CD1 4.08Å; I1152-F1154 HydrophobicContact CG2-CD2 4.26Å; I1152-F1154 HydrophobicContact CG2-CE1 3.74Å; I1152-F1154 HydrophobicContact CG2-CE2 3.96Å; I1152-F1154 HydrophobicContact CG2-CG 4.33Å; I1152-F1154 HydrophobicContact CG2-CZ 3.68Å; F1154-D1156 WeakPolarHBondContact CB-OD1 3.33Å; F1154-D1156 PolarHBondContact O-N 2.84Å; F1154-D1156 VanDerWaalsContact O-N 3.11Å; F1154-Q1157 WeakPolarHBondContact O-CA 3.47Å; F1154-Q1157 PolarHBondContact O-N 3.23Å; F1154-T1158 HydrophobicContact CD2-CG2 4.22Å; F1154-T1158 PolarHBondContact N-O 3.46Å; F1154-K1160 HydrophobicContact CD2-CB 4.48Å; F1154-K1160 HydrophobicContact CE2-CB 3.76Å; F1154-K1160 HydrophobicContact CE2-CD 4.38Å
1155	P	96.5	Very high	96.2	Very high	70 Å²	70	61.9 Å²	61.9	46%	0.455	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.6	-175.7	-22.3	35.4	0	0	0	115.4	N1138 Q1140 Q1157	N1138-P1155 HydrophobicContact CB-CG 4.42Å; N1138-P1155 WeakPolarHBondContact O-CB 3.2Å; N1138-P1155 WeakPolarHBondContact O-CG 3.32Å; Q1140-P1155 HydrophobicContact CB-CG 4.32Å; P1155-Q1157 VanDerWaalsContact C-N 3.32Å
1156	D	93.7	Very high	95.9	Very high	97 Å²	97	60.8 Å²	60.8	52%	0.519	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	2.7	172.1	66.4	-21.6	0	0	0	113	F1154 T1158 T1173	F1154-D1156 WeakPolarHBondContact CB-OD1 3.33Å; F1154-D1156 PolarHBondContact O-N 2.84Å; F1154-D1156 VanDerWaalsContact O-N 3.11Å; D1156-T1158 VanDerWaalsContact C-N 3.26Å; D1156-T1158 VanDerWaalsContact CG-OG1 3.26Å; D1156-T1158 PolarHBondContact O-N 3.07Å; D1156-T1158 VanDerWaalsContact OD1-CB 3.27Å; D1156-T1158 WeakPolarHBondContact OD1-CB 3.28Å; D1156-T1158 PolarHBondContact OD1-N 3.19Å; D1156-T1158 PolarHBondContact OD1-OG1 3.16Å; D1156-T1158 WeakPolarHBondContact OD2-CB 3.44Å; D1156-T1158 PolarHBondContact OD2-OG1 3.42Å; D1156-T1173 VanDerWaalsContact O-CG2 3.27Å; D1156-T1173 WeakPolarHBondContact O-CG2 3.43Å
1157	Q	93.7	Very high	95.8	Very high	129 Å²	129	61.1 Å²	61.1	60%	0.603	33%	0.327	S	S	*	.	S	Bend	trans	66.5	14.5	-170.5	-49.9	-68.8	1.9	0	0	115.1	F1154 P1155 V1159 T1173	F1154-Q1157 WeakPolarHBondContact O-CA 3.47Å; F1154-Q1157 PolarHBondContact O-N 3.23Å; P1155-Q1157 VanDerWaalsContact C-N 3.32Å; Q1157-V1159 PolarHBondContact O-N 3.44Å; Q1157-T1173 HydrophobicContact CB-CG2 3.78Å
1158	T	96.5	Very high	95.9	Very high	13 Å²	13	60.1 Å²	60.1	8%	0.08	32%	0.319	C	S	.	.			trans	-66.6	129.3	165.1	-66	0	0	0	0	109.2	F1154 D1156 L1172	F1154-T1158 HydrophobicContact CD2-CG2 4.22Å; F1154-T1158 PolarHBondContact N-O 3.46Å; D1156-T1158 VanDerWaalsContact C-N 3.26Å; D1156-T1158 VanDerWaalsContact CG-OG1 3.26Å; D1156-T1158 PolarHBondContact O-N 3.07Å; D1156-T1158 VanDerWaalsContact OD1-CB 3.27Å; D1156-T1158 WeakPolarHBondContact OD1-CB 3.28Å; D1156-T1158 PolarHBondContact OD1-N 3.19Å; D1156-T1158 PolarHBondContact OD1-OG1 3.16Å; D1156-T1158 WeakPolarHBondContact OD2-CB 3.44Å; D1156-T1158 PolarHBondContact OD2-OG1 3.42Å; T1158-L1172 HydrophobicContact CG2-CD2 3.85Å
1159	V	97.6	Very high	96.2	Very high	38 Å²	38	60.2 Å²	60.2	23%	0.23	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.6	177.4	-178.7	0	0	0	0	109.3	E1151 I1152 T1153 Q1157 S1170 V1171	E1151-V1159 HydrophobicContact CG-CG1 3.59Å; I1152-V1159 CarbonylContact O-C 3.58Å; I1152-V1159 WeakPolarHBondContact O-CA 3.22Å; T1153-V1159 HydrophobicContact CG2-CG2 4.22Å; Q1157-V1159 PolarHBondContact O-N 3.44Å; V1159-S1170 CarbonylContact O-C 3.49Å; V1159-S1170 WeakPolarHBondContact O-CA 3.37Å; V1159-V1171 PolarHBondContact N-O 3.46Å; V1159-V1171 PolarHBondContact O-N 2.85Å
1160	K	97.8	Very high	96.3	Very high	39 Å²	39	56 Å²	56	17%	0.17	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	113.8	175.1	-174.2	-178.1	-171.6	-171.1	0	111.7	I1152 F1154 L1162 E1168 E1169	I1152-K1160 HydrophobicContact CB-CB 4.46Å; I1152-K1160 PolarHBondContact N-O 2.84Å; I1152-K1160 PolarHBondContact O-N 3.41Å; F1154-K1160 HydrophobicContact CD2-CB 4.48Å; F1154-K1160 HydrophobicContact CE2-CB 3.76Å; F1154-K1160 HydrophobicContact CE2-CD 4.38Å; K1160-L1162 HydrophobicContact CD-CD1 4.22Å; K1160-L1162 HydrophobicContact CG-CD1 4.07Å; K1160-E1168 WeakPolarHBondContact CE-OE1 3.37Å; K1160-E1168 VanDerWaalsContact CE-OE2 3.27Å; K1160-E1168 WeakPolarHBondContact CE-OE2 3.41Å; K1160-E1168 IonicContact NZ-OE1 3.7Å; K1160-E1168 PolarHBondContact NZ-OE1 3.38Å; K1160-E1168 IonicContact NZ-OE2 3.86Å; K1160-E1168 PolarHBondContact NZ-OE2 2.95Å; K1160-E1169 CarbonylContact C-O 3.57Å; K1160-E1169 WeakPolarHBondContact CA-O 3.25Å
1161	N	97.1	Very high	96.3	Very high	37 Å²	37	54.4 Å²	54.4	20%	0.198	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.4	166.8	-58.2	-31.3	0	0	0	109.9	K1150 F1163 E1168 E1169	K1150-N1161 CarbonylContact O-C 3.58Å; K1150-N1161 WeakPolarHBondContact O-CA 3.47Å; N1161-F1163 HydrophobicContact CB-CD2 4.45Å; N1161-F1163 HydrophobicContact CB-CE2 3.71Å; N1161-F1163 HydrophobicContact CB-CZ 3.88Å; N1161-E1168 CarbonylContact O-C 3.59Å; N1161-E1168 WeakPolarHBondContact O-CA 3.42Å; N1161-E1169 HydrophobicContact CB-CB 4.23Å; N1161-E1169 PolarHBondContact N-O 2.87Å; N1161-E1169 PolarHBondContact ND2-OE2 3.44Å; N1161-E1169 PolarHBondContact O-N 3.09Å
1162	L	96.8	Very high	96.2	Very high	45 Å²	45	55.5 Å²	55.5	24%	0.236	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.7	169.2	-58.3	90.1	0	0	0	107.6	R1149 K1150 I1152 K1160	R1149-L1162 CarbonylContact C-O 3.58Å; R1149-L1162 WeakPolarHBondContact CA-O 3.35Å; K1150-L1162 HydrophobicContact CB-CB 4.44Å; K1150-L1162 HydrophobicContact CB-CD1 4.36Å; K1150-L1162 PolarHBondContact N-O 3.35Å; K1150-L1162 PolarHBondContact O-N 3.44Å; I1152-L1162 HydrophobicContact CD1-CD1 3.61Å; I1152-L1162 HydrophobicContact CG1-CD1 3.77Å; K1160-L1162 HydrophobicContact CD-CD1 4.22Å; K1160-L1162 HydrophobicContact CG-CD1 4.07Å
1163	F	96.4	Very high	96.1	Very high	40 Å²	40	59.6 Å²	59.6	18%	0.175	33%	0.326	C	S	.	.			trans	-100.5	151.6	-174.1	-63.4	-88.4	0	0	0	111.6	R1149 N1161 D1165 G1166 R1167 E1169	R1149-F1163 HydrophobicContact CG-CD1 3.9Å; R1149-F1163 HydrophobicContact CG-CE1 4.44Å; N1161-F1163 HydrophobicContact CB-CD2 4.45Å; N1161-F1163 HydrophobicContact CB-CE2 3.71Å; N1161-F1163 HydrophobicContact CB-CZ 3.88Å; F1163-D1165 VanDerWaalsContact CB-OD1 3.3Å; F1163-D1165 WeakPolarHBondContact CB-OD1 3.32Å; F1163-D1165 PolarHBondContact O-N 2.85Å; F1163-D1165 VanDerWaalsContact O-N 3.09Å; F1163-G1166 PolarHBondContact O-N 3.12Å; F1163-R1167 HydrophobicContact CB-CB 4.19Å; F1163-R1167 HydrophobicContact CD2-CB 3.86Å; F1163-R1167 HydrophobicContact CG-CB 4.38Å; F1163-R1167 PolarHBondContact N-O 3.01Å; F1163-E1169 HydrophobicContact CE2-CB 3.96Å
1164	P	95.6	Very high	95.9	Very high	88 Å²	88	62.4 Å²	62.4	57%	0.571	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.1	178.9	-24.9	33	0	0	0	115.4	D1147 R1149 G1166	D1147-P1164 WeakPolarHBondContact O-CG 3.25Å; R1149-P1164 HydrophobicContact CG-CG 4.48Å; P1164-G1166 VanDerWaalsContact C-N 3.3Å
