A0A077Z4J3_TRITR Loading...

B box type zinc finger protein ncl 1

AlphaFold DB , UniProt , Accession A0A077Z4J3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 958 aa.

						>A0A077Z4J3_TRITR|A0A077Z4J3
MTSPESVTESATDSSNSSFGTAGPEVAVGSAVTSPTPNAFGSPLSSNFQVNFGPFGALQQQFSSFNATGSQFAYDFMGTPSHQHSSSTVVQVPVCNGSLSPASMKSAANVVLSANLTRCPLCGEIFDQPKVLACFHTFCKPCLEKQIESPGRINCPQCSLETQICTDQGVDSLLSDFAVINLQEQQKVRASSYAVSNSSSPTGDRGCKGDDGNQRLSATSNATSKGSGAALQTNCTGCKSKETLAVAHCYDCTNYLCTNCVMAHQYMHCFEGHRVVDLSQVEARDMERMVRCLQHRQEPLQYFCFSCNVPVCKECVASDHPRNVHHFEPITDVGTQQVQLVQQLLEEAKAKQVSLVESFKSVDTLSQRLNMSFQKASQEIMETASLLQQVVEEQRQQVQRELENAFNGKQVALNLVDRKLQQTMEKLSHTIDFTTRLLKYTNPTETLLFKKLLENRLTCVFSYNPDVNAASSSELEFVPNIPASRLAIMNTFGYVRQCADIPLLGKSTLAPISRPTVSASSGQQYCHPSAANLPISLSGHVMSVNGNHQMGSGSSSNPGGLIPSPPHVFGDSNLLQSKQYGDSSQSLGPFSNIGSGDAYSYEKWSTGGIDASGFHQPSSGNPLSCAIHQPIPGLISDSGIYTPSPLGDHQNGVVSGHQVVELSAKLMSTPITFFPPKSQIKRLKMIYHCKFGEFGVSEAQFTEPSGVAVSAQNDIIVADTNNHRIQIFDKEGRFKFQFGECGKRDGQLLYPNRVAVNRVSGDIVVTERSPTHQIQVYNQYGQFLRKFGANILQHPRGVTVDYKGRVVVVECKVMRVIIFDMYGNVLQKFGCSKYLEFPNGVVTNDRQEIFVSDNRAHSVKVFNYEGVYLRQIGGEGLTNYPIGVGINHLGEVVVADNHNNFNLTMFTQDGNLINALESKVKHAQCFDVALLDDGSVVLASKDYRLYIYRYLQVSPLGV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	38	Very low	237 Å²	237	144.6 Å²	144.6	100%	1.167	86%	0.857	S	S	*	*				0	123.2	0	-64.7	165	168.3	0	0	107.8
2	T	36.3	Very low	37.7	Very low	141 Å²	141	142.9 Å²	142.9	87%	0.865	85%	0.849	S	S	*	*			cis	-154.7	149.8	-32	-22	0	0	0	0	106.9
3	S	32.9	Very low	37.3	Very low	115 Å²	115	143.7 Å²	143.7	80%	0.804	85%	0.846	S	S	*	*			trans	-83.9	167.4	-164.5	-50	0	0	0	0	114.2
4	P	49.5	Very low	37.2	Very low	124 Å²	124	142.7 Å²	142.7	81%	0.805	85%	0.851	S	S	*	*			trans	-95.2	174.7	-172.3	39.3	-36.2	0	0	0	113.8
5	E	44.8	Very low	37	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	84%	0.844	S	S	*	*			trans	-129.2	159.4	170	-69.2	-169.4	126.6	0	0	112.3
6	S	33.7	Very low	37	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	85%	0.845	S	S	*	*			trans	-124.1	155.3	-177.9	54.4	0	0	0	0	111
7	V	43.3	Very low	36.9	Very low	139 Å²	139	139.5 Å²	139.5	84%	0.842	84%	0.839	S	S	*	*			trans	-130	134.5	170.3	-177.6	0	0	0	0	109.7
8	T	32.7	Very low	36.7	Very low	128 Å²	128	137.7 Å²	137.7	79%	0.785	83%	0.834	S	S	*	*			trans	-118.7	141.3	175.3	50.5	0	0	0	0	109.6
9	E	39.3	Very low	36.6	Very low	193 Å²	193	142.3 Å²	142.3	90%	0.902	84%	0.842	S	S	*	*			trans	-128.5	147.6	163.8	-73.2	-164.7	123	0	0	111
10	S	31.5	Very low	36.4	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	83%	0.832	S	S	*	*			trans	-158.2	123.1	-174.1	57.9	0	0	0	0	111.8
11	A	36.5	Very low	36.4	Very low	92 Å²	92	139.1 Å²	139.1	76%	0.76	84%	0.838	S	S	*	*			trans	-152.9	101.4	171.2	0	0	0	0	0	108
12	T	35	Very low	36.3	Very low	124 Å²	124	132.7 Å²	132.7	76%	0.761	82%	0.822	S	S	*	*				80.2	103.4	78.1	58.7	0	0	0	0	115.3
13	D	31.8	Very low	36.2	Very low	153 Å²	153	129.5 Å²	129.5	82%	0.818	82%	0.818	S	S	*	*			trans	39.3	132.1	140.5	-58.3	-35.2	0	0	0	123.1
14	S	36.9	Very low	36.5	Very low	130 Å²	130	130.3 Å²	130.3	91%	0.909	82%	0.82	S	S	*	*				-156.6	141.7	123.4	-81.5	0	0	0	0	110.7
15	S	33.9	Very low	35.5	Very low	108 Å²	108	132.8 Å²	132.8	76%	0.755	82%	0.821	S	S	*	*			trans	-127.9	147.4	-170.5	58.7	0	0	0	0	112.7
16	N	36.1	Very low	35.1	Very low	160 Å²	160	130.2 Å²	130.2	86%	0.856	82%	0.819	S	S	*	*			trans	174	156.3	157.1	-97.7	-45.6	0	0	0	109.6
17	S	35.6	Very low	34.8	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	82%	0.819	S	S	*	*			cis	-170	163.9	-42.9	43	0	0	0	0	107.5
18	S	32.9	Very low	34.4	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	82%	0.82	S	S	*	*			trans	-95.7	140.2	-166.7	57	0	0	0	0	114.9
19	F	35.2	Very low	34.3	Very low	224 Å²	224	126.4 Å²	126.4	98%	0.982	81%	0.812	S	S	*	*			trans	-152.4	155.6	144.7	-106.7	-76.8	0	0	0	110.1
20	G	32.4	Very low	34	Very low	62 Å²	62	123.5 Å²	123.5	64%	0.639	81%	0.813	S	S	*	*			trans	-158.4	179.3	179.9	0	0	0	0	0	112.9
21	T	36.5	Very low	33.8	Very low	156 Å²	156	122.6 Å²	122.6	96%	0.957	81%	0.813	S	S	*	*			trans	-158.6	168.4	175.1	10.4	0	0	0	0	109.8
22	A	35.9	Very low	33.7	Very low	102 Å²	102	125.1 Å²	125.1	84%	0.843	82%	0.818	S	S	*	*			trans	-133.1	143.6	-154.4	0	0	0	0	0	117
23	G	33.6	Very low	33.6	Very low	75 Å²	75	125.3 Å²	125.3	77%	0.773	82%	0.82	S	S	*	*			trans	72.3	-178.1	150.8	0	0	0	0	0	118.5
24	P	39.5	Very low	33.3	Very low	131 Å²	131	123 Å²	123	85%	0.851	82%	0.815	S	S	*	*			cis	-125.5	-164.5	-4.7	42.2	-27.2	0	0	0	114.1
25	E	29.2	Very low	33.2	Very low	177 Å²	177	122.6 Å²	122.6	83%	0.827	81%	0.81	S	S	*	*			trans	-69.7	154.4	-171.5	-54.3	151.3	104.3	0	0	115.9
26	V	35	Very low	32.9	Very low	144 Å²	144	123.6 Å²	123.6	87%	0.873	81%	0.811	S	S	*	*			trans	-140.1	133	140.4	-178.7	0	0	0	0	108.3
27	A	28.7	Very low	33	Very low	93 Å²	93	121.2 Å²	121.2	77%	0.769	81%	0.805	S	S	*	*			trans	-127.1	114.6	-179.8	0	0	0	0	0	112.5
28	V	35.5	Very low	32.8	Very low	141 Å²	141	124.4 Å²	124.4	86%	0.855	81%	0.813	S	S	*	*			trans	-150.5	141	165.5	-169.9	0	0	0	0	106.1
29	G	30.2	Very low	32.6	Very low	60 Å²	60	123 Å²	123	62%	0.619	81%	0.808	S	S	*	*			cis	141.7	135.2	-1.6	0	0	0	0	0	110.9
30	S	32.2	Very low	32.4	Very low	133 Å²	133	122.7 Å²	122.7	93%	0.93	81%	0.807	S	S	*	*			trans	74.6	131	172	-58.5	0	0	0	0	119.3
31	A	28.5	Very low	32.3	Very low	97 Å²	97	123.3 Å²	123.3	80%	0.802	81%	0.813	S	S	*	*			trans	-70.2	171.9	175.7	0	0	0	0	0	114.8
32	V	33.4	Very low	31.9	Very low	145 Å²	145	121.4 Å²	121.4	88%	0.879	81%	0.806	S	S	*	*				-158.2	161	127.8	134.2	0	0	0	0	110.4
33	T	32.3	Very low	32	Very low	128 Å²	128	121.6 Å²	121.6	79%	0.785	80%	0.799	S	S	*	*			trans	-75.5	164.9	-166.8	51.2	0	0	0	0	116.3
34	S	25.6	Very low	31.8	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	81%	0.807	S	S	*	*			trans	-65.6	166.2	158.5	65	0	0	0	0	111.3
35	P	35.5	Very low	31.1	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	80%	0.801	S	S	*	*				-145	179.4	67	40.4	-21.2	0	0	0	116.5
36	T	28.2	Very low	31.1	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	80%	0.802	S	S	*	*			trans	-92.9	-174.3	166.3	48	0	0	0	0	111
37	P	37.4	Very low	30.7	Very low	110 Å²	110	122.5 Å²	122.5	71%	0.714	80%	0.796	S	S	*	*			cis	-127.1	176.7	-49.3	35.8	-21.7	0	0	0	112.1
38	N	31.5	Very low	30.5	Very low	173 Å²	173	128.3 Å²	128.3	93%	0.925	81%	0.805	S	S	*	*			trans	-162.8	171.9	145.2	-115.1	-39.6	0	0	0	113.6
39	A	29.3	Very low	30	Very low	77 Å²	77	129.1 Å²	129.1	64%	0.636	80%	0.799	S	S	*	*			trans	-117.7	-170.6	-164.1	0	0	0	0	0	115.3
40	F	30.4	Very low	29.8	Very low	217 Å²	217	132.4 Å²	132.4	95%	0.952	81%	0.807	S	S	*	*			trans	84	128.9	178.4	-63.2	-87.1	0	0	0	117.5
41	G	30.3	Very low	29.4	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	80%	0.796	S	S	*	*			trans	151.5	84.6	176.3	0	0	0	0	0	113.5
42	S	28.8	Very low	29.4	Very low	116 Å²	116	137 Å²	137	81%	0.811	80%	0.798	S	S	*	*			trans	-152.3	164.9	179	-53	0	0	0	0	109.9
43	P	36.8	Very low	29.2	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	79%	0.79	S	S	*	*			cis	-128.9	-179.6	-42	38.2	-24.5	0	0	0	111.3
44	L	29.7	Very low	29.1	Very low	182 Å²	182	133.3 Å²	133.3	95%	0.953	79%	0.792	S	S	*	*			trans	-133.3	152.9	153.6	-84	178.1	0	0	0	110
45	S	25.5	Very low	29.3	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	80%	0.803	S	S	*	*			trans	-136.3	144	-162.3	-50.7	0	0	0	0	112.6
46	S	29.2	Very low	29.1	Very low	123 Å²	123	136.5 Å²	136.5	86%	0.86	80%	0.802	S	S	*	*			trans	-140.8	122.3	157.6	49.4	0	0	0	0	108.9
47	N	25.5	Very low	29	Very low	139 Å²	139	135.2 Å²	135.2	74%	0.743	81%	0.805	S	S	*	*			trans	-86.5	146.2	-177.6	-66.1	-48.4	0	0	0	110.8
48	F	25.4	Very low	28.4	Very low	216 Å²	216	138 Å²	138	95%	0.947	81%	0.813	S	S	*	*			trans	-133.8	120.6	141	-123	-91.3	0	0	0	108.5
49	Q	23.7	Very low	28.1	Very low	157 Å²	157	138.4 Å²	138.4	73%	0.734	81%	0.809	S	S	*	*			trans	-123.2	120	-168.4	-172.4	179.7	14.5	0	0	108.9
50	V	26.7	Very low	28	Very low	129 Å²	129	142.8 Å²	142.8	78%	0.782	82%	0.817	S	S	*	*			trans	-101.7	128.8	174.1	-171.3	0	0	0	0	108.2
51	N	23.2	Very low	27.7	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	81%	0.81	S	S	*	*			trans	-114.5	130.8	-163.5	-146.7	4	0	0	0	110.4
52	F	29.6	Very low	27.5	Very low	194 Å²	194	147.3 Å²	147.3	85%	0.851	82%	0.818	S	S	*	*			trans	-131.2	124.7	166.1	-84.6	-78.9	0	0	0	109.2
53	G	28.1	Very low	27.3	Very low	68 Å²	68	146.6 Å²	146.6	70%	0.701	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.7	161.4	-170.9	0	0	0	0	0	114.6
54	P	31.4	Very low	26.8	Very low	129 Å²	129	146.6 Å²	146.6	84%	0.838	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.8	155	-176.7	35	-35.8	0	0	0	113.3
55	F	30.1	Very low	26.6	Very low	216 Å²	216	148.3 Å²	148.3	95%	0.947	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-103.8	150.4	162.1	-104.2	-94	0	0	0	111.4
56	G	29.7	Very low	26.5	Very low	76 Å²	76	150.9 Å²	150.9	78%	0.784	82%	0.821	S	S	*	*			trans	-90.8	175.9	-162.9	0	0	0	0	0	117
57	A	26.5	Very low	26.7	Very low	103 Å²	103	149 Å²	149	85%	0.851	81%	0.813	S	S	*	*			trans	-82.2	163.5	-173.9	0	0	0	0	0	114.8
58	L	25.9	Very low	26.8	Very low	169 Å²	169	149 Å²	149	89%	0.885	82%	0.818	S	S	*	*			trans	-144.1	135.9	157.6	-115.7	169.6	0	0	0	109.3
59	Q	23.7	Very low	27	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	81%	0.812	S	S	*	*			trans	-148.9	120.2	-176	-179.8	179.7	3.7	0	0	111.6
60	Q	28.4	Very low	27.3	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.794	81%	0.813	S	S	*	*			trans	-143.9	116.4	164	-72	174.1	-13.4	0	0	105.6
61	Q	24.1	Very low	27.3	Very low	173 Å²	173	141.9 Å²	141.9	81%	0.808	81%	0.813	S	S	*	*				54.7	103.1	74.1	-79.6	-162.5	-29.4	0	0	114.8
62	F	25.1	Very low	27.5	Very low	213 Å²	213	145.3 Å²	145.3	93%	0.934	82%	0.822	S	S	*	*			trans	-147	156.4	137.8	-97	-72.1	0	0	0	109
63	S	25.1	Very low	27.4	Very low	102 Å²	102	140 Å²	140	71%	0.713	81%	0.813	S	S	*	*			trans	-145.4	164.1	-168.4	49.8	0	0	0	0	112.9
64	S	25.5	Very low	27.3	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	82%	0.819	S	S	*	*			trans	59	119.4	165.7	54	0	0	0	0	119.2
65	F	26.2	Very low	27.3	Very low	218 Å²	218	147.4 Å²	147.4	96%	0.956	82%	0.815	S	S	*	*				-153.8	154.3	122.3	-115.4	-77.4	0	0	0	109.9
66	N	23.8	Very low	27	Very low	157 Å²	157	145.2 Å²	145.2	84%	0.84	81%	0.806	S	S	*	*			trans	-152.2	124.9	-169.3	-162.6	15.7	0	0	0	111.5
67	A	32	Very low	27	Very low	83 Å²	83	149.7 Å²	149.7	69%	0.686	81%	0.808	S	S	*	*			trans	-166.7	106.9	175.5	0	0	0	0	0	109.2
68	T	29.2	Very low	27.1	Very low	139 Å²	139	148.2 Å²	148.2	85%	0.853	80%	0.803	S	S	*	*				64.5	110.8	83	63.1	0	0	0	0	116.1
69	G	28.9	Very low	27.3	Very low	78 Å²	78	147 Å²	147	80%	0.804	80%	0.803	S	S	*	*			trans	173.8	126.5	168.2	0	0	0	0	0	115.1
70	S	30.6	Very low	27.7	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	80%	0.8	S	S	*	*			trans	-52.6	139	174.4	44.6	0	0	0	0	114.6
71	Q	25.7	Very low	27.8	Very low	166 Å²	166	142 Å²	142	78%	0.776	80%	0.803	S	S	*	*				49.6	111.8	83.6	-86.7	-173.3	-22.9	0	0	115.3
72	F	28.7	Very low	28	Very low	204 Å²	204	142.5 Å²	142.5	90%	0.895	81%	0.805	S	S	*	*				-169.6	-178.1	103.8	-106	-77.3	0	0	0	109.7
73	A	27	Very low	28.2	Very low	81 Å²	81	141.2 Å²	141.2	67%	0.669	80%	0.802	S	S	*	*			trans	-149.7	174.9	-160.5	0	0	0	0	0	115.8
74	Y	26.7	Very low	28.2	Very low	211 Å²	211	144.8 Å²	144.8	83%	0.827	81%	0.808	S	S	*	*			trans	91.3	149.3	160.3	-85.7	-80.7	0	0	0	122.2
75	D	29.4	Very low	28.3	Very low	142 Å²	142	145 Å²	145	76%	0.759	81%	0.809	S	S	*	*			trans	69.4	154.4	160.7	-58	-23.8	0	0	0	122
76	F	25.6	Very low	28.2	Very low	171 Å²	171	139.5 Å²	139.5	75%	0.75	80%	0.798	S	S	*	*			cis	-165.2	158	-41.8	-164.3	-129.5	0	0	0	109.3
77	M	28.8	Very low	28.5	Very low	169 Å²	169	137.7 Å²	137.7	83%	0.833	80%	0.797	S	S	*	*			trans	66.6	154.7	174.2	-51.6	-163.5	169.6	0	0	119.6
78	G	29.5	Very low	28.2	Very low	72 Å²	72	139.5 Å²	139.5	74%	0.742	80%	0.8	S	S	*	*			trans	128.8	64	153	0	0	0	0	0	119.8
79	T	29.2	Very low	28	Very low	144 Å²	144	139.3 Å²	139.3	88%	0.883	80%	0.798	S	S	*	*			trans	6	154.6	154.7	41	0	0	0	0	123.8
80	P	33	Very low	27.9	Very low	121 Å²	121	141.5 Å²	141.5	79%	0.786	80%	0.796	S	S	*	*			trans	-102.3	166.4	-145	40.2	-39	0	0	0	117.9
81	S	30.4	Very low	27.6	Very low	123 Å²	123	145.2 Å²	145.2	86%	0.86	80%	0.801	S	S	*	*			trans	-158.8	160.8	149.2	30.3	0	0	0	0	111.8
82	H	27.9	Very low	27.6	Very low	184 Å²	184	142.9 Å²	142.9	85%	0.852	80%	0.798	S	S	*	*			trans	-71	144.1	-175.8	-72	-112.7	0	0	0	113.3
83	Q	28.9	Very low	27.4	Very low	186 Å²	186	139.1 Å²	139.1	87%	0.869	79%	0.794	S	S	*	*				-175.4	171.1	108	-98.3	176.8	28.2	0	0	113.6
84	H	25.9	Very low	27.5	Very low	178 Å²	178	141.5 Å²	141.5	82%	0.824	80%	0.8	S	S	*	*			trans	-68.7	146.8	-172.8	-60.5	-111.8	0	0	0	113.9
85	S	27	Very low	27.4	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	80%	0.801	S	S	*	*				167.1	133.2	96.4	49.4	0	0	0	0	116.1
86	S	25	Very low	27.2	Very low	103 Å²	103	139 Å²	139	72%	0.72	81%	0.809	S	S	*	*			trans	17.9	122.4	150.4	55.9	0	0	0	0	123.3
87	S	28.5	Very low	27.1	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	81%	0.813	S	S	*	*				-163.6	120.4	123.4	-79.1	0	0	0	0	108.7
88	T	25.7	Very low	27.1	Very low	122 Å²	122	132.1 Å²	132.1	75%	0.748	81%	0.812	S	S	*	*			cis	104.6	148.9	47.3	-67.6	0	0	0	0	110.5
89	V	25.9	Very low	27	Very low	134 Å²	134	134.6 Å²	134.6	81%	0.812	81%	0.807	S	S	*	*			trans	81.5	129.6	-177.4	-170.4	0	0	0	0	113.9
90	V	25.8	Very low	26.9	Very low	125 Å²	125	130.9 Å²	130.9	76%	0.758	79%	0.787	S	S	*	*			cis	-112.1	141.9	0.4	-174.2	0	0	0	0	110.5	V92	V90-V92 HydrophobicContact CG1-CG2 4.45Å
91	Q	26	Very low	26.8	Very low	187 Å²	187	128.4 Å²	128.4	87%	0.874	77%	0.771	S	S	*	*			trans	-129.4	121.1	167.7	-164.7	172.6	9.7	0	0	109.3
92	V	25.5	Very low	26.9	Very low	116 Å²	116	126 Å²	126	70%	0.703	76%	0.759	S	S	*	*			trans	-87.3	123	-176.9	-177.4	0	0	0	0	109.6	V90	V90-V92 HydrophobicContact CG1-CG2 4.45Å
93	P	23.8	Very low	27.1	Very low	125 Å²	125	119.9 Å²	119.9	81%	0.812	74%	0.737	S	S	*	*			trans	-79.7	124.2	179.5	31	-32.9	0	0	0	111.1
94	V	29.1	Very low	27.4	Very low	131 Å²	131	114.6 Å²	114.6	79%	0.794	71%	0.713	S	S	*	*			trans	-121.5	127.6	166.9	-176.6	0	0	0	0	108.7
95	C	24.9	Very low	27.7	Very low	125 Å²	125	114.1 Å²	114.1	85%	0.845	71%	0.708	S	S	*	*			trans	-51.1	128.3	-167.3	-52.2	0	0	0	0	114.8	G97	C95-G97 PolarHBondContact O-N 3.33Å
96	N	24.1	Very low	27.9	Very low	175 Å²	175	112.5 Å²	112.5	94%	0.936	70%	0.697	S	S	*	*			trans	-60.9	122.4	163.4	-79.3	-29.8	0	0	0	109.8
97	G	24.7	Very low	28.1	Very low	80 Å²	80	110.6 Å²	110.6	83%	0.825	69%	0.688	S	S	*	*			trans	-177.5	16.6	-177.2	0	0	0	0	0	118.8	C95	C95-G97 PolarHBondContact O-N 3.33Å
98	S	28.3	Very low	28.3	Very low	117 Å²	117	108.6 Å²	108.6	82%	0.818	68%	0.678	S	S	*	*			trans	-137.2	129.3	-179.3	57.9	0	0	0	0	112.8
99	L	27.8	Very low	28.4	Very low	123 Å²	123	109.6 Å²	109.6	64%	0.644	68%	0.679	S	S	*	*			trans	-56.6	143.1	-173.1	-66.8	127.9	0	0	0	113.5	M104	L99-M104 HydrophobicContact CB-CE 4.2Å; L99-M104 HydrophobicContact CD1-CE 4.19Å
100	S	26.2	Very low	28.7	Very low	67 Å²	67	107.4 Å²	107.4	47%	0.469	67%	0.666	S	S	.	*			trans	-70.2	149.8	177	68.8	0	0	0	0	112.1	A102 S103	S100-A102 PolarHBondContact O-N 3.18Å; S100-S103 WeakPolarHBondContact O-CB 3.28Å; S100-S103 PolarHBondContact O-N 2.94Å
101	P	31.9	Very low	29	Very low	69 Å²	69	105.4 Å²	105.4	45%	0.448	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.2	-19.6	176	-26.7	35.6	0	0	0	114.5
102	A	32.1	Very low	29.2	Very low	73 Å²	73	103.9 Å²	103.9	60%	0.603	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-37.4	171.3	0	0	0	0	0	112.3	S100 M104 K105	S100-A102 PolarHBondContact O-N 3.18Å; A102-M104 VanDerWaalsContact C-N 3.29Å; A102-M104 PolarHBondContact O-N 2.99Å; A102-K105 PolarHBondContact O-N 3.15Å
103	S	32.8	Very low	29.9	Very low	55 Å²	55	103.5 Å²	103.5	39%	0.385	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-18.7	-177	-163.3	0	0	0	0	114	S100 S106	S100-S103 WeakPolarHBondContact O-CB 3.28Å; S100-S103 PolarHBondContact O-N 2.94Å; S103-S106 PolarHBondContact O-OG 3.2Å
104	M	34.5	Very low	30.8	Very low	75 Å²	75	100.9 Å²	100.9	37%	0.369	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	-12.3	173.4	-63.3	-164.3	-171.3	0	0	113.7	L99 A102 S106 A107 F359	L99-M104 HydrophobicContact CB-CE 4.2Å; L99-M104 HydrophobicContact CD1-CE 4.19Å; A102-M104 VanDerWaalsContact C-N 3.29Å; A102-M104 PolarHBondContact O-N 2.99Å; M104-S106 VanDerWaalsContact C-N 3.29Å; M104-S106 PolarHBondContact O-N 3.07Å; M104-A107 HydrophobicContact CB-CB 4.47Å; M104-A107 WeakPolarHBondContact O-CB 3.48Å; M104-A107 PolarHBondContact O-N 3.27Å; M104-A107 VanDerWaalsContact O-N 3.12Å; M104-F359 HydrophobicContact CE-CZ 4.05Å; M104-F359 HydrophobicContact SD-CE1 3.8Å; M104-F359 HydrophobicContact SD-CE2 4.06Å; M104-F359 HydrophobicContact SD-CZ 3.36Å; M104-F359 WeakPolarHBondContact SD-CZ 3.43Å
105	K	32.3	Very low	32.3	Very low	167 Å²	167	99.4 Å²	99.4	73%	0.726	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-21.7	174.8	-74.2	178.7	-178.2	179.9	0	113	A102	A102-K105 PolarHBondContact O-N 3.15Å
106	S	30.5	Very low	34.5	Very low	75 Å²	75	97.2 Å²	97.2	52%	0.524	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	-29.3	164.2	54.9	0	0	0	0	112.6	S103 M104 A108 N109 V110	S103-S106 PolarHBondContact O-OG 3.2Å; M104-S106 VanDerWaalsContact C-N 3.29Å; M104-S106 PolarHBondContact O-N 3.07Å; S106-A108 PolarHBondContact O-N 2.95Å; S106-N109 CarbonylContact O-C 3.55Å; S106-N109 PolarHBondContact O-N 2.98Å; S106-V110 VanDerWaalsContact O-CG2 3.23Å; S106-V110 WeakPolarHBondContact O-CG2 3.19Å; S106-V110 PolarHBondContact O-N 3.45Å
107	A	30.9	Very low	37	Very low	63 Å²	63	89.7 Å²	89.7	52%	0.521	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-24.3	-178.5	0	0	0	0	0	114.1	M104 V110	M104-A107 HydrophobicContact CB-CB 4.47Å; M104-A107 WeakPolarHBondContact O-CB 3.48Å; M104-A107 PolarHBondContact O-N 3.27Å; M104-A107 VanDerWaalsContact O-N 3.12Å; A107-V110 WeakPolarHBondContact O-CG2 3.47Å
108	A	31.6	Very low	39.9	Very low	76 Å²	76	91.5 Å²	91.5	63%	0.628	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-2	172.9	0	0	0	0	0	114.4	S106	S106-A108 PolarHBondContact O-N 2.95Å
109	N	28.9	Very low	42.9	Very low	144 Å²	144	86 Å²	86	77%	0.77	51%	0.513	S	S	*	.	S	Bend	trans	-137.6	33.9	-176.9	-92.8	-37.1	0	0	0	111.8	S106 V111	S106-N109 CarbonylContact O-C 3.55Å; S106-N109 PolarHBondContact O-N 2.98Å; N109-V111 PolarHBondContact O-N 3.49Å
110	V	32	Very low	45.7	Very low	87 Å²	87	83.8 Å²	83.8	53%	0.527	51%	0.506	S	S	.	.			trans	-73.9	91.9	-173.6	-175.2	0	0	0	0	112.2	S106 A107 L112	S106-V110 VanDerWaalsContact O-CG2 3.23Å; S106-V110 WeakPolarHBondContact O-CG2 3.19Å; S106-V110 PolarHBondContact O-N 3.45Å; A107-V110 WeakPolarHBondContact O-CG2 3.47Å; V110-L112 PolarHBondContact O-N 3.32Å
111	V	30.8	Very low	48.7	Very low	84 Å²	84	83.9 Å²	83.9	51%	0.509	50%	0.501	S	S	.	.			trans	55.8	27.3	145.6	-157.7	0	0	0	0	115.9	N109 S113	N109-V111 PolarHBondContact O-N 3.49Å; V111-S113 PolarHBondContact O-N 2.92Å
112	L	30.9	Very low	51.5	Low	155 Å²	155	83.4 Å²	83.4	81%	0.812	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	64	177.7	-73	175.1	0	0	0	112.8	V110 L116	V110-L112 PolarHBondContact O-N 3.32Å; L112-L116 HydrophobicContact CD2-CD1 4.07Å
113	S	39.4	Very low	54.1	Low	107 Å²	107	81.8 Å²	81.8	75%	0.748	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.2	-42.4	166	59.4	0	0	0	0	113.8	V111	V111-S113 PolarHBondContact O-N 2.92Å
114	A	44	Very low	56.7	Low	70 Å²	70	84.8 Å²	84.8	58%	0.579	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-30.4	-170.3	0	0	0	0	0	115
115	N	59.3	Low	59.1	Low	100 Å²	100	85.9 Å²	85.9	54%	0.535	50%	0.503	S	S	.	.	S	Bend	trans	-105.5	-2.1	-166.8	-73.3	-7.7	0	0	0	115.3	T117 R118	N115-T117 PolarHBondContact O-N 3.07Å; N115-R118 PolarHBondContact O-N 3.31Å; N115-R118 VanDerWaalsContact O-N 3.13Å
116	L	71.1	Confident	61.8	Low	80 Å²	80	78.7 Å²	78.7	42%	0.419	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.7	-171.3	-88	72.4	0	0	0	115.3	L112 L182	L112-L116 HydrophobicContact CD2-CD1 4.07Å; L116-L182 HydrophobicContact CB-CD2 3.98Å; L116-L182 HydrophobicContact CD2-CD2 4.44Å
117	T	78.1	Confident	64.5	Low	17 Å²	17	79 Å²	79	10%	0.104	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	3.1	-179.7	54	0	0	0	0	114.6	N115 I125 F126 L182 Q183	N115-T117 PolarHBondContact O-N 3.07Å; T117-I125 VanDerWaalsContact O-CA 3.32Å; T117-I125 WeakPolarHBondContact O-CA 3.38Å; T117-F126 VanDerWaalsContact O-CD2 3.3Å; T117-F126 WeakPolarHBondContact O-CD2 3.33Å; T117-F126 PolarHBondContact O-N 3.15Å; T117-L182 HydrophobicContact CG2-CD2 3.7Å; T117-L182 HydrophobicContact CG2-CG 3.81Å; T117-Q183 HydrophobicContact CG2-CG 4.14Å
118	R	85.8	Confident	67.2	Low	118 Å²	118	80.8 Å²	80.8	45%	0.445	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-114.5	140.3	-179.5	-72.8	179.3	174.4	-82.1	-1.9	112.7	N115 G123 E124 F126	N115-R118 PolarHBondContact O-N 3.31Å; N115-R118 VanDerWaalsContact O-N 3.13Å; R118-G123 VanDerWaalsContact CD-O 3.28Å; R118-G123 WeakPolarHBondContact CD-O 3.45Å; R118-G123 WeakPolarHBondContact CG-O 3.26Å; R118-G123 PolarHBondContact NH1-O 3.27Å; R118-E124 CarbonylContact C-O 3.51Å; R118-E124 VanDerWaalsContact CA-O 3.26Å; R118-E124 WeakPolarHBondContact CA-O 3.29Å; R118-E124 IonicContact NH1-OE2 3.39Å; R118-F126 VanDerWaalsContact C-CE2 3.43Å; R118-F126 VanDerWaalsContact O-CE2 3.23Å; R118-F126 WeakPolarHBondContact O-CE2 3.49Å; R118-F126 VanDerWaalsContact O-CZ 3.3Å; R118-F126 WeakPolarHBondContact O-CZ 3.27Å
119	C	89.9	Confident	70	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.014	44%	0.436	C	S	.	.			trans	-78.8	131.8	-179.3	-179.6	0	0	0	0	112.5	L121 G123 E124 F126 C139	C119-L121 PolarHBondContact O-N 3.25Å; C119-L121 VanDerWaalsContact O-N 3.13Å; C119-G123 WeakPolarHBondContact O-CA 3.24Å; C119-G123 PolarHBondContact O-N 3.39Å; C119-E124 PolarHBondContact N-O 2.72Å; C119-F126 VanDerWaalsContact CA-CE1 3.44Å; C119-F126 HydrophobicContact CB-CD1 3.57Å; C119-F126 HydrophobicContact CB-CE1 3.63Å; C119-F126 HydrophobicContact CB-CG 4.26Å; C119-F126 HydrophobicContact CB-CZ 4.36Å; C119-C139 WeakPolarHBondContact CB-SG 2.78Å; C119-C139 PolarHBondContact SG-N 3.24Å; C119-C139 VanDerWaalsContact SG-N 3.4Å; C119-C139 VanDerWaalsContact SG-SG 3.68Å
120	P	87.2	Confident	72.9	Confident	75 Å²	75	71 Å²	71	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.9	178.3	-25.1	34.1	0	0	0	115.5	F138	P120-F138 HydrophobicContact CB-CE1 4.12Å; P120-F138 HydrophobicContact CG-CD1 4.46Å; P120-F138 HydrophobicContact CG-CE1 4.17Å
121	L	89.6	Confident	75.8	Confident	69 Å²	69	68.4 Å²	68.4	36%	0.361	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-32.5	-175	-70.8	170.4	0	0	0	114.4	C119 F138 C142 Q146 P156	C119-L121 PolarHBondContact O-N 3.25Å; C119-L121 VanDerWaalsContact O-N 3.13Å; L121-F138 HydrophobicContact CD1-CB 4.22Å; L121-F138 HydrophobicContact CD1-CD1 3.41Å; L121-F138 VanDerWaalsContact CD1-CD1 3.41Å; L121-F138 HydrophobicContact CD1-CE1 4Å; L121-F138 HydrophobicContact CD1-CG 4Å; L121-F138 HydrophobicContact CG-CD1 3.61Å; L121-F138 HydrophobicContact CG-CE1 3.92Å; L121-C142 HydrophobicContact CB-CB 3.94Å; L121-C142 HydrophobicContact CD1-CB 3.72Å; L121-Q146 HydrophobicContact CD1-CG 4.38Å; L121-P156 HydrophobicContact CD1-CG 4.25Å; L121-P156 HydrophobicContact CD2-CB 3.95Å; L121-P156 HydrophobicContact CD2-CG 4.1Å
122	C	90.5	Very high	78.7	Confident	60 Å²	60	64.6 Å²	64.6	41%	0.405	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-8.6	-179.6	62.8	0	0	0	0	114.1	E124	C122-E124 PolarHBondContact O-N 3.19Å
123	G	85.4	Confident	81.4	Confident	38 Å²	38	60 Å²	60	39%	0.392	35%	0.348	S	S	.	.	S	Bend	trans	71.7	-17	-175.2	0	0	0	0	0	114.7	R118 C119	R118-G123 VanDerWaalsContact CD-O 3.28Å; R118-G123 WeakPolarHBondContact CD-O 3.45Å; R118-G123 WeakPolarHBondContact CG-O 3.26Å; R118-G123 PolarHBondContact NH1-O 3.27Å; C119-G123 WeakPolarHBondContact O-CA 3.24Å; C119-G123 PolarHBondContact O-N 3.39Å
124	E	88.1	Confident	83.7	Confident	119 Å²	119	56.1 Å²	56.1	56%	0.556	32%	0.32	S	S	*	.	S	Bend	trans	-75.9	164.8	179.7	-66.3	-54.4	157.6	0	0	113.9	R118 C119 C122 F126	R118-E124 CarbonylContact C-O 3.51Å; R118-E124 VanDerWaalsContact CA-O 3.26Å; R118-E124 WeakPolarHBondContact CA-O 3.29Å; R118-E124 IonicContact NH1-OE2 3.39Å; C119-E124 PolarHBondContact N-O 2.72Å; C122-E124 PolarHBondContact O-N 3.19Å; E124-F126 PolarHBondContact O-N 2.92Å
125	I	85.3	Confident	85.7	Confident	97 Å²	97	61.3 Å²	61.3	50%	0.497	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-55.4	134.6	170.8	-63	174.5	0	0	0	108.8	T117 D127 Q183	T117-I125 VanDerWaalsContact O-CA 3.32Å; T117-I125 WeakPolarHBondContact O-CA 3.38Å; I125-D127 PolarHBondContact O-N 2.82Å; I125-Q183 HydrophobicContact CG2-CG 4.38Å; I125-Q183 VanDerWaalsContact CG2-NE2 3.27Å
126	F	87.8	Confident	87.1	Confident	16 Å²	16	59.3 Å²	59.3	7%	0.07	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-56.5	122.1	-175.1	-70.9	-85	0	0	0	113	T117 R118 C119 E124 P129 T137 V179 Q183	T117-F126 VanDerWaalsContact O-CD2 3.3Å; T117-F126 WeakPolarHBondContact O-CD2 3.33Å; T117-F126 PolarHBondContact O-N 3.15Å; R118-F126 VanDerWaalsContact C-CE2 3.43Å; R118-F126 VanDerWaalsContact O-CE2 3.23Å; R118-F126 WeakPolarHBondContact O-CE2 3.49Å; R118-F126 VanDerWaalsContact O-CZ 3.3Å; R118-F126 WeakPolarHBondContact O-CZ 3.27Å; C119-F126 VanDerWaalsContact CA-CE1 3.44Å; C119-F126 HydrophobicContact CB-CD1 3.57Å; C119-F126 HydrophobicContact CB-CE1 3.63Å; C119-F126 HydrophobicContact CB-CG 4.26Å; C119-F126 HydrophobicContact CB-CZ 4.36Å; E124-F126 PolarHBondContact O-N 2.92Å; F126-P129 HydrophobicContact CB-CB 3.86Å; F126-P129 HydrophobicContact CB-CG 4.14Å; F126-P129 HydrophobicContact CD1-CB 3.93Å; F126-P129 HydrophobicContact CG-CB 4.01Å; F126-T137 HydrophobicContact CD1-CG2 4.24Å; F126-T137 HydrophobicContact CE1-CG2 3.77Å; F126-T137 WeakPolarHBondContact CE1-O 3.46Å; F126-T137 HydrophobicContact CZ-CG2 4.05Å; F126-V179 HydrophobicContact CB-CG1 4.08Å; F126-V179 HydrophobicContact CD2-CG1 3.41Å; F126-V179 VanDerWaalsContact CD2-CG1 3.41Å; F126-V179 HydrophobicContact CE2-CG1 4.01Å; F126-V179 HydrophobicContact CE2-CG2 4.34Å; F126-V179 HydrophobicContact CG-CG1 3.96Å; F126-Q183 PolarHBondContact O-NE2 2.98Å
127	D	88.8	Confident	88	Confident	83 Å²	83	56.3 Å²	56.3	44%	0.444	30%	0.302	S	S	.	.	S	Bend	trans	-96.7	119.5	164.5	172.8	20.1	0	0	0	108.9	I125 C139 K140	I125-D127 PolarHBondContact O-N 2.82Å; D127-C139 PolarHBondContact N-SG 3.16Å; D127-C139 WeakPolarHBondContact O-CA 3.3Å; D127-C139 WeakPolarHBondContact O-CB 3.42Å; D127-K140 PolarHBondContact O-N 3Å
128	Q	87.1	Confident	88.7	Confident	100 Å²	100	55.5 Å²	55.5	47%	0.467	30%	0.297	S	S	.	.	S	Bend	trans	44.1	66.6	-176.8	-71.1	162.8	82.6	0	0	112	K130 K140	Q128-K130 PolarHBondContact O-N 3.29Å; Q128-K140 HydrophobicContact CB-CB 3.95Å; Q128-K140 WeakPolarHBondContact O-CB 3.44Å; Q128-K140 PolarHBondContact O-N 3.23Å
129	P	90.2	Very high	89	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	128.6	-178.1	25.5	-33.6	0	0	0	111	F126 T137 F138 S175 D176 V179 I180	F126-P129 HydrophobicContact CB-CB 3.86Å; F126-P129 HydrophobicContact CB-CG 4.14Å; F126-P129 HydrophobicContact CD1-CB 3.93Å; F126-P129 HydrophobicContact CG-CB 4.01Å; P129-T137 HydrophobicContact CB-CG2 3.52Å; P129-F138 CarbonylContact C-O 3.54Å; P129-F138 WeakPolarHBondContact CA-O 3.23Å; P129-S175 CarbonylContact O-C 3.58Å; P129-S175 WeakPolarHBondContact O-CA 3.44Å; P129-D176 HydrophobicContact CB-CB 3.91Å; P129-D176 HydrophobicContact CG-CB 4.17Å; P129-D176 PolarHBondContact O-N 3.15Å; P129-V179 HydrophobicContact CB-CG1 4.22Å; P129-V179 HydrophobicContact CG-CB 4.35Å; P129-V179 HydrophobicContact CG-CG1 3.99Å; P129-I180 HydrophobicContact CG-CD1 4.02Å; P129-I180 HydrophobicContact CG-CG1 3.61Å
130	K	90.4	Very high	89.1	Confident	12 Å²	12	51.5 Å²	51.5	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	141.8	178	-70.4	-62.3	-160.6	176.1	0	110.2	Q128 T137 F138 K140 L143 V170 D171 L173 L174 S175	Q128-K130 PolarHBondContact O-N 3.29Å; K130-T137 WeakPolarHBondContact O-CA 3.24Å; K130-F138 PolarHBondContact N-O 3.31Å; K130-F138 PolarHBondContact O-N 3.37Å; K130-K140 HydrophobicContact CG-CB 4.06Å; K130-L143 HydrophobicContact CB-CD1 3.76Å; K130-V170 WeakPolarHBondContact CE-O 3.16Å; K130-V170 HydrophobicContact CG-CG1 4.02Å; K130-D171 PolarHBondContact NZ-O 3.23Å; K130-L173 HydrophobicContact CB-CB 4.25Å; K130-L173 HydrophobicContact CB-CD1 4.38Å; K130-L173 HydrophobicContact CD-CB 4.11Å; K130-L173 WeakPolarHBondContact CD-O 3.4Å; K130-L173 HydrophobicContact CG-CB 4.48Å; K130-L173 PolarHBondContact NZ-O 2.66Å; K130-L174 WeakPolarHBondContact CA-O 3.49Å; K130-S175 PolarHBondContact NZ-OG 3.41Å
131	V	91.9	Very high	89.4	Confident	32 Å²	32	49.8 Å²	49.8	19%	0.194	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.7	-176.5	-170.5	0	0	0	0	109.7	L174 D176	V131-L174 PolarHBondContact N-O 3.17Å; V131-D176 HydrophobicContact CG2-CB 3.75Å
132	L	91.1	Very high	89.6	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	26%	0.26	C	S	.	.			trans	-86.8	167.5	172.4	-65.5	-175.8	0	0	0	111.7	C134 F135 H136 F138 L143 I153 C155 T162 L173	L132-C134 PolarHBondContact O-N 2.85Å; L132-F135 PolarHBondContact O-N 2.93Å; L132-H136 PolarHBondContact N-O 3.49Å; L132-F138 HydrophobicContact CD1-CD2 3.95Å; L132-F138 HydrophobicContact CD1-CE2 3.75Å; L132-F138 HydrophobicContact CG-CD2 4.23Å; L132-F138 HydrophobicContact CG-CE2 4.36Å; L132-L143 HydrophobicContact CD1-CD2 4.2Å; L132-L143 HydrophobicContact CD2-CD1 4.07Å; L132-L143 HydrophobicContact CD2-CD2 4.35Å; L132-L143 HydrophobicContact CG-CD2 4.46Å; L132-I153 HydrophobicContact CD2-CG2 3.71Å; L132-C155 HydrophobicContact CD1-CB 3.73Å; L132-T162 HydrophobicContact CD2-CG2 4.07Å; L132-L173 HydrophobicContact CD2-CD1 3.72Å; L132-L173 HydrophobicContact CD2-CD2 4.39Å
133	A	88	Confident	89.6	Confident	60 Å²	60	44.4 Å²	44.4	50%	0.496	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.6	-178.6	0	0	0	0	0	114.4	L160 T162	A133-L160 HydrophobicContact CB-CD2 4.42Å; A133-T162 HydrophobicContact CB-CG2 3.97Å; A133-T162 WeakPolarHBondContact CB-OG1 3.37Å; A133-T162 PolarHBondContact N-OG1 3.08Å
134	C	87.4	Confident	89.9	Confident	25 Å²	25	47 Å²	47	17%	0.169	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	9.4	173	57.6	0	0	0	0	114.4	L132 H136 C155 C158 L160	L132-C134 PolarHBondContact O-N 2.85Å; C134-H136 PolarHBondContact O-N 2.98Å; C134-H136 PolarHBondContact SG-ND1 3.27Å; C134-C155 WeakPolarHBondContact SG-CB 3.46Å; C134-C155 PolarHBondContact SG-SG 3.34Å; C134-C158 WeakPolarHBondContact CB-SG 3.41Å; C134-C158 VanDerWaalsContact SG-SG 3.6Å; C134-L160 HydrophobicContact CB-CB 4.1Å; C134-L160 HydrophobicContact CB-CD2 3.7Å
135	F	87.9	Confident	90	Very high	179 Å²	179	49.1 Å²	49.1	79%	0.785	25%	0.25	S	S	*	.	S	Bend	trans	61.8	13.3	-175.5	-51.4	-77.1	0	0	0	116.1	L132	L132-F135 PolarHBondContact O-N 2.93Å
136	H	88	Confident	90	Very high	57 Å²	57	48.8 Å²	48.8	26%	0.264	25%	0.246	S	C	.	.			trans	-81.6	136	168.1	-68.6	104.2	0	0	0	111.1	L132 C134 F138 Q157	L132-H136 PolarHBondContact N-O 3.49Å; C134-H136 PolarHBondContact O-N 2.98Å; C134-H136 PolarHBondContact SG-ND1 3.27Å; H136-F138 HydrophobicContact CB-CD2 4.48Å; H136-F138 HydrophobicContact CB-CE2 3.54Å; H136-F138 HydrophobicContact CB-CZ 3.93Å; H136-Q157 VanDerWaalsContact CD2-CD 3.49Å; H136-Q157 PolarHBondContact CD2-OE1 3.39Å
137	T	90.2	Very high	89.9	Confident	18 Å²	18	50.8 Å²	50.8	11%	0.11	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.2	-176.6	-60.1	0	0	0	0	111.8	F126 P129 K130 D176	F126-T137 HydrophobicContact CD1-CG2 4.24Å; F126-T137 HydrophobicContact CE1-CG2 3.77Å; F126-T137 WeakPolarHBondContact CE1-O 3.46Å; F126-T137 HydrophobicContact CZ-CG2 4.05Å; P129-T137 HydrophobicContact CB-CG2 3.52Å; K130-T137 WeakPolarHBondContact O-CA 3.24Å; T137-D176 WeakPolarHBondContact CB-OD2 3.25Å; T137-D176 HydrophobicContact CG2-CB 3.59Å; T137-D176 WeakPolarHBondContact CG2-OD2 3.44Å; T137-D176 PolarHBondContact OG1-OD2 3.44Å
138	F	92.3	Very high	89.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.5	180	-57.7	-83.3	0	0	0	111.3	P120 L121 P129 K130 L132 H136 L143 Q157	P120-F138 HydrophobicContact CB-CE1 4.12Å; P120-F138 HydrophobicContact CG-CD1 4.46Å; P120-F138 HydrophobicContact CG-CE1 4.17Å; L121-F138 HydrophobicContact CD1-CB 4.22Å; L121-F138 HydrophobicContact CD1-CD1 3.41Å; L121-F138 VanDerWaalsContact CD1-CD1 3.41Å; L121-F138 HydrophobicContact CD1-CE1 4Å; L121-F138 HydrophobicContact CD1-CG 4Å; L121-F138 HydrophobicContact CG-CD1 3.61Å; L121-F138 HydrophobicContact CG-CE1 3.92Å; P129-F138 CarbonylContact C-O 3.54Å; P129-F138 WeakPolarHBondContact CA-O 3.23Å; K130-F138 PolarHBondContact N-O 3.31Å; K130-F138 PolarHBondContact O-N 3.37Å; L132-F138 HydrophobicContact CD1-CD2 3.95Å; L132-F138 HydrophobicContact CD1-CE2 3.75Å; L132-F138 HydrophobicContact CG-CD2 4.23Å; L132-F138 HydrophobicContact CG-CE2 4.36Å; H136-F138 HydrophobicContact CB-CD2 4.48Å; H136-F138 HydrophobicContact CB-CE2 3.54Å; H136-F138 HydrophobicContact CB-CZ 3.93Å; F138-L143 HydrophobicContact CB-CD1 4.22Å; F138-L143 HydrophobicContact CB-CD2 3.62Å; F138-L143 HydrophobicContact CB-CG 3.74Å; F138-L143 HydrophobicContact CD2-CD2 3.77Å; F138-L143 HydrophobicContact CG-CD2 3.85Å; F138-L143 HydrophobicContact CG-CG 4.49Å; F138-Q157 HydrophobicContact CE1-CG 4.25Å; F138-Q157 HydrophobicContact CZ-CB 4.47Å; F138-Q157 HydrophobicContact CZ-CG 3.92Å
139	C	93.1	Very high	88.8	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.034	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	140.6	171	-57.3	0	0	0	0	110.9	C119 D127 C142 L143	C119-C139 WeakPolarHBondContact CB-SG 2.78Å; C119-C139 PolarHBondContact SG-N 3.24Å; C119-C139 VanDerWaalsContact SG-N 3.4Å; C119-C139 VanDerWaalsContact SG-SG 3.68Å; D127-C139 PolarHBondContact N-SG 3.16Å; D127-C139 WeakPolarHBondContact O-CA 3.3Å; D127-C139 WeakPolarHBondContact O-CB 3.42Å; C139-C142 HydrophobicContact CB-CB 4.09Å; C139-C142 WeakPolarHBondContact O-CA 3.49Å; C139-C142 WeakPolarHBondContact O-CB 3.48Å; C139-C142 PolarHBondContact O-N 3.24Å; C139-L143 PolarHBondContact O-N 2.8Å
140	K	92.1	Very high	88.2	Confident	31 Å²	31	58 Å²	58	14%	0.135	30%	0.302	C	S	.	.	H	α-helix	trans	-51.1	-50.8	171.5	161.7	177.2	178.3	-179.9	0	112.3	D127 Q128 K130 C142 L143 E144 V170 D171	D127-K140 PolarHBondContact O-N 3Å; Q128-K140 HydrophobicContact CB-CB 3.95Å; Q128-K140 WeakPolarHBondContact O-CB 3.44Å; Q128-K140 PolarHBondContact O-N 3.23Å; K130-K140 HydrophobicContact CG-CB 4.06Å; K140-C142 PolarHBondContact O-N 3.47Å; K140-L143 PolarHBondContact O-N 2.68Å; K140-L143 VanDerWaalsContact O-N 3.07Å; K140-E144 WeakPolarHBondContact CE-OE1 3.43Å; K140-E144 HydrophobicContact CG-CG 4.23Å; K140-E144 WeakPolarHBondContact CG-OE1 3.31Å; K140-E144 IonicContact NZ-OE1 2.72Å; K140-E144 WeakPolarHBondContact O-CG 3.34Å; K140-E144 PolarHBondContact O-N 3.05Å; K140-V170 HydrophobicContact CB-CG1 3.99Å; K140-V170 HydrophobicContact CG-CB 4.38Å; K140-V170 HydrophobicContact CG-CG1 3.79Å; K140-D171 WeakPolarHBondContact CD-OD1 3.48Å; K140-D171 WeakPolarHBondContact CE-OD1 3.3Å; K140-D171 IonicContact NZ-OD1 2.72Å; K140-D171 PolarHBondContact NZ-OD1 3.42Å; K140-D171 IonicContact NZ-OD2 2.74Å; K140-D171 PolarHBondContact NZ-OD2 3.47Å
141	P	93.1	Very high	87.9	Confident	38 Å²	38	58.4 Å²	58.4	25%	0.247	31%	0.31	C	S	.	.	H	α-helix	trans	-66.5	-5.2	176.5	-24.2	35.9	0	0	0	116.1	E144 K145	P141-E144 WeakPolarHBondContact CA-OE2 3.48Å; P141-K145 VanDerWaalsContact O-CD 3.28Å; P141-K145 WeakPolarHBondContact O-CD 3.42Å; P141-K145 WeakPolarHBondContact O-CE 3.36Å; P141-K145 WeakPolarHBondContact O-CG 3.48Å
142	C	92.8	Very high	87.7	Confident	16 Å²	16	62.1 Å²	62.1	11%	0.108	32%	0.321	C	S	.	.	H	α-helix	trans	-93.4	-42.8	169.1	-66	0	0	0	0	110.9	L121 C139 K140 K145 Q146	L121-C142 HydrophobicContact CB-CB 3.94Å; L121-C142 HydrophobicContact CD1-CB 3.72Å; C139-C142 HydrophobicContact CB-CB 4.09Å; C139-C142 WeakPolarHBondContact O-CA 3.49Å; C139-C142 WeakPolarHBondContact O-CB 3.48Å; C139-C142 PolarHBondContact O-N 3.24Å; K140-C142 PolarHBondContact O-N 3.47Å; C142-K145 PolarHBondContact O-N 2.97Å; C142-Q146 WeakPolarHBondContact O-CG 3.49Å
143	L	91.3	Very high	87.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.9	-38.7	174.6	-66.3	-178.3	0	0	0	112.5	K130 L132 F138 C139 K140 K145 Q146 I147 I153 V170 L173	K130-L143 HydrophobicContact CB-CD1 3.76Å; L132-L143 HydrophobicContact CD1-CD2 4.2Å; L132-L143 HydrophobicContact CD2-CD1 4.07Å; L132-L143 HydrophobicContact CD2-CD2 4.35Å; L132-L143 HydrophobicContact CG-CD2 4.46Å; F138-L143 HydrophobicContact CB-CD1 4.22Å; F138-L143 HydrophobicContact CB-CD2 3.62Å; F138-L143 HydrophobicContact CB-CG 3.74Å; F138-L143 HydrophobicContact CD2-CD2 3.77Å; F138-L143 HydrophobicContact CG-CD2 3.85Å; F138-L143 HydrophobicContact CG-CG 4.49Å; C139-L143 PolarHBondContact O-N 2.8Å; K140-L143 PolarHBondContact O-N 2.68Å; K140-L143 VanDerWaalsContact O-N 3.07Å; L143-K145 PolarHBondContact O-N 3.25Å; L143-K145 VanDerWaalsContact O-N 3.13Å; L143-Q146 PolarHBondContact O-N 3.28Å; L143-I147 PolarHBondContact O-N 2.92Å; L143-I153 HydrophobicContact CB-CD1 3.81Å; L143-I153 HydrophobicContact CD2-CD1 3.78Å; L143-I153 HydrophobicContact CG-CD1 4.32Å; L143-I153 WeakPolarHBondContact O-CD1 3.28Å; L143-V170 HydrophobicContact CB-CG1 3.96Å; L143-V170 HydrophobicContact CB-CG2 4.03Å; L143-V170 HydrophobicContact CD1-CG1 4.13Å; L143-L173 HydrophobicContact CD1-CD1 3.81Å
144	E	91.3	Very high	87.7	Confident	94 Å²	94	62.8 Å²	62.8	44%	0.439	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.6	175.9	-71.1	171.5	154.8	0	0	112.6	K140 P141 V170	K140-E144 WeakPolarHBondContact CE-OE1 3.43Å; K140-E144 HydrophobicContact CG-CG 4.23Å; K140-E144 WeakPolarHBondContact CG-OE1 3.31Å; K140-E144 IonicContact NZ-OE1 2.72Å; K140-E144 WeakPolarHBondContact O-CG 3.34Å; K140-E144 PolarHBondContact O-N 3.05Å; P141-E144 WeakPolarHBondContact CA-OE2 3.48Å; E144-V170 HydrophobicContact CB-CG2 4.47Å; E144-V170 HydrophobicContact CG-CB 4Å; E144-V170 HydrophobicContact CG-CG1 4.49Å; E144-V170 HydrophobicContact CG-CG2 3.62Å
145	K	89.9	Confident	87.7	Confident	163 Å²	163	61.7 Å²	61.7	71%	0.709	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	3.6	176.4	-61.9	172.9	-174	167.1	0	113.8	P141 C142 L143	P141-K145 VanDerWaalsContact O-CD 3.28Å; P141-K145 WeakPolarHBondContact O-CD 3.42Å; P141-K145 WeakPolarHBondContact O-CE 3.36Å; P141-K145 WeakPolarHBondContact O-CG 3.48Å; C142-K145 PolarHBondContact O-N 2.97Å; L143-K145 PolarHBondContact O-N 3.25Å; L143-K145 VanDerWaalsContact O-N 3.13Å
146	Q	86	Confident	87.7	Confident	89 Å²	89	55.8 Å²	55.8	42%	0.416	29%	0.288	S	S	.	.	S	Bend	trans	-119.2	5.7	-179.1	-61.7	-69	-81.3	0	0	112.4	L121 C142 L143 E148 I153 P156	L121-Q146 HydrophobicContact CD1-CG 4.38Å; C142-Q146 WeakPolarHBondContact O-CG 3.49Å; L143-Q146 PolarHBondContact O-N 3.28Å; Q146-E148 PolarHBondContact O-N 3.01Å; Q146-I153 HydrophobicContact CB-CD1 4.1Å; Q146-P156 HydrophobicContact CG-CG 4.43Å
147	I	84.4	Confident	87.6	Confident	59 Å²	59	57.8 Å²	57.8	30%	0.303	30%	0.297	S	S	.	.			trans	-82.4	96.6	173.7	-61.4	174.7	0	0	0	109	L143 S149 I153 I164 V170	L143-I147 PolarHBondContact O-N 2.92Å; I147-S149 WeakPolarHBondContact CG2-O 3.48Å; I147-I153 HydrophobicContact CG1-CD1 4.06Å; I147-I164 HydrophobicContact CD1-CD1 3.61Å; I147-I164 HydrophobicContact CG1-CD1 4.18Å; I147-V170 HydrophobicContact CD1-CG2 3.67Å
148	E	77.4	Confident	87.4	Confident	186 Å²	186	59.8 Å²	59.8	87%	0.869	31%	0.311	S	S	*	.	S	Bend	trans	-78	-27.3	171.8	-61.9	-176.7	155.6	0	0	112.6	Q146	Q146-E148 PolarHBondContact O-N 3.01Å
149	S	76.5	Confident	87.3	Confident	34 Å²	34	64.5 Å²	64.5	24%	0.238	34%	0.344	C	S	.	.	S	Bend	trans	-142.1	134.7	-177.8	63.1	0	0	0	0	111.3	I147 R152	I147-S149 WeakPolarHBondContact CG2-O 3.48Å; S149-R152 VanDerWaalsContact O-O 3.07Å; S149-R152 VanDerWaalsContact OG-CG 3.29Å; S149-R152 WeakPolarHBondContact OG-CG 3.43Å; S149-R152 PolarHBondContact OG-NE 3.2Å
150	P	78.3	Confident	87	Confident	115 Å²	115	68.5 Å²	68.5	75%	0.747	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	146.6	-179.8	26.8	-35.2	0	0	0	112
151	G	82.2	Confident	86.9	Confident	22 Å²	22	70.9 Å²	70.9	23%	0.227	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-9.7	177.6	0	0	0	0	0	116	I164	G151-I164 VanDerWaalsContact C-CG1 3.46Å; G151-I164 CarbonylContact C-O 3.53Å; G151-I164 WeakPolarHBondContact CA-O 3.49Å; G151-I164 PolarHBondContact O-N 3.42Å; G151-I164 VanDerWaalsContact O-O 3.12Å
152	R	87.8	Confident	86.7	Confident	110 Å²	110	69.4 Å²	69.4	42%	0.415	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.5	176.5	61.5	168.1	178.1	-171.3	-1.1	113.7	S149 E161 T162	S149-R152 VanDerWaalsContact O-O 3.07Å; S149-R152 VanDerWaalsContact OG-CG 3.29Å; S149-R152 WeakPolarHBondContact OG-CG 3.43Å; S149-R152 PolarHBondContact OG-NE 3.2Å; R152-E161 HydrophobicContact CB-CG 4Å; R152-E161 VanDerWaalsContact CD-CD 3.47Å; R152-E161 WeakPolarHBondContact CD-OE2 3.39Å; R152-E161 IonicContact CZ-OE2 2.77Å; R152-E161 IonicContact NE-OE2 3.11Å; R152-E161 IonicContact NH1-OE2 2.95Å; R152-E161 PolarHBondContact NH1-OE2 3.33Å; R152-T162 CarbonylContact C-O 3.42Å; R152-T162 WeakPolarHBondContact CA-O 3.3Å
153	I	88.9	Confident	86.4	Confident	3 Å²	3	76.2 Å²	76.2	2%	0.015	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.6	171.9	-173.6	165.3	0	0	0	110.1	L132 L143 Q146 I147 T162 I164	L132-I153 HydrophobicContact CD2-CG2 3.71Å; L143-I153 HydrophobicContact CB-CD1 3.81Å; L143-I153 HydrophobicContact CD2-CD1 3.78Å; L143-I153 HydrophobicContact CG-CD1 4.32Å; L143-I153 WeakPolarHBondContact O-CD1 3.28Å; Q146-I153 HydrophobicContact CB-CD1 4.1Å; I147-I153 HydrophobicContact CG1-CD1 4.06Å; I153-T162 HydrophobicContact CG2-CG2 4.49Å; I153-T162 PolarHBondContact N-O 3.21Å; I153-T162 PolarHBondContact O-N 2.85Å; I153-I164 HydrophobicContact CG2-CG2 4.1Å
154	N	90.4	Very high	86.2	Confident	75 Å²	75	76.9 Å²	76.9	40%	0.401	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.6	175.6	-68.4	-28.8	0	0	0	109.8	P156 E161	N154-P156 VanDerWaalsContact O-CD 3.27Å; N154-P156 WeakPolarHBondContact O-CD 3.37Å; N154-E161 WeakPolarHBondContact OD1-CA 3.43Å; N154-E161 WeakPolarHBondContact OD1-CB 3.33Å
155	C	88.2	Confident	85.7	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.014	40%	0.396	C	S	.	.			trans	-66.9	122	178.4	176.6	0	0	0	0	112	L132 C134 Q157 C158 S159 L160	L132-C155 HydrophobicContact CD1-CB 3.73Å; C134-C155 WeakPolarHBondContact SG-CB 3.46Å; C134-C155 PolarHBondContact SG-SG 3.34Å; C155-Q157 PolarHBondContact O-N 3.32Å; C155-Q157 PolarHBondContact SG-N 2.85Å; C155-Q157 VanDerWaalsContact SG-N 3.44Å; C155-C158 PolarHBondContact O-N 2.94Å; C155-C158 PolarHBondContact SG-SG 3.09Å; C155-S159 VanDerWaalsContact O-CA 3.32Å; C155-S159 WeakPolarHBondContact O-CA 3.43Å; C155-S159 PolarHBondContact O-N 3.29Å; C155-L160 PolarHBondContact N-O 3.43Å
156	P	88.6	Confident	85.1	Confident	54 Å²	54	71.9 Å²	71.9	35%	0.351	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-9.7	180	-26.5	38.3	0	0	0	115.9	L121 Q146 N154	L121-P156 HydrophobicContact CD1-CG 4.25Å; L121-P156 HydrophobicContact CD2-CB 3.95Å; L121-P156 HydrophobicContact CD2-CG 4.1Å; Q146-P156 HydrophobicContact CG-CG 4.43Å; N154-P156 VanDerWaalsContact O-CD 3.27Å; N154-P156 WeakPolarHBondContact O-CD 3.37Å
157	Q	84.9	Confident	84.8	Confident	100 Å²	100	74.4 Å²	74.4	47%	0.467	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-21.5	179.1	-71.1	-179	-86.9	0	0	114.6	H136 F138 C155	H136-Q157 VanDerWaalsContact CD2-CD 3.49Å; H136-Q157 PolarHBondContact CD2-OE1 3.39Å; F138-Q157 HydrophobicContact CE1-CG 4.25Å; F138-Q157 HydrophobicContact CZ-CB 4.47Å; F138-Q157 HydrophobicContact CZ-CG 3.92Å; C155-Q157 PolarHBondContact O-N 3.32Å; C155-Q157 PolarHBondContact SG-N 2.85Å; C155-Q157 VanDerWaalsContact SG-N 3.44Å
158	C	86.8	Confident	84.5	Confident	60 Å²	60	74.7 Å²	74.7	41%	0.405	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.4	3.9	-176.1	65	0	0	0	0	115	C134 C155 L160	C134-C158 WeakPolarHBondContact CB-SG 3.41Å; C134-C158 VanDerWaalsContact SG-SG 3.6Å; C155-C158 PolarHBondContact O-N 2.94Å; C155-C158 PolarHBondContact SG-SG 3.09Å; C158-L160 PolarHBondContact O-N 3.37Å
159	S	90.1	Very high	84.8	Confident	99 Å²	99	66.9 Å²	66.9	69%	0.692	38%	0.377	S	S	*	.			trans	58.1	10.2	179.7	-53	0	0	0	0	116.6	C155 E161	C155-S159 VanDerWaalsContact O-CA 3.32Å; C155-S159 WeakPolarHBondContact O-CA 3.43Å; C155-S159 PolarHBondContact O-N 3.29Å; S159-E161 PolarHBondContact O-N 3.26Å
160	L	86.3	Confident	85.3	Confident	88 Å²	88	65.4 Å²	65.4	46%	0.461	37%	0.367	S	S	.	.			trans	-66.1	126.7	173.4	-170.2	72.7	0	0	0	110.2	A133 C134 C155 C158	A133-L160 HydrophobicContact CB-CD2 4.42Å; C134-L160 HydrophobicContact CB-CB 4.1Å; C134-L160 HydrophobicContact CB-CD2 3.7Å; C155-L160 PolarHBondContact N-O 3.43Å; C158-L160 PolarHBondContact O-N 3.37Å
161	E	90.4	Very high	85.7	Confident	82 Å²	82	61.9 Å²	61.9	38%	0.383	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129.2	173.1	-169.9	-179.4	95.7	0	0	110	R152 N154 S159	R152-E161 HydrophobicContact CB-CG 4Å; R152-E161 VanDerWaalsContact CD-CD 3.47Å; R152-E161 WeakPolarHBondContact CD-OE2 3.39Å; R152-E161 IonicContact CZ-OE2 2.77Å; R152-E161 IonicContact NE-OE2 3.11Å; R152-E161 IonicContact NH1-OE2 2.95Å; R152-E161 PolarHBondContact NH1-OE2 3.33Å; N154-E161 WeakPolarHBondContact OD1-CA 3.43Å; N154-E161 WeakPolarHBondContact OD1-CB 3.33Å; S159-E161 PolarHBondContact O-N 3.26Å
162	T	87.6	Confident	85.8	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.037	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124.3	171.6	-60.7	0	0	0	0	108.3	L132 A133 R152 I153 L173	L132-T162 HydrophobicContact CD2-CG2 4.07Å; A133-T162 HydrophobicContact CB-CG2 3.97Å; A133-T162 WeakPolarHBondContact CB-OG1 3.37Å; A133-T162 PolarHBondContact N-OG1 3.08Å; R152-T162 CarbonylContact C-O 3.42Å; R152-T162 WeakPolarHBondContact CA-O 3.3Å; I153-T162 HydrophobicContact CG2-CG2 4.49Å; I153-T162 PolarHBondContact N-O 3.21Å; I153-T162 PolarHBondContact O-N 2.85Å; T162-L173 HydrophobicContact CG2-CD2 3.71Å
163	Q	87.5	Confident	85.9	Confident	159 Å²	159	57.7 Å²	57.7	74%	0.743	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	141.8	175.1	-64.9	178.7	0.7	0	0	110.2
164	I	86.1	Confident	85.8	Confident	15 Å²	15	62.5 Å²	62.5	8%	0.077	35%	0.35	C	S	.	.			trans	-131.3	146.6	177.3	54.3	173.8	0	0	0	109.4	I147 G151 I153 T166 L173	I147-I164 HydrophobicContact CD1-CD1 3.61Å; I147-I164 HydrophobicContact CG1-CD1 4.18Å; G151-I164 VanDerWaalsContact C-CG1 3.46Å; G151-I164 CarbonylContact C-O 3.53Å; G151-I164 WeakPolarHBondContact CA-O 3.49Å; G151-I164 PolarHBondContact O-N 3.42Å; G151-I164 VanDerWaalsContact O-O 3.12Å; I153-I164 HydrophobicContact CG2-CG2 4.1Å; I164-T166 PolarHBondContact O-N 2.86Å; I164-L173 HydrophobicContact CG2-CD1 4.16Å; I164-L173 HydrophobicContact CG2-CD2 3.81Å; I164-L173 HydrophobicContact CG2-CG 3.9Å
165	C	80.5	Confident	85.7	Confident	52 Å²	52	60.7 Å²	60.7	35%	0.351	34%	0.343	S	S	.	.			trans	-66.4	127.5	175.7	179	0	0	0	0	109.1	D167 Q168 G169 S172	C165-D167 PolarHBondContact O-N 3.37Å; C165-D167 VanDerWaalsContact O-N 3.16Å; C165-Q168 HydrophobicContact CB-CB 4.26Å; C165-Q168 PolarHBondContact O-N 3.33Å; C165-G169 WeakPolarHBondContact O-CA 3.21Å; C165-G169 PolarHBondContact O-N 2.8Å; C165-S172 PolarHBondContact N-OG 2.92Å
166	T	78.4	Confident	85.6	Confident	99 Å²	99	61.9 Å²	61.9	61%	0.607	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-36.3	178.6	41.7	0	0	0	0	112.7	I164	I164-T166 PolarHBondContact O-N 2.86Å
167	D	79	Confident	85.4	Confident	142 Å²	142	63.9 Å²	63.9	76%	0.759	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.3	-167.8	-51.6	2.1	0	0	0	112	C165	C165-D167 PolarHBondContact O-N 3.37Å; C165-D167 VanDerWaalsContact O-N 3.16Å
168	Q	78.4	Confident	85.2	Confident	66 Å²	66	62.6 Å²	62.6	31%	0.308	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-13.5	178.4	-57.2	-166.1	18.8	0	0	113.4	C165 V170 D171	C165-Q168 HydrophobicContact CB-CB 4.26Å; C165-Q168 PolarHBondContact O-N 3.33Å; Q168-V170 PolarHBondContact O-N 2.8Å; Q168-D171 WeakPolarHBondContact O-CB 3.09Å; Q168-D171 PolarHBondContact O-N 2.99Å; Q168-D171 VanDerWaalsContact O-N 3.1Å
169	G	84.3	Confident	84.9	Confident	21 Å²	21	60.4 Å²	60.4	22%	0.216	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	52.3	-132.4	-176.6	0	0	0	0	0	112.6	C165 D171 S172	C165-G169 WeakPolarHBondContact O-CA 3.21Å; C165-G169 PolarHBondContact O-N 2.8Å; G169-D171 PolarHBondContact O-N 2.86Å; G169-D171 VanDerWaalsContact O-N 3.14Å; G169-S172 PolarHBondContact O-N 3.09Å; G169-S172 PolarHBondContact O-OG 3.05Å
170	V	87.5	Confident	84.5	Confident	4 Å²	4	57 Å²	57	2%	0.024	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-62.2	-19	-179.9	178.9	0	0	0	0	113.1	K130 K140 L143 E144 I147 Q168 S172 L173	K130-V170 WeakPolarHBondContact CE-O 3.16Å; K130-V170 HydrophobicContact CG-CG1 4.02Å; K140-V170 HydrophobicContact CB-CG1 3.99Å; K140-V170 HydrophobicContact CG-CB 4.38Å; K140-V170 HydrophobicContact CG-CG1 3.79Å; L143-V170 HydrophobicContact CB-CG1 3.96Å; L143-V170 HydrophobicContact CB-CG2 4.03Å; L143-V170 HydrophobicContact CD1-CG1 4.13Å; E144-V170 HydrophobicContact CB-CG2 4.47Å; E144-V170 HydrophobicContact CG-CB 4Å; E144-V170 HydrophobicContact CG-CG1 4.49Å; E144-V170 HydrophobicContact CG-CG2 3.62Å; I147-V170 HydrophobicContact CD1-CG2 3.67Å; Q168-V170 PolarHBondContact O-N 2.8Å; V170-S172 VanDerWaalsContact C-N 3.31Å; V170-S172 PolarHBondContact O-N 3.09Å; V170-L173 HydrophobicContact CG1-CD1 4.3Å; V170-L173 WeakPolarHBondContact O-CB 3.43Å; V170-L173 PolarHBondContact O-N 2.71Å
171	D	86.1	Confident	84	Confident	41 Å²	41	55.8 Å²	55.8	22%	0.219	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-73.5	-17.6	177.8	-79	-30.3	0	0	0	114.4	K130 K140 Q168 G169 L173 R296	K130-D171 PolarHBondContact NZ-O 3.23Å; K140-D171 WeakPolarHBondContact CD-OD1 3.48Å; K140-D171 WeakPolarHBondContact CE-OD1 3.3Å; K140-D171 IonicContact NZ-OD1 2.72Å; K140-D171 PolarHBondContact NZ-OD1 3.42Å; K140-D171 IonicContact NZ-OD2 2.74Å; K140-D171 PolarHBondContact NZ-OD2 3.47Å; Q168-D171 WeakPolarHBondContact O-CB 3.09Å; Q168-D171 PolarHBondContact O-N 2.99Å; Q168-D171 VanDerWaalsContact O-N 3.1Å; G169-D171 PolarHBondContact O-N 2.86Å; G169-D171 VanDerWaalsContact O-N 3.14Å; D171-L173 PolarHBondContact O-N 3.46Å; D171-R296 VanDerWaalsContact CB-NH2 3.25Å; D171-R296 IonicContact OD2-NH1 2.58Å
172	S	84.8	Confident	83.1	Confident	31 Å²	31	54.5 Å²	54.5	22%	0.217	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-72	-11.7	173.2	74.4	0	0	0	0	113.3	C165 G169 V170	C165-S172 PolarHBondContact N-OG 2.92Å; G169-S172 PolarHBondContact O-N 3.09Å; G169-S172 PolarHBondContact O-OG 3.05Å; V170-S172 VanDerWaalsContact C-N 3.31Å; V170-S172 PolarHBondContact O-N 3.09Å
173	L	88.3	Confident	82.4	Confident	13 Å²	13	55 Å²	55	7%	0.068	31%	0.309	C	S	.	.	S	Bend	trans	-77.6	146.8	175.9	-63.8	172.9	0	0	0	111	K130 L132 L143 T162 I164 V170 D171	K130-L173 HydrophobicContact CB-CB 4.25Å; K130-L173 HydrophobicContact CB-CD1 4.38Å; K130-L173 HydrophobicContact CD-CB 4.11Å; K130-L173 WeakPolarHBondContact CD-O 3.4Å; K130-L173 HydrophobicContact CG-CB 4.48Å; K130-L173 PolarHBondContact NZ-O 2.66Å; L132-L173 HydrophobicContact CD2-CD1 3.72Å; L132-L173 HydrophobicContact CD2-CD2 4.39Å; L143-L173 HydrophobicContact CD1-CD1 3.81Å; T162-L173 HydrophobicContact CG2-CD2 3.71Å; I164-L173 HydrophobicContact CG2-CD1 4.16Å; I164-L173 HydrophobicContact CG2-CD2 3.81Å; I164-L173 HydrophobicContact CG2-CG 3.9Å; V170-L173 HydrophobicContact CG1-CD1 4.3Å; V170-L173 WeakPolarHBondContact O-CB 3.43Å; V170-L173 PolarHBondContact O-N 2.71Å; D171-L173 PolarHBondContact O-N 3.46Å