1165	D	94	Very high	95.7	Very high	81 Å²	81	61.3 Å²	61.3	43%	0.433	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-3	177	58.6	23.9	0	0	0	113.7	F1163 R1167 P1182	F1163-D1165 VanDerWaalsContact CB-OD1 3.3Å; F1163-D1165 WeakPolarHBondContact CB-OD1 3.32Å; F1163-D1165 PolarHBondContact O-N 2.85Å; F1163-D1165 VanDerWaalsContact O-N 3.09Å; D1165-R1167 VanDerWaalsContact OD1-CB 3.3Å; D1165-R1167 WeakPolarHBondContact OD1-CB 3.42Å; D1165-R1167 WeakPolarHBondContact OD1-CG 3.45Å; D1165-R1167 PolarHBondContact OD1-N 2.97Å; D1165-R1167 IonicContact OD1-NE 2.76Å; D1165-R1167 PolarHBondContact OD1-NE 3.34Å; D1165-R1167 IonicContact OD2-CZ 2.9Å; D1165-R1167 VanDerWaalsContact OD2-CZ 3.23Å; D1165-R1167 IonicContact OD2-NE 2.78Å; D1165-R1167 PolarHBondContact OD2-NE 3.29Å; D1165-R1167 IonicContact OD2-NH2 3.23Å; D1165-R1167 PolarHBondContact OD2-NH2 3.2Å; D1165-P1182 VanDerWaalsContact O-CG 3.26Å; D1165-P1182 WeakPolarHBondContact O-CG 3.39Å
1166	G	91.9	Very high	95.6	Very high	45 Å²	45	58.2 Å²	58.2	46%	0.464	33%	0.326	S	S	.	.	S	Bend	trans	89.4	3.1	-178.3	0	0	0	0	0	114.7	F1163 P1164	F1163-G1166 PolarHBondContact O-N 3.12Å; P1164-G1166 VanDerWaalsContact C-N 3.3Å
1167	R	94.5	Very high	95.8	Very high	100 Å²	100	56.2 Å²	56.2	38%	0.377	32%	0.315	S	S	.	.			trans	-67.4	145	166.4	-74.5	-178.9	-71.8	170.9	-3.7	110.5	F1163 D1165 V1180 P1182	F1163-R1167 HydrophobicContact CB-CB 4.19Å; F1163-R1167 HydrophobicContact CD2-CB 3.86Å; F1163-R1167 HydrophobicContact CG-CB 4.38Å; F1163-R1167 PolarHBondContact N-O 3.01Å; D1165-R1167 VanDerWaalsContact OD1-CB 3.3Å; D1165-R1167 WeakPolarHBondContact OD1-CB 3.42Å; D1165-R1167 WeakPolarHBondContact OD1-CG 3.45Å; D1165-R1167 PolarHBondContact OD1-N 2.97Å; D1165-R1167 IonicContact OD1-NE 2.76Å; D1165-R1167 PolarHBondContact OD1-NE 3.34Å; D1165-R1167 IonicContact OD2-CZ 2.9Å; D1165-R1167 VanDerWaalsContact OD2-CZ 3.23Å; D1165-R1167 IonicContact OD2-NE 2.78Å; D1165-R1167 PolarHBondContact OD2-NE 3.29Å; D1165-R1167 IonicContact OD2-NH2 3.23Å; D1165-R1167 PolarHBondContact OD2-NH2 3.2Å; R1167-V1180 WeakPolarHBondContact CA-O 3.25Å; R1167-P1182 HydrophobicContact CG-CG 4.13Å
1168	E	96.6	Very high	96	Very high	62 Å²	62	52.3 Å²	52.3	29%	0.29	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.1	166	-49.8	-168.7	127	0	0	109	K1160 N1161 Q1179 V1180	K1160-E1168 WeakPolarHBondContact CE-OE1 3.37Å; K1160-E1168 VanDerWaalsContact CE-OE2 3.27Å; K1160-E1168 WeakPolarHBondContact CE-OE2 3.41Å; K1160-E1168 IonicContact NZ-OE1 3.7Å; K1160-E1168 PolarHBondContact NZ-OE1 3.38Å; K1160-E1168 IonicContact NZ-OE2 3.86Å; K1160-E1168 PolarHBondContact NZ-OE2 2.95Å; N1161-E1168 CarbonylContact O-C 3.59Å; N1161-E1168 WeakPolarHBondContact O-CA 3.42Å; E1168-Q1179 CarbonylContact O-C 3.56Å; E1168-Q1179 WeakPolarHBondContact O-CA 3.39Å; E1168-V1180 HydrophobicContact CB-CB 4.29Å; E1168-V1180 PolarHBondContact N-O 3.33Å; E1168-V1180 PolarHBondContact O-N 2.96Å
1169	E	97.1	Very high	96	Very high	45 Å²	45	53.8 Å²	53.8	21%	0.21	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	117.3	177.4	172.1	-165.1	-155.4	0	0	108.2	K1160 N1161 F1163 I1177 I1178	K1160-E1169 CarbonylContact C-O 3.57Å; K1160-E1169 WeakPolarHBondContact CA-O 3.25Å; N1161-E1169 HydrophobicContact CB-CB 4.23Å; N1161-E1169 PolarHBondContact N-O 2.87Å; N1161-E1169 PolarHBondContact ND2-OE2 3.44Å; N1161-E1169 PolarHBondContact O-N 3.09Å; F1163-E1169 HydrophobicContact CE2-CB 3.96Å; E1169-I1177 HydrophobicContact CG-CG2 3.81Å; E1169-I1178 CarbonylContact C-O 3.5Å; E1169-I1178 WeakPolarHBondContact CA-O 3.42Å
1170	S	97.6	Very high	96	Very high	26 Å²	26	53.4 Å²	53.4	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.1	176.7	-59.8	0	0	0	0	110.3	V1159 I1178	V1159-S1170 CarbonylContact O-C 3.49Å; V1159-S1170 WeakPolarHBondContact O-CA 3.37Å; S1170-I1178 PolarHBondContact N-O 3.04Å; S1170-I1178 PolarHBondContact O-N 3.4Å
1171	V	97.1	Very high	95.9	Very high	48 Å²	48	52.7 Å²	52.7	29%	0.291	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	117.6	170.8	-174.3	0	0	0	0	108.6	V1159 I1177	V1159-V1171 PolarHBondContact N-O 3.46Å; V1159-V1171 PolarHBondContact O-N 2.85Å; V1171-I1177 HydrophobicContact CG2-CG1 4.36Å; V1171-I1177 HydrophobicContact CG2-CG2 4.43Å
1172	L	96.6	Very high	95.8	Very high	58 Å²	58	55.1 Å²	55.1	30%	0.304	32%	0.318	S	S	.	.			trans	-87.1	160.7	176.8	-64.6	176.8	0	0	0	111.5	T1158 D1174 G1175 T1176 I1178	T1158-L1172 HydrophobicContact CG2-CD2 3.85Å; L1172-D1174 WeakPolarHBondContact CB-OD1 3.36Å; L1172-D1174 PolarHBondContact O-N 2.94Å; L1172-G1175 PolarHBondContact O-N 2.8Å; L1172-T1176 WeakPolarHBondContact CB-O 3.24Å; L1172-T1176 HydrophobicContact CD1-CG2 4.31Å; L1172-T1176 PolarHBondContact N-O 2.9Å; L1172-I1178 HydrophobicContact CD1-CD1 3.85Å; L1172-I1178 HydrophobicContact CG-CD1 4.43Å
1173	T	95.6	Very high	95.6	Very high	107 Å²	107	58.6 Å²	58.6	66%	0.656	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-13.4	-176.7	50.1	0	0	0	0	115.1	D1156 Q1157 G1175	D1156-T1173 VanDerWaalsContact O-CG2 3.27Å; D1156-T1173 WeakPolarHBondContact O-CG2 3.43Å; Q1157-T1173 HydrophobicContact CB-CG2 3.78Å; T1173-G1175 VanDerWaalsContact C-N 3.33Å
1174	D	94.1	Very high	95.4	Very high	79 Å²	79	59.1 Å²	59.1	42%	0.422	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.9	171.5	73.2	-33.3	0	0	0	113.1	L1172 T1176 N1191	L1172-D1174 WeakPolarHBondContact CB-OD1 3.36Å; L1172-D1174 PolarHBondContact O-N 2.94Å; D1174-T1176 VanDerWaalsContact OD1-CB 3.23Å; D1174-T1176 WeakPolarHBondContact OD1-CB 3.45Å; D1174-T1176 PolarHBondContact OD1-N 2.89Å; D1174-T1176 PolarHBondContact OD1-OG1 2.7Å; D1174-T1176 WeakPolarHBondContact OD2-CB 3.48Å; D1174-T1176 PolarHBondContact OD2-OG1 2.92Å; D1174-N1191 WeakPolarHBondContact O-CB 3.47Å; D1174-N1191 PolarHBondContact O-ND2 3.4Å
1175	G	92.3	Very high	95.4	Very high	40 Å²	40	56.1 Å²	56.1	41%	0.412	33%	0.333	S	S	.	.	S	Bend	trans	85.7	5.3	-173.3	0	0	0	0	0	114.6	L1172 T1173	L1172-G1175 PolarHBondContact O-N 2.8Å; T1173-G1175 VanDerWaalsContact C-N 3.33Å
1176	T	95.9	Very high	95.6	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.031	33%	0.332	C	S	.	.			trans	-75.1	127.3	173.9	-66.5	0	0	0	0	110.3	L1172 D1174 I1178 I1188 H1189 F1190	L1172-T1176 WeakPolarHBondContact CB-O 3.24Å; L1172-T1176 HydrophobicContact CD1-CG2 4.31Å; L1172-T1176 PolarHBondContact N-O 2.9Å; D1174-T1176 VanDerWaalsContact OD1-CB 3.23Å; D1174-T1176 WeakPolarHBondContact OD1-CB 3.45Å; D1174-T1176 PolarHBondContact OD1-N 2.89Å; D1174-T1176 PolarHBondContact OD1-OG1 2.7Å; D1174-T1176 WeakPolarHBondContact OD2-CB 3.48Å; D1174-T1176 PolarHBondContact OD2-OG1 2.92Å; T1176-I1178 HydrophobicContact CG2-CG1 4.33Å; T1176-I1188 HydrophobicContact CG2-CG2 3.71Å; T1176-H1189 CarbonylContact C-O 3.5Å; T1176-H1189 WeakPolarHBondContact CA-O 3.29Å; T1176-F1190 HydrophobicContact CG2-CD1 3.87Å; T1176-F1190 HydrophobicContact CG2-CE1 4.27Å
1177	I	96.8	Very high	95.8	Very high	56 Å²	56	56.5 Å²	56.5	29%	0.287	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.3	-179.4	-52.4	177.4	0	0	0	108.9	E1169 V1171 I1188 H1189	E1169-I1177 HydrophobicContact CG-CG2 3.81Å; V1171-I1177 HydrophobicContact CG2-CG1 4.36Å; V1171-I1177 HydrophobicContact CG2-CG2 4.43Å; I1177-I1188 CarbonylContact O-C 3.57Å; I1177-I1188 WeakPolarHBondContact O-CA 3.41Å; I1177-H1189 HydrophobicContact CB-CB 4.44Å; I1177-H1189 PolarHBondContact N-O 3.44Å; I1177-H1189 PolarHBondContact O-N 2.94Å
1178	I	97.4	Very high	95.9	Very high	47 Å²	47	52.9 Å²	52.9	24%	0.241	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	96.3	179	-55.7	175.7	0	0	0	108.8	E1169 S1170 L1172 T1176 I1188	E1169-I1178 CarbonylContact C-O 3.5Å; E1169-I1178 WeakPolarHBondContact CA-O 3.42Å; S1170-I1178 PolarHBondContact N-O 3.04Å; S1170-I1178 PolarHBondContact O-N 3.4Å; L1172-I1178 HydrophobicContact CD1-CD1 3.85Å; L1172-I1178 HydrophobicContact CG-CD1 4.43Å; T1176-I1178 HydrophobicContact CG2-CG1 4.33Å; I1178-I1188 HydrophobicContact CG1-CG1 4.33Å; I1178-I1188 HydrophobicContact CG1-CG2 4.26Å; I1178-I1188 HydrophobicContact CG2-CG1 4.29Å
1179	Q	97.5	Very high	95.9	Very high	43 Å²	43	53.8 Å²	53.8	20%	0.201	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	138.1	171.6	-175.8	178.7	-33.2	0	0	110.2	E1168 N1181 K1186 E1187	E1168-Q1179 CarbonylContact O-C 3.56Å; E1168-Q1179 WeakPolarHBondContact O-CA 3.39Å; Q1179-N1181 PolarHBondContact NE2-OD1 2.66Å; Q1179-K1186 CarbonylContact O-C 3.53Å; Q1179-K1186 VanDerWaalsContact O-CA 3.3Å; Q1179-K1186 WeakPolarHBondContact O-CA 3.35Å; Q1179-E1187 HydrophobicContact CB-CB 4.35Å; Q1179-E1187 PolarHBondContact N-O 3.36Å; Q1179-E1187 PolarHBondContact O-N 2.84Å
1180	V	97.6	Very high	95.9	Very high	30 Å²	30	54.1 Å²	54.1	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.3	171.5	-177.1	0	0	0	0	107.8	R1167 E1168 K1186	R1167-V1180 WeakPolarHBondContact CA-O 3.25Å; E1168-V1180 HydrophobicContact CB-CB 4.29Å; E1168-V1180 PolarHBondContact N-O 3.33Å; E1168-V1180 PolarHBondContact O-N 2.96Å; V1180-K1186 HydrophobicContact CG1-CG 4.27Å; V1180-K1186 HydrophobicContact CG2-CD 4.1Å; V1180-K1186 HydrophobicContact CG2-CG 4.06Å
1181	N	95.1	Very high	95.7	Very high	25 Å²	25	57.7 Å²	57.7	13%	0.134	33%	0.328	C	S	.	.			trans	-88.1	159.5	-178.2	-66.2	-40.2	0	0	0	111.2	Q1179 D1183 G1184 T1185 E1187	Q1179-N1181 PolarHBondContact NE2-OD1 2.66Å; N1181-D1183 WeakPolarHBondContact CB-OD1 3.38Å; N1181-D1183 PolarHBondContact O-N 2.89Å; N1181-D1183 VanDerWaalsContact O-N 3.15Å; N1181-G1184 PolarHBondContact O-N 3.09Å; N1181-T1185 WeakPolarHBondContact CB-OG1 3.41Å; N1181-T1185 PolarHBondContact N-O 3Å; N1181-T1185 PolarHBondContact ND2-OG1 2.92Å; N1181-E1187 PolarHBondContact ND2-OE1 2.79Å
1182	P	94.8	Very high	95.6	Very high	88 Å²	88	59.2 Å²	59.2	57%	0.571	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.2	-177.3	-17.3	31.7	0	0	0	113.9	D1165 R1167	D1165-P1182 VanDerWaalsContact O-CG 3.26Å; D1165-P1182 WeakPolarHBondContact O-CG 3.39Å; R1167-P1182 HydrophobicContact CG-CG 4.13Å
1183	D	93.8	Very high	95.3	Very high	118 Å²	118	59.2 Å²	59.2	63%	0.631	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-3.3	172.1	66.9	-1.3	0	0	0	113.6	N1181 T1185	N1181-D1183 WeakPolarHBondContact CB-OD1 3.38Å; N1181-D1183 PolarHBondContact O-N 2.89Å; N1181-D1183 VanDerWaalsContact O-N 3.15Å; D1183-T1185 VanDerWaalsContact C-N 3.33Å; D1183-T1185 VanDerWaalsContact OD1-CB 3.3Å; D1183-T1185 WeakPolarHBondContact OD1-CB 3.48Å; D1183-T1185 WeakPolarHBondContact OD1-CG2 3.38Å; D1183-T1185 PolarHBondContact OD1-N 3.37Å; D1183-T1185 PolarHBondContact OD1-OG1 3.43Å; D1183-T1185 WeakPolarHBondContact OD2-CG2 3.31Å; D1183-T1185 PolarHBondContact OD2-OG1 3.24Å
1184	G	91.1	Very high	95.3	Very high	50 Å²	50	56.1 Å²	56.1	52%	0.515	33%	0.33	S	S	.	.	S	Bend	trans	86.8	-1.2	-178.7	0	0	0	0	0	114	N1181	N1181-G1184 PolarHBondContact O-N 3.09Å
1185	T	96.1	Very high	95.4	Very high	25 Å²	25	54.3 Å²	54.3	15%	0.153	32%	0.318	C	S	.	.			trans	-67.4	148.1	171	65.5	0	0	0	0	111.1	N1181 D1183 H1198 T1199	N1181-T1185 WeakPolarHBondContact CB-OG1 3.41Å; N1181-T1185 PolarHBondContact N-O 3Å; N1181-T1185 PolarHBondContact ND2-OG1 2.92Å; D1183-T1185 VanDerWaalsContact C-N 3.33Å; D1183-T1185 VanDerWaalsContact OD1-CB 3.3Å; D1183-T1185 WeakPolarHBondContact OD1-CB 3.48Å; D1183-T1185 WeakPolarHBondContact OD1-CG2 3.38Å; D1183-T1185 PolarHBondContact OD1-N 3.37Å; D1183-T1185 PolarHBondContact OD1-OG1 3.43Å; D1183-T1185 WeakPolarHBondContact OD2-CG2 3.31Å; D1183-T1185 PolarHBondContact OD2-OG1 3.24Å; T1185-H1198 CarbonylContact C-O 3.59Å; T1185-H1198 VanDerWaalsContact CA-O 3.3Å; T1185-H1198 WeakPolarHBondContact CA-O 3.38Å; T1185-T1199 HydrophobicContact CG2-CG2 4.01Å
1186	K	97.4	Very high	95.7	Very high	98 Å²	98	54 Å²	54	43%	0.426	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	133.6	179.1	-49.5	-168.5	176.4	-170.7	0	110.3	Q1179 V1180 I1197 H1198	Q1179-K1186 CarbonylContact O-C 3.53Å; Q1179-K1186 VanDerWaalsContact O-CA 3.3Å; Q1179-K1186 WeakPolarHBondContact O-CA 3.35Å; V1180-K1186 HydrophobicContact CG1-CG 4.27Å; V1180-K1186 HydrophobicContact CG2-CD 4.1Å; V1180-K1186 HydrophobicContact CG2-CG 4.06Å; K1186-I1197 CarbonylContact O-C 3.57Å; K1186-I1197 VanDerWaalsContact O-CA 3.3Å; K1186-I1197 WeakPolarHBondContact O-CA 3.3Å; K1186-H1198 HydrophobicContact CB-CB 4.26Å; K1186-H1198 PolarHBondContact N-O 3.09Å; K1186-H1198 PolarHBondContact O-N 2.99Å
1187	E	97	Very high	95.8	Very high	37 Å²	37	54.9 Å²	54.9	17%	0.173	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.5	178.7	-62.1	178.5	-118.7	0	0	108.1	Q1179 N1181 H1189 K1195 E1196 I1197	Q1179-E1187 HydrophobicContact CB-CB 4.35Å; Q1179-E1187 PolarHBondContact N-O 3.36Å; Q1179-E1187 PolarHBondContact O-N 2.84Å; N1181-E1187 PolarHBondContact ND2-OE1 2.79Å; E1187-H1189 WeakPolarHBondContact CB-CE1 3.39Å; E1187-H1189 IonicContact OE2-CE1 2.73Å; E1187-H1189 PolarHBondContact OE2-CE1 3.27Å; E1187-K1195 WeakPolarHBondContact OE2-CE 3.18Å; E1187-K1195 IonicContact OE2-NZ 2.73Å; E1187-K1195 PolarHBondContact OE2-NZ 3.36Å; E1187-E1196 WeakPolarHBondContact CA-O 3.49Å; E1187-I1197 HydrophobicContact CG-CG1 4.37Å; E1187-I1197 HydrophobicContact CG-CG2 4.33Å
1188	I	97.4	Very high	95.8	Very high	24 Å²	24	54 Å²	54	12%	0.123	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	116	179	-54.8	172.7	0	0	0	107.2	T1176 I1177 I1178 F1190 K1195 E1196	T1176-I1188 HydrophobicContact CG2-CG2 3.71Å; I1177-I1188 CarbonylContact O-C 3.57Å; I1177-I1188 WeakPolarHBondContact O-CA 3.41Å; I1178-I1188 HydrophobicContact CG1-CG1 4.33Å; I1178-I1188 HydrophobicContact CG1-CG2 4.26Å; I1178-I1188 HydrophobicContact CG2-CG1 4.29Å; I1188-F1190 HydrophobicContact CB-CE2 4.47Å; I1188-F1190 HydrophobicContact CB-CZ 4.44Å; I1188-F1190 HydrophobicContact CG2-CD1 4.13Å; I1188-F1190 HydrophobicContact CG2-CD2 4.28Å; I1188-F1190 HydrophobicContact CG2-CE1 3.73Å; I1188-F1190 HydrophobicContact CG2-CE2 3.9Å; I1188-F1190 HydrophobicContact CG2-CG 4.4Å; I1188-F1190 HydrophobicContact CG2-CZ 3.61Å; I1188-K1195 CarbonylContact O-C 3.58Å; I1188-K1195 VanDerWaalsContact O-CA 3.31Å; I1188-K1195 WeakPolarHBondContact O-CA 3.43Å; I1188-E1196 HydrophobicContact CB-CB 4.37Å; I1188-E1196 PolarHBondContact N-O 2.97Å; I1188-E1196 PolarHBondContact O-N 3.03Å
1189	H	96.8	Very high	95.8	Very high	80 Å²	80	53.4 Å²	53.4	37%	0.37	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.3	173	-58	74.9	0	0	0	107.8	T1176 I1177 E1187 K1195	T1176-H1189 CarbonylContact C-O 3.5Å; T1176-H1189 WeakPolarHBondContact CA-O 3.29Å; I1177-H1189 HydrophobicContact CB-CB 4.44Å; I1177-H1189 PolarHBondContact N-O 3.44Å; I1177-H1189 PolarHBondContact O-N 2.94Å; E1187-H1189 WeakPolarHBondContact CB-CE1 3.39Å; E1187-H1189 IonicContact OE2-CE1 2.73Å; E1187-H1189 PolarHBondContact OE2-CE1 3.27Å; H1189-K1195 PolarHBondContact NE2-NZ 3Å