174	L	87.2	Confident	81.6	Confident	104 Å²	104	48.1 Å²	48.1	55%	0.545	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-63.8	143.8	171.6	-71	168.3	0	0	0	110.6	K130 V131 L293	K130-L174 WeakPolarHBondContact CA-O 3.49Å; V131-L174 PolarHBondContact N-O 3.17Å; L174-L293 HydrophobicContact CD2-CD1 4.03Å
175	S	88.6	Confident	80.6	Confident	36 Å²	36	50.6 Å²	50.6	25%	0.252	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-86.5	146.6	172.8	-56.9	0	0	0	0	110.6	P129 K130 F177	P129-S175 CarbonylContact O-C 3.58Å; P129-S175 WeakPolarHBondContact O-CA 3.44Å; K130-S175 PolarHBondContact NZ-OG 3.41Å; S175-F177 VanDerWaalsContact O-CD2 3.24Å; S175-F177 WeakPolarHBondContact O-CD2 3.48Å; S175-F177 WeakPolarHBondContact O-CE2 3.37Å; S175-F177 PolarHBondContact O-N 2.93Å
176	D	86	Confident	79.9	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.15	29%	0.292	C	S	.	.			trans	-79.4	88.5	178.3	-166.8	-34.6	0	0	0	110.9	P129 V131 T137 A178 V179 I180	P129-D176 HydrophobicContact CB-CB 3.91Å; P129-D176 HydrophobicContact CG-CB 4.17Å; P129-D176 PolarHBondContact O-N 3.15Å; V131-D176 HydrophobicContact CG2-CB 3.75Å; T137-D176 WeakPolarHBondContact CB-OD2 3.25Å; T137-D176 HydrophobicContact CG2-CB 3.59Å; T137-D176 WeakPolarHBondContact CG2-OD2 3.44Å; T137-D176 PolarHBondContact OG1-OD2 3.44Å; D176-A178 PolarHBondContact O-N 2.8Å; D176-A178 WeakPolarHBondContact OD1-CB 3.38Å; D176-A178 PolarHBondContact OD1-N 2.92Å; D176-A178 VanDerWaalsContact OD1-N 3.08Å; D176-V179 HydrophobicContact CB-CB 4.04Å; D176-V179 HydrophobicContact CB-CG2 4.24Å; D176-V179 VanDerWaalsContact CG-CG2 3.43Å; D176-V179 PolarHBondContact O-N 3.29Å; D176-V179 PolarHBondContact OD1-N 2.77Å; D176-V179 VanDerWaalsContact OD2-CG2 3.29Å; D176-V179 WeakPolarHBondContact OD2-CG2 3.44Å; D176-I180 WeakPolarHBondContact O-CB 3.28Å; D176-I180 WeakPolarHBondContact O-CD1 3.39Å; D176-I180 VanDerWaalsContact O-CG1 3.22Å; D176-I180 WeakPolarHBondContact O-CG1 3.45Å; D176-I180 PolarHBondContact O-N 3.17Å
177	F	85.4	Confident	79.2	Confident	96 Å²	96	51.3 Å²	51.3	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-27.2	179.3	-57.6	-73.1	0	0	0	113	S175 N181 V290	S175-F177 VanDerWaalsContact O-CD2 3.24Å; S175-F177 WeakPolarHBondContact O-CD2 3.48Å; S175-F177 WeakPolarHBondContact O-CE2 3.37Å; S175-F177 PolarHBondContact O-N 2.93Å; F177-N181 VanDerWaalsContact O-CB 3.28Å; F177-N181 WeakPolarHBondContact O-CB 3.42Å; F177-N181 PolarHBondContact O-N 2.99Å; F177-N181 PolarHBondContact O-ND2 3.49Å; F177-N181 PolarHBondContact O-OD1 2.85Å; F177-V290 HydrophobicContact CE1-CG1 4.18Å; F177-V290 HydrophobicContact CE1-CG2 4.23Å; F177-V290 HydrophobicContact CZ-CG1 3.79Å; F177-V290 HydrophobicContact CZ-CG2 4.46Å
178	A	79	Confident	78.3	Confident	72 Å²	72	46 Å²	46	60%	0.595	25%	0.251	S	S	*	.	H	α-helix	trans	-73.3	-45.7	178.7	0	0	0	0	0	111.2	D176 N181 L182	D176-A178 PolarHBondContact O-N 2.8Å; D176-A178 WeakPolarHBondContact OD1-CB 3.38Å; D176-A178 PolarHBondContact OD1-N 2.92Å; D176-A178 VanDerWaalsContact OD1-N 3.08Å; A178-N181 PolarHBondContact O-N 3.45Å; A178-L182 VanDerWaalsContact O-CB 3.24Å; A178-L182 WeakPolarHBondContact O-CB 3.28Å; A178-L182 PolarHBondContact O-N 3.06Å
179	V	81.2	Confident	76.9	Confident	15 Å²	15	50.9 Å²	50.9	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-43.7	173.2	168.8	0	0	0	0	111.2	F126 P129 D176 L182 Q183	F126-V179 HydrophobicContact CB-CG1 4.08Å; F126-V179 HydrophobicContact CD2-CG1 3.41Å; F126-V179 VanDerWaalsContact CD2-CG1 3.41Å; F126-V179 HydrophobicContact CE2-CG1 4.01Å; F126-V179 HydrophobicContact CE2-CG2 4.34Å; F126-V179 HydrophobicContact CG-CG1 3.96Å; P129-V179 HydrophobicContact CB-CG1 4.22Å; P129-V179 HydrophobicContact CG-CB 4.35Å; P129-V179 HydrophobicContact CG-CG1 3.99Å; D176-V179 HydrophobicContact CB-CB 4.04Å; D176-V179 HydrophobicContact CB-CG2 4.24Å; D176-V179 VanDerWaalsContact CG-CG2 3.43Å; D176-V179 PolarHBondContact O-N 3.29Å; D176-V179 PolarHBondContact OD1-N 2.77Å; D176-V179 VanDerWaalsContact OD2-CG2 3.29Å; D176-V179 WeakPolarHBondContact OD2-CG2 3.44Å; V179-L182 PolarHBondContact O-N 3.04Å; V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 WeakPolarHBondContact O-CG 3.3Å; V179-Q183 PolarHBondContact O-N 3.42Å
180	I	81.1	Confident	75.1	Confident	26 Å²	26	51.7 Å²	51.7	13%	0.133	27%	0.271	C	S	.	.	H	α-helix	trans	-59.7	-50.5	177.9	-71.8	165.4	0	0	0	110.9	P129 D176 L182 Q183 E184	P129-I180 HydrophobicContact CG-CD1 4.02Å; P129-I180 HydrophobicContact CG-CG1 3.61Å; D176-I180 WeakPolarHBondContact O-CB 3.28Å; D176-I180 WeakPolarHBondContact O-CD1 3.39Å; D176-I180 VanDerWaalsContact O-CG1 3.22Å; D176-I180 WeakPolarHBondContact O-CG1 3.45Å; D176-I180 PolarHBondContact O-N 3.17Å; I180-L182 VanDerWaalsContact C-N 3.33Å; I180-L182 PolarHBondContact O-N 3.3Å; I180-Q183 PolarHBondContact O-N 3.16Å; I180-E184 PolarHBondContact O-N 3.46Å; I180-E184 VanDerWaalsContact O-N 3.09Å
181	N	76.1	Confident	73.1	Confident	64 Å²	64	53.2 Å²	53.2	34%	0.342	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-36.2	179.4	-68.4	-4.1	0	0	0	111.5	F177 A178 E184 Q185	F177-N181 VanDerWaalsContact O-CB 3.28Å; F177-N181 WeakPolarHBondContact O-CB 3.42Å; F177-N181 PolarHBondContact O-N 2.99Å; F177-N181 PolarHBondContact O-ND2 3.49Å; F177-N181 PolarHBondContact O-OD1 2.85Å; A178-N181 PolarHBondContact O-N 3.45Å; N181-E184 PolarHBondContact O-N 3.03Å; N181-Q185 WeakPolarHBondContact O-CG 3.4Å; N181-Q185 PolarHBondContact O-N 2.74Å
182	L	71.9	Confident	70.9	Confident	54 Å²	54	54.9 Å²	54.9	28%	0.283	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-43	175.1	-179.8	61.2	0	0	0	112.2	L116 T117 A178 V179 I180 E184 Q185 Q186	L116-L182 HydrophobicContact CB-CD2 3.98Å; L116-L182 HydrophobicContact CD2-CD2 4.44Å; T117-L182 HydrophobicContact CG2-CD2 3.7Å; T117-L182 HydrophobicContact CG2-CG 3.81Å; A178-L182 VanDerWaalsContact O-CB 3.24Å; A178-L182 WeakPolarHBondContact O-CB 3.28Å; A178-L182 PolarHBondContact O-N 3.06Å; V179-L182 PolarHBondContact O-N 3.04Å; I180-L182 VanDerWaalsContact C-N 3.33Å; I180-L182 PolarHBondContact O-N 3.3Å; L182-E184 VanDerWaalsContact C-N 3.25Å; L182-E184 PolarHBondContact O-N 3.14Å; L182-Q185 PolarHBondContact O-N 3.24Å; L182-Q186 WeakPolarHBondContact O-CG 3.42Å; L182-Q186 PolarHBondContact O-N 3.33Å
183	Q	73	Confident	68.6	Low	17 Å²	17	62.5 Å²	62.5	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-60.8	-35.7	173.6	-74.6	178.9	-10.9	0	0	112	T117 I125 F126 V179 I180 Q186 K187	T117-Q183 HydrophobicContact CG2-CG 4.14Å; I125-Q183 HydrophobicContact CG2-CG 4.38Å; I125-Q183 VanDerWaalsContact CG2-NE2 3.27Å; F126-Q183 PolarHBondContact O-NE2 2.98Å; V179-Q183 HydrophobicContact CG1-CG 4.49Å; V179-Q183 WeakPolarHBondContact O-CG 3.3Å; V179-Q183 PolarHBondContact O-N 3.42Å; I180-Q183 PolarHBondContact O-N 3.16Å; Q183-Q186 PolarHBondContact O-N 3.14Å; Q183-K187 VanDerWaalsContact O-CG 3.31Å; Q183-K187 WeakPolarHBondContact O-CG 3.37Å; Q183-K187 PolarHBondContact O-N 3.14Å
184	E	71.1	Confident	66.1	Low	14 Å²	14	64.6 Å²	64.6	7%	0.065	34%	0.341	C	S	.	.	H	α-helix	trans	-77.8	-39.2	179.7	-77.6	165.3	-158.5	0	0	112.7	I180 N181 L182 Q186 K187 V188 M286 R288	I180-E184 PolarHBondContact O-N 3.46Å; I180-E184 VanDerWaalsContact O-N 3.09Å; N181-E184 PolarHBondContact O-N 3.03Å; L182-E184 VanDerWaalsContact C-N 3.25Å; L182-E184 PolarHBondContact O-N 3.14Å; E184-Q186 PolarHBondContact O-N 2.96Å; E184-K187 HydrophobicContact CG-CD 4.3Å; E184-K187 PolarHBondContact O-N 2.89Å; E184-K187 VanDerWaalsContact O-N 3.12Å; E184-V188 WeakPolarHBondContact O-CG2 3.33Å; E184-V188 PolarHBondContact O-N 3.14Å; E184-M286 HydrophobicContact CB-CE 4.22Å; E184-R288 VanDerWaalsContact CD-NH1 3.26Å; E184-R288 IonicContact OE1-CZ 3.19Å; E184-R288 IonicContact OE1-NH1 3.23Å; E184-R288 PolarHBondContact OE1-NH1 3.06Å; E184-R288 IonicContact OE1-NH2 3.45Å; E184-R288 PolarHBondContact OE1-NH2 2.73Å; E184-R288 IonicContact OE2-CZ 2.8Å; E184-R288 IonicContact OE2-NE 3.63Å; E184-R288 PolarHBondContact OE2-NE 2.84Å; E184-R288 IonicContact OE2-NH1 2.84Å; E184-R288 PolarHBondContact OE2-NH1 3.24Å; E184-R288 VanDerWaalsContact OE2-NH1 3.11Å; E184-R288 IonicContact OE2-NH2 2.68Å; E184-R288 PolarHBondContact OE2-NH2 2.92Å
185	Q	65.4	Low	63.8	Low	68 Å²	68	65.1 Å²	65.1	32%	0.318	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-34.2	168.2	-71.3	-177.4	4.5	0	0	112.1	N181 L182 R189 A283	N181-Q185 WeakPolarHBondContact O-CG 3.4Å; N181-Q185 PolarHBondContact O-N 2.74Å; L182-Q185 PolarHBondContact O-N 3.24Å; Q185-R189 WeakPolarHBondContact O-CB 3.3Å; Q185-R189 VanDerWaalsContact O-CG 3.32Å; Q185-R189 WeakPolarHBondContact O-CG 3.42Å; Q185-R189 PolarHBondContact O-N 3.29Å; Q185-A283 HydrophobicContact CG-CB 4.05Å; Q185-A283 PolarHBondContact NE2-O 2.98Å
186	Q	65	Low	61.3	Low	94 Å²	94	67.8 Å²	67.8	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-67.8	-42	172.4	-74.1	177	7.1	0	0	112.4	L182 Q183 E184 A190	L182-Q186 WeakPolarHBondContact O-CG 3.42Å; L182-Q186 PolarHBondContact O-N 3.33Å; Q183-Q186 PolarHBondContact O-N 3.14Å; E184-Q186 PolarHBondContact O-N 2.96Å; Q186-A190 WeakPolarHBondContact O-CB 3.48Å; Q186-A190 PolarHBondContact O-N 3.1Å
187	K	64.6	Low	58.6	Low	71 Å²	71	73.9 Å²	73.9	31%	0.309	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-44.8	174.3	-68.1	162.1	-167.1	166.4	0	112	Q183 E184 A190 S191	Q183-K187 VanDerWaalsContact O-CG 3.31Å; Q183-K187 WeakPolarHBondContact O-CG 3.37Å; Q183-K187 PolarHBondContact O-N 3.14Å; E184-K187 HydrophobicContact CG-CD 4.3Å; E184-K187 PolarHBondContact O-N 2.89Å; E184-K187 VanDerWaalsContact O-N 3.12Å; K187-A190 PolarHBondContact O-N 2.91Å; K187-S191 PolarHBondContact O-N 3.48Å; K187-S191 PolarHBondContact O-OG 3.45Å
188	V	58.4	Low	56	Low	32 Å²	32	74.5 Å²	74.5	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-65	-46.3	177.9	175.2	0	0	0	0	111	E184 A190 S191 S192	E184-V188 WeakPolarHBondContact O-CG2 3.33Å; E184-V188 PolarHBondContact O-N 3.14Å; V188-A190 VanDerWaalsContact C-N 3.34Å; V188-A190 PolarHBondContact O-N 3.17Å; V188-S191 VanDerWaalsContact O-CB 3.32Å; V188-S191 WeakPolarHBondContact O-CB 3.4Å; V188-S191 PolarHBondContact O-N 2.9Å; V188-S192 PolarHBondContact O-N 3.29Å
189	R	49.4	Very low	54	Low	167 Å²	167	77 Å²	77	63%	0.63	43%	0.429	S	S	*	.	H	α-helix	trans	-64.9	-33.6	176.6	-75	179	174.4	-176.9	-0.4	113.4	Q185 S191 S192 Y193	Q185-R189 WeakPolarHBondContact O-CB 3.3Å; Q185-R189 VanDerWaalsContact O-CG 3.32Å; Q185-R189 WeakPolarHBondContact O-CG 3.42Å; Q185-R189 PolarHBondContact O-N 3.29Å; R189-S191 PolarHBondContact O-N 3.08Å; R189-S192 PolarHBondContact O-OG 2.97Å; R189-Y193 WeakPolarHBondContact O-CD2 3.33Å
190	A	47.6	Very low	51.6	Low	39 Å²	39	82 Å²	82	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-25.3	172.7	0	0	0	0	0	112.7	Q186 K187 V188	Q186-A190 WeakPolarHBondContact O-CB 3.48Å; Q186-A190 PolarHBondContact O-N 3.1Å; K187-A190 PolarHBondContact O-N 2.91Å; V188-A190 VanDerWaalsContact C-N 3.34Å; V188-A190 PolarHBondContact O-N 3.17Å
191	S	45.1	Very low	49.5	Very low	35 Å²	35	86.6 Å²	86.6	25%	0.245	50%	0.496	C	S	.	.	H	α-helix	trans	-80.5	-41.2	-179.2	-53.9	0	0	0	0	112.6	K187 V188 R189 Y193 A194	K187-S191 PolarHBondContact O-N 3.48Å; K187-S191 PolarHBondContact O-OG 3.45Å; V188-S191 VanDerWaalsContact O-CB 3.32Å; V188-S191 WeakPolarHBondContact O-CB 3.4Å; V188-S191 PolarHBondContact O-N 2.9Å; R189-S191 PolarHBondContact O-N 3.08Å; S191-Y193 PolarHBondContact O-N 2.83Å; S191-A194 PolarHBondContact O-N 3.23Å
192	S	39.5	Very low	47.6	Very low	76 Å²	76	90.7 Å²	90.7	53%	0.531	52%	0.524	S	S	.	.	H	α-helix	trans	-73.4	-27.6	-171.6	52.7	0	0	0	0	114.9	V188 R189 A194	V188-S192 PolarHBondContact O-N 3.29Å; R189-S192 PolarHBondContact O-OG 2.97Å; S192-A194 PolarHBondContact O-N 3.17Å
193	Y	36.5	Very low	45.7	Very low	192 Å²	192	91.6 Å²	91.6	75%	0.753	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-9	174.6	-77.3	-77.8	0	0	0	114.3	R189 S191	R189-Y193 WeakPolarHBondContact O-CD2 3.33Å; S191-Y193 PolarHBondContact O-N 2.83Å
194	A	36.8	Very low	43.8	Very low	56 Å²	56	96.8 Å²	96.8	46%	0.463	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-11.9	-176.8	0	0	0	0	0	114.5	S191 S192	S191-A194 PolarHBondContact O-N 3.23Å; S192-A194 PolarHBondContact O-N 3.17Å
195	V	38.6	Very low	42.1	Very low	116 Å²	116	106.3 Å²	106.3	70%	0.703	61%	0.61	S	S	*	*	S	Bend	trans	-97.3	-15.7	-165.7	-174.1	0	0	0	0	113.5	N197	V195-N197 PolarHBondContact O-N 3.31Å
196	S	34.8	Very low	40.6	Very low	92 Å²	92	106.5 Å²	106.5	64%	0.643	63%	0.63	S	S	*	*	S	Bend	trans	-91.2	8.3	-171	51.4	0	0	0	0	116.1
197	N	29.4	Very low	39.2	Very low	155 Å²	155	108.1 Å²	108.1	83%	0.829	65%	0.65	S	S	*	*	S	Bend	trans	-128.4	47	-171.3	-95	-28.3	0	0	0	114.2	V195	V195-N197 PolarHBondContact O-N 3.31Å
198	S	32.4	Very low	37.8	Very low	109 Å²	109	114.7 Å²	114.7	76%	0.762	68%	0.679	S	S	*	*			trans	-153.3	72.6	175.3	64.8	0	0	0	0	115.7
199	S	35.3	Very low	36.7	Very low	124 Å²	124	116.5 Å²	116.5	87%	0.867	70%	0.704	S	S	*	*			trans	-150.2	134.8	160.4	54.4	0	0	0	0	111.8
200	S	32.6	Very low	36.2	Very low	122 Å²	122	116.9 Å²	116.9	85%	0.853	72%	0.719	S	S	*	*			trans	-87.7	167.8	-163.2	-55.2	0	0	0	0	115.1
201	P	35.1	Very low	35.6	Very low	121 Å²	121	122.6 Å²	122.6	79%	0.786	74%	0.744	S	S	*	*			trans	-107.9	152.3	-156.5	39.3	-34.3	0	0	0	116.7
202	T	36.4	Very low	35.2	Very low	151 Å²	151	125 Å²	125	93%	0.926	78%	0.775	S	S	*	*			trans	-152.2	155.4	157.6	51.9	0	0	0	0	109.3
203	G	32.8	Very low	34.9	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	78%	0.781	S	S	*	*			trans	125.8	29.6	154.5	0	0	0	0	0	123
204	D	32.6	Very low	34.8	Very low	125 Å²	125	124.9 Å²	124.9	67%	0.668	78%	0.776	S	S	*	*			trans	67.7	137.2	138.5	-156.4	9.7	0	0	0	123.2
205	R	36.5	Very low	34.4	Very low	214 Å²	214	131.4 Å²	131.4	81%	0.808	79%	0.789	S	S	*	*			trans	77.1	87	147	-117.9	170.5	-74.1	-162.9	3.6	125.2
206	G	32.7	Very low	34.1	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	79%	0.79	S	S	*	*				77.3	155.7	127.8	0	0	0	0	0	120.1
207	C	35.3	Very low	33.9	Very low	128 Å²	128	133 Å²	133	87%	0.865	79%	0.794	S	S	*	*			cis	-152	155.8	-2.8	-97.9	0	0	0	0	113.1
208	K	35.8	Very low	34	Very low	209 Å²	209	129.9 Å²	129.9	91%	0.909	79%	0.789	S	S	*	*			trans	-24.3	154.8	165.5	-57.8	170.5	176.8	-176.2	0	118.3
209	G	35.8	Very low	33.7	Very low	71 Å²	71	131.7 Å²	131.7	73%	0.732	80%	0.796	S	S	*	*			cis	159	-148.9	-0.3	0	0	0	0	0	115
210	D	38.4	Very low	33.5	Very low	174 Å²	174	130.7 Å²	130.7	93%	0.93	79%	0.789	S	S	*	*			trans	81.9	138.4	177.5	-74.2	-1	0	0	0	120.3
211	D	35.3	Very low	33.3	Very low	160 Å²	160	131.7 Å²	131.7	86%	0.856	79%	0.785	S	S	*	*			trans	-106.2	151.4	-167	-72.5	-78.4	0	0	0	113.7
212	G	37.5	Very low	33.1	Very low	86 Å²	86	129.6 Å²	129.6	89%	0.887	78%	0.778	S	S	*	*			trans	-132.8	74.1	177.2	0	0	0	0	0	112.7
213	N	32.5	Very low	32.8	Very low	124 Å²	124	128.8 Å²	128.8	66%	0.663	77%	0.773	S	S	*	*			trans	-84.8	151.2	-157.2	-141.5	-11	0	0	0	115.5
214	Q	33.7	Very low	32.7	Very low	140 Å²	140	131.2 Å²	131.2	65%	0.654	78%	0.778	S	S	*	*			trans	72.5	150.3	152.8	-66.8	179	60.4	0	0	118.8
215	R	29.3	Very low	32.5	Very low	194 Å²	194	135.6 Å²	135.6	73%	0.732	79%	0.791	S	S	*	*			cis	-167.5	166.4	0.1	-130.3	-179.9	165.1	-177	-6.4	113.8
216	L	31.2	Very low	32	Very low	138 Å²	138	129 Å²	129	72%	0.723	79%	0.789	S	S	*	*			trans	66.9	152.4	152.4	-66	165.6	0	0	0	116.6
217	S	30.6	Very low	31.8	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	80%	0.795	S	S	*	*			cis	-168.8	153.7	-12.2	42.8	0	0	0	0	110.4
218	A	32.4	Very low	31.3	Very low	89 Å²	89	129.5 Å²	129.5	74%	0.736	80%	0.797	S	S	*	*			cis	-170.2	156.4	-19.8	0	0	0	0	0	109
219	T	26	Very low	31	Very low	146 Å²	146	123.3 Å²	123.3	90%	0.896	79%	0.785	S	S	*	*			trans	-132.3	121.5	171.4	38.1	0	0	0	0	110.4
220	S	31	Very low	30.7	Very low	103 Å²	103	123.3 Å²	123.3	72%	0.72	78%	0.778	S	S	*	*			trans	-167.6	165.2	174.6	72.5	0	0	0	0	108.5
221	N	28.5	Very low	30.6	Very low	143 Å²	143	120.1 Å²	120.1	77%	0.765	76%	0.76	S	S	*	*			cis	-160.4	169.2	16	-148	-17	0	0	0	112.5
222	A	31.7	Very low	31.5	Very low	78 Å²	78	118.2 Å²	118.2	65%	0.645	75%	0.746	S	S	*	*			trans	67.6	148.2	146.2	0	0	0	0	0	121.2
223	T	28.4	Very low	32.8	Very low	134 Å²	134	115.5 Å²	115.5	82%	0.822	71%	0.713	S	S	*	*			cis	-169.2	139.3	-26.8	32.9	0	0	0	0	109.6
224	S	31.2	Very low	35.1	Very low	123 Å²	123	112.7 Å²	112.7	86%	0.86	70%	0.698	S	S	*	*			trans	-158	156.7	139.8	62.6	0	0	0	0	110.4
225	K	28	Very low	37.5	Very low	217 Å²	217	106.3 Å²	106.3	94%	0.943	67%	0.669	S	S	*	*			trans	-95.6	135.6	-171.3	-63.2	170.5	-179.8	173.9	0	111.1
226	G	26.3	Very low	40	Very low	75 Å²	75	100.9 Å²	100.9	77%	0.773	66%	0.657	S	S	*	*			trans	-159	127.3	167.8	0	0	0	0	0	110	G228	G226-G228 PolarHBondContact O-N 2.97Å
227	S	28.5	Very low	42.1	Very low	124 Å²	124	96.3 Å²	96.3	87%	0.867	64%	0.643	S	S	*	*			trans	-74.4	125.1	-168.7	-56.8	0	0	0	0	112.6	A229	S227-A229 VanDerWaalsContact C-N 3.34Å; S227-A229 PolarHBondContact O-N 3.04Å
228	G	25.5	Very low	44.5	Very low	87 Å²	87	93 Å²	93	90%	0.897	62%	0.619	S	S	*	*			trans	-72.7	82.9	171.1	0	0	0	0	0	111.8	G226 A230	G226-G228 PolarHBondContact O-N 2.97Å; G228-A230 PolarHBondContact O-N 2.77Å
229	A	28.4	Very low	46.7	Very low	79 Å²	79	98.9 Å²	98.9	65%	0.653	63%	0.628	S	S	*	*			trans	-75.7	117.4	173.6	0	0	0	0	0	110.5	S227 L231	S227-A229 VanDerWaalsContact C-N 3.34Å; S227-A229 PolarHBondContact O-N 3.04Å; A229-L231 PolarHBondContact O-N 2.82Å
230	A	29.5	Very low	49	Very low	72 Å²	72	94.4 Å²	94.4	60%	0.595	60%	0.603	S	S	*	*			trans	-66.3	125.1	164.1	0	0	0	0	0	108.6	G228 Q232	G228-A230 PolarHBondContact O-N 2.77Å; A230-Q232 VanDerWaalsContact C-N 3.3Å; A230-Q232 PolarHBondContact O-N 3.34Å
231	L	37.8	Very low	50.7	Low	106 Å²	106	98.1 Å²	98.1	56%	0.555	61%	0.607	S	S	*	*			trans	-72.8	86.1	177.9	-93.2	77.1	0	0	0	110.3	A229 T233	A229-L231 PolarHBondContact O-N 2.82Å; L231-T233 PolarHBondContact O-N 3.3Å
232	Q	52.8	Low	52.7	Low	120 Å²	120	99.7 Å²	99.7	56%	0.561	61%	0.609	S	S	*	*			trans	-63.3	114.3	157.5	-74.4	-179.9	-13.2	0	0	108.6	A230 N234 L244	A230-Q232 VanDerWaalsContact C-N 3.3Å; A230-Q232 PolarHBondContact O-N 3.34Å; Q232-N234 PolarHBondContact O-N 2.97Å; Q232-L244 HydrophobicContact CB-CD2 3.71Å; Q232-L244 HydrophobicContact CG-CD2 4.12Å
233	T	66.3	Low	55	Low	29 Å²	29	98.1 Å²	98.1	18%	0.178	59%	0.592	C	S	.	*			trans	-75.7	110.9	174.5	34.3	0	0	0	0	110.2	L231 A245	L231-T233 PolarHBondContact O-N 3.3Å; T233-A245 WeakPolarHBondContact O-CB 3.44Å; T233-A245 PolarHBondContact O-N 3.21Å
234	N	80.1	Confident	57.5	Low	66 Å²	66	95.9 Å²	95.9	35%	0.353	57%	0.574	S	S	.	*	B	Isolated β-bridge	trans	-73.6	157.7	170.5	-48.5	95.8	0	0	0	110.9	Q232 T236 K241 E242 T243	Q232-N234 PolarHBondContact O-N 2.97Å; N234-T236 PolarHBondContact O-N 2.67Å; N234-K241 WeakPolarHBondContact CB-O 3.39Å; N234-K241 PolarHBondContact ND2-O 3.09Å; N234-E242 PolarHBondContact ND2-O 3.09Å; N234-T243 CarbonylContact C-O 3.38Å; N234-T243 WeakPolarHBondContact CA-O 3.44Å
235	C	83.2	Confident	59.9	Low	6 Å²	6	90.8 Å²	90.8	4%	0.041	54%	0.539	C	S	.	.			trans	-64.8	125.7	174.6	176.7	0	0	0	0	111.6	G237 C238 T243 Y255 C257 C260	C235-G237 PolarHBondContact SG-N 3.21Å; C235-G237 VanDerWaalsContact SG-N 3.37Å; C235-C238 VanDerWaalsContact CB-SG 3.59Å; C235-C238 PolarHBondContact SG-SG 3.07Å; C235-T243 WeakPolarHBondContact CB-O 3.16Å; C235-T243 PolarHBondContact N-O 2.85Å; C235-Y255 CarbonylContact C-O 3.57Å; C235-Y255 WeakPolarHBondContact CA-O 3.47Å; C235-Y255 PolarHBondContact SG-O 3.21Å; C235-C257 HydrophobicContact CB-CB 3.63Å; C235-C257 VanDerWaalsContact CB-N 3.34Å; C235-C257 PolarHBondContact SG-N 2.77Å; C235-C260 PolarHBondContact SG-SG 2.74Å
236	T	82.1	Confident	62.5	Low	79 Å²	79	82.9 Å²	82.9	49%	0.485	51%	0.509	S	S	.	.	S	Bend	trans	-87	-17.9	174.9	57.4	0	0	0	0	112.5	N234 N254 Y255	N234-T236 PolarHBondContact O-N 2.67Å; T236-N254 WeakPolarHBondContact CB-OD1 3.38Å; T236-N254 WeakPolarHBondContact OG1-CA 3.41Å; T236-N254 WeakPolarHBondContact OG1-CB 3.24Å; T236-N254 PolarHBondContact OG1-OD1 3.48Å; T236-Y255 HydrophobicContact CG2-CD2 4.34Å; T236-Y255 PolarHBondContact N-O 2.99Å; T236-Y255 PolarHBondContact OG1-N 3.45Å; T236-Y255 PolarHBondContact OG1-O 2.96Å
237	G	76.3	Confident	65.2	Low	42 Å²	42	79.4 Å²	79.4	43%	0.433	47%	0.473	S	S	.	.	S	Bend	trans	-80.9	-6.6	-178.7	0	0	0	0	0	116.5	C235 Y255	C235-G237 PolarHBondContact SG-N 3.21Å; C235-G237 VanDerWaalsContact SG-N 3.37Å; G237-Y255 PolarHBondContact N-O 3.22Å
238	C	80.5	Confident	67.7	Low	34 Å²	34	74.5 Å²	74.5	23%	0.23	44%	0.437	C	S	.	.	S	Bend	trans	-125.6	161.8	-176.3	65.3	0	0	0	0	113.7	C235 S240 T243 C260	C235-C238 VanDerWaalsContact CB-SG 3.59Å; C235-C238 PolarHBondContact SG-SG 3.07Å; C238-S240 VanDerWaalsContact C-N 3.26Å; C238-S240 PolarHBondContact O-N 3.48Å; C238-S240 PolarHBondContact SG-O 3.49Å; C238-S240 PolarHBondContact SG-OG 3.47Å; C238-T243 PolarHBondContact SG-OG1 3.01Å; C238-C260 VanDerWaalsContact CB-SG 3.6Å
239	K	78.8	Confident	70.3	Confident	213 Å²	213	70.3 Å²	70.3	93%	0.926	39%	0.394	S	S	*	.	S	Bend	trans	-70.2	-20.4	174.6	-66.8	-175.6	178.2	179.7	0	113.4	K241	K239-K241 PolarHBondContact O-N 3.12Å; K239-K241 VanDerWaalsContact O-N 3.14Å
240	S	74.3	Confident	72.3	Confident	53 Å²	53	69.3 Å²	69.3	37%	0.371	37%	0.373	S	S	.	.			trans	-82	85.8	177.9	46.9	0	0	0	0	111.1	C238 E242 T243	C238-S240 VanDerWaalsContact C-N 3.26Å; C238-S240 PolarHBondContact O-N 3.48Å; C238-S240 PolarHBondContact SG-O 3.49Å; C238-S240 PolarHBondContact SG-OG 3.47Å; S240-E242 PolarHBondContact O-N 3Å; S240-T243 PolarHBondContact O-N 3.14Å; S240-T243 VanDerWaalsContact O-N 3.09Å; S240-T243 PolarHBondContact O-OG1 3.1Å; S240-T243 PolarHBondContact OG-OG1 3.26Å
241	K	65.9	Low	74.5	Confident	181 Å²	181	70.4 Å²	70.4	79%	0.787	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-14.7	180	-68.1	-174.2	175.7	-174.9	0	115.3	N234 K239	N234-K241 WeakPolarHBondContact CB-O 3.39Å; N234-K241 PolarHBondContact ND2-O 3.09Å; K239-K241 PolarHBondContact O-N 3.12Å; K239-K241 VanDerWaalsContact O-N 3.14Å
242	E	71.8	Confident	76.4	Confident	175 Å²	175	66.5 Å²	66.5	82%	0.818	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-20.9	-177.8	-66.6	168.9	-170.2	0	0	113.4	N234 S240 L244	N234-E242 PolarHBondContact ND2-O 3.09Å; S240-E242 PolarHBondContact O-N 3Å; E242-L244 PolarHBondContact O-N 3.16Å
243	T	79.9	Confident	77.5	Confident	46 Å²	46	65.5 Å²	65.5	28%	0.282	35%	0.353	S	S	.	.	S	Bend	trans	-68	125.5	-178.2	47.1	0	0	0	0	111.5	N234 C235 C238 S240	N234-T243 CarbonylContact C-O 3.38Å; N234-T243 WeakPolarHBondContact CA-O 3.44Å; C235-T243 WeakPolarHBondContact CB-O 3.16Å; C235-T243 PolarHBondContact N-O 2.85Å; C238-T243 PolarHBondContact SG-OG1 3.01Å; S240-T243 PolarHBondContact O-N 3.14Å; S240-T243 VanDerWaalsContact O-N 3.09Å; S240-T243 PolarHBondContact O-OG1 3.1Å; S240-T243 PolarHBondContact OG-OG1 3.26Å
244	L	81.2	Confident	78.1	Confident	87 Å²	87	66.7 Å²	66.7	46%	0.455	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-60.6	144.5	177.4	-60.5	179	0	0	0	112	Q232 E242 C257	Q232-L244 HydrophobicContact CB-CD2 3.71Å; Q232-L244 HydrophobicContact CG-CD2 4.12Å; E242-L244 PolarHBondContact O-N 3.16Å; L244-C257 VanDerWaalsContact O-CA 3.29Å; L244-C257 WeakPolarHBondContact O-CA 3.34Å; L244-C257 WeakPolarHBondContact O-CB 3.34Å
245	A	80.6	Confident	78.2	Confident	15 Å²	15	65.6 Å²	65.6	12%	0.124	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-79.2	144.3	168.8	0	0	0	0	0	111.2	T233 L256 L278	T233-A245 WeakPolarHBondContact O-CB 3.44Å; T233-A245 PolarHBondContact O-N 3.21Å; A245-L256 CarbonylContact C-O 3.31Å; A245-L256 WeakPolarHBondContact CA-O 3.41Å; A245-L278 HydrophobicContact CB-CD1 3.87Å
246	V	83.7	Confident	78.2	Confident	51 Å²	51	65.3 Å²	65.3	31%	0.309	35%	0.348	S	S	.	.			trans	-120.2	-18.6	173.8	-58.8	0	0	0	0	111.9	L256 V261 L278	V246-L256 PolarHBondContact N-O 2.93Å; V246-V261 HydrophobicContact CG2-CG2 3.97Å; V246-L278 WeakPolarHBondContact O-CB 3.46Å; V246-L278 PolarHBondContact O-N 3.44Å
247	A	81.7	Confident	78.4	Confident	3 Å²	3	61.8 Å²	61.8	3%	0.025	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	171.1	178.5	0	0	0	0	0	111.8	L256 V261 V275 V276	A247-L256 HydrophobicContact CB-CB 4.5Å; A247-L256 PolarHBondContact N-O 2.92Å; A247-L256 VanDerWaalsContact N-O 3.1Å; A247-L256 PolarHBondContact O-N 3.31Å; A247-V261 HydrophobicContact CB-CG2 3.53Å; A247-V275 HydrophobicContact CB-CG1 3.54Å; A247-V276 CarbonylContact C-O 3.57Å; A247-V276 VanDerWaalsContact CA-O 3.23Å; A247-V276 WeakPolarHBondContact CA-O 3.48Å; A247-V276 VanDerWaalsContact CB-O 3.29Å; A247-V276 WeakPolarHBondContact CB-O 3.31Å
248	H	81.1	Confident	78.9	Confident	20 Å²	20	64 Å²	64	9%	0.093	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.8	171.1	177.3	-97.4	0	0	0	110.2	Y250 N254 Y255 V275 V276 L278	H248-Y250 AromaticContact ND1-CD2 3.93Å; H248-Y250 AromaticContact ND1-CG 3.95Å; H248-N254 WeakPolarHBondContact CA-O 3.47Å; H248-Y255 HydrophobicContact CB-CD1 4.4Å; H248-Y255 AromaticContact CD2-CE1 3.98Å; H248-V275 WeakPolarHBondContact O-CA 3.16Å; H248-V276 PolarHBondContact N-O 3.07Å; H248-V276 PolarHBondContact O-N 3.47Å; H248-L278 HydrophobicContact CB-CD2 4.22Å
249	C	80.4	Confident	79.2	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117.6	167.1	172.7	0	0	0	0	109.4	C252 T253 N254 L256 R274 V275	C249-C252 HydrophobicContact CB-CB 3.63Å; C249-C252 WeakPolarHBondContact CB-SG 3.35Å; C249-C252 WeakPolarHBondContact SG-CB 3.44Å; C249-C252 PolarHBondContact SG-N 3.2Å; C249-C252 CovalentContact SG-SG 2.04Å; C249-C252 PolarHBondContact SG-SG 3.4Å; C249-T253 VanDerWaalsContact O-CA 3.31Å; C249-T253 WeakPolarHBondContact O-CA 3.46Å; C249-T253 PolarHBondContact O-N 2.92Å; C249-N254 PolarHBondContact N-O 3.47Å; C249-N254 PolarHBondContact O-N 2.96Å; C249-L256 HydrophobicContact CB-CD1 3.99Å; C249-L256 HydrophobicContact CB-CD2 4.38Å; C249-L256 HydrophobicContact CB-CG 4.27Å; C249-R274 WeakPolarHBondContact CA-O 3.45Å; C249-V275 HydrophobicContact CB-CG2 4.12Å
250	Y	70.3	Confident	79.7	Confident	57 Å²	57	58.8 Å²	58.8	22%	0.224	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-47.7	-179.9	-81.2	-87.4	0	0	0	112.7	H248 C252 T253 R274 V276	H248-Y250 AromaticContact ND1-CD2 3.93Å; H248-Y250 AromaticContact ND1-CG 3.95Å; Y250-C252 VanDerWaalsContact C-N 3.3Å; Y250-C252 PolarHBondContact O-N 2.91Å; Y250-T253 PolarHBondContact O-N 3.36Å; Y250-T253 VanDerWaalsContact O-N 3.14Å; Y250-R274 PolarHBondContact N-O 3.36Å; Y250-V276 HydrophobicContact CD2-CG2 4.08Å; Y250-V276 HydrophobicContact CE2-CB 3.93Å; Y250-V276 HydrophobicContact CE2-CG2 3.66Å
251	D	75.6	Confident	80.3	Confident	95 Å²	95	57.3 Å²	57.3	51%	0.508	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.4	-177.4	-49.1	-91.9	0	0	0	112.2	H273 R274	D251-H273 WeakPolarHBondContact OD2-CA 3.31Å; D251-R274 PolarHBondContact OD2-N 3.4Å
252	C	77	Confident	81.3	Confident	24 Å²	24	53.1 Å²	53.1	16%	0.162	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-19.6	175.9	-34.3	0	0	0	0	113.7	C249 Y250 N254 H264 H273	C249-C252 HydrophobicContact CB-CB 3.63Å; C249-C252 WeakPolarHBondContact CB-SG 3.35Å; C249-C252 WeakPolarHBondContact SG-CB 3.44Å; C249-C252 PolarHBondContact SG-N 3.2Å; C249-C252 CovalentContact SG-SG 2.04Å; C249-C252 PolarHBondContact SG-SG 3.4Å; Y250-C252 VanDerWaalsContact C-N 3.3Å; Y250-C252 PolarHBondContact O-N 2.91Å; C252-N254 HydrophobicContact CB-CB 3.86Å; C252-N254 PolarHBondContact O-N 3.45Å; C252-N254 PolarHBondContact O-ND2 2.87Å; C252-H264 PolarHBondContact SG-NE2 2.85Å; C252-H273 VanDerWaalsContact SG-CE1 3.58Å; C252-H273 PolarHBondContact SG-ND1 3.26Å
253	T	75.7	Confident	82	Confident	100 Å²	100	46.3 Å²	46.3	61%	0.613	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	30.6	-161.9	61.6	0	0	0	0	114.5	C249 Y250	C249-T253 VanDerWaalsContact O-CA 3.31Å; C249-T253 WeakPolarHBondContact O-CA 3.46Å; C249-T253 PolarHBondContact O-N 2.92Å; Y250-T253 PolarHBondContact O-N 3.36Å; Y250-T253 VanDerWaalsContact O-N 3.14Å
254	N	80.2	Confident	82.4	Confident	54 Å²	54	45.2 Å²	45.2	29%	0.289	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.8	-173.5	-86.2	-53.1	0	0	0	112.5	T236 H248 C249 C252 L256	T236-N254 WeakPolarHBondContact CB-OD1 3.38Å; T236-N254 WeakPolarHBondContact OG1-CA 3.41Å; T236-N254 WeakPolarHBondContact OG1-CB 3.24Å; T236-N254 PolarHBondContact OG1-OD1 3.48Å; H248-N254 WeakPolarHBondContact CA-O 3.47Å; C249-N254 PolarHBondContact N-O 3.47Å; C249-N254 PolarHBondContact O-N 2.96Å; C252-N254 HydrophobicContact CB-CB 3.86Å; C252-N254 PolarHBondContact O-N 3.45Å; C252-N254 PolarHBondContact O-ND2 2.87Å; N254-L256 HydrophobicContact CB-CD2 3.94Å
255	Y	81.1	Confident	82.6	Confident	42 Å²	42	47 Å²	47	17%	0.165	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.5	166.1	-66.7	-78.7	0	0	0	109.4	C235 T236 G237 H248 L278	C235-Y255 CarbonylContact C-O 3.57Å; C235-Y255 WeakPolarHBondContact CA-O 3.47Å; C235-Y255 PolarHBondContact SG-O 3.21Å; T236-Y255 HydrophobicContact CG2-CD2 4.34Å; T236-Y255 PolarHBondContact N-O 2.99Å; T236-Y255 PolarHBondContact OG1-N 3.45Å; T236-Y255 PolarHBondContact OG1-O 2.96Å; G237-Y255 PolarHBondContact N-O 3.22Å; H248-Y255 HydrophobicContact CB-CD1 4.4Å; H248-Y255 AromaticContact CD2-CE1 3.98Å; Y255-L278 HydrophobicContact CD1-CD1 4.36Å; Y255-L278 HydrophobicContact CD1-CD2 4.24Å; Y255-L278 HydrophobicContact CE1-CD2 4.15Å
256	L	83.3	Confident	82.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.4	-170.8	-52.8	-171.5	0	0	0	111.1	A245 V246 A247 C249 N254 C260 V261 H264 V275	A245-L256 CarbonylContact C-O 3.31Å; A245-L256 WeakPolarHBondContact CA-O 3.41Å; V246-L256 PolarHBondContact N-O 2.93Å; A247-L256 HydrophobicContact CB-CB 4.5Å; A247-L256 PolarHBondContact N-O 2.92Å; A247-L256 VanDerWaalsContact N-O 3.1Å; A247-L256 PolarHBondContact O-N 3.31Å; C249-L256 HydrophobicContact CB-CD1 3.99Å; C249-L256 HydrophobicContact CB-CD2 4.38Å; C249-L256 HydrophobicContact CB-CG 4.27Å; N254-L256 HydrophobicContact CB-CD2 3.94Å; L256-C260 HydrophobicContact CB-CB 3.81Å; L256-C260 HydrophobicContact CD2-CB 3.94Å; L256-C260 HydrophobicContact CG-CB 4.31Å; L256-V261 HydrophobicContact CB-CG2 3.77Å; L256-V261 HydrophobicContact CD1-CG2 4.22Å; L256-H264 HydrophobicContact CD1-CB 4.37Å; L256-V275 HydrophobicContact CD1-CG1 3.9Å; L256-V275 HydrophobicContact CD1-CG2 3.76Å
257	C	87	Confident	82.9	Confident	6 Å²	6	57.2 Å²	57.2	4%	0.041	29%	0.293	C	S	.	.			trans	-71.9	167.2	160.7	62.5	0	0	0	0	110.1	C235 L244 N259 C260 V261	C235-C257 HydrophobicContact CB-CB 3.63Å; C235-C257 VanDerWaalsContact CB-N 3.34Å; C235-C257 PolarHBondContact SG-N 2.77Å; L244-C257 VanDerWaalsContact O-CA 3.29Å; L244-C257 WeakPolarHBondContact O-CA 3.34Å; L244-C257 WeakPolarHBondContact O-CB 3.34Å; C257-N259 PolarHBondContact O-N 2.94Å; C257-N259 VanDerWaalsContact O-N 3.11Å; C257-C260 WeakPolarHBondContact O-CA 3.32Å; C257-C260 WeakPolarHBondContact O-CB 3.41Å; C257-C260 PolarHBondContact O-N 3.05Å; C257-C260 VanDerWaalsContact SG-SG 3.68Å; C257-V261 PolarHBondContact O-N 3.19Å
258	T	86.4	Confident	82.8	Confident	89 Å²	89	64.8 Å²	64.8	55%	0.546	33%	0.328	S	S	.	.	H	α-helix	trans	-50.8	-40.9	-177.8	-28.6	0	0	0	0	112.7	C260 V261 M262	T258-C260 VanDerWaalsContact C-N 3.3Å; T258-C260 PolarHBondContact O-N 2.85Å; T258-V261 PolarHBondContact O-N 2.72Å; T258-M262 VanDerWaalsContact O-CG 3.3Å; T258-M262 WeakPolarHBondContact O-CG 3.3Å; T258-M262 PolarHBondContact O-N 2.89Å
259	N	87.4	Confident	82.8	Confident	123 Å²	123	68 Å²	68	66%	0.658	35%	0.352	S	S	*	.	H	α-helix	trans	-63.9	-32.9	176.7	-63.4	-11.5	0	0	0	113.1	C257 A263	C257-N259 PolarHBondContact O-N 2.94Å; C257-N259 VanDerWaalsContact O-N 3.11Å; N259-A263 PolarHBondContact O-N 2.89Å
260	C	88.1	Confident	83	Confident	13 Å²	13	70.9 Å²	70.9	9%	0.088	36%	0.364	C	S	.	.	H	α-helix	trans	-80.6	-31.8	176.1	-67.2	0	0	0	0	112.4	C235 C238 L256 C257 T258 A263 H264	C235-C260 PolarHBondContact SG-SG 2.74Å; C238-C260 VanDerWaalsContact CB-SG 3.6Å; L256-C260 HydrophobicContact CB-CB 3.81Å; L256-C260 HydrophobicContact CD2-CB 3.94Å; L256-C260 HydrophobicContact CG-CB 4.31Å; C257-C260 WeakPolarHBondContact O-CA 3.32Å; C257-C260 WeakPolarHBondContact O-CB 3.41Å; C257-C260 PolarHBondContact O-N 3.05Å; C257-C260 VanDerWaalsContact SG-SG 3.68Å; T258-C260 VanDerWaalsContact C-N 3.3Å; T258-C260 PolarHBondContact O-N 2.85Å; C260-A263 WeakPolarHBondContact O-CB 3.13Å; C260-A263 PolarHBondContact O-N 3.31Å; C260-H264 PolarHBondContact O-N 2.83Å; C260-H264 PolarHBondContact O-ND1 3.47Å
261	V	87.9	Confident	83.4	Confident	22 Å²	22	74.9 Å²	74.9	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-60.9	-47.5	169.5	178	0	0	0	0	110	V246 A247 L256 C257 T258 A263 H264 Q265 V275	V246-V261 HydrophobicContact CG2-CG2 3.97Å; A247-V261 HydrophobicContact CB-CG2 3.53Å; L256-V261 HydrophobicContact CB-CG2 3.77Å; L256-V261 HydrophobicContact CD1-CG2 4.22Å; C257-V261 PolarHBondContact O-N 3.19Å; T258-V261 PolarHBondContact O-N 2.72Å; V261-A263 VanDerWaalsContact C-N 3.32Å; V261-A263 PolarHBondContact O-N 3.04Å; V261-H264 PolarHBondContact O-N 2.88Å; V261-H264 VanDerWaalsContact O-N 3.08Å; V261-Q265 WeakPolarHBondContact O-CG 3.32Å; V261-Q265 PolarHBondContact O-N 2.79Å; V261-V275 HydrophobicContact CG1-CG1 4.29Å; V261-V275 HydrophobicContact CG2-CG1 4.23Å
262	M	86	Confident	83.5	Confident	94 Å²	94	73.8 Å²	73.8	46%	0.463	40%	0.396	S	S	.	.	H	α-helix	trans	-56.8	-44.4	172.4	-66.5	-70.4	-69.6	0	0	111.4	T258 H264 Q265 Y266	T258-M262 VanDerWaalsContact O-CG 3.3Å; T258-M262 WeakPolarHBondContact O-CG 3.3Å; T258-M262 PolarHBondContact O-N 2.89Å; M262-H264 VanDerWaalsContact C-N 3.3Å; M262-H264 PolarHBondContact O-N 3.23Å; M262-Q265 PolarHBondContact O-N 3.02Å; M262-Q265 VanDerWaalsContact O-N 3.13Å; M262-Y266 HydrophobicContact CE-CD2 4.04Å; M262-Y266 HydrophobicContact CE-CE2 3.54Å; M262-Y266 VanDerWaalsContact O-CD2 3.23Å; M262-Y266 WeakPolarHBondContact O-CD2 3.4Å; M262-Y266 PolarHBondContact O-N 2.74Å; M262-Y266 VanDerWaalsContact O-N 3.09Å; M262-Y266 HydrophobicContact SD-CE2 3.95Å
263	A	87.2	Confident	83.8	Confident	31 Å²	31	75.8 Å²	75.8	26%	0.256	40%	0.403	S	S	.	.	H	α-helix	trans	-58.4	-40.9	175.5	0	0	0	0	0	112.3	N259 C260 V261 Q265 Y266 M267 F270	N259-A263 PolarHBondContact O-N 2.89Å; C260-A263 WeakPolarHBondContact O-CB 3.13Å; C260-A263 PolarHBondContact O-N 3.31Å; V261-A263 VanDerWaalsContact C-N 3.32Å; V261-A263 PolarHBondContact O-N 3.04Å; A263-Q265 VanDerWaalsContact C-N 3.31Å; A263-Q265 PolarHBondContact O-N 3.37Å; A263-Y266 PolarHBondContact O-N 2.82Å; A263-M267 HydrophobicContact CB-CG 4.45Å; A263-M267 VanDerWaalsContact O-CB 3.23Å; A263-M267 WeakPolarHBondContact O-CB 3.23Å; A263-M267 VanDerWaalsContact O-CG 3.24Å; A263-M267 WeakPolarHBondContact O-CG 3.36Å; A263-M267 PolarHBondContact O-N 3.45Å; A263-F270 HydrophobicContact CB-CE2 4.27Å; A263-F270 WeakPolarHBondContact O-CD2 3.28Å
264	H	88.5	Confident	84	Confident	24 Å²	24	80 Å²	80	11%	0.111	41%	0.408	C	S	.	.	H	α-helix	trans	-69.7	-25.6	177.6	-74.5	62.3	0	0	0	113.7	C252 L256 C260 V261 M262 F270 H273 V275	C252-H264 PolarHBondContact SG-NE2 2.85Å; L256-H264 HydrophobicContact CD1-CB 4.37Å; C260-H264 PolarHBondContact O-N 2.83Å; C260-H264 PolarHBondContact O-ND1 3.47Å; V261-H264 PolarHBondContact O-N 2.88Å; V261-H264 VanDerWaalsContact O-N 3.08Å; M262-H264 VanDerWaalsContact C-N 3.3Å; M262-H264 PolarHBondContact O-N 3.23Å; H264-F270 HydrophobicContact CB-CB 4.24Å; H264-F270 AromaticContact CD2-CG 3.84Å; H264-F270 AromaticContact ND1-CD2 3.95Å; H264-F270 AromaticContact NE2-CD1 3.83Å; H264-F270 AromaticContact NE2-CG 3.9Å; H264-H273 AromaticContact CD2-ND1 3.76Å; H264-H273 AromaticContact NE2-ND1 3.94Å; H264-V275 HydrophobicContact CB-CG2 3.71Å
265	Q	84.5	Confident	84.1	Confident	123 Å²	123	79.6 Å²	79.6	58%	0.575	41%	0.406	S	S	*	.	H	α-helix	trans	-82.9	-24.8	177.5	-71.5	172.3	-17.5	0	0	113.6	V261 M262 A263	V261-Q265 WeakPolarHBondContact O-CG 3.32Å; V261-Q265 PolarHBondContact O-N 2.79Å; M262-Q265 PolarHBondContact O-N 3.02Å; M262-Q265 VanDerWaalsContact O-N 3.13Å; A263-Q265 VanDerWaalsContact C-N 3.31Å; A263-Q265 PolarHBondContact O-N 3.37Å
266	Y	85.7	Confident	83.8	Confident	174 Å²	174	79.9 Å²	79.9	68%	0.682	41%	0.413	S	S	*	.	H	α-helix	trans	-123.4	-3.7	-169.2	-64.5	-68	0	0	0	115.8	M262 A263	M262-Y266 HydrophobicContact CE-CD2 4.04Å; M262-Y266 HydrophobicContact CE-CE2 3.54Å; M262-Y266 VanDerWaalsContact O-CD2 3.23Å; M262-Y266 WeakPolarHBondContact O-CD2 3.4Å; M262-Y266 PolarHBondContact O-N 2.74Å; M262-Y266 VanDerWaalsContact O-N 3.09Å; M262-Y266 HydrophobicContact SD-CE2 3.95Å; A263-Y266 PolarHBondContact O-N 2.82Å
267	M	85.1	Confident	83.5	Confident	107 Å²	107	83.1 Å²	83.1	53%	0.527	43%	0.43	S	S	.	.			trans	-109.7	124.1	178.5	-58.5	-69.6	-67.7	0	0	111.5	A263 C269 F270	A263-M267 HydrophobicContact CB-CG 4.45Å; A263-M267 VanDerWaalsContact O-CB 3.23Å; A263-M267 WeakPolarHBondContact O-CB 3.23Å; A263-M267 VanDerWaalsContact O-CG 3.24Å; A263-M267 WeakPolarHBondContact O-CG 3.36Å; A263-M267 PolarHBondContact O-N 3.45Å; M267-C269 PolarHBondContact O-N 3.03Å; M267-F270 HydrophobicContact CB-CD2 3.98Å; M267-F270 HydrophobicContact CB-CE2 4.37Å; M267-F270 PolarHBondContact O-N 3.13Å
268	H	79.9	Confident	82.8	Confident	163 Å²	163	84.7 Å²	84.7	76%	0.755	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-52.1	-27.3	177	-84.4	-64.3	0	0	0	114.5	F270 E271	H268-F270 PolarHBondContact O-N 3.15Å; H268-E271 IonicContact CE1-OE2 3.51Å; H268-E271 IonicContact CG-OE2 3.83Å; H268-E271 IonicContact ND1-OE2 2.72Å; H268-E271 PolarHBondContact ND1-OE2 3.2Å; H268-E271 WeakPolarHBondContact O-CB 3.31Å; H268-E271 PolarHBondContact O-N 3.4Å
269	C	81.5	Confident	81.7	Confident	87 Å²	87	85.1 Å²	85.1	59%	0.588	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-70.9	-3.9	177.6	55.4	0	0	0	0	115	M267	M267-C269 PolarHBondContact O-N 3.03Å
270	F	84.9	Confident	80.2	Confident	61 Å²	61	86.1 Å²	86.1	27%	0.268	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-125.4	12.8	173.4	-52	-53	0	0	0	112.1	A263 H264 M267 H268 G272 H273	A263-F270 HydrophobicContact CB-CE2 4.27Å; A263-F270 WeakPolarHBondContact O-CD2 3.28Å; H264-F270 HydrophobicContact CB-CB 4.24Å; H264-F270 AromaticContact CD2-CG 3.84Å; H264-F270 AromaticContact ND1-CD2 3.95Å; H264-F270 AromaticContact NE2-CD1 3.83Å; H264-F270 AromaticContact NE2-CG 3.9Å; M267-F270 HydrophobicContact CB-CD2 3.98Å; M267-F270 HydrophobicContact CB-CE2 4.37Å; M267-F270 PolarHBondContact O-N 3.13Å; H268-F270 PolarHBondContact O-N 3.15Å; F270-G272 PolarHBondContact O-N 2.98Å; F270-H273 AromaticContact CD1-CE1 3.78Å; F270-H273 AromaticContact CD1-ND1 3.69Å; F270-H273 VanDerWaalsContact O-CB 3.28Å; F270-H273 WeakPolarHBondContact O-CB 3.31Å; F270-H273 PolarHBondContact O-N 3.48Å
271	E	78.6	Confident	78.5	Confident	141 Å²	141	86.7 Å²	86.7	66%	0.659	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	124.7	-179.1	-172.5	170.4	-171.6	0	0	110.7	H268	H268-E271 IonicContact CE1-OE2 3.51Å; H268-E271 IonicContact CG-OE2 3.83Å; H268-E271 IonicContact ND1-OE2 2.72Å; H268-E271 PolarHBondContact ND1-OE2 3.2Å; H268-E271 WeakPolarHBondContact O-CB 3.31Å; H268-E271 PolarHBondContact O-N 3.4Å
272	G	77.3	Confident	76.5	Confident	71 Å²	71	92.3 Å²	92.3	73%	0.732	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	-9.6	-174.2	0	0	0	0	0	115.6	F270 R274	F270-G272 PolarHBondContact O-N 2.98Å; G272-R274 PolarHBondContact O-N 2.97Å
273	H	82.8	Confident	74.6	Confident	67 Å²	67	90.2 Å²	90.2	31%	0.31	47%	0.47	S	S	.	.			trans	-66.4	127.7	178.2	-73	-176.3	0	0	0	112.7	D251 C252 H264 F270 V275	D251-H273 WeakPolarHBondContact OD2-CA 3.31Å; C252-H273 VanDerWaalsContact SG-CE1 3.58Å; C252-H273 PolarHBondContact SG-ND1 3.26Å; H264-H273 AromaticContact CD2-ND1 3.76Å; H264-H273 AromaticContact NE2-ND1 3.94Å; F270-H273 AromaticContact CD1-CE1 3.78Å; F270-H273 AromaticContact CD1-ND1 3.69Å; F270-H273 VanDerWaalsContact O-CB 3.28Å; F270-H273 WeakPolarHBondContact O-CB 3.31Å; F270-H273 PolarHBondContact O-N 3.48Å; H273-V275 PolarHBondContact O-N 3.32Å
274	R	80.2	Confident	72.6	Confident	189 Å²	189	99.2 Å²	99.2	71%	0.713	50%	0.498	S	S	*	.			trans	-76.4	100	173.6	-75.3	-173.6	170.7	-157.7	-1.5	110.7	C249 Y250 D251 G272	C249-R274 WeakPolarHBondContact CA-O 3.45Å; Y250-R274 PolarHBondContact N-O 3.36Å; D251-R274 PolarHBondContact OD2-N 3.4Å; G272-R274 PolarHBondContact O-N 2.97Å
275	V	82.2	Confident	70.5	Confident	44 Å²	44	103.7 Å²	103.7	27%	0.267	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.1	168.2	-179.1	0	0	0	0	109.7	A247 H248 C249 L256 V261 H264 H273	A247-V275 HydrophobicContact CB-CG1 3.54Å; H248-V275 WeakPolarHBondContact O-CA 3.16Å; C249-V275 HydrophobicContact CB-CG2 4.12Å; L256-V275 HydrophobicContact CD1-CG1 3.9Å; L256-V275 HydrophobicContact CD1-CG2 3.76Å; V261-V275 HydrophobicContact CG1-CG1 4.29Å; V261-V275 HydrophobicContact CG2-CG1 4.23Å; H264-V275 HydrophobicContact CB-CG2 3.71Å; H273-V275 PolarHBondContact O-N 3.32Å
276	V	76	Confident	68.8	Low	49 Å²	49	99.7 Å²	99.7	30%	0.297	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.4	175.7	-179.8	0	0	0	0	109.8	A247 H248 Y250 V281	A247-V276 CarbonylContact C-O 3.57Å; A247-V276 VanDerWaalsContact CA-O 3.23Å; A247-V276 WeakPolarHBondContact CA-O 3.48Å; A247-V276 VanDerWaalsContact CB-O 3.29Å; A247-V276 WeakPolarHBondContact CB-O 3.31Å; H248-V276 PolarHBondContact N-O 3.07Å; H248-V276 PolarHBondContact O-N 3.47Å; Y250-V276 HydrophobicContact CD2-CG2 4.08Å; Y250-V276 HydrophobicContact CE2-CB 3.93Å; Y250-V276 HydrophobicContact CE2-CG2 3.66Å; V276-V281 HydrophobicContact CG1-CG2 4.12Å
277	D	76.6	Confident	67.2	Low	67 Å²	67	99.7 Å²	99.7	36%	0.358	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	133.4	178.1	-166.5	-63	0	0	0	111	S279 Q280	D277-S279 PolarHBondContact O-N 3.31Å; D277-S279 VanDerWaalsContact O-N 3.16Å; D277-S279 VanDerWaalsContact OD1-CB 3.26Å; D277-S279 WeakPolarHBondContact OD1-CB 3.43Å; D277-S279 PolarHBondContact OD1-N 3.39Å; D277-S279 PolarHBondContact OD1-OG 3.22Å; D277-Q280 HydrophobicContact CB-CG 4.35Å; D277-Q280 PolarHBondContact O-N 2.93Å
278	L	71.6	Confident	66.1	Low	39 Å²	39	100.1 Å²	100.1	20%	0.204	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	-177.4	-71.3	169.9	0	0	0	112.8	A245 V246 H248 Y255 Q280	A245-L278 HydrophobicContact CB-CD1 3.87Å; V246-L278 WeakPolarHBondContact O-CB 3.46Å; V246-L278 PolarHBondContact O-N 3.44Å; H248-L278 HydrophobicContact CB-CD2 4.22Å; Y255-L278 HydrophobicContact CD1-CD1 4.36Å; Y255-L278 HydrophobicContact CD1-CD2 4.24Å; Y255-L278 HydrophobicContact CE1-CD2 4.15Å; L278-Q280 VanDerWaalsContact C-N 3.29Å
279	S	62.9	Low	65.7	Low	98 Å²	98	98.3 Å²	98.3	69%	0.685	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.7	172.6	65.6	0	0	0	0	114.1	D277	D277-S279 PolarHBondContact O-N 3.31Å; D277-S279 VanDerWaalsContact O-N 3.16Å; D277-S279 VanDerWaalsContact OD1-CB 3.26Å; D277-S279 WeakPolarHBondContact OD1-CB 3.43Å; D277-S279 PolarHBondContact OD1-N 3.39Å; D277-S279 PolarHBondContact OD1-OG 3.22Å
280	Q	56.5	Low	65.6	Low	145 Å²	145	97 Å²	97	68%	0.678	49%	0.488	S	S	*	.	S	Bend	trans	-108.4	0.6	-174.3	-60	-177.1	15.9	0	0	113.8	D277 L278 E282	D277-Q280 HydrophobicContact CB-CG 4.35Å; D277-Q280 PolarHBondContact O-N 2.93Å; L278-Q280 VanDerWaalsContact C-N 3.29Å; Q280-E282 PolarHBondContact O-N 3.05Å
281	V	52.1	Low	65.6	Low	24 Å²	24	100.5 Å²	100.5	15%	0.145	50%	0.5	C	S	.	.			trans	-79.4	90.9	-177.4	-174.8	0	0	0	0	110.9	V276 M286	V276-V281 HydrophobicContact CG1-CG2 4.12Å; V281-M286 HydrophobicContact CG1-CG 3.88Å; V281-M286 HydrophobicContact CG1-SD 4.14Å
282	E	47.1	Very low	66	Low	141 Å²	141	94.3 Å²	94.3	66%	0.659	47%	0.472	S	S	*	.			trans	-63.7	135.7	157.9	-73.1	-150.8	175.4	0	0	109.8	Q280 R284 D285	Q280-E282 PolarHBondContact O-N 3.05Å; E282-R284 PolarHBondContact O-N 3.29Å; E282-D285 PolarHBondContact O-N 3.4Å
283	A	45.6	Very low	66.3	Low	49 Å²	49	94.5 Å²	94.5	41%	0.405	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	14.5	-167.7	0	0	0	0	0	115.7	Q185	Q185-A283 HydrophobicContact CG-CB 4.05Å; Q185-A283 PolarHBondContact NE2-O 2.98Å
284	R	45.4	Very low	66.4	Low	220 Å²	220	96.3 Å²	96.3	83%	0.83	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-26.3	176.4	-68.9	-179.5	172.7	178.3	-2.1	112.8	E282 M286	E282-R284 PolarHBondContact O-N 3.29Å; R284-M286 VanDerWaalsContact C-N 3.33Å; R284-M286 PolarHBondContact O-N 2.77Å
285	D	43.9	Very low	66.6	Low	118 Å²	118	89.4 Å²	89.4	63%	0.631	44%	0.44	S	S	*	.			trans	-90.6	5.5	-170.1	-64.7	-2.5	0	0	0	113.5	E282 E287	E282-D285 PolarHBondContact O-N 3.4Å; D285-E287 PolarHBondContact O-N 3.03Å
286	M	48.3	Very low	66.6	Low	39 Å²	39	92.8 Å²	92.8	19%	0.192	45%	0.448	C	S	.	.			trans	-77.7	61.6	173.3	-71.2	-176.2	62.1	0	0	111.7	E184 V281 R284 R288	E184-M286 HydrophobicContact CB-CE 4.22Å; V281-M286 HydrophobicContact CG1-CG 3.88Å; V281-M286 HydrophobicContact CG1-SD 4.14Å; R284-M286 VanDerWaalsContact C-N 3.33Å; R284-M286 PolarHBondContact O-N 2.77Å; M286-R288 PolarHBondContact O-N 3.05Å
287	E	53	Low	67	Low	175 Å²	175	98.5 Å²	98.5	82%	0.818	47%	0.472	S	S	*	.			trans	-64.9	94.7	172.5	-75.1	-160.8	134	0	0	111	D285 M289	D285-E287 PolarHBondContact O-N 3.03Å; E287-M289 PolarHBondContact O-N 2.7Å
288	R	62.5	Low	67.4	Low	115 Å²	115	97.7 Å²	97.7	43%	0.434	47%	0.466	S	S	.	.			trans	-77.7	115.9	171.9	-78.3	-167.3	146.2	177.1	4	110.8	E184 M286 V290	E184-R288 VanDerWaalsContact CD-NH1 3.26Å; E184-R288 IonicContact OE1-CZ 3.19Å; E184-R288 IonicContact OE1-NH1 3.23Å; E184-R288 PolarHBondContact OE1-NH1 3.06Å; E184-R288 IonicContact OE1-NH2 3.45Å; E184-R288 PolarHBondContact OE1-NH2 2.73Å; E184-R288 IonicContact OE2-CZ 2.8Å; E184-R288 IonicContact OE2-NE 3.63Å; E184-R288 PolarHBondContact OE2-NE 2.84Å; E184-R288 IonicContact OE2-NH1 2.84Å; E184-R288 PolarHBondContact OE2-NH1 3.24Å; E184-R288 VanDerWaalsContact OE2-NH1 3.11Å; E184-R288 IonicContact OE2-NH2 2.68Å; E184-R288 PolarHBondContact OE2-NH2 2.92Å; M286-R288 PolarHBondContact O-N 3.05Å; R288-V290 PolarHBondContact O-N 3.4Å
289	M	70.4	Confident	68.2	Low	125 Å²	125	96.6 Å²	96.6	62%	0.616	46%	0.461	S	S	*	.			trans	-57.6	102.2	171.9	-178.6	177	-75	0	0	111.2	E287 P299	E287-M289 PolarHBondContact O-N 2.7Å; M289-P299 HydrophobicContact CE-CB 4.43Å; M289-P299 HydrophobicContact CG-CB 3.71Å; M289-P299 HydrophobicContact SD-CB 3.85Å; M289-P299 HydrophobicContact SD-CG 4.33Å
290	V	80.4	Confident	69.5	Low	59 Å²	59	94 Å²	94	36%	0.358	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-76.1	126.3	175.8	-173.1	0	0	0	0	109.3	F177 R288 L300	F177-V290 HydrophobicContact CE1-CG1 4.18Å; F177-V290 HydrophobicContact CE1-CG2 4.23Å; F177-V290 HydrophobicContact CZ-CG1 3.79Å; F177-V290 HydrophobicContact CZ-CG2 4.46Å; R288-V290 PolarHBondContact O-N 3.4Å; V290-L300 HydrophobicContact CB-CD1 4.36Å; V290-L300 HydrophobicContact CG1-CD1 3.79Å; V290-L300 PolarHBondContact O-N 2.83Å
291	R	85.1	Confident	71.1	Confident	136 Å²	136	90.1 Å²	90.1	51%	0.513	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-95.4	152.3	-178.3	-64.6	168.6	179.2	-82.5	-0.8	110.8	R296 Q297 E298	R291-R296 WeakPolarHBondContact CD-O 3.41Å; R291-Q297 PolarHBondContact NH1-O 2.8Å; R291-E298 WeakPolarHBondContact CA-O 3.45Å
292	C	86.5	Confident	73	Confident	10 Å²	10	91.5 Å²	91.5	7%	0.068	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-68.1	146.1	178.3	-179.3	0	0	0	0	112.1	Q294 H295 R296 E298 L300 C312 C315	C292-Q294 PolarHBondContact SG-N 2.82Å; C292-H295 HydrophobicContact CB-CB 3.96Å; C292-H295 WeakPolarHBondContact CB-O 3.49Å; C292-H295 CarbonylContact O-C 3.57Å; C292-H295 PolarHBondContact SG-N 3.48Å; C292-H295 VanDerWaalsContact SG-N 3.41Å; C292-R296 VanDerWaalsContact O-CA 3.28Å; C292-R296 WeakPolarHBondContact O-CA 3.46Å; C292-R296 PolarHBondContact O-N 3.19Å; C292-E298 PolarHBondContact N-O 2.67Å; C292-L300 HydrophobicContact CB-CD2 3.8Å; C292-C312 HydrophobicContact CB-CB 4.01Å; C292-C315 PolarHBondContact SG-SG 2.85Å
293	L	83.8	Confident	75.2	Confident	76 Å²	76	86 Å²	86	40%	0.398	40%	0.398	S	S	.	.	S	Bend	trans	-73.3	-35.4	177.1	-64.4	179	0	0	0	113	L174	L174-L293 HydrophobicContact CD2-CD1 4.03Å
294	Q	83.3	Confident	77.4	Confident	104 Å²	104	83.7 Å²	83.7	49%	0.486	38%	0.379	S	S	.	.	S	Bend	trans	-73.2	-61	170.3	-64	169.7	-56.5	0	0	109.4	C292 R296 C315 D319	C292-Q294 PolarHBondContact SG-N 2.82Å; Q294-R296 PolarHBondContact O-N 2.6Å; Q294-C315 PolarHBondContact OE1-SG 3.34Å; Q294-D319 PolarHBondContact NE2-OD2 2.88Å
295	H	86.4	Confident	79.6	Confident	45 Å²	45	76.3 Å²	76.3	21%	0.208	35%	0.353	C	S	.	.	S	Bend	trans	-96.3	70.2	-171.2	-58.4	108.6	0	0	0	110.7	C292 Q297 E298 E314 C315	C292-H295 HydrophobicContact CB-CB 3.96Å; C292-H295 WeakPolarHBondContact CB-O 3.49Å; C292-H295 CarbonylContact O-C 3.57Å; C292-H295 PolarHBondContact SG-N 3.48Å; C292-H295 VanDerWaalsContact SG-N 3.41Å; H295-Q297 PolarHBondContact O-N 2.95Å; H295-E298 HydrophobicContact CB-CB 4.16Å; H295-E298 PolarHBondContact O-N 3.41Å; H295-E314 HydrophobicContact CB-CB 4.14Å; H295-E314 VanDerWaalsContact CB-OE2 3.28Å; H295-E314 WeakPolarHBondContact CB-OE2 3.12Å; H295-E314 IonicContact CD2-OE2 2.93Å; H295-E314 PolarHBondContact CD2-OE2 3.12Å; H295-E314 IonicContact CG-OE2 3.14Å; H295-C315 PolarHBondContact ND1-SG 2.91Å
296	R	82	Confident	81.9	Confident	115 Å²	115	73.9 Å²	73.9	43%	0.434	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-15.4	-166.9	-64.4	-172.5	-177.8	-170	3.6	116.3	D171 R291 C292 Q294	D171-R296 VanDerWaalsContact CB-NH2 3.25Å; D171-R296 IonicContact OD2-NH1 2.58Å; R291-R296 WeakPolarHBondContact CD-O 3.41Å; C292-R296 VanDerWaalsContact O-CA 3.28Å; C292-R296 WeakPolarHBondContact O-CA 3.46Å; C292-R296 PolarHBondContact O-N 3.19Å; Q294-R296 PolarHBondContact O-N 2.6Å
297	Q	82.8	Confident	83.9	Confident	169 Å²	169	74.2 Å²	74.2	79%	0.79	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-24.6	173.7	-59.7	-165.5	23.9	0	0	112.9	R291 H295	R291-Q297 PolarHBondContact NH1-O 2.8Å; H295-Q297 PolarHBondContact O-N 2.95Å
298	E	86.7	Confident	85.7	Confident	50 Å²	50	71.4 Å²	71.4	23%	0.234	34%	0.341	C	S	.	.	S	Bend	trans	-88.8	138.5	-175.1	-83	-67.9	103.8	0	0	113.1	R291 C292 H295 C312 E314	R291-E298 WeakPolarHBondContact CA-O 3.45Å; C292-E298 PolarHBondContact N-O 2.67Å; H295-E298 HydrophobicContact CB-CB 4.16Å; H295-E298 PolarHBondContact O-N 3.41Å; E298-C312 HydrophobicContact CB-CB 3.79Å; E298-E314 HydrophobicContact CG-CG 3.98Å
299	P	88.5	Confident	87	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.104	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-71.7	146.9	171	29.7	-33.6	0	0	0	112	M289 Q301 C312	M289-P299 HydrophobicContact CE-CB 4.43Å; M289-P299 HydrophobicContact CG-CB 3.71Å; M289-P299 HydrophobicContact SD-CB 3.85Å; M289-P299 HydrophobicContact SD-CG 4.33Å; P299-Q301 HydrophobicContact CB-CG 4.13Å; P299-Q301 HydrophobicContact CG-CG 3.93Å; P299-Q301 PolarHBondContact O-N 3.12Å; P299-C312 WeakPolarHBondContact O-CA 3.45Å; P299-C312 WeakPolarHBondContact O-CB 3.44Å
300	L	89.3	Confident	88	Confident	42 Å²	42	65.9 Å²	65.9	22%	0.22	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-69	127.4	163.7	-61.1	176	0	0	0	108.7	V290 C292 P310 C312 I330	V290-L300 HydrophobicContact CB-CD1 4.36Å; V290-L300 HydrophobicContact CG1-CD1 3.79Å; V290-L300 PolarHBondContact O-N 2.83Å; C292-L300 HydrophobicContact CB-CD2 3.8Å; L300-P310 HydrophobicContact CB-CB 4.49Å; L300-P310 HydrophobicContact CD1-CB 4.12Å; L300-P310 HydrophobicContact CD1-CG 4.06Å; L300-C312 HydrophobicContact CD2-CB 4.45Å; L300-I330 HydrophobicContact CB-CD1 4.12Å