1190	F	96.4	Very high	95.6	Very high	52 Å²	52	56.1 Å²	56.1	23%	0.228	33%	0.333	C	S	.	.			trans	-81.6	150.5	179	-62.4	-77.9	0	0	0	110.8	T1176 I1188 T1192 G1193 Q1194 E1196	T1176-F1190 HydrophobicContact CG2-CD1 3.87Å; T1176-F1190 HydrophobicContact CG2-CE1 4.27Å; I1188-F1190 HydrophobicContact CB-CE2 4.47Å; I1188-F1190 HydrophobicContact CB-CZ 4.44Å; I1188-F1190 HydrophobicContact CG2-CD1 4.13Å; I1188-F1190 HydrophobicContact CG2-CD2 4.28Å; I1188-F1190 HydrophobicContact CG2-CE1 3.73Å; I1188-F1190 HydrophobicContact CG2-CE2 3.9Å; I1188-F1190 HydrophobicContact CG2-CG 4.4Å; I1188-F1190 HydrophobicContact CG2-CZ 3.61Å; F1190-T1192 PolarHBondContact O-N 2.89Å; F1190-G1193 PolarHBondContact O-N 3.08Å; F1190-Q1194 HydrophobicContact CB-CB 4.42Å; F1190-Q1194 HydrophobicContact CD2-CB 3.99Å; F1190-Q1194 WeakPolarHBondContact CD2-O 3.49Å; F1190-Q1194 PolarHBondContact N-O 3.41Å; F1190-E1196 HydrophobicContact CE2-CB 3.96Å
1191	N	93.3	Very high	95.5	Very high	102 Å²	102	61 Å²	61	55%	0.545	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-22.9	171.1	56.2	17.7	0	0	0	114.8	D1174 G1193	D1174-N1191 WeakPolarHBondContact O-CB 3.47Å; D1174-N1191 PolarHBondContact O-ND2 3.4Å; N1191-G1193 PolarHBondContact O-N 3.24Å
1192	T	94.3	Very high	95.6	Very high	79 Å²	79	62 Å²	62	49%	0.485	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	2.1	173.1	56.9	0	0	0	0	114.8	F1190 Q1194 P1208	F1190-T1192 PolarHBondContact O-N 2.89Å; T1192-Q1194 PolarHBondContact O-N 2.59Å; T1192-P1208 WeakPolarHBondContact O-CG 3.38Å
1193	G	91.2	Very high	95.7	Very high	58 Å²	58	63.3 Å²	63.3	60%	0.598	35%	0.353	S	S	*	.	S	Bend	trans	73.4	0.9	-172.9	0	0	0	0	0	114.3	F1190 N1191	F1190-G1193 PolarHBondContact O-N 3.08Å; N1191-G1193 PolarHBondContact O-N 3.24Å
1194	Q	95.6	Very high	95.9	Very high	42 Å²	42	60 Å²	60	20%	0.196	33%	0.332	C	S	.	.			trans	-72.8	142.5	170.1	-66.8	175.7	35.5	0	0	110.1	F1190 T1192 R1205 E1206 Y1207 P1208	F1190-Q1194 HydrophobicContact CB-CB 4.42Å; F1190-Q1194 HydrophobicContact CD2-CB 3.99Å; F1190-Q1194 WeakPolarHBondContact CD2-O 3.49Å; F1190-Q1194 PolarHBondContact N-O 3.41Å; T1192-Q1194 PolarHBondContact O-N 2.59Å; Q1194-R1205 VanDerWaalsContact OE1-CZ 3.28Å; Q1194-E1206 WeakPolarHBondContact CA-O 3.39Å; Q1194-Y1207 HydrophobicContact CG-CD1 4.07Å; Q1194-P1208 HydrophobicContact CG-CG 4.31Å
1195	K	96.8	Very high	96.2	Very high	42 Å²	42	60.9 Å²	60.9	18%	0.183	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.3	174.2	-175.4	176	-176.6	174.7	0	110.3	E1187 I1188 H1189 I1197 R1205 E1206	E1187-K1195 WeakPolarHBondContact OE2-CE 3.18Å; E1187-K1195 IonicContact OE2-NZ 2.73Å; E1187-K1195 PolarHBondContact OE2-NZ 3.36Å; I1188-K1195 CarbonylContact O-C 3.58Å; I1188-K1195 VanDerWaalsContact O-CA 3.31Å; I1188-K1195 WeakPolarHBondContact O-CA 3.43Å; H1189-K1195 PolarHBondContact NE2-NZ 3Å; K1195-I1197 HydrophobicContact CD-CD1 4.44Å; K1195-I1197 HydrophobicContact CD-CG1 4.4Å; K1195-I1197 HydrophobicContact CG-CG1 4.29Å; K1195-R1205 CarbonylContact O-C 3.53Å; K1195-R1205 WeakPolarHBondContact O-CA 3.47Å; K1195-E1206 HydrophobicContact CB-CB 4.36Å; K1195-E1206 PolarHBondContact N-O 3.4Å; K1195-E1206 PolarHBondContact O-N 3.04Å
1196	E	97.6	Very high	96.2	Very high	34 Å²	34	62.3 Å²	62.3	16%	0.159	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	123.2	174	-162.5	174.8	128	0	0	111.4	E1187 I1188 F1190 H1198 R1204 R1205	E1187-E1196 WeakPolarHBondContact CA-O 3.49Å; I1188-E1196 HydrophobicContact CB-CB 4.37Å; I1188-E1196 PolarHBondContact N-O 2.97Å; I1188-E1196 PolarHBondContact O-N 3.03Å; F1190-E1196 HydrophobicContact CE2-CB 3.96Å; E1196-H1198 IonicContact OE1-CD2 3.6Å; E1196-H1198 IonicContact OE1-CE1 2.97Å; E1196-H1198 IonicContact OE1-NE2 3.29Å; E1196-H1198 PolarHBondContact OE1-NE2 2.94Å; E1196-R1204 CarbonylContact C-O 3.47Å; E1196-R1204 VanDerWaalsContact CA-O 3.23Å; E1196-R1204 WeakPolarHBondContact CA-O 3.31Å; E1196-R1204 WeakPolarHBondContact CG-O 3.43Å; E1196-R1205 HydrophobicContact CB-CG 4.35Å; E1196-R1205 HydrophobicContact CG-CB 4.17Å; E1196-R1205 HydrophobicContact CG-CG 4.33Å; E1196-R1205 WeakPolarHBondContact OE2-CD 3.42Å; E1196-R1205 IonicContact OE2-CZ 3.23Å; E1196-R1205 IonicContact OE2-NE 3.66Å; E1196-R1205 IonicContact OE2-NH1 3.74Å; E1196-R1205 PolarHBondContact OE2-NH1 3.36Å
1197	I	97.6	Very high	96.2	Very high	23 Å²	23	61 Å²	61	12%	0.118	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.1	-175.2	-51.9	176.6	0	0	0	108.4	K1186 E1187 K1195 T1199 K1203 R1204	K1186-I1197 CarbonylContact O-C 3.57Å; K1186-I1197 VanDerWaalsContact O-CA 3.3Å; K1186-I1197 WeakPolarHBondContact O-CA 3.3Å; E1187-I1197 HydrophobicContact CG-CG1 4.37Å; E1187-I1197 HydrophobicContact CG-CG2 4.33Å; K1195-I1197 HydrophobicContact CD-CD1 4.44Å; K1195-I1197 HydrophobicContact CD-CG1 4.4Å; K1195-I1197 HydrophobicContact CG-CG1 4.29Å; I1197-T1199 HydrophobicContact CG2-CG2 4.2Å; I1197-K1203 CarbonylContact O-C 3.53Å; I1197-K1203 WeakPolarHBondContact O-CA 3.46Å; I1197-R1204 HydrophobicContact CB-CB 4.49Å; I1197-R1204 PolarHBondContact N-O 3.06Å; I1197-R1204 PolarHBondContact O-N 3.02Å
1198	H	97.4	Very high	96.1	Very high	37 Å²	37	63.5 Å²	63.5	17%	0.171	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.1	172.1	-59	176.7	0	0	0	109.1	T1185 K1186 E1196 K1203	T1185-H1198 CarbonylContact C-O 3.59Å; T1185-H1198 VanDerWaalsContact CA-O 3.3Å; T1185-H1198 WeakPolarHBondContact CA-O 3.38Å; K1186-H1198 HydrophobicContact CB-CB 4.26Å; K1186-H1198 PolarHBondContact N-O 3.09Å; K1186-H1198 PolarHBondContact O-N 2.99Å; E1196-H1198 IonicContact OE1-CD2 3.6Å; E1196-H1198 IonicContact OE1-CE1 2.97Å; E1196-H1198 IonicContact OE1-NE2 3.29Å; E1196-H1198 PolarHBondContact OE1-NE2 2.94Å; H1198-K1203 HydrophobicContact CB-CG 4.36Å
1199	T	96.8	Very high	95.9	Very high	35 Å²	35	67 Å²	67	22%	0.215	36%	0.356	C	S	.	.			trans	-114.8	177.1	169.5	73.2	0	0	0	0	109.5	T1185 I1197 E1201 Y1202	T1185-T1199 HydrophobicContact CG2-CG2 4.01Å; I1197-T1199 HydrophobicContact CG2-CG2 4.2Å; T1199-E1201 PolarHBondContact O-N 2.96Å; T1199-E1201 PolarHBondContact OG1-N 3.29Å; T1199-E1201 VanDerWaalsContact OG1-N 3.15Å; T1199-Y1202 HydrophobicContact CG2-CD2 4.25Å; T1199-Y1202 HydrophobicContact CG2-CE1 4.06Å; T1199-Y1202 HydrophobicContact CG2-CE2 3.69Å; T1199-Y1202 PolarHBondContact N-O 3.42Å; T1199-Y1202 WeakPolarHBondContact OG1-CD1 3.41Å; T1199-Y1202 PolarHBondContact OG1-N 2.66Å; T1199-Y1202 PolarHBondContact OG1-O 2.85Å
1200	A	94.8	Very high	95.7	Very high	99 Å²	99	65.2 Å²	65.2	82%	0.818	36%	0.359	S	S	*	.	S	Bend	trans	-66.2	-18.3	171.1	0	0	0	0	0	113.4
1201	E	94.9	Very high	95.7	Very high	133 Å²	133	63.3 Å²	63.3	62%	0.621	35%	0.352	S	S	*	.	S	Bend	trans	-106.3	-28.8	-173.6	-61.5	-176	169.8	0	0	113.4	T1199 Y1216 T1217	T1199-E1201 PolarHBondContact O-N 2.96Å; T1199-E1201 PolarHBondContact OG1-N 3.29Å; T1199-E1201 VanDerWaalsContact OG1-N 3.15Å; E1201-Y1216 WeakPolarHBondContact O-CA 3.28Å; E1201-T1217 PolarHBondContact O-N 2.81Å; E1201-T1217 PolarHBondContact O-OG1 3.47Å