301	Q	89.5	Confident	88.5	Confident	65 Å²	65	63.2 Å²	63.2	30%	0.304	31%	0.312	S	S	.	.			trans	-134.9	-20.7	-173.6	-66.5	-164.5	-36.3	0	0	114	P299 V311 P329 I330	P299-Q301 HydrophobicContact CB-CG 4.13Å; P299-Q301 HydrophobicContact CG-CG 3.93Å; P299-Q301 PolarHBondContact O-N 3.12Å; Q301-V311 PolarHBondContact N-O 2.86Å; Q301-P329 WeakPolarHBondContact O-CA 3.36Å; Q301-I330 PolarHBondContact O-N 3.21Å
302	Y	92	Very high	88.9	Confident	52 Å²	52	56.7 Å²	56.7	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.7	179	-49.6	-76.7	0	0	0	110.9	P310 V311 K313 V316 F327 E328 P329 I330	Y302-P310 CarbonylContact O-C 3.52Å; Y302-P310 WeakPolarHBondContact O-CA 3.32Å; Y302-V311 PolarHBondContact N-O 3.44Å; Y302-V311 PolarHBondContact O-N 2.82Å; Y302-K313 HydrophobicContact CE2-CG 4Å; Y302-V316 HydrophobicContact CD2-CG2 3.9Å; Y302-F327 AromaticContact CD1-CD2 3.97Å; Y302-F327 HydrophobicContact CD1-CD2 3.97Å; Y302-F327 HydrophobicContact CD1-CE2 4.09Å; Y302-F327 HydrophobicContact CD2-CD2 4.5Å; Y302-F327 HydrophobicContact CD2-CE2 4.35Å; Y302-F327 AromaticContact CG-CD2 3.79Å; Y302-F327 HydrophobicContact CG-CD2 3.79Å; Y302-F327 AromaticContact CG-CE2 4Å; Y302-F327 HydrophobicContact CG-CE2 4Å; Y302-E328 CarbonylContact C-O 3.5Å; Y302-E328 WeakPolarHBondContact CA-O 3.39Å; Y302-P329 HydrophobicContact CD1-CG 4.38Å; Y302-P329 HydrophobicContact CE1-CG 4.43Å; Y302-I330 VanDerWaalsContact C-CG1 3.48Å
303	F	93.5	Very high	89.1	Confident	26 Å²	26	61.1 Å²	61.1	11%	0.114	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.8	171.1	-173.4	-102.1	0	0	0	109.4	F305 N308 P310 F327 E328 I330 V333 Q337	F303-F305 HydrophobicContact CD1-CD1 4.15Å; F303-F305 HydrophobicContact CD1-CE1 4.22Å; F303-F305 HydrophobicContact CD1-CG 4.37Å; F303-F305 HydrophobicContact CD1-CZ 4.49Å; F303-F305 HydrophobicContact CE1-CD1 4.11Å; F303-F305 HydrophobicContact CE1-CE1 4.35Å; F303-F305 PolarHBondContact O-N 3.48Å; F303-N308 WeakPolarHBondContact CZ-OD1 3.41Å; F303-P310 HydrophobicContact CD2-CB 4.44Å; F303-F327 WeakPolarHBondContact O-CA 3.33Å; F303-F327 VanDerWaalsContact O-CB 3.25Å; F303-F327 WeakPolarHBondContact O-CB 3.37Å; F303-E328 PolarHBondContact N-O 2.78Å; F303-E328 PolarHBondContact O-N 2.91Å; F303-E328 VanDerWaalsContact O-N 3.17Å; F303-I330 HydrophobicContact CB-CG1 4.27Å; F303-V333 HydrophobicContact CB-CG2 3.74Å; F303-V333 HydrophobicContact CD1-CG2 4.37Å; F303-V333 HydrophobicContact CG-CG2 4.33Å; F303-Q337 HydrophobicContact CD1-CG 4.08Å; F303-Q337 HydrophobicContact CE1-CG 3.85Å; F303-Q337 HydrophobicContact CZ-CG 4.11Å
304	C	92.9	Very high	89.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	97.8	-179.2	-177.9	0	0	0	0	110.8	S306 C307 N308 V309 V311 H320 H326 F327	C304-S306 VanDerWaalsContact C-N 3.27Å; C304-S306 PolarHBondContact O-N 2.75Å; C304-C307 HydrophobicContact CB-CB 4.48Å; C304-C307 CarbonylContact O-C 3.57Å; C304-C307 PolarHBondContact O-N 2.95Å; C304-C307 VanDerWaalsContact O-N 3.12Å; C304-N308 WeakPolarHBondContact O-CA 3.31Å; C304-N308 PolarHBondContact O-N 3.12Å; C304-V309 WeakPolarHBondContact CB-O 3.46Å; C304-V309 PolarHBondContact N-O 2.99Å; C304-V309 PolarHBondContact O-N 3.08Å; C304-V311 HydrophobicContact CB-CG1 4.08Å; C304-V311 HydrophobicContact CB-CG2 4.24Å; C304-H320 PolarHBondContact SG-ND1 2.82Å; C304-H326 CarbonylContact C-O 3.59Å; C304-F327 HydrophobicContact CB-CB 4.19Å
305	F	91.8	Very high	89.9	Confident	65 Å²	65	57.2 Å²	57.2	29%	0.285	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-38.8	176.3	-71.7	-77	0	0	0	113	F303 C307 N308 H326 E328 V333	F303-F305 HydrophobicContact CD1-CD1 4.15Å; F303-F305 HydrophobicContact CD1-CE1 4.22Å; F303-F305 HydrophobicContact CD1-CG 4.37Å; F303-F305 HydrophobicContact CD1-CZ 4.49Å; F303-F305 HydrophobicContact CE1-CD1 4.11Å; F303-F305 HydrophobicContact CE1-CE1 4.35Å; F303-F305 PolarHBondContact O-N 3.48Å; F305-C307 PolarHBondContact O-N 3.24Å; F305-N308 PolarHBondContact O-N 3Å; F305-H326 AromaticContact CD2-CD2 3.52Å; F305-H326 AromaticContact CD2-NE2 3.47Å; F305-H326 WeakPolarHBondContact CD2-NE2 3.46Å; F305-H326 AromaticContact CE2-NE2 3.87Å; F305-H326 AromaticContact CG-CD2 3.92Å; F305-H326 PolarHBondContact N-O 3.25Å; F305-E328 HydrophobicContact CE2-CB 4.06Å; F305-E328 HydrophobicContact CE2-CG 3.96Å; F305-V333 HydrophobicContact CE2-CG1 4.1Å; F305-V333 HydrophobicContact CZ-CB 4.07Å; F305-V333 HydrophobicContact CZ-CG1 3.81Å; F305-V333 HydrophobicContact CZ-CG2 4.29Å
306	S	91.2	Very high	90.1	Very high	67 Å²	67	56.3 Å²	56.3	47%	0.469	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.8	179	-61	0	0	0	0	114.2	C304 H325 H326	C304-S306 VanDerWaalsContact C-N 3.27Å; C304-S306 PolarHBondContact O-N 2.75Å; S306-H325 WeakPolarHBondContact OG-CA 3.44Å; S306-H326 PolarHBondContact N-O 2.98Å; S306-H326 PolarHBondContact OG-N 3.09Å
307	C	89.7	Confident	90.4	Very high	47 Å²	47	55 Å²	55	32%	0.318	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-2.2	-179.1	-56.7	0	0	0	0	113.2	C304 F305 V309 H320 H325	C304-C307 HydrophobicContact CB-CB 4.48Å; C304-C307 CarbonylContact O-C 3.57Å; C304-C307 PolarHBondContact O-N 2.95Å; C304-C307 VanDerWaalsContact O-N 3.12Å; F305-C307 PolarHBondContact O-N 3.24Å; C307-V309 VanDerWaalsContact C-N 3.3Å; C307-V309 HydrophobicContact CB-CG2 3.73Å; C307-V309 PolarHBondContact O-N 3.4Å; C307-H320 VanDerWaalsContact SG-CE1 3.5Å; C307-H320 PolarHBondContact SG-ND1 3.3Å; C307-H325 PolarHBondContact SG-CE1 3.07Å
308	N	90.5	Very high	90.7	Very high	115 Å²	115	49.6 Å²	49.6	62%	0.615	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	37.9	-175	-156.9	37.9	0	0	0	114.8	F303 C304 F305	F303-N308 WeakPolarHBondContact CZ-OD1 3.41Å; C304-N308 WeakPolarHBondContact O-CA 3.31Å; C304-N308 PolarHBondContact O-N 3.12Å; F305-N308 PolarHBondContact O-N 3Å
309	V	90.3	Very high	90.8	Very high	61 Å²	61	51 Å²	51	37%	0.37	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.1	-177.1	-69.7	0	0	0	0	113.5	C304 C307 V311	C304-V309 WeakPolarHBondContact CB-O 3.46Å; C304-V309 PolarHBondContact N-O 2.99Å; C304-V309 PolarHBondContact O-N 3.08Å; C307-V309 VanDerWaalsContact C-N 3.3Å; C307-V309 HydrophobicContact CB-CG2 3.73Å; C307-V309 PolarHBondContact O-N 3.4Å; V309-V311 HydrophobicContact CG2-CG1 4.21Å
310	P	91.4	Very high	90.8	Very high	63 Å²	63	51.2 Å²	51.2	41%	0.409	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	141.3	169.2	32.5	-34.9	0	0	0	111.5	L300 Y302 F303 I330	L300-P310 HydrophobicContact CB-CB 4.49Å; L300-P310 HydrophobicContact CD1-CB 4.12Å; L300-P310 HydrophobicContact CD1-CG 4.06Å; Y302-P310 CarbonylContact O-C 3.52Å; Y302-P310 WeakPolarHBondContact O-CA 3.32Å; F303-P310 HydrophobicContact CD2-CB 4.44Å; P310-I330 HydrophobicContact CB-CD1 3.98Å
311	V	92.2	Very high	90.8	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	154	-173.8	-61.5	0	0	0	0	111.6	Q301 Y302 C304 V309 C315 V316	Q301-V311 PolarHBondContact N-O 2.86Å; Y302-V311 PolarHBondContact N-O 3.44Å; Y302-V311 PolarHBondContact O-N 2.82Å; C304-V311 HydrophobicContact CB-CG1 4.08Å; C304-V311 HydrophobicContact CB-CG2 4.24Å; V309-V311 HydrophobicContact CG2-CG1 4.21Å; V311-C315 HydrophobicContact CB-CB 3.79Å; V311-C315 HydrophobicContact CG1-CB 4.26Å; V311-V316 HydrophobicContact CG2-CG2 3.77Å
312	C	92.5	Very high	90.7	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.308	C	S	.	.			trans	-96.2	-178.6	172.8	70.4	0	0	0	0	112.1	C292 E298 P299 L300 C315 V316	C292-C312 HydrophobicContact CB-CB 4.01Å; E298-C312 HydrophobicContact CB-CB 3.79Å; P299-C312 WeakPolarHBondContact O-CA 3.45Å; P299-C312 WeakPolarHBondContact O-CB 3.44Å; L300-C312 HydrophobicContact CD2-CB 4.45Å; C312-C315 PolarHBondContact O-N 3.31Å; C312-C315 PolarHBondContact SG-N 2.83Å; C312-C315 VanDerWaalsContact SG-N 3.42Å; C312-C315 PolarHBondContact SG-SG 2.81Å; C312-V316 WeakPolarHBondContact O-CG2 3.49Å; C312-V316 PolarHBondContact O-N 3.48Å; C312-V316 VanDerWaalsContact O-N 3.09Å
313	K	91.9	Very high	90.5	Very high	103 Å²	103	61.4 Å²	61.4	45%	0.448	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-41.4	176.4	-73.8	168.9	169.5	132.9	0	113.2	Y302 V316 A317	Y302-K313 HydrophobicContact CE2-CG 4Å; K313-V316 WeakPolarHBondContact O-CB 3.44Å; K313-V316 PolarHBondContact O-N 3.01Å; K313-A317 PolarHBondContact O-N 3.03Å; K313-A317 VanDerWaalsContact O-N 3.08Å
314	E	92.1	Very high	90.3	Very high	96 Å²	96	64.7 Å²	64.7	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-67	-43.4	178.4	-71.4	-179	157.2	0	0	111.5	H295 E298 V316 A317 S318	H295-E314 HydrophobicContact CB-CB 4.14Å; H295-E314 VanDerWaalsContact CB-OE2 3.28Å; H295-E314 WeakPolarHBondContact CB-OE2 3.12Å; H295-E314 IonicContact CD2-OE2 2.93Å; H295-E314 PolarHBondContact CD2-OE2 3.12Å; H295-E314 IonicContact CG-OE2 3.14Å; E298-E314 HydrophobicContact CG-CG 3.98Å; E314-V316 PolarHBondContact O-N 2.83Å; E314-A317 WeakPolarHBondContact O-CA 3.22Å; E314-A317 WeakPolarHBondContact O-CB 3.3Å; E314-A317 PolarHBondContact O-N 3.18Å; E314-S318 PolarHBondContact O-N 2.84Å; E314-S318 PolarHBondContact O-OG 3.08Å
315	C	90.4	Very high	90.2	Very high	2 Å²	2	66.7 Å²	66.7	1%	0.014	37%	0.366	C	S	.	.	H	α-helix	trans	-56.8	-36.9	171.1	-65.8	0	0	0	0	112.9	C292 Q294 H295 V311 C312 A317 D319 H320	C292-C315 PolarHBondContact SG-SG 2.85Å; Q294-C315 PolarHBondContact OE1-SG 3.34Å; H295-C315 PolarHBondContact ND1-SG 2.91Å; V311-C315 HydrophobicContact CB-CB 3.79Å; V311-C315 HydrophobicContact CG1-CB 4.26Å; C312-C315 PolarHBondContact O-N 3.31Å; C312-C315 PolarHBondContact SG-N 2.83Å; C312-C315 VanDerWaalsContact SG-N 3.42Å; C312-C315 PolarHBondContact SG-SG 2.81Å; C315-A317 VanDerWaalsContact C-N 3.31Å; C315-D319 PolarHBondContact O-N 2.8Å; C315-H320 PolarHBondContact O-N 2.92Å
316	V	90.6	Very high	90.2	Very high	26 Å²	26	68.3 Å²	68.3	16%	0.158	37%	0.374	C	S	.	.	H	α-helix	trans	-70.1	-27.4	176.2	157	0	0	0	0	112.4	Y302 V311 C312 K313 E314 H320 F327	Y302-V316 HydrophobicContact CD2-CG2 3.9Å; V311-V316 HydrophobicContact CG2-CG2 3.77Å; C312-V316 WeakPolarHBondContact O-CG2 3.49Å; C312-V316 PolarHBondContact O-N 3.48Å; C312-V316 VanDerWaalsContact O-N 3.09Å; K313-V316 WeakPolarHBondContact O-CB 3.44Å; K313-V316 PolarHBondContact O-N 3.01Å; E314-V316 PolarHBondContact O-N 2.83Å; V316-H320 CarbonylContact O-C 3.55Å; V316-F327 HydrophobicContact CB-CE1 4.34Å; V316-F327 HydrophobicContact CB-CZ 4.09Å; V316-F327 HydrophobicContact CG1-CE1 3.77Å; V316-F327 HydrophobicContact CG1-CE2 4.03Å; V316-F327 HydrophobicContact CG1-CZ 3.26Å; V316-F327 HydrophobicContact CG2-CD1 4.16Å; V316-F327 HydrophobicContact CG2-CD2 4.21Å; V316-F327 HydrophobicContact CG2-CE1 3.79Å; V316-F327 HydrophobicContact CG2-CE2 3.85Å; V316-F327 HydrophobicContact CG2-CG 4.35Å; V316-F327 HydrophobicContact CG2-CZ 3.63Å
317	A	89.6	Confident	90.3	Very high	86 Å²	86	65.7 Å²	65.7	71%	0.711	35%	0.354	S	S	*	.	H	α-helix	trans	-84.1	-27.5	175.9	0	0	0	0	0	113.1	K313 E314 C315	K313-A317 PolarHBondContact O-N 3.03Å; K313-A317 VanDerWaalsContact O-N 3.08Å; E314-A317 WeakPolarHBondContact O-CA 3.22Å; E314-A317 WeakPolarHBondContact O-CB 3.3Å; E314-A317 PolarHBondContact O-N 3.18Å; C315-A317 VanDerWaalsContact C-N 3.31Å
318	S	88.8	Confident	90.3	Very high	57 Å²	57	67.3 Å²	67.3	40%	0.399	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-76.9	178.3	72.1	0	0	0	0	113.3	E314	E314-S318 PolarHBondContact O-N 2.84Å; E314-S318 PolarHBondContact O-OG 3.08Å
319	D	87.6	Confident	90.4	Very high	78 Å²	78	63.8 Å²	63.8	42%	0.417	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-17.9	-160.6	-55	-4	0	0	0	112.1	Q294 C315 H325	Q294-D319 PolarHBondContact NE2-OD2 2.88Å; C315-D319 PolarHBondContact O-N 2.8Å; D319-H325 PolarHBondContact O-CE1 3.45Å; D319-H325 PolarHBondContact O-ND1 3.44Å
320	H	88.7	Confident	90.4	Very high	21 Å²	21	63.7 Å²	63.7	10%	0.097	34%	0.338	C	S	.	.	S	Bend	trans	-125.7	57.2	-178.5	-55	-101.1	0	0	0	113.9	C304 C307 C315 V316 H325 F327	C304-H320 PolarHBondContact SG-ND1 2.82Å; C307-H320 VanDerWaalsContact SG-CE1 3.5Å; C307-H320 PolarHBondContact SG-ND1 3.3Å; C315-H320 PolarHBondContact O-N 2.92Å; V316-H320 CarbonylContact O-C 3.55Å; H320-H325 WeakPolarHBondContact CA-ND1 3.34Å; H320-H325 HydrophobicContact CB-CB 4.21Å; H320-H325 AromaticContact CG-ND1 3.66Å; H320-H325 AromaticContact ND1-ND1 3.27Å; H320-H325 PolarHBondContact ND1-ND1 3.29Å; H320-F327 WeakPolarHBondContact O-CE1 3.44Å
321	P	89.1	Confident	90.2	Very high	40 Å²	40	66.3 Å²	66.3	26%	0.26	35%	0.352	S	S	.	.			trans	-70.3	140.1	-179.1	33	-37.5	0	0	0	111.6	N323 V324 H325	P321-N323 WeakPolarHBondContact CB-OD1 3.46Å; P321-N323 PolarHBondContact O-N 2.97Å; P321-V324 HydrophobicContact CG-CB 4.38Å; P321-V324 HydrophobicContact CG-CG2 4.14Å; P321-V324 PolarHBondContact O-N 3.01Å; P321-H325 PolarHBondContact O-N 3.46Å
322	R	87.5	Confident	90	Very high	190 Å²	190	71.4 Å²	71.4	72%	0.717	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.5	-172.1	-78.7	-174.5	174.6	-114	-3.7	116.1	F327	R322-F327 HydrophobicContact CB-CE1 4.37Å; R322-F327 HydrophobicContact CG-CD1 4.43Å; R322-F327 HydrophobicContact CG-CE1 3.35Å; R322-F327 HydrophobicContact CG-CE2 4.42Å; R322-F327 HydrophobicContact CG-CZ 3.34Å
323	N	87.5	Confident	90	Very high	144 Å²	144	71.6 Å²	71.6	77%	0.77	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-10.5	178.5	65.9	-54.3	0	0	0	113.6	P321	P321-N323 WeakPolarHBondContact CB-OD1 3.46Å; P321-N323 PolarHBondContact O-N 2.97Å
324	V	90.7	Very high	89.6	Confident	94 Å²	94	67.8 Å²	67.8	57%	0.57	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-41.8	177.4	-170.6	0	0	0	0	110.6	P321	P321-V324 HydrophobicContact CG-CB 4.38Å; P321-V324 HydrophobicContact CG-CG2 4.14Å; P321-V324 PolarHBondContact O-N 3.01Å
325	H	91	Very high	89.4	Confident	43 Å²	43	67.9 Å²	67.9	20%	0.199	38%	0.378	C	S	.	.			trans	-115	130.5	-174.8	-67.4	163	0	0	0	112.5	S306 C307 D319 H320 P321	S306-H325 WeakPolarHBondContact OG-CA 3.44Å; C307-H325 PolarHBondContact SG-CE1 3.07Å; D319-H325 PolarHBondContact O-CE1 3.45Å; D319-H325 PolarHBondContact O-ND1 3.44Å; H320-H325 WeakPolarHBondContact CA-ND1 3.34Å; H320-H325 HydrophobicContact CB-CB 4.21Å; H320-H325 AromaticContact CG-ND1 3.66Å; H320-H325 AromaticContact ND1-ND1 3.27Å; H320-H325 PolarHBondContact ND1-ND1 3.29Å; P321-H325 PolarHBondContact O-N 3.46Å
326	H	91.7	Very high	89.2	Confident	98 Å²	98	73.1 Å²	73.1	45%	0.454	40%	0.402	S	S	.	.			trans	-84.8	132	170.8	172.4	51	0	0	0	110	C304 F305 S306 E328	C304-H326 CarbonylContact C-O 3.59Å; F305-H326 AromaticContact CD2-CD2 3.52Å; F305-H326 AromaticContact CD2-NE2 3.47Å; F305-H326 WeakPolarHBondContact CD2-NE2 3.46Å; F305-H326 AromaticContact CE2-NE2 3.87Å; F305-H326 AromaticContact CG-CD2 3.92Å; F305-H326 PolarHBondContact N-O 3.25Å; S306-H326 PolarHBondContact N-O 2.98Å; S306-H326 PolarHBondContact OG-N 3.09Å; H326-E328 IonicContact CE1-OE1 3.84Å
327	F	91.4	Very high	89.1	Confident	12 Å²	12	73.5 Å²	73.5	5%	0.053	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152.2	176.7	64.2	-100.1	0	0	0	111.7	Y302 F303 C304 V316 H320 R322	Y302-F327 AromaticContact CD1-CD2 3.97Å; Y302-F327 HydrophobicContact CD1-CD2 3.97Å; Y302-F327 HydrophobicContact CD1-CE2 4.09Å; Y302-F327 HydrophobicContact CD2-CD2 4.5Å; Y302-F327 HydrophobicContact CD2-CE2 4.35Å; Y302-F327 AromaticContact CG-CD2 3.79Å; Y302-F327 HydrophobicContact CG-CD2 3.79Å; Y302-F327 AromaticContact CG-CE2 4Å; Y302-F327 HydrophobicContact CG-CE2 4Å; F303-F327 WeakPolarHBondContact O-CA 3.33Å; F303-F327 VanDerWaalsContact O-CB 3.25Å; F303-F327 WeakPolarHBondContact O-CB 3.37Å; C304-F327 HydrophobicContact CB-CB 4.19Å; V316-F327 HydrophobicContact CB-CE1 4.34Å; V316-F327 HydrophobicContact CB-CZ 4.09Å; V316-F327 HydrophobicContact CG1-CE1 3.77Å; V316-F327 HydrophobicContact CG1-CE2 4.03Å; V316-F327 HydrophobicContact CG1-CZ 3.26Å; V316-F327 HydrophobicContact CG2-CD1 4.16Å; V316-F327 HydrophobicContact CG2-CD2 4.21Å; V316-F327 HydrophobicContact CG2-CE1 3.79Å; V316-F327 HydrophobicContact CG2-CE2 3.85Å; V316-F327 HydrophobicContact CG2-CG 4.35Å; V316-F327 HydrophobicContact CG2-CZ 3.63Å; H320-F327 WeakPolarHBondContact O-CE1 3.44Å; R322-F327 HydrophobicContact CB-CE1 4.37Å; R322-F327 HydrophobicContact CG-CD1 4.43Å; R322-F327 HydrophobicContact CG-CE1 3.35Å; R322-F327 HydrophobicContact CG-CE2 4.42Å; R322-F327 HydrophobicContact CG-CZ 3.34Å
328	E	91.4	Very high	89	Confident	81 Å²	81	73.2 Å²	73.2	38%	0.379	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	163.4	178.9	-64	-169.4	155.5	0	0	110.7	Y302 F303 F305 H326 V333	Y302-E328 CarbonylContact C-O 3.5Å; Y302-E328 WeakPolarHBondContact CA-O 3.39Å; F303-E328 PolarHBondContact N-O 2.78Å; F303-E328 PolarHBondContact O-N 2.91Å; F303-E328 VanDerWaalsContact O-N 3.17Å; F305-E328 HydrophobicContact CE2-CB 4.06Å; F305-E328 HydrophobicContact CE2-CG 3.96Å; H326-E328 IonicContact CE1-OE1 3.84Å; E328-V333 HydrophobicContact CB-CG1 3.84Å; E328-V333 VanDerWaalsContact OE2-CG1 3.32Å; E328-V333 WeakPolarHBondContact OE2-CG1 3.45Å
329	P	92.5	Very high	88.8	Confident	41 Å²	41	75.9 Å²	75.9	27%	0.266	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	139.2	179.9	-22.5	35.3	0	0	0	112.8	Q301 Y302 T331 D332 V333	Q301-P329 WeakPolarHBondContact O-CA 3.36Å; Y302-P329 HydrophobicContact CD1-CG 4.38Å; Y302-P329 HydrophobicContact CE1-CG 4.43Å; P329-T331 WeakPolarHBondContact CB-OG1 3.22Å; P329-T331 PolarHBondContact O-N 3.06Å; P329-D332 WeakPolarHBondContact CD-OD2 3.44Å; P329-D332 WeakPolarHBondContact CG-OD2 3.31Å; P329-D332 PolarHBondContact O-N 3.49Å; P329-V333 PolarHBondContact O-N 3.22Å
330	I	90	Very high	88.8	Confident	59 Å²	59	76.1 Å²	76.1	30%	0.303	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-29.3	178.9	-67	171.8	0	0	0	111.5	L300 Q301 Y302 F303 P310 D332 G334	L300-I330 HydrophobicContact CB-CD1 4.12Å; Q301-I330 PolarHBondContact O-N 3.21Å; Y302-I330 VanDerWaalsContact C-CG1 3.48Å; F303-I330 HydrophobicContact CB-CG1 4.27Å; P310-I330 HydrophobicContact CB-CD1 3.98Å; I330-D332 PolarHBondContact O-N 3.06Å; I330-G334 VanDerWaalsContact O-CA 3.29Å; I330-G334 WeakPolarHBondContact O-CA 3.32Å; I330-G334 PolarHBondContact O-N 3.42Å
331	T	87.3	Confident	88.5	Confident	118 Å²	118	79.9 Å²	79.9	72%	0.724	42%	0.423	S	S	*	.	H	α-helix	trans	-57	-31.4	173.3	45.1	0	0	0	0	113.4	P329	P329-T331 WeakPolarHBondContact CB-OG1 3.22Å; P329-T331 PolarHBondContact O-N 3.06Å
332	D	88.4	Confident	88.3	Confident	110 Å²	110	83.2 Å²	83.2	59%	0.588	44%	0.435	S	S	*	.	H	α-helix	trans	-97.1	-38.9	-167	-52.5	-1.2	0	0	0	109.9	P329 I330	P329-D332 WeakPolarHBondContact CD-OD2 3.44Å; P329-D332 WeakPolarHBondContact CG-OD2 3.31Å; P329-D332 PolarHBondContact O-N 3.49Å; I330-D332 PolarHBondContact O-N 3.06Å
333	V	90.6	Very high	88.2	Confident	5 Å²	5	79.6 Å²	79.6	3%	0.03	43%	0.426	C	S	.	.	H	α-helix	trans	-106.1	-13.4	-174.6	-51.7	0	0	0	0	114.4	F303 F305 E328 P329 T335 Q336 Q337	F303-V333 HydrophobicContact CB-CG2 3.74Å; F303-V333 HydrophobicContact CD1-CG2 4.37Å; F303-V333 HydrophobicContact CG-CG2 4.33Å; F305-V333 HydrophobicContact CE2-CG1 4.1Å; F305-V333 HydrophobicContact CZ-CB 4.07Å; F305-V333 HydrophobicContact CZ-CG1 3.81Å; F305-V333 HydrophobicContact CZ-CG2 4.29Å; E328-V333 HydrophobicContact CB-CG1 3.84Å; E328-V333 VanDerWaalsContact OE2-CG1 3.32Å; E328-V333 WeakPolarHBondContact OE2-CG1 3.45Å; P329-V333 PolarHBondContact O-N 3.22Å; V333-T335 PolarHBondContact O-N 3.16Å; V333-Q336 WeakPolarHBondContact O-CB 3.35Å; V333-Q336 PolarHBondContact O-N 3.41Å; V333-Q337 PolarHBondContact O-N 3.49Å
334	G	84.7	Confident	88.1	Confident	22 Å²	22	78 Å²	78	23%	0.227	42%	0.417	C	S	.	.	H	α-helix	trans	-57.4	-44.6	-173	0	0	0	0	0	113.5	I330 Q336 Q337 V338	I330-G334 VanDerWaalsContact O-CA 3.29Å; I330-G334 WeakPolarHBondContact O-CA 3.32Å; I330-G334 PolarHBondContact O-N 3.42Å; G334-Q336 VanDerWaalsContact C-N 3.31Å; G334-Q336 PolarHBondContact O-N 3.12Å; G334-Q337 PolarHBondContact O-N 3.48Å; G334-V338 WeakPolarHBondContact O-CG2 3.13Å; G334-V338 PolarHBondContact O-N 3.05Å
335	T	87.3	Confident	87.7	Confident	99 Å²	99	77.9 Å²	77.9	61%	0.607	41%	0.413	S	S	*	.	H	α-helix	trans	-60.3	-39.1	176.6	-53.6	0	0	0	0	112.3	V333 V338 Q339	V333-T335 PolarHBondContact O-N 3.16Å; T335-V338 PolarHBondContact O-N 3.03Å; T335-Q339 WeakPolarHBondContact O-CG 3.21Å; T335-Q339 PolarHBondContact O-N 3.21Å
336	Q	87.5	Confident	87.4	Confident	111 Å²	111	80.9 Å²	80.9	52%	0.519	43%	0.427	S	S	.	.	H	α-helix	trans	-69.4	-42.8	178.3	-170.5	-173.3	17.6	0	0	111.4	V333 G334 V338 Q339 L340	V333-Q336 WeakPolarHBondContact O-CB 3.35Å; V333-Q336 PolarHBondContact O-N 3.41Å; G334-Q336 VanDerWaalsContact C-N 3.31Å; G334-Q336 PolarHBondContact O-N 3.12Å; Q336-V338 VanDerWaalsContact C-N 3.33Å; Q336-V338 PolarHBondContact O-N 3.37Å; Q336-Q339 WeakPolarHBondContact O-CB 3.42Å; Q336-Q339 PolarHBondContact O-N 2.93Å; Q336-L340 PolarHBondContact O-N 3.33Å; Q336-L340 VanDerWaalsContact O-N 3.09Å
337	Q	88.3	Confident	87.1	Confident	35 Å²	35	81.3 Å²	81.3	16%	0.164	43%	0.429	C	S	.	.	H	α-helix	trans	-64.6	-38.2	176.3	-63	-52	-50.1	0	0	111.8	F303 V333 G334 Q339 L340 V341	F303-Q337 HydrophobicContact CD1-CG 4.08Å; F303-Q337 HydrophobicContact CE1-CG 3.85Å; F303-Q337 HydrophobicContact CZ-CG 4.11Å; V333-Q337 PolarHBondContact O-N 3.49Å; G334-Q337 PolarHBondContact O-N 3.48Å; Q337-Q339 PolarHBondContact O-N 2.94Å; Q337-L340 PolarHBondContact O-N 3.26Å; Q337-V341 WeakPolarHBondContact O-CG2 3.44Å; Q337-V341 PolarHBondContact O-N 3.05Å; Q337-V341 VanDerWaalsContact O-N 3.13Å
338	V	86.8	Confident	86.6	Confident	80 Å²	80	83.4 Å²	83.4	49%	0.485	45%	0.449	S	S	.	.	H	α-helix	trans	-64.1	-38	173.4	170	0	0	0	0	111.8	G334 T335 Q336 V341 Q342	G334-V338 WeakPolarHBondContact O-CG2 3.13Å; G334-V338 PolarHBondContact O-N 3.05Å; T335-V338 PolarHBondContact O-N 3.03Å; Q336-V338 VanDerWaalsContact C-N 3.33Å; Q336-V338 PolarHBondContact O-N 3.37Å; V338-V341 PolarHBondContact O-N 3.15Å; V338-Q342 HydrophobicContact CG1-CG 4.49Å; V338-Q342 VanDerWaalsContact O-CG 3.31Å; V338-Q342 WeakPolarHBondContact O-CG 3.34Å; V338-Q342 PolarHBondContact O-N 2.93Å
339	Q	84.4	Confident	86.2	Confident	112 Å²	112	83.8 Å²	83.8	52%	0.523	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-39.2	174.6	-74.9	170.5	0.8	0	0	112.7	T335 Q336 Q337 V341 Q342 Q343	T335-Q339 WeakPolarHBondContact O-CG 3.21Å; T335-Q339 PolarHBondContact O-N 3.21Å; Q336-Q339 WeakPolarHBondContact O-CB 3.42Å; Q336-Q339 PolarHBondContact O-N 2.93Å; Q337-Q339 PolarHBondContact O-N 2.94Å; Q339-V341 PolarHBondContact O-N 3.15Å; Q339-Q342 WeakPolarHBondContact O-CB 3.29Å; Q339-Q342 PolarHBondContact O-N 2.86Å; Q339-Q343 PolarHBondContact O-N 2.96Å
340	L	88.1	Confident	85.6	Confident	83 Å²	83	84.9 Å²	84.9	44%	0.435	46%	0.461	S	S	.	.	H	α-helix	trans	-62.9	-41.5	174.4	-67.2	171.6	0	0	0	111.8	Q336 Q337 Q342 Q343 L344	Q336-L340 PolarHBondContact O-N 3.33Å; Q336-L340 VanDerWaalsContact O-N 3.09Å; Q337-L340 PolarHBondContact O-N 3.26Å; L340-Q342 VanDerWaalsContact C-N 3.34Å; L340-Q342 PolarHBondContact O-N 3.31Å; L340-Q343 PolarHBondContact O-N 2.68Å; L340-L344 WeakPolarHBondContact O-CG 3.5Å; L340-L344 PolarHBondContact O-N 2.69Å; L340-L344 VanDerWaalsContact O-N 3.11Å
341	V	82.9	Confident	85.2	Confident	100 Å²	100	88 Å²	88	61%	0.606	47%	0.473	S	S	*	.	H	α-helix	trans	-65.3	-36.4	174.3	175.1	0	0	0	0	111.7	Q337 V338 Q339 L345	Q337-V341 WeakPolarHBondContact O-CG2 3.44Å; Q337-V341 PolarHBondContact O-N 3.05Å; Q337-V341 VanDerWaalsContact O-N 3.13Å; V338-V341 PolarHBondContact O-N 3.15Å; Q339-V341 PolarHBondContact O-N 3.15Å; V341-L345 WeakPolarHBondContact O-CB 3.29Å; V341-L345 PolarHBondContact O-N 3.46Å; V341-L345 VanDerWaalsContact O-N 3.09Å
342	Q	83.8	Confident	84.8	Confident	110 Å²	110	88.3 Å²	88.3	51%	0.514	47%	0.466	S	S	.	.	H	α-helix	trans	-65.6	-41	174.3	-73.2	170.4	-0.1	0	0	112.3	V338 Q339 L340 L345 E346	V338-Q342 HydrophobicContact CG1-CG 4.49Å; V338-Q342 VanDerWaalsContact O-CG 3.31Å; V338-Q342 WeakPolarHBondContact O-CG 3.34Å; V338-Q342 PolarHBondContact O-N 2.93Å; Q339-Q342 WeakPolarHBondContact O-CB 3.29Å; Q339-Q342 PolarHBondContact O-N 2.86Å; L340-Q342 VanDerWaalsContact C-N 3.34Å; L340-Q342 PolarHBondContact O-N 3.31Å; Q342-L345 WeakPolarHBondContact O-CB 3.08Å; Q342-L345 PolarHBondContact O-N 2.82Å; Q342-E346 PolarHBondContact O-N 2.83Å; Q342-E346 VanDerWaalsContact O-N 3.16Å
343	Q	85.3	Confident	84.4	Confident	114 Å²	114	87 Å²	87	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-49.5	175	-177	-175.5	-30.3	0	0	111.4	Q339 L340 L345 E346 E347	Q339-Q343 PolarHBondContact O-N 2.96Å; L340-Q343 PolarHBondContact O-N 2.68Å; Q343-L345 PolarHBondContact O-N 2.84Å; Q343-E346 PolarHBondContact O-N 2.89Å; Q343-E346 VanDerWaalsContact O-N 3.09Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.48Å; Q343-E347 PolarHBondContact NE2-OE1 3.36Å; Q343-E347 PolarHBondContact O-N 3.01Å
344	L	85.6	Confident	83.8	Confident	110 Å²	110	89.1 Å²	89.1	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-58.5	-32.9	177.6	-70	170.6	0	0	0	112.3	L340 A348	L340-L344 WeakPolarHBondContact O-CG 3.5Å; L340-L344 PolarHBondContact O-N 2.69Å; L340-L344 VanDerWaalsContact O-N 3.11Å; L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.34Å
345	L	83.6	Confident	83.6	Confident	93 Å²	93	92.8 Å²	92.8	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-69	-39.7	175.6	-179.2	61.6	0	0	0	112.8	V341 Q342 Q343 A348 K349	V341-L345 WeakPolarHBondContact O-CB 3.29Å; V341-L345 PolarHBondContact O-N 3.46Å; V341-L345 VanDerWaalsContact O-N 3.09Å; Q342-L345 WeakPolarHBondContact O-CB 3.08Å; Q342-L345 PolarHBondContact O-N 2.82Å; Q343-L345 PolarHBondContact O-N 2.84Å; L345-A348 PolarHBondContact O-N 3.21Å; L345-K349 HydrophobicContact CG-CD 4.43Å; L345-K349 VanDerWaalsContact O-CG 3.29Å; L345-K349 WeakPolarHBondContact O-CG 3.23Å; L345-K349 PolarHBondContact O-N 2.81Å
346	E	82.7	Confident	83.3	Confident	105 Å²	105	91.2 Å²	91.2	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-70.5	-38.1	175.2	-61	-47.9	137.3	0	0	112.2	Q342 Q343 A348 K349 A350	Q342-E346 PolarHBondContact O-N 2.83Å; Q342-E346 VanDerWaalsContact O-N 3.16Å; Q343-E346 PolarHBondContact O-N 2.89Å; Q343-E346 VanDerWaalsContact O-N 3.09Å; E346-A348 VanDerWaalsContact C-N 3.33Å; E346-A348 PolarHBondContact O-N 2.87Å; E346-K349 VanDerWaalsContact CD-NZ 3.3Å; E346-K349 PolarHBondContact O-N 2.97Å; E346-K349 IonicContact OE1-NZ 3.95Å; E346-K349 PolarHBondContact OE1-NZ 2.72Å; E346-K349 WeakPolarHBondContact OE2-CD 3.35Å; E346-K349 IonicContact OE2-NZ 3.7Å; E346-K349 PolarHBondContact OE2-NZ 3.01Å; E346-A350 WeakPolarHBondContact O-CB 3.43Å; E346-A350 PolarHBondContact O-N 2.84Å
347	E	86.6	Confident	82.8	Confident	108 Å²	108	91.5 Å²	91.5	51%	0.505	48%	0.482	S	S	.	.	H	α-helix	trans	-61	-42	171.8	-70	178.5	-156	0	0	111.5	Q343 A350 K351	Q343-E347 WeakPolarHBondContact CG-OE1 3.48Å; Q343-E347 PolarHBondContact NE2-OE1 3.36Å; Q343-E347 PolarHBondContact O-N 3.01Å; E347-A350 PolarHBondContact O-N 3.49Å; E347-K351 WeakPolarHBondContact O-CB 3.34Å; E347-K351 PolarHBondContact O-N 3.42Å
348	A	80.8	Confident	82.4	Confident	56 Å²	56	92.6 Å²	92.6	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.1	0	0	0	0	0	112.8	L344 L345 E346 K351 Q352	L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.4Å; L344-A348 PolarHBondContact O-N 3.34Å; L345-A348 PolarHBondContact O-N 3.21Å; E346-A348 VanDerWaalsContact C-N 3.33Å; E346-A348 PolarHBondContact O-N 2.87Å; A348-K351 PolarHBondContact O-N 2.92Å; A348-Q352 PolarHBondContact O-N 3.04Å
349	K	82.7	Confident	82.1	Confident	88 Å²	88	94.1 Å²	94.1	38%	0.383	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-46.4	174.3	-75.3	162.3	173.6	177.7	0	111.9	L345 E346 K351 Q352 V353	L345-K349 HydrophobicContact CG-CD 4.43Å; L345-K349 VanDerWaalsContact O-CG 3.29Å; L345-K349 WeakPolarHBondContact O-CG 3.23Å; L345-K349 PolarHBondContact O-N 2.81Å; E346-K349 VanDerWaalsContact CD-NZ 3.3Å; E346-K349 PolarHBondContact O-N 2.97Å; E346-K349 IonicContact OE1-NZ 3.95Å; E346-K349 PolarHBondContact OE1-NZ 2.72Å; E346-K349 WeakPolarHBondContact OE2-CD 3.35Å; E346-K349 IonicContact OE2-NZ 3.7Å; E346-K349 PolarHBondContact OE2-NZ 3.01Å; K349-K351 VanDerWaalsContact C-N 3.27Å; K349-K351 PolarHBondContact O-N 2.85Å; K349-Q352 WeakPolarHBondContact O-CB 3.39Å; K349-Q352 PolarHBondContact O-N 2.84Å; K349-Q352 VanDerWaalsContact O-N 3.13Å; K349-V353 PolarHBondContact O-N 2.84Å; K349-V353 VanDerWaalsContact O-N 3.11Å
350	A	80.4	Confident	81.9	Confident	64 Å²	64	94.8 Å²	94.8	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-41	176	0	0	0	0	0	111.2	E346 E347 V353 S354	E346-A350 WeakPolarHBondContact O-CB 3.43Å; E346-A350 PolarHBondContact O-N 2.84Å; E347-A350 PolarHBondContact O-N 3.49Å; A350-V353 PolarHBondContact O-N 3.38Å; A350-S354 PolarHBondContact O-N 2.91Å
351	K	81.6	Confident	81.6	Confident	125 Å²	125	93.6 Å²	93.6	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-67	-37.1	175.2	-169.2	57.8	174.3	178	0	112.9	E347 A348 K349 S354 L355	E347-K351 WeakPolarHBondContact O-CB 3.34Å; E347-K351 PolarHBondContact O-N 3.42Å; A348-K351 PolarHBondContact O-N 2.92Å; K349-K351 VanDerWaalsContact C-N 3.27Å; K349-K351 PolarHBondContact O-N 2.85Å; K351-S354 PolarHBondContact O-N 2.98Å; K351-L355 HydrophobicContact CG-CD1 4.29Å; K351-L355 WeakPolarHBondContact O-CG 3.26Å; K351-L355 PolarHBondContact O-N 2.97Å
352	Q	78.4	Confident	81.6	Confident	124 Å²	124	93.3 Å²	93.3	58%	0.579	49%	0.492	S	S	*	.	H	α-helix	trans	-59.9	-45.2	175.9	-171	-175	14.6	0	0	111.7	A348 K349 L355 V356	A348-Q352 PolarHBondContact O-N 3.04Å; K349-Q352 WeakPolarHBondContact O-CB 3.39Å; K349-Q352 PolarHBondContact O-N 2.84Å; K349-Q352 VanDerWaalsContact O-N 3.13Å; Q352-L355 PolarHBondContact O-N 2.85Å; Q352-V356 WeakPolarHBondContact O-CG2 3.49Å; Q352-V356 PolarHBondContact O-N 2.99Å
353	V	81.1	Confident	81.4	Confident	83 Å²	83	90.7 Å²	90.7	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-60	-49.4	176.8	176.7	0	0	0	0	110.8	K349 A350 L355 V356 E357	K349-V353 PolarHBondContact O-N 2.84Å; K349-V353 VanDerWaalsContact O-N 3.11Å; A350-V353 PolarHBondContact O-N 3.38Å; V353-L355 VanDerWaalsContact C-N 3.28Å; V353-L355 PolarHBondContact O-N 3.17Å; V353-V356 PolarHBondContact O-N 2.96Å; V353-V356 VanDerWaalsContact O-N 3.08Å; V353-E357 WeakPolarHBondContact O-CG 3.36Å; V353-E357 PolarHBondContact O-N 3.35Å
354	S	77.8	Confident	81.2	Confident	50 Å²	50	88.4 Å²	88.4	35%	0.35	48%	0.476	S	S	.	.	H	α-helix	trans	-58.1	-36.1	177.3	175	0	0	0	0	113.3	A350 K351 S358	A350-S354 PolarHBondContact O-N 2.91Å; K351-S354 PolarHBondContact O-N 2.98Å; S354-S358 WeakPolarHBondContact O-CB 3.49Å; S354-S358 PolarHBondContact O-N 3.4Å; S354-S358 PolarHBondContact O-OG 2.85Å
355	L	79.6	Confident	81.2	Confident	99 Å²	99	87.5 Å²	87.5	52%	0.518	47%	0.471	S	S	.	.	H	α-helix	trans	-72.1	-37.8	175.3	-71.4	171.4	0	0	0	112.3	K351 Q352 V353 E357 S358 F359	K351-L355 HydrophobicContact CG-CD1 4.29Å; K351-L355 WeakPolarHBondContact O-CG 3.26Å; K351-L355 PolarHBondContact O-N 2.97Å; Q352-L355 PolarHBondContact O-N 2.85Å; V353-L355 VanDerWaalsContact C-N 3.28Å; V353-L355 PolarHBondContact O-N 3.17Å; L355-E357 VanDerWaalsContact C-N 3.33Å; L355-S358 WeakPolarHBondContact O-CB 3.31Å; L355-S358 PolarHBondContact O-N 3.31Å; L355-F359 PolarHBondContact O-N 2.81Å
356	V	80.6	Confident	81.3	Confident	66 Å²	66	86 Å²	86	40%	0.4	47%	0.468	S	S	.	.	H	α-helix	trans	-66.8	-34.3	175.1	169.4	0	0	0	0	111.8	Q352 V353 K360	Q352-V356 WeakPolarHBondContact O-CG2 3.49Å; Q352-V356 PolarHBondContact O-N 2.99Å; V353-V356 PolarHBondContact O-N 2.96Å; V353-V356 VanDerWaalsContact O-N 3.08Å; V356-K360 WeakPolarHBondContact O-CG 3.35Å; V356-K360 PolarHBondContact O-N 3.09Å
357	E	77.3	Confident	81.6	Confident	116 Å²	116	86 Å²	86	54%	0.542	47%	0.468	S	S	.	.	H	α-helix	trans	-69.1	-43	171.8	-69.4	175.8	160	0	0	111.9	V353 L355 F359 K360 S361	V353-E357 WeakPolarHBondContact O-CG 3.36Å; V353-E357 PolarHBondContact O-N 3.35Å; L355-E357 VanDerWaalsContact C-N 3.33Å; E357-F359 VanDerWaalsContact C-N 3.29Å; E357-F359 PolarHBondContact O-N 3.01Å; E357-K360 PolarHBondContact O-N 2.84Å; E357-S361 PolarHBondContact O-N 2.7Å; E357-S361 VanDerWaalsContact O-N 3.07Å
358	S	80.7	Confident	81.6	Confident	58 Å²	58	88.1 Å²	88.1	41%	0.406	47%	0.472	S	S	.	.	H	α-helix	trans	-59.7	-38.9	174.1	-58.1	0	0	0	0	111.9	S354 L355 S361 V362	S354-S358 WeakPolarHBondContact O-CB 3.49Å; S354-S358 PolarHBondContact O-N 3.4Å; S354-S358 PolarHBondContact O-OG 2.85Å; L355-S358 WeakPolarHBondContact O-CB 3.31Å; L355-S358 PolarHBondContact O-N 3.31Å; S358-S361 PolarHBondContact O-N 2.8Å; S358-S361 PolarHBondContact O-OG 3.21Å; S358-V362 PolarHBondContact O-N 3.47Å
359	F	79.4	Confident	81.9	Confident	113 Å²	113	91.4 Å²	91.4	50%	0.496	48%	0.481	S	S	.	.	H	α-helix	trans	-64.2	-42.9	175.9	-174.4	-94.1	0	0	0	112.5	M104 L355 E357 S361 V362 D363	M104-F359 HydrophobicContact CE-CZ 4.05Å; M104-F359 HydrophobicContact SD-CE1 3.8Å; M104-F359 HydrophobicContact SD-CE2 4.06Å; M104-F359 HydrophobicContact SD-CZ 3.36Å; M104-F359 WeakPolarHBondContact SD-CZ 3.43Å; L355-F359 PolarHBondContact O-N 2.81Å; E357-F359 VanDerWaalsContact C-N 3.29Å; E357-F359 PolarHBondContact O-N 3.01Å; F359-S361 VanDerWaalsContact C-N 3.29Å; F359-S361 PolarHBondContact O-N 2.67Å; F359-V362 PolarHBondContact O-N 3.48Å; F359-D363 PolarHBondContact O-N 3.4Å
360	K	81.4	Confident	82.2	Confident	125 Å²	125	91.4 Å²	91.4	54%	0.543	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-33.8	175.5	-66.6	165.4	-171.2	167.3	0	112.4	V356 E357 T364	V356-K360 WeakPolarHBondContact O-CG 3.35Å; V356-K360 PolarHBondContact O-N 3.09Å; E357-K360 PolarHBondContact O-N 2.84Å; K360-T364 PolarHBondContact O-N 3.23Å; K360-T364 VanDerWaalsContact O-N 3.16Å; K360-T364 PolarHBondContact O-OG1 2.89Å
361	S	80.4	Confident	82.6	Confident	59 Å²	59	94.7 Å²	94.7	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-69.9	-35.4	178.2	81.8	0	0	0	0	112.1	E357 S358 F359 T364 L365	E357-S361 PolarHBondContact O-N 2.7Å; E357-S361 VanDerWaalsContact O-N 3.07Å; S358-S361 PolarHBondContact O-N 2.8Å; S358-S361 PolarHBondContact O-OG 3.21Å; F359-S361 VanDerWaalsContact C-N 3.29Å; F359-S361 PolarHBondContact O-N 2.67Å; S361-T364 WeakPolarHBondContact O-CB 3.41Å; S361-T364 PolarHBondContact O-N 3.11Å; S361-L365 VanDerWaalsContact O-CG 3.3Å; S361-L365 WeakPolarHBondContact O-CG 3.44Å; S361-L365 PolarHBondContact O-N 3.21Å
362	V	83.3	Confident	82.9	Confident	93 Å²	93	92.3 Å²	92.3	56%	0.564	49%	0.49	S	S	*	.	H	α-helix	trans	-64.7	-43.8	175.4	174.4	0	0	0	0	112.1	S358 F359 T364 L365 S366	S358-V362 PolarHBondContact O-N 3.47Å; F359-V362 PolarHBondContact O-N 3.48Å; V362-T364 VanDerWaalsContact C-N 3.33Å; V362-T364 PolarHBondContact O-N 2.67Å; V362-L365 PolarHBondContact O-N 2.74Å; V362-S366 PolarHBondContact O-N 3.06Å
363	D	80	Confident	83.6	Confident	55 Å²	55	93.6 Å²	93.6	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-59.5	-44.6	173.7	-176.2	28.7	0	0	0	111.1	F359 L365 S366 Q367	F359-D363 PolarHBondContact O-N 3.4Å; D363-L365 VanDerWaalsContact C-N 3.32Å; D363-L365 PolarHBondContact O-N 2.78Å; D363-S366 WeakPolarHBondContact O-CB 3.37Å; D363-S366 PolarHBondContact O-N 3.35Å; D363-Q367 WeakPolarHBondContact O-CG 3.13Å; D363-Q367 PolarHBondContact O-N 3.02Å; D363-Q367 PolarHBondContact OD1-NE2 3.18Å; D363-Q367 PolarHBondContact OD2-NE2 2.95Å; D363-Q367 VanDerWaalsContact OD2-NE2 3.13Å
364	T	82	Confident	84.2	Confident	66 Å²	66	96 Å²	96	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-37.5	175.7	-52.7	0	0	0	0	112.8	K360 S361 V362 R368	K360-T364 PolarHBondContact O-N 3.23Å; K360-T364 VanDerWaalsContact O-N 3.16Å; K360-T364 PolarHBondContact O-OG1 2.89Å; S361-T364 WeakPolarHBondContact O-CB 3.41Å; S361-T364 PolarHBondContact O-N 3.11Å; V362-T364 VanDerWaalsContact C-N 3.33Å; V362-T364 PolarHBondContact O-N 2.67Å; T364-R368 WeakPolarHBondContact O-CB 3.44Å; T364-R368 PolarHBondContact O-N 3.15Å; T364-R368 VanDerWaalsContact O-N 3.17Å
365	L	83.8	Confident	84.8	Confident	92 Å²	92	100 Å²	100	48%	0.482	51%	0.511	S	S	.	.	H	α-helix	trans	-71	-40.2	176.2	-73.1	168.2	0	0	0	112	S361 V362 D363 R368 L369	S361-L365 VanDerWaalsContact O-CG 3.3Å; S361-L365 WeakPolarHBondContact O-CG 3.44Å; S361-L365 PolarHBondContact O-N 3.21Å; V362-L365 PolarHBondContact O-N 2.74Å; D363-L365 VanDerWaalsContact C-N 3.32Å; D363-L365 PolarHBondContact O-N 2.78Å; L365-R368 PolarHBondContact O-N 2.74Å; L365-L369 PolarHBondContact O-N 2.95Å
366	S	86.6	Confident	85.4	Confident	61 Å²	61	96.9 Å²	96.9	43%	0.427	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-46.2	175.8	-176.4	0	0	0	0	111.7	V362 D363 R368 L369 N370	V362-S366 PolarHBondContact O-N 3.06Å; D363-S366 WeakPolarHBondContact O-CB 3.37Å; D363-S366 PolarHBondContact O-N 3.35Å; S366-R368 PolarHBondContact O-N 3.33Å; S366-L369 PolarHBondContact O-N 2.86Å; S366-N370 PolarHBondContact O-N 2.92Å; S366-N370 VanDerWaalsContact O-N 3.11Å; S366-N370 PolarHBondContact O-ND2 2.93Å
367	Q	88.8	Confident	86	Confident	104 Å²	104	96.3 Å²	96.3	49%	0.486	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-43.6	176.3	-67.3	169	28.5	0	0	111.4	D363 L369 N370 M371	D363-Q367 WeakPolarHBondContact O-CG 3.13Å; D363-Q367 PolarHBondContact O-N 3.02Å; D363-Q367 PolarHBondContact OD1-NE2 3.18Å; D363-Q367 PolarHBondContact OD2-NE2 2.95Å; D363-Q367 VanDerWaalsContact OD2-NE2 3.13Å; Q367-L369 PolarHBondContact O-N 2.98Å; Q367-N370 PolarHBondContact O-N 2.97Å; Q367-M371 WeakPolarHBondContact O-CG 3.38Å; Q367-M371 PolarHBondContact O-N 2.68Å
368	R	87.8	Confident	86.8	Confident	153 Å²	153	95.1 Å²	95.1	58%	0.577	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-40	176.8	-168.9	-176.7	-59	156.5	4.4	112.9	T364 L365 S366 M371 S372	T364-R368 WeakPolarHBondContact O-CB 3.44Å; T364-R368 PolarHBondContact O-N 3.15Å; T364-R368 VanDerWaalsContact O-N 3.17Å; L365-R368 PolarHBondContact O-N 2.74Å; S366-R368 PolarHBondContact O-N 3.33Å; R368-M371 PolarHBondContact O-N 2.89Å; R368-S372 WeakPolarHBondContact O-CB 3.35Å; R368-S372 PolarHBondContact O-N 3.2Å
369	L	86.1	Confident	87.4	Confident	125 Å²	125	96.3 Å²	96.3	65%	0.654	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-44.1	176.6	179.1	60.2	0	0	0	111.6	L365 S366 Q367 S372 F373	L365-L369 PolarHBondContact O-N 2.95Å; S366-L369 PolarHBondContact O-N 2.86Å; Q367-L369 PolarHBondContact O-N 2.98Å; L369-S372 PolarHBondContact O-N 3.18Å; L369-F373 PolarHBondContact O-N 3.24Å
370	N	89.5	Confident	88	Confident	89 Å²	89	94.8 Å²	94.8	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-44.1	176.9	-79.1	-82.9	0	0	0	112.2	S366 Q367 S372 F373 Q374	S366-N370 PolarHBondContact O-N 2.92Å; S366-N370 VanDerWaalsContact O-N 3.11Å; S366-N370 PolarHBondContact O-ND2 2.93Å; Q367-N370 PolarHBondContact O-N 2.97Å; N370-S372 VanDerWaalsContact C-N 3.33Å; N370-S372 PolarHBondContact O-N 2.69Å; N370-F373 PolarHBondContact O-N 2.81Å; N370-Q374 WeakPolarHBondContact O-CG 3.39Å; N370-Q374 PolarHBondContact O-N 3.26Å
371	M	89.1	Confident	88.6	Confident	132 Å²	132	93.8 Å²	93.8	65%	0.65	49%	0.487	S	S	*	.	H	α-helix	trans	-61.8	-40.1	173.9	-68.5	178.4	72.4	0	0	112.2	Q367 R368 Q374 K375	Q367-M371 WeakPolarHBondContact O-CG 3.38Å; Q367-M371 PolarHBondContact O-N 2.68Å; R368-M371 PolarHBondContact O-N 2.89Å; M371-Q374 PolarHBondContact O-N 3.08Å; M371-K375 WeakPolarHBondContact O-CB 3.36Å; M371-K375 PolarHBondContact O-N 2.96Å
372	S	88	Confident	89.2	Confident	76 Å²	76	95.9 Å²	95.9	53%	0.531	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-39.9	178.5	-169.4	0	0	0	0	112.2	R368 L369 N370 A376	R368-S372 WeakPolarHBondContact O-CB 3.35Å; R368-S372 PolarHBondContact O-N 3.2Å; L369-S372 PolarHBondContact O-N 3.18Å; N370-S372 VanDerWaalsContact C-N 3.33Å; N370-S372 PolarHBondContact O-N 2.69Å; S372-A376 WeakPolarHBondContact O-CB 3.38Å; S372-A376 PolarHBondContact O-N 2.66Å
373	F	91.9	Very high	89.6	Confident	151 Å²	151	93.9 Å²	93.9	66%	0.662	48%	0.478	S	S	*	.	H	α-helix	trans	-63.5	-47.3	174.1	174.4	-97.7	0	0	0	112.1	L369 N370 K375 A376 S377	L369-F373 PolarHBondContact O-N 3.24Å; N370-F373 PolarHBondContact O-N 2.81Å; F373-K375 PolarHBondContact O-N 2.97Å; F373-A376 PolarHBondContact O-N 2.96Å; F373-S377 PolarHBondContact O-N 2.65Å
374	Q	93.1	Very high	90.1	Very high	132 Å²	132	92.6 Å²	92.6	62%	0.617	48%	0.475	S	S	*	.	H	α-helix	trans	-61	-44.5	178.1	-72	175.4	-6.7	0	0	111.9	N370 M371 S377 Q378	N370-Q374 WeakPolarHBondContact O-CG 3.39Å; N370-Q374 PolarHBondContact O-N 3.26Å; M371-Q374 PolarHBondContact O-N 3.08Å; Q374-S377 PolarHBondContact O-N 3.14Å; Q374-Q378 PolarHBondContact O-N 2.85Å; Q374-Q378 VanDerWaalsContact O-N 3.09Å
375	K	92.1	Very high	90.7	Very high	136 Å²	136	93.1 Å²	93.1	59%	0.591	48%	0.481	S	S	*	.	H	α-helix	trans	-60.8	-49.2	177.1	-169.3	176.4	-167.1	-76.6	0	111.9	M371 F373 S377 Q378 E379	M371-K375 WeakPolarHBondContact O-CB 3.36Å; M371-K375 PolarHBondContact O-N 2.96Å; F373-K375 PolarHBondContact O-N 2.97Å; K375-S377 VanDerWaalsContact C-N 3.29Å; K375-S377 PolarHBondContact O-N 2.93Å; K375-Q378 WeakPolarHBondContact O-CB 3.25Å; K375-Q378 PolarHBondContact O-N 3.1Å; K375-Q378 VanDerWaalsContact O-N 3.11Å; K375-E379 IonicContact NZ-OE1 3.98Å; K375-E379 PolarHBondContact NZ-OE1 3.26Å; K375-E379 WeakPolarHBondContact O-CG 3.46Å; K375-E379 PolarHBondContact O-N 3.42Å
376	A	91	Very high	91.1	Very high	32 Å²	32	93.6 Å²	93.6	26%	0.264	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-35.7	179	0	0	0	0	0	112.5	S372 F373 Q378 I380	S372-A376 WeakPolarHBondContact O-CB 3.38Å; S372-A376 PolarHBondContact O-N 2.66Å; F373-A376 PolarHBondContact O-N 2.96Å; A376-Q378 VanDerWaalsContact C-N 3.34Å; A376-I380 WeakPolarHBondContact O-CD1 3.23Å; A376-I380 VanDerWaalsContact O-CG1 3.28Å; A376-I380 WeakPolarHBondContact O-CG1 3.12Å; A376-I380 PolarHBondContact O-N 3.14Å
377	S	93.5	Very high	91.2	Very high	55 Å²	55	92.9 Å²	92.9	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-67.5	-33.9	175.2	-167.7	0	0	0	0	112.8	F373 Q374 K375 M381	F373-S377 PolarHBondContact O-N 2.65Å; Q374-S377 PolarHBondContact O-N 3.14Å; K375-S377 VanDerWaalsContact C-N 3.29Å; K375-S377 PolarHBondContact O-N 2.93Å; S377-M381 WeakPolarHBondContact O-CG 3.36Å
378	Q	93.7	Very high	91.4	Very high	91 Å²	91	94.5 Å²	94.5	43%	0.425	48%	0.483	S	S	.	.	H	α-helix	trans	-70.9	-47.7	175.8	-176.5	63.4	22.7	0	0	111.3	Q374 K375 A376 I380 M381 E382	Q374-Q378 PolarHBondContact O-N 2.85Å; Q374-Q378 VanDerWaalsContact O-N 3.09Å; K375-Q378 WeakPolarHBondContact O-CB 3.25Å; K375-Q378 PolarHBondContact O-N 3.1Å; K375-Q378 VanDerWaalsContact O-N 3.11Å; A376-Q378 VanDerWaalsContact C-N 3.34Å; Q378-I380 PolarHBondContact O-N 3.38Å; Q378-M381 PolarHBondContact O-N 2.85Å; Q378-M381 VanDerWaalsContact OE1-CE 3.25Å; Q378-E382 HydrophobicContact CG-CG 4.45Å; Q378-E382 WeakPolarHBondContact CG-OE1 3.36Å; Q378-E382 PolarHBondContact NE2-OE1 3.02Å; Q378-E382 PolarHBondContact O-N 3.07Å
379	E	93.1	Very high	91.6	Very high	83 Å²	83	92.4 Å²	92.4	39%	0.388	48%	0.479	S	S	.	.	H	α-helix	trans	-55.2	-37.6	177.7	-71.6	168.2	171.3	0	0	112.4	K375 T383	K375-E379 IonicContact NZ-OE1 3.98Å; K375-E379 PolarHBondContact NZ-OE1 3.26Å; K375-E379 WeakPolarHBondContact O-CG 3.46Å; K375-E379 PolarHBondContact O-N 3.42Å; E379-T383 VanDerWaalsContact O-CB 3.3Å; E379-T383 WeakPolarHBondContact O-CB 3.33Å; E379-T383 PolarHBondContact O-N 2.93Å; E379-T383 PolarHBondContact O-OG1 3.17Å
380	I	92.6	Very high	91.9	Very high	80 Å²	80	90 Å²	90	41%	0.41	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-41.4	176.3	-72.2	165.2	0	0	0	111.7	A376 Q378 A384 F492 V495	A376-I380 WeakPolarHBondContact O-CD1 3.23Å; A376-I380 VanDerWaalsContact O-CG1 3.28Å; A376-I380 WeakPolarHBondContact O-CG1 3.12Å; A376-I380 PolarHBondContact O-N 3.14Å; Q378-I380 PolarHBondContact O-N 3.38Å; I380-A384 PolarHBondContact O-N 3.38Å; I380-A384 VanDerWaalsContact O-N 3.14Å; I380-F492 HydrophobicContact CG2-CE1 4.38Å; I380-V495 HydrophobicContact CD1-CG2 4.28Å
381	M	93.5	Very high	91.9	Very high	105 Å²	105	90.4 Å²	90.4	52%	0.517	48%	0.475	S	S	.	.	H	α-helix	trans	-71.1	-40.1	179.1	-66.1	-173.7	-64.8	0	0	111.8	S377 Q378 A384 S385	S377-M381 WeakPolarHBondContact O-CG 3.36Å; Q378-M381 PolarHBondContact O-N 2.85Å; Q378-M381 VanDerWaalsContact OE1-CE 3.25Å; M381-A384 PolarHBondContact O-N 2.92Å; M381-S385 PolarHBondContact O-N 3.18Å
382	E	94	Very high	92.1	Very high	103 Å²	103	87.6 Å²	87.6	48%	0.481	46%	0.46	S	S	.	.	H	α-helix	trans	-65.1	-44	176.7	-71.2	168.2	170	0	0	111.4	Q378 A384 S385 L386	Q378-E382 HydrophobicContact CG-CG 4.45Å; Q378-E382 WeakPolarHBondContact CG-OE1 3.36Å; Q378-E382 PolarHBondContact NE2-OE1 3.02Å; Q378-E382 PolarHBondContact O-N 3.07Å; E382-A384 VanDerWaalsContact C-N 3.32Å; E382-A384 PolarHBondContact O-N 2.97Å; E382-S385 WeakPolarHBondContact O-CB 3.47Å; E382-S385 PolarHBondContact O-N 3.05Å; E382-L386 PolarHBondContact O-N 2.86Å
383	T	90.7	Very high	92.3	Very high	50 Å²	50	88.7 Å²	88.7	31%	0.307	46%	0.457	S	S	.	.	H	α-helix	trans	-60.1	-41	174.8	-58.1	0	0	0	0	111.9	E379 L387	E379-T383 VanDerWaalsContact O-CB 3.3Å; E379-T383 WeakPolarHBondContact O-CB 3.33Å; E379-T383 PolarHBondContact O-N 2.93Å; E379-T383 PolarHBondContact O-OG1 3.17Å; T383-L387 HydrophobicContact CG2-CD1 4.2Å; T383-L387 WeakPolarHBondContact O-CG 3.46Å; T383-L387 PolarHBondContact O-N 2.98Å; T383-L387 VanDerWaalsContact O-N 3.14Å
384	A	91.9	Very high	92.3	Very high	29 Å²	29	87 Å²	87	24%	0.24	45%	0.451	C	S	.	.	H	α-helix	trans	-64.5	-40.4	176	0	0	0	0	0	112.5	I380 M381 E382 Q388 F492	I380-A384 PolarHBondContact O-N 3.38Å; I380-A384 VanDerWaalsContact O-N 3.14Å; M381-A384 PolarHBondContact O-N 2.92Å; E382-A384 VanDerWaalsContact C-N 3.32Å; E382-A384 PolarHBondContact O-N 2.97Å; A384-Q388 WeakPolarHBondContact O-CG 3.45Å; A384-Q388 PolarHBondContact O-N 2.82Å; A384-F492 HydrophobicContact CB-CE2 4.06Å; A384-F492 HydrophobicContact CB-CZ 4.07Å
385	S	93.4	Very high	92.4	Very high	76 Å²	76	86.2 Å²	86.2	53%	0.531	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-46.7	176.8	-168	0	0	0	0	111.9	M381 E382 L387 Q388 Q389	M381-S385 PolarHBondContact O-N 3.18Å; E382-S385 WeakPolarHBondContact O-CB 3.47Å; E382-S385 PolarHBondContact O-N 3.05Å; S385-L387 VanDerWaalsContact C-N 3.33Å; S385-L387 PolarHBondContact O-N 3.5Å; S385-Q388 WeakPolarHBondContact O-CB 3.45Å; S385-Q388 PolarHBondContact O-N 3.41Å; S385-Q388 VanDerWaalsContact O-N 3.1Å; S385-Q389 PolarHBondContact O-N 3.27Å
386	L	91.7	Very high	92.5	Very high	103 Å²	103	83.8 Å²	83.8	54%	0.539	43%	0.433	S	S	.	.	H	α-helix	trans	-59.5	-42.3	178.3	-179	62.4	0	0	0	112.1	E382 Q388 Q389 V390	E382-L386 PolarHBondContact O-N 2.86Å; L386-Q388 VanDerWaalsContact C-N 3.32Å; L386-Q388 PolarHBondContact O-N 3Å; L386-Q389 PolarHBondContact O-N 2.89Å; L386-V390 WeakPolarHBondContact O-CG2 3.37Å; L386-V390 PolarHBondContact O-N 2.87Å
387	L	90.2	Very high	92.7	Very high	46 Å²	46	85.5 Å²	85.5	24%	0.241	44%	0.436	C	S	.	.	H	α-helix	trans	-67.4	-30.3	177.3	-72.2	169.9	0	0	0	112.9	T383 S385 V391 F492	T383-L387 HydrophobicContact CG2-CD1 4.2Å; T383-L387 WeakPolarHBondContact O-CG 3.46Å; T383-L387 PolarHBondContact O-N 2.98Å; T383-L387 VanDerWaalsContact O-N 3.14Å; S385-L387 VanDerWaalsContact C-N 3.33Å; S385-L387 PolarHBondContact O-N 3.5Å; L387-V391 WeakPolarHBondContact O-CG2 3.29Å; L387-V391 PolarHBondContact O-N 2.87Å; L387-F492 HydrophobicContact CD1-CB 4.48Å; L387-F492 HydrophobicContact CD1-CD2 3.47Å; L387-F492 VanDerWaalsContact CD1-CD2 3.47Å; L387-F492 HydrophobicContact CD1-CE2 4.07Å; L387-F492 HydrophobicContact CD1-CG 4.34Å
388	Q	91.7	Very high	92.6	Very high	138 Å²	138	84.9 Å²	84.9	65%	0.645	43%	0.43	S	S	*	.	H	α-helix	trans	-67.3	-42.7	171.5	-69.9	171.5	23.8	0	0	111.3	A384 S385 L386 V391 E392	A384-Q388 WeakPolarHBondContact O-CG 3.45Å; A384-Q388 PolarHBondContact O-N 2.82Å; S385-Q388 WeakPolarHBondContact O-CB 3.45Å; S385-Q388 PolarHBondContact O-N 3.41Å; S385-Q388 VanDerWaalsContact O-N 3.1Å; L386-Q388 VanDerWaalsContact C-N 3.32Å; L386-Q388 PolarHBondContact O-N 3Å; Q388-V391 PolarHBondContact O-N 2.88Å; Q388-E392 PolarHBondContact O-N 3.2Å
389	Q	92.8	Very high	92.6	Very high	108 Å²	108	85 Å²	85	51%	0.505	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-45.9	175.6	-177.3	-178.8	-29.1	0	0	111.9	S385 L386 V391 E392 E393	S385-Q389 PolarHBondContact O-N 3.27Å; L386-Q389 PolarHBondContact O-N 2.89Å; Q389-V391 VanDerWaalsContact C-N 3.3Å; Q389-V391 PolarHBondContact O-N 3.27Å; Q389-E392 WeakPolarHBondContact O-CB 3.37Å; Q389-E392 PolarHBondContact O-N 2.78Å; Q389-E392 VanDerWaalsContact O-N 3.11Å; Q389-E393 HydrophobicContact CG-CG 4.44Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.4Å; Q389-E393 PolarHBondContact NE2-OE1 2.95Å; Q389-E393 WeakPolarHBondContact O-CG 3.15Å; Q389-E393 PolarHBondContact O-N 3.39Å
390	V	91.4	Very high	92.7	Very high	75 Å²	75	87.2 Å²	87.2	46%	0.455	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-36.6	179	172	0	0	0	0	112.2	L386 Q394	L386-V390 WeakPolarHBondContact O-CG2 3.37Å; L386-V390 PolarHBondContact O-N 2.87Å; V390-Q394 WeakPolarHBondContact O-CB 3.33Å; V390-Q394 PolarHBondContact O-N 3.02Å
391	V	91	Very high	92.7	Very high	97 Å²	97	88.4 Å²	88.4	59%	0.588	44%	0.439	S	S	*	.	H	α-helix	trans	-67.6	-38.2	174.7	169.7	0	0	0	0	111.6	L387 Q388 Q389 Q394 R395	L387-V391 WeakPolarHBondContact O-CG2 3.29Å; L387-V391 PolarHBondContact O-N 2.87Å; Q388-V391 PolarHBondContact O-N 2.88Å; Q389-V391 VanDerWaalsContact C-N 3.3Å; Q389-V391 PolarHBondContact O-N 3.27Å; V391-Q394 PolarHBondContact O-N 2.82Å; V391-R395 PolarHBondContact O-N 2.93Å
392	E	93.1	Very high	92.7	Very high	73 Å²	73	87.8 Å²	87.8	34%	0.341	44%	0.437	S	S	.	.	H	α-helix	trans	-69.3	-40.9	176.7	173.8	53.3	-153.1	0	0	112.5	Q388 Q389 R395 Q396	Q388-E392 PolarHBondContact O-N 3.2Å; Q389-E392 WeakPolarHBondContact O-CB 3.37Å; Q389-E392 PolarHBondContact O-N 2.78Å; Q389-E392 VanDerWaalsContact O-N 3.11Å; E392-R395 WeakPolarHBondContact O-CB 3.43Å; E392-R395 PolarHBondContact O-N 3.1Å; E392-R395 IonicContact OE1-CZ 3.73Å; E392-R395 IonicContact OE1-NE 2.81Å; E392-R395 PolarHBondContact OE1-NE 3.44Å; E392-R395 IonicContact OE1-NH2 3.29Å; E392-R395 PolarHBondContact OE1-NH2 3.07Å; E392-R395 IonicContact OE2-CZ 3.74Å; E392-R395 IonicContact OE2-NE 2.72Å; E392-R395 PolarHBondContact OE2-NE 3.37Å; E392-R395 IonicContact OE2-NH2 2.97Å; E392-R395 PolarHBondContact OE2-NH2 3.19Å; E392-Q396 WeakPolarHBondContact O-CG 3.41Å; E392-Q396 PolarHBondContact O-N 3.05Å; E392-Q396 VanDerWaalsContact O-N 3.07Å; E392-Q396 PolarHBondContact OE1-NE2 2.86Å
393	E	92.7	Very high	92.7	Very high	100 Å²	100	88.5 Å²	88.5	47%	0.467	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-43	172.6	-72.9	175.9	-164.4	0	0	111.6	Q389 R395 Q396 Q397	Q389-E393 HydrophobicContact CG-CG 4.44Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.4Å; Q389-E393 PolarHBondContact NE2-OE1 2.95Å; Q389-E393 WeakPolarHBondContact O-CG 3.15Å; Q389-E393 PolarHBondContact O-N 3.39Å; E393-R395 VanDerWaalsContact C-N 3.33Å; E393-R395 PolarHBondContact O-N 3.23Å; E393-Q396 PolarHBondContact O-N 3.25Å; E393-Q397 PolarHBondContact O-N 3.36Å
394	Q	92	Very high	92.7	Very high	115 Å²	115	91.5 Å²	91.5	54%	0.537	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-36.3	175.7	-172.4	63	43	0	0	112	V390 V391 Q397 V398	V390-Q394 WeakPolarHBondContact O-CB 3.33Å; V390-Q394 PolarHBondContact O-N 3.02Å; V391-Q394 PolarHBondContact O-N 2.82Å; Q394-Q397 PolarHBondContact O-N 3.4Å; Q394-V398 WeakPolarHBondContact O-CG2 3.29Å; Q394-V398 PolarHBondContact O-N 2.78Å