1202	Y	95.8	Very high	95.9	Very high	46 Å²	46	59.9 Å²	59.9	18%	0.18	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.8	-175.3	62.1	-101	0	0	0	113.9	T1199 R1204 T1214 V1215 Y1216	T1199-Y1202 HydrophobicContact CG2-CD2 4.25Å; T1199-Y1202 HydrophobicContact CG2-CE1 4.06Å; T1199-Y1202 HydrophobicContact CG2-CE2 3.69Å; T1199-Y1202 PolarHBondContact N-O 3.42Å; T1199-Y1202 WeakPolarHBondContact OG1-CD1 3.41Å; T1199-Y1202 PolarHBondContact OG1-N 2.66Å; T1199-Y1202 PolarHBondContact OG1-O 2.85Å; Y1202-R1204 HydrophobicContact CD2-CB 3.88Å; Y1202-R1204 HydrophobicContact CE2-CB 3.85Å; Y1202-R1204 PolarHBondContact OH-NH2 2.86Å; Y1202-T1214 HydrophobicContact CD1-CG2 4.45Å; Y1202-T1214 HydrophobicContact CD2-CG2 3.69Å; Y1202-T1214 HydrophobicContact CE2-CG2 4.47Å; Y1202-T1214 HydrophobicContact CG-CG2 3.68Å; Y1202-V1215 CarbonylContact C-O 3.56Å; Y1202-V1215 VanDerWaalsContact CA-O 3.24Å; Y1202-V1215 WeakPolarHBondContact CA-O 3.23Å; Y1202-V1215 WeakPolarHBondContact CB-O 3.36Å; Y1202-Y1216 HydrophobicContact CD1-CD1 4.34Å; Y1202-Y1216 HydrophobicContact CD1-CE1 4.05Å; Y1202-Y1216 HydrophobicContact CG-CD1 4.47Å; Y1202-Y1216 HydrophobicContact CG-CE1 4.39Å
1203	K	97.8	Very high	96	Very high	115 Å²	115	60.6 Å²	60.6	50%	0.5	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.6	159.6	-64.4	-172.2	172.5	-174.4	0	109.1	I1197 H1198 T1214 V1215	I1197-K1203 CarbonylContact O-C 3.53Å; I1197-K1203 WeakPolarHBondContact O-CA 3.46Å; H1198-K1203 HydrophobicContact CB-CG 4.36Å; K1203-T1214 CarbonylContact O-C 3.55Å; K1203-T1214 WeakPolarHBondContact O-CA 3.5Å; K1203-V1215 PolarHBondContact N-O 3.44Å; K1203-V1215 PolarHBondContact O-N 2.83Å
1204	R	97.5	Very high	96.3	Very high	50 Å²	50	57.9 Å²	57.9	19%	0.189	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.6	178.1	177.1	-176.5	-61.5	158.8	11.1	110.1	E1196 I1197 Y1202 E1206 V1212 K1213 T1214	E1196-R1204 CarbonylContact C-O 3.47Å; E1196-R1204 VanDerWaalsContact CA-O 3.23Å; E1196-R1204 WeakPolarHBondContact CA-O 3.31Å; E1196-R1204 WeakPolarHBondContact CG-O 3.43Å; I1197-R1204 HydrophobicContact CB-CB 4.49Å; I1197-R1204 PolarHBondContact N-O 3.06Å; I1197-R1204 PolarHBondContact O-N 3.02Å; Y1202-R1204 HydrophobicContact CD2-CB 3.88Å; Y1202-R1204 HydrophobicContact CE2-CB 3.85Å; Y1202-R1204 PolarHBondContact OH-NH2 2.86Å; R1204-E1206 WeakPolarHBondContact CD-OE1 3.22Å; R1204-E1206 HydrophobicContact CG-CG 3.91Å; R1204-E1206 IonicContact NH1-OE1 2.7Å; R1204-V1212 VanDerWaalsContact CD-CG1 3.48Å; R1204-V1212 HydrophobicContact CG-CG1 3.56Å; R1204-K1213 CarbonylContact C-O 3.53Å; R1204-K1213 VanDerWaalsContact CA-O 3.31Å; R1204-K1213 WeakPolarHBondContact CA-O 3.49Å; R1204-T1214 HydrophobicContact CB-CG2 4.26Å; R1204-T1214 WeakPolarHBondContact CG-OG1 3.23Å; R1204-T1214 PolarHBondContact NE-OG1 3.4Å; R1204-T1214 VanDerWaalsContact NE-OG1 3.16Å
1205	R	97.6	Very high	96.4	Very high	67 Å²	67	59 Å²	59	25%	0.253	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.8	169.2	-162.7	170.3	-177.5	127.5	-7.4	110	Q1194 K1195 E1196 Y1207 V1212 K1213	Q1194-R1205 VanDerWaalsContact OE1-CZ 3.28Å; K1195-R1205 CarbonylContact O-C 3.53Å; K1195-R1205 WeakPolarHBondContact O-CA 3.47Å; E1196-R1205 HydrophobicContact CB-CG 4.35Å; E1196-R1205 HydrophobicContact CG-CB 4.17Å; E1196-R1205 HydrophobicContact CG-CG 4.33Å; E1196-R1205 WeakPolarHBondContact OE2-CD 3.42Å; E1196-R1205 IonicContact OE2-CZ 3.23Å; E1196-R1205 IonicContact OE2-NE 3.66Å; E1196-R1205 IonicContact OE2-NH1 3.74Å; E1196-R1205 PolarHBondContact OE2-NH1 3.36Å; R1205-Y1207 HydrophobicContact CB-CE2 4.03Å; R1205-Y1207 HydrophobicContact CG-CD2 4.4Å; R1205-Y1207 HydrophobicContact CG-CE2 3.9Å; R1205-V1212 WeakPolarHBondContact O-CA 3.45Å; R1205-K1213 PolarHBondContact N-O 2.95Å; R1205-K1213 PolarHBondContact O-N 3.05Å
1206	E	97.1	Very high	96.4	Very high	56 Å²	56	59.6 Å²	59.6	26%	0.262	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.8	-178.8	-52	-177.1	158.6	0	0	106.8	Q1194 K1195 R1204 V1212	Q1194-E1206 WeakPolarHBondContact CA-O 3.39Å; K1195-E1206 HydrophobicContact CB-CB 4.36Å; K1195-E1206 PolarHBondContact N-O 3.4Å; K1195-E1206 PolarHBondContact O-N 3.04Å; R1204-E1206 WeakPolarHBondContact CD-OE1 3.22Å; R1204-E1206 HydrophobicContact CG-CG 3.91Å; R1204-E1206 IonicContact NH1-OE1 2.7Å; E1206-V1212 HydrophobicContact CB-CG2 4.31Å; E1206-V1212 HydrophobicContact CG-CG1 4.15Å; E1206-V1212 HydrophobicContact CG-CG2 4.07Å
1207	Y	96.5	Very high	96.4	Very high	69 Å²	69	63.7 Å²	63.7	27%	0.271	34%	0.341	S	S	.	.			trans	-107.9	150.8	-172	-67.8	-98.8	0	0	0	110.7	Q1194 R1205 D1209 G1210 T1211 K1213	Q1194-Y1207 HydrophobicContact CG-CD1 4.07Å; R1205-Y1207 HydrophobicContact CB-CE2 4.03Å; R1205-Y1207 HydrophobicContact CG-CD2 4.4Å; R1205-Y1207 HydrophobicContact CG-CE2 3.9Å; Y1207-D1209 WeakPolarHBondContact CB-OD1 3.21Å; Y1207-D1209 PolarHBondContact O-N 3.39Å; Y1207-G1210 PolarHBondContact O-N 3.22Å; Y1207-T1211 HydrophobicContact CD2-CG2 4.41Å; Y1207-T1211 WeakPolarHBondContact CD2-O 3.02Å; Y1207-T1211 PolarHBondContact N-O 3.4Å; Y1207-K1213 HydrophobicContact CE2-CB 4.33Å; Y1207-K1213 HydrophobicContact CE2-CD 3.9Å; Y1207-K1213 HydrophobicContact CE2-CG 4.03Å
1208	P	95.4	Very high	96.2	Very high	91 Å²	91	66.2 Å²	66.2	59%	0.591	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19.7	-179.7	-29.2	34.7	0	0	0	116.3	T1192 Q1194 G1210	T1192-P1208 WeakPolarHBondContact O-CG 3.38Å; Q1194-P1208 HydrophobicContact CG-CG 4.31Å; P1208-G1210 PolarHBondContact O-N 3.5Å
1209	D	93.6	Very high	96	Very high	98 Å²	98	65.6 Å²	65.6	52%	0.524	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-11.4	173.6	72.9	-36.1	0	0	0	113.1	Y1207 T1211 P1226	Y1207-D1209 WeakPolarHBondContact CB-OD1 3.21Å; Y1207-D1209 PolarHBondContact O-N 3.39Å; D1209-T1211 VanDerWaalsContact OD1-CB 3.24Å; D1209-T1211 WeakPolarHBondContact OD1-CB 3.45Å; D1209-T1211 PolarHBondContact OD1-N 3.4Å; D1209-T1211 PolarHBondContact OD1-OG1 2.71Å; D1209-T1211 VanDerWaalsContact OD2-CB 3.31Å; D1209-T1211 WeakPolarHBondContact OD2-CB 3.32Å; D1209-T1211 PolarHBondContact OD2-OG1 3.44Å; D1209-P1226 WeakPolarHBondContact O-CG 3.34Å
1210	G	92.8	Very high	95.9	Very high	42 Å²	42	70.5 Å²	70.5	43%	0.433	37%	0.373	S	S	.	.	S	Bend	trans	92.7	3	-172.1	0	0	0	0	0	114.2	Y1207 P1208	Y1207-G1210 PolarHBondContact O-N 3.22Å; P1208-G1210 PolarHBondContact O-N 3.5Å
1211	T	95.4	Very high	96	Very high	12 Å²	12	69.8 Å²	69.8	7%	0.074	35%	0.352	C	S	.	.			trans	-71.8	136.2	173.7	-68.9	0	0	0	0	109.8	Y1207 D1209 K1213 T1223 R1224 P1226	Y1207-T1211 HydrophobicContact CD2-CG2 4.41Å; Y1207-T1211 WeakPolarHBondContact CD2-O 3.02Å; Y1207-T1211 PolarHBondContact N-O 3.4Å; D1209-T1211 VanDerWaalsContact OD1-CB 3.24Å; D1209-T1211 WeakPolarHBondContact OD1-CB 3.45Å; D1209-T1211 PolarHBondContact OD1-N 3.4Å; D1209-T1211 PolarHBondContact OD1-OG1 2.71Å; D1209-T1211 VanDerWaalsContact OD2-CB 3.31Å; D1209-T1211 WeakPolarHBondContact OD2-CB 3.32Å; D1209-T1211 PolarHBondContact OD2-OG1 3.44Å; T1211-K1213 HydrophobicContact CG2-CG 4.19Å; T1211-T1223 HydrophobicContact CG2-CG2 4.06Å; T1211-R1224 WeakPolarHBondContact CA-O 3.47Å; T1211-P1226 WeakPolarHBondContact OG1-CD 3.47Å
1212	V	97.6	Very high	96.1	Very high	29 Å²	29	65 Å²	65	18%	0.176	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.7	177.6	177.1	0	0	0	0	109.8	R1204 R1205 E1206 T1223 R1224	R1204-V1212 VanDerWaalsContact CD-CG1 3.48Å; R1204-V1212 HydrophobicContact CG-CG1 3.56Å; R1205-V1212 WeakPolarHBondContact O-CA 3.45Å; E1206-V1212 HydrophobicContact CB-CG2 4.31Å; E1206-V1212 HydrophobicContact CG-CG1 4.15Å; E1206-V1212 HydrophobicContact CG-CG2 4.07Å; V1212-T1223 WeakPolarHBondContact O-CA 3.27Å; V1212-R1224 HydrophobicContact CB-CB 4.31Å; V1212-R1224 PolarHBondContact N-O 3.27Å; V1212-R1224 PolarHBondContact O-N 2.76Å
1213	K	97.2	Very high	96.1	Very high	94 Å²	94	63.9 Å²	63.9	41%	0.409	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.3	177	-64.3	-175.2	-178.3	176.5	0	109.8	R1204 R1205 Y1207 T1211 E1222 T1223	R1204-K1213 CarbonylContact C-O 3.53Å; R1204-K1213 VanDerWaalsContact CA-O 3.31Å; R1204-K1213 WeakPolarHBondContact CA-O 3.49Å; R1205-K1213 PolarHBondContact N-O 2.95Å; R1205-K1213 PolarHBondContact O-N 3.05Å; Y1207-K1213 HydrophobicContact CE2-CB 4.33Å; Y1207-K1213 HydrophobicContact CE2-CD 3.9Å; Y1207-K1213 HydrophobicContact CE2-CG 4.03Å; T1211-K1213 HydrophobicContact CG2-CG 4.19Å; K1213-E1222 CarbonylContact C-O 3.57Å; K1213-E1222 WeakPolarHBondContact CA-O 3.43Å; K1213-T1223 HydrophobicContact CG-CG2 4.09Å
1214	T	97.6	Very high	96	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.3	178	-54.2	0	0	0	0	110.3	Y1202 K1203 R1204 Y1216 Q1221 E1222	Y1202-T1214 HydrophobicContact CD1-CG2 4.45Å; Y1202-T1214 HydrophobicContact CD2-CG2 3.69Å; Y1202-T1214 HydrophobicContact CE2-CG2 4.47Å; Y1202-T1214 HydrophobicContact CG-CG2 3.68Å; K1203-T1214 CarbonylContact O-C 3.55Å; K1203-T1214 WeakPolarHBondContact O-CA 3.5Å; R1204-T1214 HydrophobicContact CB-CG2 4.26Å; R1204-T1214 WeakPolarHBondContact CG-OG1 3.23Å; R1204-T1214 PolarHBondContact NE-OG1 3.4Å; R1204-T1214 VanDerWaalsContact NE-OG1 3.16Å; T1214-Y1216 HydrophobicContact CG2-CD2 4.17Å; T1214-Y1216 HydrophobicContact CG2-CE1 4.16Å; T1214-Y1216 HydrophobicContact CG2-CE2 3.7Å; T1214-Q1221 CarbonylContact O-C 3.51Å; T1214-Q1221 WeakPolarHBondContact O-CA 3.5Å; T1214-E1222 PolarHBondContact N-O 3.45Å; T1214-E1222 PolarHBondContact O-N 2.63Å
1215	V	97.6	Very high	95.9	Very high	65 Å²	65	63.8 Å²	63.8	39%	0.394	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.4	174.5	-177.3	0	0	0	0	108.6	Y1202 K1203 R1220 Q1221	Y1202-V1215 CarbonylContact C-O 3.56Å; Y1202-V1215 VanDerWaalsContact CA-O 3.24Å; Y1202-V1215 WeakPolarHBondContact CA-O 3.23Å; Y1202-V1215 WeakPolarHBondContact CB-O 3.36Å; K1203-V1215 PolarHBondContact N-O 3.44Å; K1203-V1215 PolarHBondContact O-N 2.83Å; V1215-R1220 WeakPolarHBondContact CA-O 3.21Å; V1215-Q1221 HydrophobicContact CG1-CG 4.39Å; V1215-Q1221 HydrophobicContact CG2-CG 4.2Å
1216	Y	96.8	Very high	95.7	Very high	56 Å²	56	63.5 Å²	63.5	22%	0.22	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	158.6	-178.3	-65.5	-92.7	0	0	0	111.7	E1201 Y1202 T1214 D1218 G1219 R1220 E1222	E1201-Y1216 WeakPolarHBondContact O-CA 3.28Å; Y1202-Y1216 HydrophobicContact CD1-CD1 4.34Å; Y1202-Y1216 HydrophobicContact CD1-CE1 4.05Å; Y1202-Y1216 HydrophobicContact CG-CD1 4.47Å; Y1202-Y1216 HydrophobicContact CG-CE1 4.39Å; T1214-Y1216 HydrophobicContact CG2-CD2 4.17Å; T1214-Y1216 HydrophobicContact CG2-CE1 4.16Å; T1214-Y1216 HydrophobicContact CG2-CE2 3.7Å; Y1216-D1218 PolarHBondContact O-N 3.38Å; Y1216-G1219 PolarHBondContact O-N 3.3Å; Y1216-R1220 HydrophobicContact CD2-CB 4.28Å; Y1216-R1220 PolarHBondContact N-O 2.94Å; Y1216-E1222 HydrophobicContact CE2-CB 4.29Å; Y1216-E1222 HydrophobicContact CE2-CG 3.83Å; Y1216-E1222 WeakPolarHBondContact CE2-OE1 3.32Å; Y1216-E1222 PolarHBondContact OH-OE1 2.92Å
1217	T	95.9	Very high	95.5	Very high	119 Å²	119	64.3 Å²	64.3	73%	0.73	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.5	178.9	48.9	0	0	0	0	114.5	E1201 G1219	E1201-T1217 PolarHBondContact O-N 2.81Å; E1201-T1217 PolarHBondContact O-OG1 3.47Å; T1217-G1219 VanDerWaalsContact C-N 3.27Å
1218	D	94.1	Very high	95.2	Very high	76 Å²	76	63.5 Å²	63.5	41%	0.406	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.6	170.9	85.8	-22.7	0	0	0	113.9	Y1216 R1220	Y1216-D1218 PolarHBondContact O-N 3.38Å; D1218-R1220 WeakPolarHBondContact OD1-CB 3.44Å; D1218-R1220 WeakPolarHBondContact OD1-CG 3.31Å; D1218-R1220 PolarHBondContact OD1-N 2.84Å; D1218-R1220 VanDerWaalsContact OD1-N 3.08Å; D1218-R1220 IonicContact OD1-NE 2.68Å; D1218-R1220 IonicContact OD2-CZ 3.9Å; D1218-R1220 VanDerWaalsContact OD2-CZ 3.23Å; D1218-R1220 IonicContact OD2-NE 3.51Å; D1218-R1220 PolarHBondContact OD2-NE 3.08Å; D1218-R1220 IonicContact OD2-NH2 2.62Å; D1218-R1220 PolarHBondContact OD2-NH2 3.45Å
1219	G	92.7	Very high	95.1	Very high	24 Å²	24	62 Å²	62	25%	0.247	34%	0.335	C	S	.	.	S	Bend	trans	91.3	-6.4	178.5	0	0	0	0	0	115.1	Y1216 T1217 K1235	Y1216-G1219 PolarHBondContact O-N 3.3Å; T1217-G1219 VanDerWaalsContact C-N 3.27Å; G1219-K1235 WeakPolarHBondContact O-CA 3.37Å
1220	R	95.1	Very high	95.1	Very high	139 Å²	139	59.3 Å²	59.3	53%	0.525	32%	0.321	S	S	.	.			trans	-63.8	148.6	174.4	-71.7	-178.1	-131.6	-155.1	1.6	112	V1215 Y1216 D1218 K1233	V1215-R1220 WeakPolarHBondContact CA-O 3.21Å; Y1216-R1220 HydrophobicContact CD2-CB 4.28Å; Y1216-R1220 PolarHBondContact N-O 2.94Å; D1218-R1220 WeakPolarHBondContact OD1-CB 3.44Å; D1218-R1220 WeakPolarHBondContact OD1-CG 3.31Å; D1218-R1220 PolarHBondContact OD1-N 2.84Å; D1218-R1220 VanDerWaalsContact OD1-N 3.08Å; D1218-R1220 IonicContact OD1-NE 2.68Å; D1218-R1220 IonicContact OD2-CZ 3.9Å; D1218-R1220 VanDerWaalsContact OD2-CZ 3.23Å; D1218-R1220 IonicContact OD2-NE 3.51Å; D1218-R1220 PolarHBondContact OD2-NE 3.08Å; D1218-R1220 IonicContact OD2-NH2 2.62Å; D1218-R1220 PolarHBondContact OD2-NH2 3.45Å; R1220-K1233 WeakPolarHBondContact CA-O 3.3Å
1221	Q	97	Very high	95.3	Very high	84 Å²	84	59.3 Å²	59.3	39%	0.393	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	114.6	177.6	-47.8	-178.1	4.6	0	0	110.2	T1214 V1215 V1232 K1233	T1214-Q1221 CarbonylContact O-C 3.51Å; T1214-Q1221 WeakPolarHBondContact O-CA 3.5Å; V1215-Q1221 HydrophobicContact CG1-CG 4.39Å; V1215-Q1221 HydrophobicContact CG2-CG 4.2Å; Q1221-V1232 CarbonylContact O-C 3.54Å; Q1221-V1232 VanDerWaalsContact O-CA 3.3Å; Q1221-V1232 WeakPolarHBondContact O-CA 3.47Å; Q1221-K1233 HydrophobicContact CB-CB 4.3Å; Q1221-K1233 PolarHBondContact N-O 3.39Å; Q1221-K1233 PolarHBondContact O-N 2.94Å
1222	E	96.5	Very high	95.3	Very high	32 Å²	32	59.6 Å²	59.6	15%	0.15	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.5	169.6	-74.8	-176.1	-144.2	0	0	110.5	K1213 T1214 Y1216 R1224 L1230 V1232	K1213-E1222 CarbonylContact C-O 3.57Å; K1213-E1222 WeakPolarHBondContact CA-O 3.43Å; T1214-E1222 PolarHBondContact N-O 3.45Å; T1214-E1222 PolarHBondContact O-N 2.63Å; Y1216-E1222 HydrophobicContact CE2-CB 4.29Å; Y1216-E1222 HydrophobicContact CE2-CG 3.83Å; Y1216-E1222 WeakPolarHBondContact CE2-OE1 3.32Å; Y1216-E1222 PolarHBondContact OH-OE1 2.92Å; E1222-R1224 IonicContact OE1-NH2 2.79Å; E1222-R1224 IonicContact OE2-CZ 3.18Å; E1222-R1224 VanDerWaalsContact OE2-CZ 3.27Å; E1222-R1224 IonicContact OE2-NE 3.75Å; E1222-R1224 PolarHBondContact OE2-NE 3.12Å; E1222-R1224 IonicContact OE2-NH2 3.97Å; E1222-R1224 PolarHBondContact OE2-NH2 2.88Å; E1222-L1230 HydrophobicContact CB-CD1 4.08Å; E1222-L1230 HydrophobicContact CG-CD1 4.12Å; E1222-V1232 HydrophobicContact CG-CG1 4.02Å; E1222-V1232 HydrophobicContact CG-CG2 3.98Å
1223	T	96.9	Very high	95.3	Very high	22 Å²	22	59.6 Å²	59.6	14%	0.135	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.8	163.7	-58.4	0	0	0	0	108.9	T1211 V1212 K1213 Y1225 R1231	T1211-T1223 HydrophobicContact CG2-CG2 4.06Å; V1212-T1223 WeakPolarHBondContact O-CA 3.27Å; K1213-T1223 HydrophobicContact CG-CG2 4.09Å; T1223-Y1225 HydrophobicContact CG2-CD1 4.22Å; T1223-Y1225 HydrophobicContact CG2-CD2 4.13Å; T1223-Y1225 HydrophobicContact CG2-CE1 3.85Å; T1223-Y1225 HydrophobicContact CG2-CE2 3.75Å; T1223-Y1225 HydrophobicContact CG2-CG 4.37Å; T1223-R1231 PolarHBondContact N-O 2.8Å; T1223-R1231 PolarHBondContact O-N 2.93Å