395	R	94	Very high	92.6	Very high	115 Å²	115	92.1 Å²	92.1	43%	0.434	46%	0.46	S	S	.	.	H	α-helix	trans	-58.7	-50.5	173	-174.9	-171.5	72.3	77.8	-0.5	110.8	V391 E392 E393 Q397 V398 Q399	V391-R395 PolarHBondContact O-N 2.93Å; E392-R395 WeakPolarHBondContact O-CB 3.43Å; E392-R395 PolarHBondContact O-N 3.1Å; E392-R395 IonicContact OE1-CZ 3.73Å; E392-R395 IonicContact OE1-NE 2.81Å; E392-R395 PolarHBondContact OE1-NE 3.44Å; E392-R395 IonicContact OE1-NH2 3.29Å; E392-R395 PolarHBondContact OE1-NH2 3.07Å; E392-R395 IonicContact OE2-CZ 3.74Å; E392-R395 IonicContact OE2-NE 2.72Å; E392-R395 PolarHBondContact OE2-NE 3.37Å; E392-R395 IonicContact OE2-NH2 2.97Å; E392-R395 PolarHBondContact OE2-NH2 3.19Å; E393-R395 VanDerWaalsContact C-N 3.33Å; E393-R395 PolarHBondContact O-N 3.23Å; R395-Q397 VanDerWaalsContact C-N 3.35Å; R395-Q397 PolarHBondContact O-N 3.14Å; R395-V398 PolarHBondContact O-N 3.4Å; R395-Q399 WeakPolarHBondContact O-CG 3.38Å; R395-Q399 PolarHBondContact O-N 2.77Å; R395-Q399 VanDerWaalsContact O-N 3.12Å
396	Q	95.3	Very high	92.5	Very high	86 Å²	86	93.6 Å²	93.6	40%	0.402	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-38.8	179.6	-65.8	176.5	26.3	0	0	112.2	E392 E393 R400	E392-Q396 WeakPolarHBondContact O-CG 3.41Å; E392-Q396 PolarHBondContact O-N 3.05Å; E392-Q396 VanDerWaalsContact O-N 3.07Å; E392-Q396 PolarHBondContact OE1-NE2 2.86Å; E393-Q396 PolarHBondContact O-N 3.25Å; Q396-R400 WeakPolarHBondContact O-CG 3.3Å; Q396-R400 PolarHBondContact O-N 2.98Å; Q396-R400 VanDerWaalsContact O-N 3.16Å
397	Q	93.7	Very high	92.4	Very high	68 Å²	68	93 Å²	93	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-64	-48.7	177.8	-179.6	57.2	20.7	0	0	112.3	E393 Q394 R395 Q399 R400 E401	E393-Q397 PolarHBondContact O-N 3.36Å; Q394-Q397 PolarHBondContact O-N 3.4Å; R395-Q397 VanDerWaalsContact C-N 3.35Å; R395-Q397 PolarHBondContact O-N 3.14Å; Q397-Q399 VanDerWaalsContact C-N 3.31Å; Q397-Q399 PolarHBondContact O-N 3.43Å; Q397-R400 PolarHBondContact O-N 2.82Å; Q397-E401 PolarHBondContact NE2-OE1 3.13Å; Q397-E401 PolarHBondContact O-N 3.44Å
398	V	92.2	Very high	92.2	Very high	41 Å²	41	92.9 Å²	92.9	25%	0.248	46%	0.464	C	S	.	.	H	α-helix	trans	-65	-35.1	-180	174.4	0	0	0	0	111.6	Q394 R395 E401 L402 F477	Q394-V398 WeakPolarHBondContact O-CG2 3.29Å; Q394-V398 PolarHBondContact O-N 2.78Å; R395-V398 PolarHBondContact O-N 3.4Å; V398-E401 PolarHBondContact O-N 3.14Å; V398-L402 PolarHBondContact O-N 2.94Å; V398-F477 HydrophobicContact CG1-CD2 3.85Å; V398-F477 HydrophobicContact CG1-CE2 3.84Å
399	Q	94.1	Very high	91.9	Very high	94 Å²	94	89.1 Å²	89.1	44%	0.439	45%	0.446	S	S	.	.	H	α-helix	trans	-62.5	-44.6	173.9	-75.5	-176.8	-40.3	0	0	112.1	R395 Q397 E401 L402 E403	R395-Q399 WeakPolarHBondContact O-CG 3.38Å; R395-Q399 PolarHBondContact O-N 2.77Å; R395-Q399 VanDerWaalsContact O-N 3.12Å; Q397-Q399 VanDerWaalsContact C-N 3.31Å; Q397-Q399 PolarHBondContact O-N 3.43Å; Q399-E401 VanDerWaalsContact C-N 3.31Å; Q399-E401 PolarHBondContact O-N 3.45Å; Q399-L402 PolarHBondContact O-N 2.78Å; Q399-E403 WeakPolarHBondContact O-CG 3.35Å; Q399-E403 PolarHBondContact O-N 2.88Å
400	R	94.3	Very high	91.7	Very high	129 Å²	129	87.4 Å²	87.4	49%	0.487	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-35.6	174.5	-68.3	-173.6	-60.4	-144.8	1.2	112.5	Q396 Q397 N404	Q396-R400 WeakPolarHBondContact O-CG 3.3Å; Q396-R400 PolarHBondContact O-N 2.98Å; Q396-R400 VanDerWaalsContact O-N 3.16Å; Q397-R400 PolarHBondContact O-N 2.82Å; R400-N404 WeakPolarHBondContact O-CB 3.24Å; R400-N404 PolarHBondContact O-N 2.77Å; R400-N404 PolarHBondContact O-ND2 3.16Å
401	E	92.7	Very high	91.5	Very high	105 Å²	105	88.7 Å²	88.7	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-67.3	-40.7	176	-73.2	174.2	-162.8	0	0	111.9	Q397 V398 Q399 N404 A405	Q397-E401 PolarHBondContact NE2-OE1 3.13Å; Q397-E401 PolarHBondContact O-N 3.44Å; V398-E401 PolarHBondContact O-N 3.14Å; Q399-E401 VanDerWaalsContact C-N 3.31Å; Q399-E401 PolarHBondContact O-N 3.45Å; E401-N404 PolarHBondContact O-N 3.23Å; E401-A405 WeakPolarHBondContact O-CB 3.37Å; E401-A405 PolarHBondContact O-N 2.89Å
402	L	93	Very high	91.2	Very high	92 Å²	92	86.7 Å²	86.7	48%	0.482	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-45.9	174	179.5	62.2	0	0	0	112.2	V398 Q399 N404 A405 F406 L475	V398-L402 PolarHBondContact O-N 2.94Å; Q399-L402 PolarHBondContact O-N 2.78Å; L402-N404 PolarHBondContact O-N 3.18Å; L402-A405 PolarHBondContact O-N 3.28Å; L402-F406 WeakPolarHBondContact O-CB 3.24Å; L402-F406 PolarHBondContact O-N 3.16Å; L402-L475 HydrophobicContact CD1-CB 4.27Å; L402-L475 HydrophobicContact CD1-CD1 4.29Å
403	E	94.1	Very high	90.8	Very high	118 Å²	118	86.3 Å²	86.3	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-59.7	-44.1	175.5	-73.7	172.9	-176	0	0	111.9	Q399 F406 N407	Q399-E403 WeakPolarHBondContact O-CG 3.35Å; Q399-E403 PolarHBondContact O-N 2.88Å; E403-F406 PolarHBondContact O-N 2.86Å; E403-N407 WeakPolarHBondContact O-CB 3.31Å; E403-N407 VanDerWaalsContact O-CG 3.31Å; E403-N407 PolarHBondContact O-N 2.88Å; E403-N407 PolarHBondContact O-ND2 3.47Å
404	N	91.8	Very high	90.6	Very high	114 Å²	114	85 Å²	85	61%	0.61	44%	0.435	S	S	*	.	H	α-helix	trans	-65.6	-40.7	177.3	-79.1	-58.6	0	0	0	112.2	R400 E401 L402 G408	R400-N404 WeakPolarHBondContact O-CB 3.24Å; R400-N404 PolarHBondContact O-N 2.77Å; R400-N404 PolarHBondContact O-ND2 3.16Å; E401-N404 PolarHBondContact O-N 3.23Å; L402-N404 PolarHBondContact O-N 3.18Å; N404-G408 PolarHBondContact O-N 2.82Å
405	A	89	Confident	90.3	Very high	41 Å²	41	84.3 Å²	84.3	34%	0.339	44%	0.435	S	S	.	.	H	α-helix	trans	-64.4	-43.1	175.9	0	0	0	0	0	112	E401 L402 K409 L475	E401-A405 WeakPolarHBondContact O-CB 3.37Å; E401-A405 PolarHBondContact O-N 2.89Å; L402-A405 PolarHBondContact O-N 3.28Å; A405-K409 WeakPolarHBondContact O-CG 3.37Å; A405-K409 PolarHBondContact O-N 3.35Å; A405-L475 HydrophobicContact CB-CD2 3.94Å
406	F	90.9	Very high	89.9	Confident	108 Å²	108	81 Å²	81	47%	0.474	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-52.9	174.2	175.6	-97.3	0	0	0	111.7	L402 E403 G408 K409 Q410 L475	L402-F406 WeakPolarHBondContact O-CB 3.24Å; L402-F406 PolarHBondContact O-N 3.16Å; E403-F406 PolarHBondContact O-N 2.86Å; F406-G408 VanDerWaalsContact C-N 3.32Å; F406-G408 PolarHBondContact O-N 2.67Å; F406-K409 PolarHBondContact O-N 3.01Å; F406-Q410 WeakPolarHBondContact O-CB 3.44Å; F406-Q410 PolarHBondContact O-N 2.83Å; F406-L475 HydrophobicContact CB-CD1 4.06Å; F406-L475 HydrophobicContact CD2-CD1 4.46Å
407	N	91	Very high	89.5	Confident	89 Å²	89	80.3 Å²	80.3	48%	0.476	43%	0.426	S	S	.	.	H	α-helix	trans	-60.3	-40.5	179.8	-75.5	-43.7	0	0	0	112.2	E403 Q410 V411	E403-N407 WeakPolarHBondContact O-CB 3.31Å; E403-N407 VanDerWaalsContact O-CG 3.31Å; E403-N407 PolarHBondContact O-N 2.88Å; E403-N407 PolarHBondContact O-ND2 3.47Å; N407-Q410 PolarHBondContact O-N 2.79Å; N407-V411 WeakPolarHBondContact O-CG2 3.3Å; N407-V411 PolarHBondContact O-N 3.12Å
408	G	86.3	Confident	89.3	Confident	45 Å²	45	85 Å²	85	46%	0.464	44%	0.441	S	S	.	.	H	α-helix	trans	-60.4	-47.8	174.9	0	0	0	0	0	112.9	N404 F406 V411 A412	N404-G408 PolarHBondContact O-N 2.82Å; F406-G408 VanDerWaalsContact C-N 3.32Å; F406-G408 PolarHBondContact O-N 2.67Å; G408-V411 PolarHBondContact O-N 2.74Å; G408-A412 PolarHBondContact O-N 3.11Å; G408-A412 VanDerWaalsContact O-N 3.12Å
409	K	85.4	Confident	89	Confident	59 Å²	59	88.4 Å²	88.4	26%	0.257	45%	0.452	S	S	.	.	H	α-helix	trans	-64.6	-42.4	176	-70.5	-171.9	-178.8	-164.5	0	111.9	A405 F406 V411 A412 L413 S472 S473 E474 L475	A405-K409 WeakPolarHBondContact O-CG 3.37Å; A405-K409 PolarHBondContact O-N 3.35Å; F406-K409 PolarHBondContact O-N 3.01Å; K409-V411 PolarHBondContact O-N 2.83Å; K409-A412 PolarHBondContact O-N 2.82Å; K409-L413 WeakPolarHBondContact O-CG 3.38Å; K409-L413 PolarHBondContact O-N 2.86Å; K409-S472 PolarHBondContact NZ-O 3.21Å; K409-S473 VanDerWaalsContact CD-O 3.3Å; K409-S473 WeakPolarHBondContact CD-O 3.49Å; K409-S473 PolarHBondContact NZ-O 3.25Å; K409-E474 PolarHBondContact NZ-O 3.32Å; K409-L475 HydrophobicContact CD-CD2 4.12Å; K409-L475 HydrophobicContact CD-CG 4.32Å
410	Q	87.9	Confident	88.8	Confident	72 Å²	72	87.2 Å²	87.2	34%	0.336	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-41	178.3	-173.5	63.1	73.5	0	0	112.3	F406 N407 L413 N414	F406-Q410 WeakPolarHBondContact O-CB 3.44Å; F406-Q410 PolarHBondContact O-N 2.83Å; N407-Q410 PolarHBondContact O-N 2.79Å; Q410-L413 PolarHBondContact O-N 2.93Å; Q410-N414 PolarHBondContact NE2-OD1 3.04Å; Q410-N414 WeakPolarHBondContact O-CB 3.43Å; Q410-N414 PolarHBondContact O-N 2.91Å; Q410-N414 PolarHBondContact O-ND2 2.89Å; Q410-N414 PolarHBondContact O-OD1 3.06Å
411	V	87.6	Confident	88.6	Confident	101 Å²	101	85 Å²	85	61%	0.612	44%	0.444	S	S	*	.	H	α-helix	trans	-65.9	-38.9	175.1	169.7	0	0	0	0	111.6	N407 G408 K409 N414 L415	N407-V411 WeakPolarHBondContact O-CG2 3.3Å; N407-V411 PolarHBondContact O-N 3.12Å; G408-V411 PolarHBondContact O-N 2.74Å; K409-V411 PolarHBondContact O-N 2.83Å; V411-N414 PolarHBondContact O-N 3.21Å; V411-L415 PolarHBondContact O-N 3.11Å; V411-L415 VanDerWaalsContact O-N 3.09Å
412	A	83.6	Confident	88.5	Confident	55 Å²	55	85 Å²	85	46%	0.455	44%	0.444	S	S	.	.	H	α-helix	trans	-63.7	-46.3	175.6	0	0	0	0	0	112.1	G408 K409 N414 L415 V416	G408-A412 PolarHBondContact O-N 3.11Å; G408-A412 VanDerWaalsContact O-N 3.12Å; K409-A412 PolarHBondContact O-N 2.82Å; A412-N414 PolarHBondContact O-N 2.9Å; A412-L415 WeakPolarHBondContact O-CB 3.42Å; A412-L415 PolarHBondContact O-N 3.07Å; A412-L415 VanDerWaalsContact O-N 3.14Å; A412-V416 PolarHBondContact O-N 2.87Å; A412-V416 VanDerWaalsContact O-N 3.17Å
413	L	85.2	Confident	88.3	Confident	65 Å²	65	82 Å²	82	34%	0.34	43%	0.429	S	S	.	.	H	α-helix	trans	-58.9	-47	175.3	-69.2	170.9	0	0	0	111.6	K409 Q410 L415 V416 D417 A470	K409-L413 WeakPolarHBondContact O-CG 3.38Å; K409-L413 PolarHBondContact O-N 2.86Å; Q410-L413 PolarHBondContact O-N 2.93Å; L413-L415 PolarHBondContact O-N 3.32Å; L413-V416 PolarHBondContact O-N 2.84Å; L413-V416 VanDerWaalsContact O-N 3.09Å; L413-D417 PolarHBondContact O-N 2.89Å; L413-A470 HydrophobicContact CD2-CB 3.7Å
414	N	87.6	Confident	88.1	Confident	73 Å²	73	82.6 Å²	82.6	39%	0.39	43%	0.434	S	S	.	.	H	α-helix	trans	-61.9	-26.1	177.5	-67.5	-7.3	0	0	0	113	Q410 V411 A412 R418	Q410-N414 PolarHBondContact NE2-OD1 3.04Å; Q410-N414 WeakPolarHBondContact O-CB 3.43Å; Q410-N414 PolarHBondContact O-N 2.91Å; Q410-N414 PolarHBondContact O-ND2 2.89Å; Q410-N414 PolarHBondContact O-OD1 3.06Å; V411-N414 PolarHBondContact O-N 3.21Å; A412-N414 PolarHBondContact O-N 2.9Å; N414-R418 VanDerWaalsContact O-CG 3.28Å; N414-R418 WeakPolarHBondContact O-CG 3.42Å; N414-R418 PolarHBondContact O-N 2.72Å
415	L	85.8	Confident	88.2	Confident	100 Å²	100	82.3 Å²	82.3	52%	0.524	43%	0.429	S	S	.	.	H	α-helix	trans	-77.4	-35.3	175.1	-168.3	72.6	0	0	0	112.2	V411 A412 L413 K419	V411-L415 PolarHBondContact O-N 3.11Å; V411-L415 VanDerWaalsContact O-N 3.09Å; A412-L415 WeakPolarHBondContact O-CB 3.42Å; A412-L415 PolarHBondContact O-N 3.07Å; A412-L415 VanDerWaalsContact O-N 3.14Å; L413-L415 PolarHBondContact O-N 3.32Å; L415-K419 WeakPolarHBondContact O-CG 3.32Å; L415-K419 PolarHBondContact O-N 2.89Å
416	V	86	Confident	88.2	Confident	46 Å²	46	85.9 Å²	85.9	28%	0.279	44%	0.437	S	S	.	.	H	α-helix	trans	-69.3	-47.6	175	176	0	0	0	0	110.3	A412 L413 R418 K419 L420	A412-V416 PolarHBondContact O-N 2.87Å; A412-V416 VanDerWaalsContact O-N 3.17Å; L413-V416 PolarHBondContact O-N 2.84Å; L413-V416 VanDerWaalsContact O-N 3.09Å; V416-R418 PolarHBondContact O-N 2.74Å; V416-K419 PolarHBondContact O-N 2.97Å; V416-K419 VanDerWaalsContact O-N 3.1Å; V416-L420 HydrophobicContact CG1-CD1 3.92Å; V416-L420 HydrophobicContact CG1-CG 4.34Å; V416-L420 WeakPolarHBondContact O-CG 3.34Å; V416-L420 PolarHBondContact O-N 3.09Å
417	D	86.9	Confident	88.2	Confident	72 Å²	72	83.3 Å²	83.3	39%	0.385	43%	0.428	S	S	.	.	H	α-helix	trans	-52.5	-53.3	175.4	171.7	54	0	0	0	112.1	L413 K419 L420 Q421	L413-D417 PolarHBondContact O-N 2.89Å; D417-K419 VanDerWaalsContact C-N 3.28Å; D417-K419 PolarHBondContact O-N 2.93Å; D417-L420 WeakPolarHBondContact O-CB 3.35Å; D417-L420 PolarHBondContact O-N 2.64Å; D417-L420 VanDerWaalsContact O-N 3.08Å; D417-Q421 WeakPolarHBondContact O-CG 3.42Å; D417-Q421 PolarHBondContact O-N 3.15Å; D417-Q421 PolarHBondContact OD1-NE2 3.06Å; D417-Q421 PolarHBondContact OD2-NE2 3.35Å
418	R	89.8	Confident	88.3	Confident	167 Å²	167	81.9 Å²	81.9	63%	0.63	43%	0.425	S	S	*	.	H	α-helix	trans	-58.4	-34.8	176.9	-74.2	174.5	177.2	-171.2	-0.4	113.7	N414 V416 Q422	N414-R418 VanDerWaalsContact O-CG 3.28Å; N414-R418 WeakPolarHBondContact O-CG 3.42Å; N414-R418 PolarHBondContact O-N 2.72Å; V416-R418 PolarHBondContact O-N 2.74Å; R418-Q422 WeakPolarHBondContact O-CB 3.5Å; R418-Q422 VanDerWaalsContact O-CG 3.28Å; R418-Q422 WeakPolarHBondContact O-CG 3.38Å; R418-Q422 PolarHBondContact O-N 3.34Å
419	K	87	Confident	88.6	Confident	111 Å²	111	85.7 Å²	85.7	48%	0.483	43%	0.43	S	S	.	.	H	α-helix	trans	-72.8	-38	175.7	-75.4	177.1	178.4	178.9	0	112.1	L415 V416 D417 T423	L415-K419 WeakPolarHBondContact O-CG 3.32Å; L415-K419 PolarHBondContact O-N 2.89Å; V416-K419 PolarHBondContact O-N 2.97Å; V416-K419 VanDerWaalsContact O-N 3.1Å; D417-K419 VanDerWaalsContact C-N 3.28Å; D417-K419 PolarHBondContact O-N 2.93Å; K419-T423 WeakPolarHBondContact O-CB 3.31Å; K419-T423 PolarHBondContact O-N 2.84Å; K419-T423 VanDerWaalsContact O-N 3.14Å; K419-T423 PolarHBondContact O-OG1 3.23Å
420	L	88.1	Confident	88.9	Confident	69 Å²	69	83.3 Å²	83.3	36%	0.361	42%	0.42	S	S	.	.	H	α-helix	trans	-62.2	-52.3	174.2	-71.9	168.3	0	0	0	110.7	V416 D417 Q422 T423 M424 Y463 P465	V416-L420 HydrophobicContact CG1-CD1 3.92Å; V416-L420 HydrophobicContact CG1-CG 4.34Å; V416-L420 WeakPolarHBondContact O-CG 3.34Å; V416-L420 PolarHBondContact O-N 3.09Å; D417-L420 WeakPolarHBondContact O-CB 3.35Å; D417-L420 PolarHBondContact O-N 2.64Å; D417-L420 VanDerWaalsContact O-N 3.08Å; L420-Q422 PolarHBondContact O-N 2.74Å; L420-T423 PolarHBondContact O-N 2.97Å; L420-M424 WeakPolarHBondContact O-CB 3.28Å; L420-M424 PolarHBondContact O-N 3.41Å; L420-Y463 HydrophobicContact CD2-CE1 4.44Å; L420-P465 HydrophobicContact CD2-CB 3.74Å; L420-P465 HydrophobicContact CD2-CG 3.77Å
421	Q	91.7	Very high	89.1	Confident	84 Å²	84	84 Å²	84	39%	0.393	43%	0.425	S	S	.	.	H	α-helix	trans	-53.6	-54.3	177.3	-69.2	170	7	0	0	111.8	D417 T423 M424 E425	D417-Q421 WeakPolarHBondContact O-CG 3.42Å; D417-Q421 PolarHBondContact O-N 3.15Å; D417-Q421 PolarHBondContact OD1-NE2 3.06Å; D417-Q421 PolarHBondContact OD2-NE2 3.35Å; Q421-T423 PolarHBondContact O-N 2.93Å; Q421-T423 VanDerWaalsContact O-N 3.14Å; Q421-M424 PolarHBondContact O-N 2.95Å; Q421-M424 VanDerWaalsContact O-N 3.16Å; Q421-E425 WeakPolarHBondContact O-CG 3.33Å; Q421-E425 PolarHBondContact O-N 3.21Å
422	Q	90.3	Very high	89.4	Confident	103 Å²	103	82.8 Å²	82.8	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-61	-25	178.4	-74.3	-178.4	16.6	0	0	114.1	R418 L420 K426	R418-Q422 WeakPolarHBondContact O-CB 3.5Å; R418-Q422 VanDerWaalsContact O-CG 3.28Å; R418-Q422 WeakPolarHBondContact O-CG 3.38Å; R418-Q422 PolarHBondContact O-N 3.34Å; L420-Q422 PolarHBondContact O-N 2.74Å; Q422-K426 WeakPolarHBondContact O-CD 3.41Å; Q422-K426 WeakPolarHBondContact O-CE 3.35Å; Q422-K426 WeakPolarHBondContact O-CG 3.21Å
423	T	88	Confident	89.9	Confident	29 Å²	29	83.9 Å²	83.9	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-84.2	-40.4	177.8	-56.1	0	0	0	0	110.6	K419 L420 Q421 K426 L427 Y463	K419-T423 WeakPolarHBondContact O-CB 3.31Å; K419-T423 PolarHBondContact O-N 2.84Å; K419-T423 VanDerWaalsContact O-N 3.14Å; K419-T423 PolarHBondContact O-OG1 3.23Å; L420-T423 PolarHBondContact O-N 2.97Å; Q421-T423 PolarHBondContact O-N 2.93Å; Q421-T423 VanDerWaalsContact O-N 3.14Å; T423-K426 PolarHBondContact O-N 2.97Å; T423-L427 WeakPolarHBondContact O-CB 3.19Å; T423-L427 PolarHBondContact O-N 2.74Å; T423-Y463 HydrophobicContact CG2-CD1 3.82Å; T423-Y463 HydrophobicContact CG2-CE1 4.17Å; T423-Y463 HydrophobicContact CG2-CG 4.28Å
424	M	90.3	Very high	90.1	Very high	131 Å²	131	82.1 Å²	82.1	65%	0.645	40%	0.402	S	S	*	.	H	α-helix	trans	-61.2	-44.7	174.4	-172.6	177.2	72	0	0	111.8	L420 Q421 K426 L427 S428	L420-M424 WeakPolarHBondContact O-CB 3.28Å; L420-M424 PolarHBondContact O-N 3.41Å; Q421-M424 PolarHBondContact O-N 2.95Å; Q421-M424 VanDerWaalsContact O-N 3.16Å; M424-K426 PolarHBondContact O-N 2.98Å; M424-L427 PolarHBondContact O-N 2.99Å; M424-S428 PolarHBondContact O-N 2.94Å
425	E	93.1	Very high	90.4	Very high	109 Å²	109	82.8 Å²	82.8	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-58.4	-47.6	173.5	-72.9	173.5	177.3	0	0	112	Q421 L427 S428 H429	Q421-E425 WeakPolarHBondContact O-CG 3.33Å; Q421-E425 PolarHBondContact O-N 3.21Å; E425-L427 VanDerWaalsContact C-N 3.29Å; E425-L427 PolarHBondContact O-N 2.72Å; E425-S428 PolarHBondContact O-N 3.17Å; E425-H429 PolarHBondContact O-N 2.83Å; E425-H429 PolarHBondContact O-ND1 3.3Å
426	K	89.3	Confident	90.7	Very high	115 Å²	115	85.1 Å²	85.1	50%	0.5	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-36.1	179.2	-71.6	164.8	-162.2	155	0	111.7	Q422 T423 M424 T430	Q422-K426 WeakPolarHBondContact O-CD 3.41Å; Q422-K426 WeakPolarHBondContact O-CE 3.35Å; Q422-K426 WeakPolarHBondContact O-CG 3.21Å; T423-K426 PolarHBondContact O-N 2.97Å; M424-K426 PolarHBondContact O-N 2.98Å; K426-T430 WeakPolarHBondContact O-CB 3.21Å; K426-T430 PolarHBondContact O-N 3.09Å; K426-T430 PolarHBondContact O-OG1 3.14Å
427	L	91.1	Very high	91	Very high	55 Å²	55	83.4 Å²	83.4	29%	0.288	40%	0.4	S	S	.	.	H	α-helix	trans	-68.5	-48.9	175	179.4	56.2	0	0	0	111.2	T423 M424 E425 H429 T430 I431 V460	T423-L427 WeakPolarHBondContact O-CB 3.19Å; T423-L427 PolarHBondContact O-N 2.74Å; M424-L427 PolarHBondContact O-N 2.99Å; E425-L427 VanDerWaalsContact C-N 3.29Å; E425-L427 PolarHBondContact O-N 2.72Å; L427-H429 PolarHBondContact O-N 2.58Å; L427-T430 CarbonylContact O-C 3.53Å; L427-T430 WeakPolarHBondContact O-CA 3.5Å; L427-T430 WeakPolarHBondContact O-CB 3.34Å; L427-T430 PolarHBondContact O-N 3.05Å; L427-I431 HydrophobicContact CD1-CD1 3.9Å; L427-I431 HydrophobicContact CD1-CG1 4.07Å; L427-I431 HydrophobicContact CG-CD1 3.84Å; L427-I431 HydrophobicContact CG-CG1 4.45Å; L427-I431 WeakPolarHBondContact O-CG1 3.43Å; L427-I431 PolarHBondContact O-N 2.76Å; L427-V460 HydrophobicContact CB-CG1 4.47Å; L427-V460 HydrophobicContact CD1-CG1 4.19Å; L427-V460 HydrophobicContact CD2-CG1 4.18Å
428	S	93.7	Very high	91.3	Very high	58 Å²	58	85.5 Å²	85.5	41%	0.406	41%	0.411	S	S	.	.	H	α-helix	trans	-55.2	-54.7	177.6	-165.3	0	0	0	0	111.2	M424 E425 T430 I431 D432	M424-S428 PolarHBondContact O-N 2.94Å; E425-S428 PolarHBondContact O-N 3.17Å; S428-T430 PolarHBondContact O-N 3.44Å; S428-T430 VanDerWaalsContact O-N 3.09Å; S428-I431 CarbonylContact O-C 3.54Å; S428-I431 WeakPolarHBondContact O-CA 3.31Å; S428-I431 WeakPolarHBondContact O-CB 3.45Å; S428-I431 PolarHBondContact O-N 3.19Å; S428-D432 VanDerWaalsContact O-CG 3.32Å; S428-D432 PolarHBondContact O-N 2.84Å; S428-D432 PolarHBondContact OG-OD2 2.79Å
429	H	92.4	Very high	91.4	Very high	125 Å²	125	84.3 Å²	84.3	58%	0.579	41%	0.41	S	S	*	.	H	α-helix	trans	-56.6	-31.7	177.6	-69.7	109.3	0	0	0	113.4	E425 L427 F433	E425-H429 PolarHBondContact O-N 2.83Å; E425-H429 PolarHBondContact O-ND1 3.3Å; L427-H429 PolarHBondContact O-N 2.58Å; H429-F433 VanDerWaalsContact O-CB 3.3Å; H429-F433 WeakPolarHBondContact O-CB 3.2Å; H429-F433 PolarHBondContact O-N 2.85Å; H429-F433 VanDerWaalsContact O-N 3.09Å
430	T	91.2	Very high	91.7	Very high	9 Å²	9	86.9 Å²	86.9	6%	0.055	42%	0.418	C	S	.	.	H	α-helix	trans	-75.8	-38.4	177.1	-57.7	0	0	0	0	111.5	K426 L427 S428 T434 L453 R456 L457	K426-T430 WeakPolarHBondContact O-CB 3.21Å; K426-T430 PolarHBondContact O-N 3.09Å; K426-T430 PolarHBondContact O-OG1 3.14Å; L427-T430 CarbonylContact O-C 3.53Å; L427-T430 WeakPolarHBondContact O-CA 3.5Å; L427-T430 WeakPolarHBondContact O-CB 3.34Å; L427-T430 PolarHBondContact O-N 3.05Å; S428-T430 PolarHBondContact O-N 3.44Å; S428-T430 VanDerWaalsContact O-N 3.09Å; T430-T434 VanDerWaalsContact O-CB 3.3Å; T430-T434 WeakPolarHBondContact O-CB 3.38Å; T430-T434 PolarHBondContact O-N 2.89Å; T430-T434 PolarHBondContact O-OG1 3.19Å; T430-L453 HydrophobicContact CG2-CD2 4.4Å; T430-R456 HydrophobicContact CG2-CB 4.36Å; T430-L457 HydrophobicContact CG2-CD2 4.06Å; T430-L457 HydrophobicContact CG2-CG 4.45Å
431	I	92.7	Very high	91.7	Very high	86 Å²	86	85.9 Å²	85.9	44%	0.441	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-52.3	171.6	-67.1	167.4	0	0	0	109.8	L427 S428 F433 T434 T435	L427-I431 HydrophobicContact CD1-CD1 3.9Å; L427-I431 HydrophobicContact CD1-CG1 4.07Å; L427-I431 HydrophobicContact CG-CD1 3.84Å; L427-I431 HydrophobicContact CG-CG1 4.45Å; L427-I431 WeakPolarHBondContact O-CG1 3.43Å; L427-I431 PolarHBondContact O-N 2.76Å; S428-I431 CarbonylContact O-C 3.54Å; S428-I431 WeakPolarHBondContact O-CA 3.31Å; S428-I431 WeakPolarHBondContact O-CB 3.45Å; S428-I431 PolarHBondContact O-N 3.19Å; I431-F433 VanDerWaalsContact C-N 3.26Å; I431-F433 PolarHBondContact O-N 2.95Å; I431-T434 PolarHBondContact O-N 3.42Å; I431-T435 WeakPolarHBondContact O-CB 3.46Å; I431-T435 PolarHBondContact O-N 3.02Å; I431-T435 PolarHBondContact O-OG1 2.81Å
432	D	93.8	Very high	91.7	Very high	77 Å²	77	85.1 Å²	85.1	41%	0.412	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-35.6	-179.4	-67.2	-47.1	0	0	0	112.6	S428 R436	S428-D432 VanDerWaalsContact O-CG 3.32Å; S428-D432 PolarHBondContact O-N 2.84Å; S428-D432 PolarHBondContact OG-OD2 2.79Å; D432-R436 WeakPolarHBondContact O-CG 3.37Å; D432-R436 PolarHBondContact O-N 2.8Å; D432-R436 PolarHBondContact O-NE 3.37Å
433	F	93.3	Very high	91.7	Very high	78 Å²	78	85 Å²	85	34%	0.342	42%	0.422	S	S	.	.	H	α-helix	trans	-69.9	-49.5	171.6	179.6	-93.3	0	0	0	111.8	H429 I431 T435 R436 L437 F449 L453	H429-F433 VanDerWaalsContact O-CB 3.3Å; H429-F433 WeakPolarHBondContact O-CB 3.2Å; H429-F433 PolarHBondContact O-N 2.85Å; H429-F433 VanDerWaalsContact O-N 3.09Å; I431-F433 VanDerWaalsContact C-N 3.26Å; I431-F433 PolarHBondContact O-N 2.95Å; F433-T435 PolarHBondContact O-N 3.43Å; F433-R436 PolarHBondContact O-N 3.01Å; F433-L437 HydrophobicContact CE1-CD2 4.3Å; F433-L437 WeakPolarHBondContact O-CB 3.36Å; F433-L437 PolarHBondContact O-N 2.92Å; F433-F449 AromaticContact CE1-CD1 3.99Å; F433-F449 HydrophobicContact CE1-CD1 3.99Å; F433-F449 HydrophobicContact CE1-CE1 4.45Å; F433-F449 HydrophobicContact CE1-CG 4.21Å; F433-F449 AromaticContact CZ-CD1 3.74Å; F433-F449 HydrophobicContact CZ-CD1 3.74Å; F433-F449 AromaticContact CZ-CE1 3.74Å; F433-F449 HydrophobicContact CZ-CE1 3.74Å; F433-F449 HydrophobicContact CZ-CG 4.19Å; F433-F449 HydrophobicContact CZ-CZ 4.18Å; F433-L453 HydrophobicContact CD1-CD2 4.06Å; F433-L453 HydrophobicContact CE1-CD2 4.29Å
434	T	90.8	Very high	91.8	Very high	28 Å²	28	88.6 Å²	88.6	17%	0.172	44%	0.444	C	S	.	.	H	α-helix	trans	-64.1	-42.1	-176.7	-54.8	0	0	0	0	112	T430 I431 R436 L437 L438 L453	T430-T434 VanDerWaalsContact O-CB 3.3Å; T430-T434 WeakPolarHBondContact O-CB 3.38Å; T430-T434 PolarHBondContact O-N 2.89Å; T430-T434 PolarHBondContact O-OG1 3.19Å; I431-T434 PolarHBondContact O-N 3.42Å; T434-R436 VanDerWaalsContact C-N 3.35Å; T434-R436 PolarHBondContact O-N 2.93Å; T434-L437 WeakPolarHBondContact O-CB 3.41Å; T434-L437 PolarHBondContact O-N 2.96Å; T434-L438 HydrophobicContact CG2-CD1 3.88Å; T434-L438 HydrophobicContact CG2-CG 4.3Å; T434-L438 WeakPolarHBondContact O-CB 3.42Å; T434-L438 WeakPolarHBondContact O-CG 3.34Å; T434-L438 PolarHBondContact O-N 3.34Å; T434-L453 HydrophobicContact CG2-CD1 4.15Å; T434-L453 WeakPolarHBondContact OG1-CD2 3.34Å
435	T	93.2	Very high	91.9	Very high	86 Å²	86	86.3 Å²	86.3	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-65.7	-35.2	176.7	-63.3	0	0	0	0	112	I431 F433 K439	I431-T435 WeakPolarHBondContact O-CB 3.46Å; I431-T435 PolarHBondContact O-N 3.02Å; I431-T435 PolarHBondContact O-OG1 2.81Å; F433-T435 PolarHBondContact O-N 3.43Å; T435-K439 VanDerWaalsContact O-CB 3.26Å; T435-K439 WeakPolarHBondContact O-CB 3.37Å; T435-K439 PolarHBondContact O-N 3.04Å
436	R	92.8	Very high	91.8	Very high	149 Å²	149	82.6 Å²	82.6	56%	0.562	42%	0.416	S	S	*	.	H	α-helix	trans	-69.5	-42.1	172.2	-78.1	179.3	-70.4	171	-3	112	D432 F433 T434 K439 Y440	D432-R436 WeakPolarHBondContact O-CG 3.37Å; D432-R436 PolarHBondContact O-N 2.8Å; D432-R436 PolarHBondContact O-NE 3.37Å; F433-R436 PolarHBondContact O-N 3.01Å; T434-R436 VanDerWaalsContact C-N 3.35Å; T434-R436 PolarHBondContact O-N 2.93Å; R436-K439 PolarHBondContact O-N 3.4Å; R436-Y440 VanDerWaalsContact O-CD2 3.3Å; R436-Y440 WeakPolarHBondContact O-CD2 3.35Å; R436-Y440 PolarHBondContact O-N 3.24Å
437	L	92.3	Very high	91.9	Very high	11 Å²	11	82.3 Å²	82.3	6%	0.058	42%	0.42	C	S	.	.	H	α-helix	trans	-58.6	-55.6	176.9	-174.6	72.8	0	0	0	110.9	F433 T434 K439 Y440 T441 T446 F449 L453	F433-L437 HydrophobicContact CE1-CD2 4.3Å; F433-L437 WeakPolarHBondContact O-CB 3.36Å; F433-L437 PolarHBondContact O-N 2.92Å; T434-L437 WeakPolarHBondContact O-CB 3.41Å; T434-L437 PolarHBondContact O-N 2.96Å; L437-K439 PolarHBondContact O-N 2.66Å; L437-Y440 PolarHBondContact O-N 2.94Å; L437-T441 HydrophobicContact CD1-CG2 3.83Å; L437-T441 WeakPolarHBondContact CD1-OG1 3.29Å; L437-T441 PolarHBondContact O-N 2.8Å; L437-T441 VanDerWaalsContact O-N 3.07Å; L437-T441 PolarHBondContact O-OG1 2.95Å; L437-T446 HydrophobicContact CD2-CG2 4.26Å; L437-F449 HydrophobicContact CD1-CD2 3.54Å; L437-F449 HydrophobicContact CD1-CE2 3.79Å; L437-F449 HydrophobicContact CD1-CG 4.39Å; L437-F449 HydrophobicContact CD2-CB 3.82Å; L437-F449 HydrophobicContact CD2-CD2 3.91Å; L437-F449 HydrophobicContact CD2-CG 4.09Å; L437-F449 HydrophobicContact CG-CD2 4.4Å; L437-L453 HydrophobicContact CD2-CD1 3.96Å