1224	R	95.6	Very high	95.2	Very high	114 Å²	114	57 Å²	57	43%	0.43	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.2	170.7	-63.7	168.9	-169.4	-160	2.6	107	T1211 V1212 E1222 L1230	T1211-R1224 WeakPolarHBondContact CA-O 3.47Å; V1212-R1224 HydrophobicContact CB-CB 4.31Å; V1212-R1224 PolarHBondContact N-O 3.27Å; V1212-R1224 PolarHBondContact O-N 2.76Å; E1222-R1224 IonicContact OE1-NH2 2.79Å; E1222-R1224 IonicContact OE2-CZ 3.18Å; E1222-R1224 VanDerWaalsContact OE2-CZ 3.27Å; E1222-R1224 IonicContact OE2-NE 3.75Å; E1222-R1224 PolarHBondContact OE2-NE 3.12Å; E1222-R1224 IonicContact OE2-NH2 3.97Å; E1222-R1224 PolarHBondContact OE2-NH2 2.88Å; R1224-L1230 HydrophobicContact CG-CD1 3.61Å
1225	Y	95.3	Very high	95.1	Very high	49 Å²	49	63.6 Å²	63.6	19%	0.192	33%	0.326	C	S	.	.			trans	-88.9	158.5	177.7	-63.2	-85.6	0	0	0	110.4	T1223 T1227 G1228 R1229 R1231	T1223-Y1225 HydrophobicContact CG2-CD1 4.22Å; T1223-Y1225 HydrophobicContact CG2-CD2 4.13Å; T1223-Y1225 HydrophobicContact CG2-CE1 3.85Å; T1223-Y1225 HydrophobicContact CG2-CE2 3.75Å; T1223-Y1225 HydrophobicContact CG2-CG 4.37Å; Y1225-T1227 PolarHBondContact O-N 3.46Å; Y1225-G1228 PolarHBondContact O-N 3.03Å; Y1225-R1229 HydrophobicContact CD2-CB 4.06Å; Y1225-R1229 HydrophobicContact CD2-CG 3.97Å; Y1225-R1229 WeakPolarHBondContact CD2-O 3.28Å; Y1225-R1229 HydrophobicContact CE2-CG 4.47Å; Y1225-R1229 PolarHBondContact N-O 2.95Å; Y1225-R1231 HydrophobicContact CE2-CB 4.1Å
1226	P	93.8	Very high	94.9	Very high	61 Å²	61	65.5 Å²	65.5	40%	0.396	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22	179.7	-22.3	31.6	0	0	0	113.8	D1209 T1211 G1228	D1209-P1226 WeakPolarHBondContact O-CG 3.34Å; T1211-P1226 WeakPolarHBondContact OG1-CD 3.47Å; P1226-G1228 PolarHBondContact O-N 3.19Å
1227	T	92.5	Very high	94.6	Very high	74 Å²	74	64.5 Å²	64.5	45%	0.454	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	7.6	176.7	56	0	0	0	0	114.1	Y1225 R1229	Y1225-T1227 PolarHBondContact O-N 3.46Å; T1227-R1229 PolarHBondContact O-N 3.3Å
1228	G	89.2	Confident	94.5	Very high	51 Å²	51	63.4 Å²	63.4	53%	0.526	33%	0.331	S	S	.	.	S	Bend	trans	75.5	-4.1	-176.3	0	0	0	0	0	114.8	Y1225 P1226 L1230	Y1225-G1228 PolarHBondContact O-N 3.03Å; P1226-G1228 PolarHBondContact O-N 3.19Å; G1228-L1230 PolarHBondContact O-N 2.9Å
1229	R	93.5	Very high	94.5	Very high	60 Å²	60	62.8 Å²	62.8	23%	0.226	33%	0.329	C	S	.	.			trans	-63.8	127.7	173.1	178	-174	176.3	-155.7	1.1	110.1	Y1225 T1227 D1242	Y1225-R1229 HydrophobicContact CD2-CB 4.06Å; Y1225-R1229 HydrophobicContact CD2-CG 3.97Å; Y1225-R1229 WeakPolarHBondContact CD2-O 3.28Å; Y1225-R1229 HydrophobicContact CE2-CG 4.47Å; Y1225-R1229 PolarHBondContact N-O 2.95Å; T1227-R1229 PolarHBondContact O-N 3.3Å; R1229-D1242 IonicContact CZ-OD1 2.79Å; R1229-D1242 VanDerWaalsContact CZ-OD1 3.29Å; R1229-D1242 IonicContact CZ-OD2 3.56Å; R1229-D1242 IonicContact NE-OD1 3.69Å; R1229-D1242 PolarHBondContact NE-OD1 2.81Å; R1229-D1242 VanDerWaalsContact NH2-CG 3.29Å; R1229-D1242 IonicContact NH2-OD1 3.22Å; R1229-D1242 PolarHBondContact NH2-OD1 3.44Å; R1229-D1242 IonicContact NH2-OD2 3.63Å; R1229-D1242 PolarHBondContact NH2-OD2 3.43Å
1230	L	94.8	Very high	94.6	Very high	42 Å²	42	66.7 Å²	66.7	22%	0.22	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.3	172	172.7	65.4	0	0	0	110	E1222 R1224 G1228 V1232 L1241 D1242 N1243	E1222-L1230 HydrophobicContact CB-CD1 4.08Å; E1222-L1230 HydrophobicContact CG-CD1 4.12Å; R1224-L1230 HydrophobicContact CG-CD1 3.61Å; G1228-L1230 PolarHBondContact O-N 2.9Å; L1230-V1232 HydrophobicContact CD1-CG2 3.98Å; L1230-V1232 HydrophobicContact CD2-CG2 4.18Å; L1230-V1232 HydrophobicContact CG-CG2 3.86Å; L1230-L1241 HydrophobicContact CD2-CD2 4.12Å; L1230-D1242 CarbonylContact O-C 3.57Å; L1230-D1242 WeakPolarHBondContact O-CA 3.43Å; L1230-N1243 PolarHBondContact O-N 3.41Å
1231	R	95.4	Very high	94.5	Very high	42 Å²	42	64.2 Å²	64.2	16%	0.158	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.9	171.2	-176.7	-177.1	179.6	-169.4	-0.3	109	D668 T1223 Y1225 V1239 L1241	D668-R1231 IonicContact OD2-NH1 2.99Å; T1223-R1231 PolarHBondContact N-O 2.8Å; T1223-R1231 PolarHBondContact O-N 2.93Å; Y1225-R1231 HydrophobicContact CE2-CB 4.1Å; R1231-V1239 HydrophobicContact CG-CG1 4Å; R1231-L1241 CarbonylContact C-O 3.59Å; R1231-L1241 WeakPolarHBondContact CA-O 3.45Å
1232	V	96.8	Very high	94.3	Very high	18 Å²	18	62 Å²	62	11%	0.109	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.7	-179.4	-165.4	0	0	0	0	109.4	Q1221 E1222 L1230 V1239 V1240 L1241	Q1221-V1232 CarbonylContact O-C 3.54Å; Q1221-V1232 VanDerWaalsContact O-CA 3.3Å; Q1221-V1232 WeakPolarHBondContact O-CA 3.47Å; E1222-V1232 HydrophobicContact CG-CG1 4.02Å; E1222-V1232 HydrophobicContact CG-CG2 3.98Å; L1230-V1232 HydrophobicContact CD1-CG2 3.98Å; L1230-V1232 HydrophobicContact CD2-CG2 4.18Å; L1230-V1232 HydrophobicContact CG-CG2 3.86Å; V1232-V1239 CarbonylContact O-C 3.59Å; V1232-V1239 WeakPolarHBondContact O-CA 3.46Å; V1232-V1240 PolarHBondContact O-N 3.03Å; V1232-L1241 HydrophobicContact CB-CB 4.06Å; V1232-L1241 HydrophobicContact CG2-CB 3.93Å; V1232-L1241 HydrophobicContact CG2-CD2 4.05Å; V1232-L1241 HydrophobicContact CG2-CG 4.4Å; V1232-L1241 PolarHBondContact N-O 3.31Å; V1232-L1241 PolarHBondContact O-N 2.91Å
1233	K	97	Very high	93.9	Very high	29 Å²	29	64.8 Å²	64.8	13%	0.126	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	145.3	167.5	-69.5	-175.3	168	-172.6	0	109.7	D669 R1220 Q1221 G1237 N1238 V1239	D669-K1233 IonicContact OD1-NZ 2.74Å; D669-K1233 PolarHBondContact OD1-NZ 3.36Å; D669-K1233 IonicContact OD2-NZ 2.77Å; R1220-K1233 WeakPolarHBondContact CA-O 3.3Å; Q1221-K1233 HydrophobicContact CB-CB 4.3Å; Q1221-K1233 PolarHBondContact N-O 3.39Å; Q1221-K1233 PolarHBondContact O-N 2.94Å; K1233-G1237 VanDerWaalsContact CD-O 3.28Å; K1233-G1237 WeakPolarHBondContact CD-O 3.47Å; K1233-G1237 WeakPolarHBondContact CG-O 3.18Å; K1233-N1238 CarbonylContact C-O 3.5Å; K1233-N1238 VanDerWaalsContact CA-O 3.22Å; K1233-N1238 WeakPolarHBondContact CA-O 3.35Å; K1233-V1239 HydrophobicContact CG-CG2 4.26Å
1234	D	95.5	Very high	93.3	Very high	39 Å²	39	71.5 Å²	71.5	21%	0.209	37%	0.374	C	S	.	.			trans	-77.1	176.6	163.7	62.7	28.9	0	0	0	111.9	D1236 G1237 N1238 V1240	D1234-D1236 PolarHBondContact O-N 2.91Å; D1234-D1236 VanDerWaalsContact O-N 3.14Å; D1234-D1236 VanDerWaalsContact OD1-C 3.26Å; D1234-D1236 WeakPolarHBondContact OD1-CA 3.48Å; D1234-D1236 WeakPolarHBondContact OD1-CB 3.28Å; D1234-D1236 PolarHBondContact OD1-N 3.38Å; D1234-G1237 PolarHBondContact O-N 3.07Å; D1234-G1237 PolarHBondContact OD1-N 3.35Å; D1234-N1238 PolarHBondContact N-O 3.39Å; D1234-N1238 PolarHBondContact OD1-N 3.49Å; D1234-N1238 PolarHBondContact OD1-ND2 2.9Å; D1234-N1238 VanDerWaalsContact OD1-ND2 3.12Å; D1234-N1238 WeakPolarHBondContact OD2-CB 3.48Å; D1234-N1238 PolarHBondContact OD2-ND2 2.88Å; D1234-V1240 HydrophobicContact CB-CG2 3.66Å
1235	K	95.3	Very high	91.5	Very high	140 Å²	140	71.8 Å²	71.8	61%	0.609	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.6	175.7	63.9	168.9	-177.4	69.9	0	114.5	G1219	G1219-K1235 WeakPolarHBondContact O-CA 3.37Å
1236	D	93.8	Very high	89.4	Confident	105 Å²	105	77.8 Å²	77.8	56%	0.561	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	8.1	-178.9	-53.9	-56.8	0	0	0	110.9	D1234 N1238	D1234-D1236 PolarHBondContact O-N 2.91Å; D1234-D1236 VanDerWaalsContact O-N 3.14Å; D1234-D1236 VanDerWaalsContact OD1-C 3.26Å; D1234-D1236 WeakPolarHBondContact OD1-CA 3.48Å; D1234-D1236 WeakPolarHBondContact OD1-CB 3.28Å; D1234-D1236 PolarHBondContact OD1-N 3.38Å; D1236-N1238 WeakPolarHBondContact CB-ND2 3.32Å; D1236-N1238 PolarHBondContact O-ND2 3.39Å
1237	G	91.1	Very high	87.2	Confident	34 Å²	34	80.7 Å²	80.7	35%	0.351	43%	0.432	S	S	.	.	S	Bend	trans	86.4	-6.3	176.4	0	0	0	0	0	115.6	K1233 D1234	K1233-G1237 VanDerWaalsContact CD-O 3.28Å; K1233-G1237 WeakPolarHBondContact CD-O 3.47Å; K1233-G1237 WeakPolarHBondContact CG-O 3.18Å; D1234-G1237 PolarHBondContact O-N 3.07Å; D1234-G1237 PolarHBondContact OD1-N 3.35Å
1238	N	93.4	Very high	84.9	Confident	97 Å²	97	81.8 Å²	81.8	52%	0.519	45%	0.449	S	S	.	.			trans	-77.6	138.6	-173.2	-49.3	-84.5	0	0	0	111	K1233 D1234 D1236 V1240	K1233-N1238 CarbonylContact C-O 3.5Å; K1233-N1238 VanDerWaalsContact CA-O 3.22Å; K1233-N1238 WeakPolarHBondContact CA-O 3.35Å; D1234-N1238 PolarHBondContact N-O 3.39Å; D1234-N1238 PolarHBondContact OD1-N 3.49Å; D1234-N1238 PolarHBondContact OD1-ND2 2.9Å; D1234-N1238 VanDerWaalsContact OD1-ND2 3.12Å; D1234-N1238 WeakPolarHBondContact OD2-CB 3.48Å; D1234-N1238 PolarHBondContact OD2-ND2 2.88Å; D1236-N1238 WeakPolarHBondContact CB-ND2 3.32Å; D1236-N1238 PolarHBondContact O-ND2 3.39Å; N1238-V1240 PolarHBondContact O-N 3.49Å; N1238-V1240 VanDerWaalsContact O-N 3.14Å
1239	V	94.3	Very high	82.7	Confident	63 Å²	63	83.2 Å²	83.2	38%	0.382	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	104.5	179.5	-175.4	0	0	0	0	110	R1231 V1232 K1233 L1241 D1242	R1231-V1239 HydrophobicContact CG-CG1 4Å; V1232-V1239 CarbonylContact O-C 3.59Å; V1232-V1239 WeakPolarHBondContact O-CA 3.46Å; K1233-V1239 HydrophobicContact CG-CG2 4.26Å; V1239-L1241 WeakPolarHBondContact CG1-O 3.36Å; V1239-D1242 HydrophobicContact CG1-CB 3.83Å
1240	V	94.2	Very high	80.5	Confident	105 Å²	105	86.1 Å²	86.1	64%	0.636	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	-32.9	179.2	-168.4	0	0	0	0	111.5	V1232 D1234 N1238	V1232-V1240 PolarHBondContact O-N 3.03Å; D1234-V1240 HydrophobicContact CB-CG2 3.66Å; N1238-V1240 PolarHBondContact O-N 3.49Å; N1238-V1240 VanDerWaalsContact O-N 3.14Å
1241	L	92.1	Very high	78.2	Confident	87 Å²	87	91.4 Å²	91.4	46%	0.455	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.4	178.4	-178.9	67.6	0	0	0	109.4	L1230 R1231 V1232 V1239	L1230-L1241 HydrophobicContact CD2-CD2 4.12Å; R1231-L1241 CarbonylContact C-O 3.59Å; R1231-L1241 WeakPolarHBondContact CA-O 3.45Å; V1232-L1241 HydrophobicContact CB-CB 4.06Å; V1232-L1241 HydrophobicContact CG2-CB 3.93Å; V1232-L1241 HydrophobicContact CG2-CD2 4.05Å; V1232-L1241 HydrophobicContact CG2-CG 4.4Å; V1232-L1241 PolarHBondContact N-O 3.31Å; V1232-L1241 PolarHBondContact O-N 2.91Å; V1239-L1241 WeakPolarHBondContact CG1-O 3.36Å
1242	D	93.9	Very high	76.1	Confident	39 Å²	39	98.5 Å²	98.5	21%	0.209	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	83.7	172	-171	-0	0	0	0	107.7	R1229 L1230 V1239 R1244	R1229-D1242 IonicContact CZ-OD1 2.79Å; R1229-D1242 VanDerWaalsContact CZ-OD1 3.29Å; R1229-D1242 IonicContact CZ-OD2 3.56Å; R1229-D1242 IonicContact NE-OD1 3.69Å; R1229-D1242 PolarHBondContact NE-OD1 2.81Å; R1229-D1242 VanDerWaalsContact NH2-CG 3.29Å; R1229-D1242 IonicContact NH2-OD1 3.22Å; R1229-D1242 PolarHBondContact NH2-OD1 3.44Å; R1229-D1242 IonicContact NH2-OD2 3.63Å; R1229-D1242 PolarHBondContact NH2-OD2 3.43Å; L1230-D1242 CarbonylContact O-C 3.57Å; L1230-D1242 WeakPolarHBondContact O-CA 3.43Å; V1239-D1242 HydrophobicContact CG1-CB 3.83Å; D1242-R1244 PolarHBondContact O-N 3.13Å; D1242-R1244 WeakPolarHBondContact OD1-CG 3.48Å; D1242-R1244 IonicContact OD1-NE 2.75Å; D1242-R1244 IonicContact OD2-CZ 2.81Å; D1242-R1244 IonicContact OD2-NE 3.04Å; D1242-R1244 PolarHBondContact OD2-NE 3.44Å; D1242-R1244 IonicContact OD2-NH2 3.99Å; D1242-R1244 PolarHBondContact OD2-NH2 2.81Å
1243	N	88.8	Confident	73.6	Confident	89 Å²	89	105.5 Å²	105.5	48%	0.476	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.3	74.7	-179.1	-169.4	24.3	0	0	0	109.8	L1230 L1245	L1230-N1243 PolarHBondContact O-N 3.41Å; N1243-L1245 PolarHBondContact O-N 3.29Å; N1243-L1245 VanDerWaalsContact O-N 3.16Å
1244	R	82.4	Confident	70.9	Confident	164 Å²	164	117.3 Å²	117.3	62%	0.619	63%	0.629	S	S	*	*			trans	-70.9	101.8	168.5	-58.2	-177.8	-168.7	-165.7	2.3	107.3	D1242 Q1246	D1242-R1244 PolarHBondContact O-N 3.13Å; D1242-R1244 WeakPolarHBondContact OD1-CG 3.48Å; D1242-R1244 IonicContact OD1-NE 2.75Å; D1242-R1244 IonicContact OD2-CZ 2.81Å; D1242-R1244 IonicContact OD2-NE 3.04Å; D1242-R1244 PolarHBondContact OD2-NE 3.44Å; D1242-R1244 IonicContact OD2-NH2 3.99Å; D1242-R1244 PolarHBondContact OD2-NH2 2.81Å; R1244-Q1246 PolarHBondContact O-N 3Å
1245	L	59.1	Low	69.6	Low	120 Å²	120	121.2 Å²	121.2	63%	0.628	65%	0.65	S	S	*	*			trans	-51.2	109	162	-73.9	167.6	0	0	0	107.6	N1243	N1243-L1245 PolarHBondContact O-N 3.29Å; N1243-L1245 VanDerWaalsContact O-N 3.16Å
1246	Q	50.2	Low	68.3	Low	175 Å²	175	120.2 Å²	120.2	82%	0.818	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-71.5	134.6	171	-62.3	-172.4	22.2	0	0	106.9	R1244 A1248	R1244-Q1246 PolarHBondContact O-N 3Å; Q1246-A1248 PolarHBondContact O-N 2.92Å
1247	P	48.6	Very low	66.9	Low	121 Å²	121	121.1 Å²	121.1	79%	0.786	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-57.4	132.8	166.2	26.9	-33	0	0	0	107.6	A1249	P1247-A1249 PolarHBondContact O-N 2.96Å; P1247-A1249 VanDerWaalsContact O-N 3.16Å
1248	A	44.1	Very low	65.4	Low	97 Å²	97	126.2 Å²	126.2	80%	0.802	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-55.6	124.6	178.9	0	0	0	0	0	109	Q1246	Q1246-A1248 PolarHBondContact O-N 2.92Å
1249	A	42.3	Very low	63.7	Low	82 Å²	82	128 Å²	128	68%	0.678	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.9	130.2	175.6	0	0	0	0	0	108.3	P1247 N1251	P1247-A1249 PolarHBondContact O-N 2.96Å; P1247-A1249 VanDerWaalsContact O-N 3.16Å; A1249-N1251 PolarHBondContact O-N 3.22Å
1250	P	48.4	Very low	61.7	Low	120 Å²	120	132.3 Å²	132.3	78%	0.779	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-60.8	125.8	176.6	24.9	-32.9	0	0	0	108.7	Q1252	P1250-Q1252 PolarHBondContact O-N 3.3Å
1251	N	45.8	Very low	59.3	Low	154 Å²	154	134.3 Å²	134.3	82%	0.824	71%	0.71	S	S	*	*			trans	-59.2	112.7	-178	-83.9	-31.6	0	0	0	110.1	A1249 H1253	A1249-N1251 PolarHBondContact O-N 3.22Å; N1251-H1253 PolarHBondContact O-N 2.93Å; N1251-H1253 VanDerWaalsContact O-N 3.13Å
1252	Q	50.9	Low	56.8	Low	191 Å²	191	137.9 Å²	137.9	89%	0.893	73%	0.73	S	S	*	*			trans	-75.3	98.3	166.3	-73.3	-171.6	-16.6	0	0	109.1	P1250	P1250-Q1252 PolarHBondContact O-N 3.3Å
1253	H	44.3	Very low	53.7	Low	164 Å²	164	146.2 Å²	146.2	76%	0.759	77%	0.773	S	S	*	*			trans	-130.4	94.7	164.4	-98.5	-80.8	0	0	0	109.8	N1251	N1251-H1253 PolarHBondContact O-N 2.93Å; N1251-H1253 VanDerWaalsContact O-N 3.13Å
1254	F	39.9	Very low	50.5	Low	277 Å²	277	151.4 Å²	151.4	100%	1.215	80%	0.8	S	S	*	*			trans	39.5	0	163.1	-73.6	-84.6	0	0	0	118.3

Retrieved 1,254 of 1,254 residues in 910.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).