438	L	91.5	Very high	91.9	Very high	116 Å²	116	86.5 Å²	86.5	61%	0.607	44%	0.442	S	S	*	.	H	α-helix	trans	-63.5	-21.8	-178.6	-68.5	173.9	0	0	0	114.1	T434 T446	T434-L438 HydrophobicContact CG2-CD1 3.88Å; T434-L438 HydrophobicContact CG2-CG 4.3Å; T434-L438 WeakPolarHBondContact O-CB 3.42Å; T434-L438 WeakPolarHBondContact O-CG 3.34Å; T434-L438 PolarHBondContact O-N 3.34Å; L438-T446 HydrophobicContact CD2-CG2 3.95Å
439	K	93.2	Very high	91.8	Very high	142 Å²	142	87.3 Å²	87.3	62%	0.617	44%	0.438	S	S	*	.	H	α-helix	trans	-87.6	-28.7	-180	-171.9	178.4	176.1	-160.1	0	113.7	T435 R436 L437	T435-K439 VanDerWaalsContact O-CB 3.26Å; T435-K439 WeakPolarHBondContact O-CB 3.37Å; T435-K439 PolarHBondContact O-N 3.04Å; R436-K439 PolarHBondContact O-N 3.4Å; L437-K439 PolarHBondContact O-N 2.66Å
440	Y	92.2	Very high	91.8	Very high	164 Å²	164	86.3 Å²	86.3	64%	0.643	43%	0.432	S	S	*	.	H	α-helix	trans	-126.6	-1.6	-166.6	-58.2	-58.1	0	0	0	115.4	R436 L437	R436-Y440 VanDerWaalsContact O-CD2 3.3Å; R436-Y440 WeakPolarHBondContact O-CD2 3.35Å; R436-Y440 PolarHBondContact O-N 3.24Å; L437-Y440 PolarHBondContact O-N 2.94Å
441	T	89.6	Confident	91.8	Very high	49 Å²	49	93.4 Å²	93.4	30%	0.301	46%	0.462	S	S	.	.	S	Bend	trans	-118.2	153.5	-179.2	67	0	0	0	0	112.8	L437 E445 T446	L437-T441 HydrophobicContact CD1-CG2 3.83Å; L437-T441 WeakPolarHBondContact CD1-OG1 3.29Å; L437-T441 PolarHBondContact O-N 2.8Å; L437-T441 VanDerWaalsContact O-N 3.07Å; L437-T441 PolarHBondContact O-OG1 2.95Å; T441-E445 VanDerWaalsContact CA-OE2 3.29Å; T441-E445 WeakPolarHBondContact CA-OE2 3.16Å; T441-E445 VanDerWaalsContact CB-OE2 3.27Å; T441-E445 WeakPolarHBondContact CB-OE2 3.48Å; T441-E445 HydrophobicContact CG2-CB 4.33Å; T441-T446 PolarHBondContact OG1-OG1 3.33Å
442	N	90.3	Very high	91.8	Very high	67 Å²	67	93.7 Å²	93.7	36%	0.358	46%	0.464	S	S	.	.			trans	-76.3	166.5	175.3	73.4	57.7	0	0	0	111.4	T444 E445 T446	N442-T444 VanDerWaalsContact C-N 3.26Å; N442-T444 PolarHBondContact O-N 2.68Å; N442-T444 WeakPolarHBondContact OD1-CA 3.35Å; N442-T444 VanDerWaalsContact OD1-CB 3.28Å; N442-T444 WeakPolarHBondContact OD1-CB 3.23Å; N442-T444 PolarHBondContact OD1-N 3.4Å; N442-E445 PolarHBondContact N-OE2 3.33Å; N442-E445 PolarHBondContact ND2-OE1 2.84Å; N442-E445 PolarHBondContact ND2-OE2 2.89Å; N442-E445 VanDerWaalsContact ND2-OE2 3.15Å; N442-E445 PolarHBondContact O-N 2.55Å; N442-E445 PolarHBondContact OD1-N 2.97Å; N442-E445 VanDerWaalsContact OD1-N 3.07Å; N442-T446 PolarHBondContact O-N 2.76Å; N442-T446 PolarHBondContact O-OG1 3.3Å
443	P	91.9	Very high	91.7	Very high	102 Å²	102	91 Å²	91	66%	0.662	45%	0.449	S	S	*	.	H	α-helix	trans	-57.5	-34.9	-176.9	-28.1	36.7	0	0	0	114.4	L447	P443-L447 WeakPolarHBondContact O-CB 3.49Å; P443-L447 WeakPolarHBondContact O-CD1 3.39Å; P443-L447 WeakPolarHBondContact O-CG 3.48Å; P443-L447 PolarHBondContact O-N 3.01Å
444	T	89.5	Confident	91.5	Very high	103 Å²	103	91.7 Å²	91.7	63%	0.632	45%	0.454	S	S	*	.	H	α-helix	trans	-67.8	-45.9	178.5	-49.5	0	0	0	0	111.1	N442 L447 L448	N442-T444 VanDerWaalsContact C-N 3.26Å; N442-T444 PolarHBondContact O-N 2.68Å; N442-T444 WeakPolarHBondContact OD1-CA 3.35Å; N442-T444 VanDerWaalsContact OD1-CB 3.28Å; N442-T444 WeakPolarHBondContact OD1-CB 3.23Å; N442-T444 PolarHBondContact OD1-N 3.4Å; T444-L447 PolarHBondContact O-N 3.26Å; T444-L448 PolarHBondContact O-N 3.29Å
445	E	92.2	Very high	91.5	Very high	83 Å²	83	95 Å²	95	39%	0.388	47%	0.47	S	S	.	.	H	α-helix	trans	-62.3	-43.2	175.5	-72.2	162	178.7	0	0	111.8	T441 N442 L447 L448 F449	T441-E445 VanDerWaalsContact CA-OE2 3.29Å; T441-E445 WeakPolarHBondContact CA-OE2 3.16Å; T441-E445 VanDerWaalsContact CB-OE2 3.27Å; T441-E445 WeakPolarHBondContact CB-OE2 3.48Å; T441-E445 HydrophobicContact CG2-CB 4.33Å; N442-E445 PolarHBondContact N-OE2 3.33Å; N442-E445 PolarHBondContact ND2-OE1 2.84Å; N442-E445 PolarHBondContact ND2-OE2 2.89Å; N442-E445 VanDerWaalsContact ND2-OE2 3.15Å; N442-E445 PolarHBondContact O-N 2.55Å; N442-E445 PolarHBondContact OD1-N 2.97Å; N442-E445 VanDerWaalsContact OD1-N 3.07Å; E445-L447 VanDerWaalsContact C-N 3.33Å; E445-L447 PolarHBondContact O-N 2.86Å; E445-L448 WeakPolarHBondContact O-CB 3.49Å; E445-L448 PolarHBondContact O-N 3.14Å; E445-F449 WeakPolarHBondContact O-CD2 3.48Å
446	T	90.4	Very high	91.2	Very high	31 Å²	31	97.3 Å²	97.3	19%	0.19	47%	0.47	C	S	.	.	H	α-helix	trans	-59.5	-43.4	174.3	-68	0	0	0	0	111.4	L437 L438 T441 N442 L448 F449	L437-T446 HydrophobicContact CD2-CG2 4.26Å; L438-T446 HydrophobicContact CD2-CG2 3.95Å; T441-T446 PolarHBondContact OG1-OG1 3.33Å; N442-T446 PolarHBondContact O-N 2.76Å; N442-T446 PolarHBondContact O-OG1 3.3Å; T446-L448 VanDerWaalsContact C-N 3.28Å; T446-L448 PolarHBondContact O-N 2.89Å; T446-F449 PolarHBondContact O-N 3.3Å; T446-F449 VanDerWaalsContact O-N 3.15Å
447	L	91	Very high	91.1	Very high	110 Å²	110	92.5 Å²	92.5	58%	0.576	46%	0.455	S	S	*	.	H	α-helix	trans	-66	-25.2	-177.3	-77.9	168.4	0	0	0	113.8	P443 T444 E445 F449 K450	P443-L447 WeakPolarHBondContact O-CB 3.49Å; P443-L447 WeakPolarHBondContact O-CD1 3.39Å; P443-L447 WeakPolarHBondContact O-CG 3.48Å; P443-L447 PolarHBondContact O-N 3.01Å; T444-L447 PolarHBondContact O-N 3.26Å; E445-L447 VanDerWaalsContact C-N 3.33Å; E445-L447 PolarHBondContact O-N 2.86Å; L447-F449 PolarHBondContact O-N 2.86Å; L447-K450 HydrophobicContact CD2-CB 4.41Å; L447-K450 HydrophobicContact CD2-CD 3.99Å; L447-K450 VanDerWaalsContact O-CB 3.25Å; L447-K450 WeakPolarHBondContact O-CB 3.45Å; L447-K450 PolarHBondContact O-N 2.9Å; L447-K450 VanDerWaalsContact O-N 3.15Å
448	L	91.5	Very high	91	Very high	142 Å²	142	96.3 Å²	96.3	74%	0.743	48%	0.478	S	S	*	.	H	α-helix	trans	-58.8	-33.9	173.1	-66	173.7	0	0	0	112.3	T444 E445 T446	T444-L448 PolarHBondContact O-N 3.29Å; E445-L448 WeakPolarHBondContact O-CB 3.49Å; E445-L448 PolarHBondContact O-N 3.14Å; T446-L448 VanDerWaalsContact C-N 3.28Å; T446-L448 PolarHBondContact O-N 2.89Å
449	F	92.3	Very high	90.6	Very high	75 Å²	75	94.9 Å²	94.9	33%	0.329	48%	0.477	S	S	.	.	H	α-helix	trans	-88.9	-10.6	179.5	-64.1	-82.3	0	0	0	113.8	F433 L437 E445 T446 L447 K451 L452 L453	F433-F449 AromaticContact CE1-CD1 3.99Å; F433-F449 HydrophobicContact CE1-CD1 3.99Å; F433-F449 HydrophobicContact CE1-CE1 4.45Å; F433-F449 HydrophobicContact CE1-CG 4.21Å; F433-F449 AromaticContact CZ-CD1 3.74Å; F433-F449 HydrophobicContact CZ-CD1 3.74Å; F433-F449 AromaticContact CZ-CE1 3.74Å; F433-F449 HydrophobicContact CZ-CE1 3.74Å; F433-F449 HydrophobicContact CZ-CG 4.19Å; F433-F449 HydrophobicContact CZ-CZ 4.18Å; L437-F449 HydrophobicContact CD1-CD2 3.54Å; L437-F449 HydrophobicContact CD1-CE2 3.79Å; L437-F449 HydrophobicContact CD1-CG 4.39Å; L437-F449 HydrophobicContact CD2-CB 3.82Å; L437-F449 HydrophobicContact CD2-CD2 3.91Å; L437-F449 HydrophobicContact CD2-CG 4.09Å; L437-F449 HydrophobicContact CG-CD2 4.4Å; E445-F449 WeakPolarHBondContact O-CD2 3.48Å; T446-F449 PolarHBondContact O-N 3.3Å; T446-F449 VanDerWaalsContact O-N 3.15Å; L447-F449 PolarHBondContact O-N 2.86Å; F449-K451 PolarHBondContact O-N 2.89Å; F449-L452 WeakPolarHBondContact O-CB 3.28Å; F449-L452 PolarHBondContact O-N 3.48Å; F449-L453 HydrophobicContact CB-CD1 4.26Å; F449-L453 HydrophobicContact CB-CG 4.35Å; F449-L453 PolarHBondContact O-N 2.85Å
450	K	91.8	Very high	90.2	Very high	105 Å²	105	89.7 Å²	89.7	46%	0.457	46%	0.458	S	S	.	.	H	α-helix	trans	-45.6	-57.9	-172.5	-179.6	-173.7	165.3	179.4	0	112.4	L447 L452 L453 E454	L447-K450 HydrophobicContact CD2-CB 4.41Å; L447-K450 HydrophobicContact CD2-CD 3.99Å; L447-K450 VanDerWaalsContact O-CB 3.25Å; L447-K450 WeakPolarHBondContact O-CB 3.45Å; L447-K450 PolarHBondContact O-N 2.9Å; L447-K450 VanDerWaalsContact O-N 3.15Å; K450-L452 VanDerWaalsContact C-N 3.27Å; K450-L452 PolarHBondContact O-N 3.42Å; K450-L453 PolarHBondContact O-N 2.85Å; K450-L453 VanDerWaalsContact O-N 3.16Å; K450-E454 WeakPolarHBondContact CE-OE1 3.4Å; K450-E454 VanDerWaalsContact CE-OE2 3.24Å; K450-E454 WeakPolarHBondContact CE-OE2 3.4Å; K450-E454 HydrophobicContact CG-CG 4.31Å; K450-E454 IonicContact NZ-OE1 3.28Å; K450-E454 PolarHBondContact NZ-OE1 2.84Å; K450-E454 WeakPolarHBondContact O-CG 3.32Å; K450-E454 PolarHBondContact O-N 3.13Å
451	K	91.7	Very high	89.9	Confident	157 Å²	157	89.1 Å²	89.1	68%	0.683	46%	0.458	S	S	*	.	H	α-helix	trans	-62.6	-31.2	-176.8	-172.9	175.2	-178.6	178	0	113.3	F449 N455	F449-K451 PolarHBondContact O-N 2.89Å; K451-N455 WeakPolarHBondContact O-CB 3.36Å; K451-N455 PolarHBondContact O-N 3.02Å; K451-N455 VanDerWaalsContact O-N 3.17Å; K451-N455 PolarHBondContact O-OD1 3.15Å
452	L	91.9	Very high	89.7	Confident	92 Å²	92	90.9 Å²	90.9	48%	0.482	47%	0.473	S	S	.	.	H	α-helix	trans	-74.7	-38.5	177.6	-176.1	64.1	0	0	0	111.4	F449 K450 R456	F449-L452 WeakPolarHBondContact O-CB 3.28Å; F449-L452 PolarHBondContact O-N 3.48Å; K450-L452 VanDerWaalsContact C-N 3.27Å; K450-L452 PolarHBondContact O-N 3.42Å; L452-R456 WeakPolarHBondContact O-CB 3.23Å; L452-R456 WeakPolarHBondContact O-CG 3.33Å; L452-R456 PolarHBondContact O-N 2.73Å; L452-R456 VanDerWaalsContact O-N 3.08Å
453	L	91.9	Very high	89.5	Confident	21 Å²	21	91.5 Å²	91.5	11%	0.11	47%	0.471	C	S	.	.	H	α-helix	trans	-70.2	-46	175.6	-65.1	179.2	0	0	0	111.6	T430 F433 T434 L437 F449 K450 N455 R456 L457	T430-L453 HydrophobicContact CG2-CD2 4.4Å; F433-L453 HydrophobicContact CD1-CD2 4.06Å; F433-L453 HydrophobicContact CE1-CD2 4.29Å; T434-L453 HydrophobicContact CG2-CD1 4.15Å; T434-L453 WeakPolarHBondContact OG1-CD2 3.34Å; L437-L453 HydrophobicContact CD2-CD1 3.96Å; F449-L453 HydrophobicContact CB-CD1 4.26Å; F449-L453 HydrophobicContact CB-CG 4.35Å; F449-L453 PolarHBondContact O-N 2.85Å; K450-L453 PolarHBondContact O-N 2.85Å; K450-L453 VanDerWaalsContact O-N 3.16Å; L453-N455 VanDerWaalsContact C-N 3.34Å; L453-N455 PolarHBondContact O-N 2.97Å; L453-R456 PolarHBondContact O-N 3.42Å; L453-L457 WeakPolarHBondContact O-CB 3.47Å; L453-L457 VanDerWaalsContact O-CG 3.31Å; L453-L457 WeakPolarHBondContact O-CG 3.45Å; L453-L457 PolarHBondContact O-N 3.48Å
454	E	90.7	Very high	88.9	Confident	92 Å²	92	93.2 Å²	93.2	43%	0.43	47%	0.474	S	S	.	.	H	α-helix	trans	-54.6	-49.2	174.1	-74.7	175.2	142.1	0	0	111.1	K450 R456 T458	K450-E454 WeakPolarHBondContact CE-OE1 3.4Å; K450-E454 VanDerWaalsContact CE-OE2 3.24Å; K450-E454 WeakPolarHBondContact CE-OE2 3.4Å; K450-E454 HydrophobicContact CG-CG 4.31Å; K450-E454 IonicContact NZ-OE1 3.28Å; K450-E454 PolarHBondContact NZ-OE1 2.84Å; K450-E454 WeakPolarHBondContact O-CG 3.32Å; K450-E454 PolarHBondContact O-N 3.13Å; E454-R456 PolarHBondContact O-N 2.8Å; E454-T458 VanDerWaalsContact O-CB 3.24Å; E454-T458 WeakPolarHBondContact O-CB 3.42Å; E454-T458 PolarHBondContact O-N 3.25Å; E454-T458 PolarHBondContact O-OG1 3.09Å
455	N	89.4	Confident	88.2	Confident	98 Å²	98	90.5 Å²	90.5	52%	0.524	46%	0.459	S	S	.	.	H	α-helix	trans	-60.7	-46	176.9	-75.6	0.2	0	0	0	112.5	K451 L453 C459	K451-N455 WeakPolarHBondContact O-CB 3.36Å; K451-N455 PolarHBondContact O-N 3.02Å; K451-N455 VanDerWaalsContact O-N 3.17Å; K451-N455 PolarHBondContact O-OD1 3.15Å; L453-N455 VanDerWaalsContact C-N 3.34Å; L453-N455 PolarHBondContact O-N 2.97Å; N455-C459 PolarHBondContact O-N 3.11Å; N455-C459 PolarHBondContact O-SG 3.31Å; N455-C459 VanDerWaalsContact O-SG 3.33Å
456	R	88.1	Confident	87	Confident	135 Å²	135	91.5 Å²	91.5	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-46.2	-179.5	-80	-177.7	171.5	-128.1	0	112.5	T430 L452 L453 E454 C459 V460	T430-R456 HydrophobicContact CG2-CB 4.36Å; L452-R456 WeakPolarHBondContact O-CB 3.23Å; L452-R456 WeakPolarHBondContact O-CG 3.33Å; L452-R456 PolarHBondContact O-N 2.73Å; L452-R456 VanDerWaalsContact O-N 3.08Å; L453-R456 PolarHBondContact O-N 3.42Å; E454-R456 PolarHBondContact O-N 2.8Å; R456-C459 PolarHBondContact O-N 3.34Å; R456-V460 PolarHBondContact O-N 3.06Å
457	L	89.4	Confident	86.1	Confident	48 Å²	48	93.9 Å²	93.9	25%	0.251	48%	0.481	S	S	.	.	H	α-helix	trans	-68.2	-40.5	-178.8	-68	171.6	0	0	0	111.2	T430 L453 C459 V460 F461	T430-L457 HydrophobicContact CG2-CD2 4.06Å; T430-L457 HydrophobicContact CG2-CG 4.45Å; L453-L457 WeakPolarHBondContact O-CB 3.47Å; L453-L457 VanDerWaalsContact O-CG 3.31Å; L453-L457 WeakPolarHBondContact O-CG 3.45Å; L453-L457 PolarHBondContact O-N 3.48Å; L457-C459 VanDerWaalsContact C-N 3.32Å; L457-C459 PolarHBondContact O-N 3.35Å; L457-V460 PolarHBondContact O-N 3.41Å; L457-V460 VanDerWaalsContact O-N 3.09Å; L457-F461 HydrophobicContact CB-CD2 4.29Å; L457-F461 HydrophobicContact CB-CE2 3.8Å; L457-F461 HydrophobicContact CB-CZ 4.27Å; L457-F461 HydrophobicContact CD2-CZ 4.48Å; L457-F461 VanDerWaalsContact O-CD2 3.23Å; L457-F461 WeakPolarHBondContact O-CD2 3.43Å; L457-F461 VanDerWaalsContact O-CG 3.28Å; L457-F461 WeakPolarHBondContact O-CG 3.45Å; L457-F461 PolarHBondContact O-N 3.37Å
458	T	89.7	Confident	84.9	Confident	90 Å²	90	94.8 Å²	94.8	55%	0.552	49%	0.486	S	S	*	.	H	α-helix	trans	-57.4	-44.4	175.1	-57.5	0	0	0	0	111.6	E454 V460 F461 S462	E454-T458 VanDerWaalsContact O-CB 3.24Å; E454-T458 WeakPolarHBondContact O-CB 3.42Å; E454-T458 PolarHBondContact O-N 3.25Å; E454-T458 PolarHBondContact O-OG1 3.09Å; T458-V460 VanDerWaalsContact C-N 3.32Å; T458-V460 PolarHBondContact O-N 2.97Å; T458-F461 PolarHBondContact O-N 3.07Å; T458-S462 WeakPolarHBondContact O-CB 3.37Å; T458-S462 PolarHBondContact O-N 3.22Å; T458-S462 PolarHBondContact O-OG 3Å
459	C	84.9	Confident	83.4	Confident	87 Å²	87	91 Å²	91	59%	0.588	48%	0.476	S	S	*	.	H	α-helix	trans	-61.1	-37.9	176	-70.3	0	0	0	0	112.9	N455 R456 L457 S462 Y463	N455-C459 PolarHBondContact O-N 3.11Å; N455-C459 PolarHBondContact O-SG 3.31Å; N455-C459 VanDerWaalsContact O-SG 3.33Å; R456-C459 PolarHBondContact O-N 3.34Å; L457-C459 VanDerWaalsContact C-N 3.32Å; L457-C459 PolarHBondContact O-N 3.35Å; C459-S462 PolarHBondContact O-OG 2.75Å; C459-Y463 PolarHBondContact O-N 3.26Å
460	V	84.6	Confident	81.7	Confident	33 Å²	33	88.7 Å²	88.7	20%	0.2	47%	0.471	C	S	.	.	H	α-helix	trans	-73.5	-41.4	176.6	-179.6	0	0	0	0	111.5	L427 R456 L457 T458 S462 Y463	L427-V460 HydrophobicContact CB-CG1 4.47Å; L427-V460 HydrophobicContact CD1-CG1 4.19Å; L427-V460 HydrophobicContact CD2-CG1 4.18Å; R456-V460 PolarHBondContact O-N 3.06Å; L457-V460 PolarHBondContact O-N 3.41Å; L457-V460 VanDerWaalsContact O-N 3.09Å; T458-V460 VanDerWaalsContact C-N 3.32Å; T458-V460 PolarHBondContact O-N 2.97Å; V460-S462 PolarHBondContact O-N 2.97Å; V460-Y463 WeakPolarHBondContact O-CB 3.31Å; V460-Y463 PolarHBondContact O-N 2.84Å
461	F	86.1	Confident	80.1	Confident	151 Å²	151	88.5 Å²	88.5	66%	0.662	48%	0.482	S	S	*	.	H	α-helix	trans	-65.9	-25.5	176.2	-60.6	-37	0	0	0	113.1	L457 T458 Y463	L457-F461 HydrophobicContact CB-CD2 4.29Å; L457-F461 HydrophobicContact CB-CE2 3.8Å; L457-F461 HydrophobicContact CB-CZ 4.27Å; L457-F461 HydrophobicContact CD2-CZ 4.48Å; L457-F461 VanDerWaalsContact O-CD2 3.23Å; L457-F461 WeakPolarHBondContact O-CD2 3.43Å; L457-F461 VanDerWaalsContact O-CG 3.28Å; L457-F461 WeakPolarHBondContact O-CG 3.45Å; L457-F461 PolarHBondContact O-N 3.37Å; T458-F461 PolarHBondContact O-N 3.07Å; F461-Y463 VanDerWaalsContact C-N 3.34Å
462	S	84.3	Confident	78.6	Confident	87 Å²	87	85 Å²	85	61%	0.608	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.5	170.9	69.5	0	0	0	0	114.2	T458 C459 V460 N464	T458-S462 WeakPolarHBondContact O-CB 3.37Å; T458-S462 PolarHBondContact O-N 3.22Å; T458-S462 PolarHBondContact O-OG 3Å; C459-S462 PolarHBondContact O-OG 2.75Å; V460-S462 PolarHBondContact O-N 2.97Å; S462-N464 PolarHBondContact O-N 2.8Å
463	Y	85.6	Confident	77.3	Confident	79 Å²	79	82.7 Å²	82.7	31%	0.31	47%	0.469	S	S	.	.			trans	-82.9	97.7	-178.1	-177.8	-97.5	0	0	0	111.3	L420 T423 C459 V460 F461 P465	L420-Y463 HydrophobicContact CD2-CE1 4.44Å; T423-Y463 HydrophobicContact CG2-CD1 3.82Å; T423-Y463 HydrophobicContact CG2-CE1 4.17Å; T423-Y463 HydrophobicContact CG2-CG 4.28Å; C459-Y463 PolarHBondContact O-N 3.26Å; V460-Y463 WeakPolarHBondContact O-CB 3.31Å; V460-Y463 PolarHBondContact O-N 2.84Å; F461-Y463 VanDerWaalsContact C-N 3.34Å; Y463-P465 HydrophobicContact CE1-CB 3.9Å; Y463-P465 HydrophobicContact CE1-CG 4.18Å
464	N	80.4	Confident	76.6	Confident	138 Å²	138	90 Å²	90	74%	0.738	50%	0.503	S	S	*	.			trans	-98.2	114.8	164.3	-78	-88.6	0	0	0	109.1	S462	S462-N464 PolarHBondContact O-N 2.8Å
465	P	73.7	Confident	76.3	Confident	46 Å²	46	88.9 Å²	88.9	30%	0.299	50%	0.5	S	S	.	.			trans	-71.8	129.4	171.6	29.5	-32.3	0	0	0	109.8	L420 Y463 V467	L420-P465 HydrophobicContact CD2-CB 3.74Å; L420-P465 HydrophobicContact CD2-CG 3.77Å; Y463-P465 HydrophobicContact CE1-CB 3.9Å; Y463-P465 HydrophobicContact CE1-CG 4.18Å; P465-V467 VanDerWaalsContact C-N 3.3Å; P465-V467 HydrophobicContact CB-CG2 4.19Å; P465-V467 HydrophobicContact CG-CG2 4.18Å; P465-V467 PolarHBondContact O-N 3.25Å
466	D	68.6	Low	76.3	Confident	105 Å²	105	92.1 Å²	92.1	56%	0.561	51%	0.512	S	S	*	.			trans	-76.4	84.6	172.3	-171.1	-3.7	0	0	0	110.4	N468 A469	D466-N468 VanDerWaalsContact C-N 3.32Å; D466-N468 PolarHBondContact OD1-N 2.88Å; D466-N468 VanDerWaalsContact OD1-N 3.14Å; D466-A469 HydrophobicContact CB-CB 4.43Å; D466-A469 PolarHBondContact OD1-N 2.77Å
467	V	71.2	Confident	76.4	Confident	81 Å²	81	92.3 Å²	92.3	49%	0.491	52%	0.516	S	S	.	.			trans	-79.9	-18.1	173.4	-174.1	0	0	0	0	111	P465 A469 A470 S471	P465-V467 VanDerWaalsContact C-N 3.3Å; P465-V467 HydrophobicContact CB-CG2 4.19Å; P465-V467 HydrophobicContact CG-CG2 4.18Å; P465-V467 PolarHBondContact O-N 3.25Å; V467-A469 VanDerWaalsContact C-N 3.34Å; V467-A470 WeakPolarHBondContact O-CA 3.49Å; V467-A470 WeakPolarHBondContact O-CB 3.32Å; V467-A470 PolarHBondContact O-N 3.23Å; V467-S471 PolarHBondContact O-N 2.69Å
468	N	65.5	Low	76.5	Confident	128 Å²	128	95 Å²	95	68%	0.684	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-72.5	-30.2	177.8	-67.5	-10.4	0	0	0	111.2	D466 A470 S471	D466-N468 VanDerWaalsContact C-N 3.32Å; D466-N468 PolarHBondContact OD1-N 2.88Å; D466-N468 VanDerWaalsContact OD1-N 3.14Å; N468-A470 PolarHBondContact O-N 3.34Å; N468-A470 VanDerWaalsContact O-N 3.14Å; N468-S471 PolarHBondContact O-N 3.29Å; N468-S471 PolarHBondContact O-OG 2.84Å
469	A	58.7	Low	76.5	Confident	63 Å²	63	94.3 Å²	94.3	52%	0.521	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-58.3	-19.9	165.9	0	0	0	0	0	113.7	D466 V467 S472	D466-A469 HydrophobicContact CB-CB 4.43Å; D466-A469 PolarHBondContact OD1-N 2.77Å; V467-A469 VanDerWaalsContact C-N 3.34Å; A469-S472 PolarHBondContact O-OG 3.15Å
470	A	57.8	Low	76.8	Confident	27 Å²	27	95 Å²	95	22%	0.223	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-93.6	-8	174.4	0	0	0	0	0	114	L413 V467 N468 S472 S473	L413-A470 HydrophobicContact CD2-CB 3.7Å; V467-A470 WeakPolarHBondContact O-CA 3.49Å; V467-A470 WeakPolarHBondContact O-CB 3.32Å; V467-A470 PolarHBondContact O-N 3.23Å; N468-A470 PolarHBondContact O-N 3.34Å; N468-A470 VanDerWaalsContact O-N 3.14Å; A470-S472 VanDerWaalsContact C-N 3.29Å; A470-S472 PolarHBondContact O-N 3.1Å; A470-S473 WeakPolarHBondContact O-CB 3.35Å; A470-S473 PolarHBondContact O-OG 3.15Å
471	S	57.3	Low	77	Confident	100 Å²	100	99.1 Å²	99.1	70%	0.699	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.9	177.1	72.4	0	0	0	0	113.2	V467 N468 S473	V467-S471 PolarHBondContact O-N 2.69Å; N468-S471 PolarHBondContact O-N 3.29Å; N468-S471 PolarHBondContact O-OG 2.84Å; S471-S473 PolarHBondContact O-N 3.46Å
472	S	60.8	Low	77	Confident	83 Å²	83	96.6 Å²	96.6	58%	0.58	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	23.1	174.4	60.9	0	0	0	0	113.4	K409 A469 A470 E474	K409-S472 PolarHBondContact NZ-O 3.21Å; A469-S472 PolarHBondContact O-OG 3.15Å; A470-S472 VanDerWaalsContact C-N 3.29Å; A470-S472 PolarHBondContact O-N 3.1Å; S472-E474 VanDerWaalsContact C-N 3.34Å; S472-E474 PolarHBondContact O-N 3.47Å
473	S	63.9	Low	77	Confident	45 Å²	45	94.7 Å²	94.7	32%	0.315	54%	0.537	S	S	.	.			trans	-75.2	-11.5	-170.5	-78.6	0	0	0	0	116.1	K409 A470 S471	K409-S473 VanDerWaalsContact CD-O 3.3Å; K409-S473 WeakPolarHBondContact CD-O 3.49Å; K409-S473 PolarHBondContact NZ-O 3.25Å; A470-S473 WeakPolarHBondContact O-CB 3.35Å; A470-S473 PolarHBondContact O-OG 3.15Å; S471-S473 PolarHBondContact O-N 3.46Å
474	E	78	Confident	76.9	Confident	173 Å²	173	94.1 Å²	94.1	81%	0.808	55%	0.545	S	S	*	.			trans	-57.4	147.9	-179.2	-169.3	159.2	-139.8	0	0	114.1	K409 S472	K409-E474 PolarHBondContact NZ-O 3.32Å; S472-E474 VanDerWaalsContact C-N 3.34Å; S472-E474 PolarHBondContact O-N 3.47Å
475	L	83.6	Confident	77.1	Confident	70 Å²	70	96 Å²	96	37%	0.366	54%	0.542	S	S	.	.			trans	-136	120.4	179	-68.2	173.2	0	0	0	108.5	L402 A405 F406 K409	L402-L475 HydrophobicContact CD1-CB 4.27Å; L402-L475 HydrophobicContact CD1-CD1 4.29Å; A405-L475 HydrophobicContact CB-CD2 3.94Å; F406-L475 HydrophobicContact CB-CD1 4.06Å; F406-L475 HydrophobicContact CD2-CD1 4.46Å; K409-L475 HydrophobicContact CD-CD2 4.12Å; K409-L475 HydrophobicContact CD-CG 4.32Å
476	E	89.3	Confident	77.5	Confident	166 Å²	166	98.8 Å²	98.8	78%	0.776	55%	0.553	S	S	*	*			trans	-128.3	145.8	-178.2	-172.4	-176.1	-166.6	0	0	110.2	V478	E476-V478 HydrophobicContact CG-CG2 3.9Å
477	F	91.6	Very high	78.1	Confident	138 Å²	138	96.1 Å²	96.1	61%	0.605	55%	0.546	S	S	*	.			trans	-110.7	115.8	168	170.8	-107.2	0	0	0	109.8	V398 P479	V398-F477 HydrophobicContact CG1-CD2 3.85Å; V398-F477 HydrophobicContact CG1-CE2 3.84Å; F477-P479 HydrophobicContact CE1-CB 3.87Å; F477-P479 HydrophobicContact CE1-CG 4.4Å; F477-P479 HydrophobicContact CZ-CB 4.18Å; F477-P479 WeakPolarHBondContact O-CD 3.49Å
478	V	91.1	Very high	78.9	Confident	106 Å²	106	96 Å²	96	64%	0.642	54%	0.542	S	S	*	.			trans	-106.8	104	-175.6	-176.6	0	0	0	0	110.4	E476	E476-V478 HydrophobicContact CG-CG2 3.9Å
479	P	89.7	Confident	79.8	Confident	74 Å²	74	96 Å²	96	48%	0.481	54%	0.539	S	S	.	.			trans	-84.5	126.4	-174.3	31.6	-34.9	0	0	0	113.5	F477 I481	F477-P479 HydrophobicContact CE1-CB 3.87Å; F477-P479 HydrophobicContact CE1-CG 4.4Å; F477-P479 HydrophobicContact CZ-CB 4.18Å; F477-P479 WeakPolarHBondContact O-CD 3.49Å; P479-I481 HydrophobicContact CB-CG1 4.21Å; P479-I481 PolarHBondContact O-N 2.83Å
480	N	90.4	Very high	80.8	Confident	103 Å²	103	98.7 Å²	98.7	55%	0.551	55%	0.545	S	S	*	.			trans	-91.9	61.7	176.2	-165.8	-10.8	0	0	0	112.9	P482 A483 S484	N480-P482 VanDerWaalsContact C-CD 3.43Å; N480-A483 HydrophobicContact CB-CB 4.41Å; N480-A483 VanDerWaalsContact CG-CB 3.46Å; N480-A483 WeakPolarHBondContact ND2-CB 3.33Å; N480-A483 PolarHBondContact O-N 3.03Å; N480-A483 VanDerWaalsContact OD1-CB 3.3Å; N480-A483 WeakPolarHBondContact OD1-CB 3.41Å; N480-A483 PolarHBondContact OD1-N 2.9Å; N480-S484 PolarHBondContact O-N 3.42Å; N480-S484 PolarHBondContact O-OG 2.86Å
481	I	88.4	Confident	82	Confident	119 Å²	119	102 Å²	102	61%	0.61	56%	0.563	S	S	*	*	H	α-helix	trans	-52.4	-42.3	-178	-55.8	175.9	0	0	0	113.3	P479 A483 S484 R485	P479-I481 HydrophobicContact CB-CG1 4.21Å; P479-I481 PolarHBondContact O-N 2.83Å; I481-A483 PolarHBondContact O-N 2.61Å; I481-S484 PolarHBondContact O-N 2.87Å; I481-R485 WeakPolarHBondContact O-CB 3.31Å; I481-R485 PolarHBondContact O-N 2.97Å
482	P	87.7	Confident	83.4	Confident	98 Å²	98	101.1 Å²	101.1	64%	0.636	55%	0.547	S	S	*	.	H	α-helix	trans	-62.1	-43.3	179.4	-23.8	35.5	0	0	0	113.1	N480 L486	N480-P482 VanDerWaalsContact C-CD 3.43Å; P482-L486 WeakPolarHBondContact O-CB 3.46Å; P482-L486 PolarHBondContact O-N 2.73Å
483	A	83.3	Confident	84.4	Confident	47 Å²	47	99.6 Å²	99.6	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-68.2	-42.3	177.1	0	0	0	0	0	111.6	N480 I481 R485 L486 A487	N480-A483 HydrophobicContact CB-CB 4.41Å; N480-A483 VanDerWaalsContact CG-CB 3.46Å; N480-A483 WeakPolarHBondContact ND2-CB 3.33Å; N480-A483 PolarHBondContact O-N 3.03Å; N480-A483 VanDerWaalsContact OD1-CB 3.3Å; N480-A483 WeakPolarHBondContact OD1-CB 3.41Å; N480-A483 PolarHBondContact OD1-N 2.9Å; I481-A483 PolarHBondContact O-N 2.61Å; A483-R485 VanDerWaalsContact C-N 3.35Å; A483-R485 PolarHBondContact O-N 2.92Å; A483-L486 PolarHBondContact O-N 2.92Å; A483-A487 WeakPolarHBondContact O-CB 3.49Å; A483-A487 PolarHBondContact O-N 2.79Å
484	S	83.5	Confident	85.5	Confident	67 Å²	67	105 Å²	105	47%	0.469	56%	0.558	S	S	.	*	H	α-helix	trans	-59.8	-42.9	175.9	-59.1	0	0	0	0	112.2	N480 I481 A487 I488	N480-S484 PolarHBondContact O-N 3.42Å; N480-S484 PolarHBondContact O-OG 2.86Å; I481-S484 PolarHBondContact O-N 2.87Å; S484-A487 PolarHBondContact O-N 2.83Å; S484-I488 VanDerWaalsContact O-CG1 3.31Å; S484-I488 WeakPolarHBondContact O-CG1 3.47Å; S484-I488 PolarHBondContact O-N 2.87Å
485	R	85	Confident	85.9	Confident	177 Å²	177	101.8 Å²	101.8	67%	0.668	55%	0.55	S	S	*	*	H	α-helix	trans	-63.9	-45.7	176.4	-177.8	176.7	179.7	165.3	3.2	111.9	I481 A483 A487 I488 M489	I481-R485 WeakPolarHBondContact O-CB 3.31Å; I481-R485 PolarHBondContact O-N 2.97Å; A483-R485 VanDerWaalsContact C-N 3.35Å; A483-R485 PolarHBondContact O-N 2.92Å; R485-A487 VanDerWaalsContact C-N 3.34Å; R485-I488 PolarHBondContact O-N 2.88Å; R485-M489 HydrophobicContact CG-CG 4.49Å; R485-M489 HydrophobicContact CG-SD 3.98Å; R485-M489 WeakPolarHBondContact O-CB 3.28Å; R485-M489 WeakPolarHBondContact O-CG 3.45Å; R485-M489 PolarHBondContact O-N 3.08Å
486	L	81.4	Confident	85.7	Confident	104 Å²	104	107.9 Å²	107.9	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-65.4	-38.7	178.6	-177.8	60.2	0	0	0	111.7	P482 A483 N490	P482-L486 WeakPolarHBondContact O-CB 3.46Å; P482-L486 PolarHBondContact O-N 2.73Å; A483-L486 PolarHBondContact O-N 2.92Å; L486-N490 WeakPolarHBondContact O-CB 3.43Å; L486-N490 PolarHBondContact O-N 3.42Å; L486-N490 PolarHBondContact O-ND2 2.9Å
487	A	82.3	Confident	85	Confident	50 Å²	50	108.6 Å²	108.6	41%	0.413	57%	0.572	S	S	.	*	H	α-helix	trans	-59.5	-55.2	173.8	0	0	0	0	0	110.9	A483 S484 R485 M489 N490 T491	A483-A487 WeakPolarHBondContact O-CB 3.49Å; A483-A487 PolarHBondContact O-N 2.79Å; S484-A487 PolarHBondContact O-N 2.83Å; R485-A487 VanDerWaalsContact C-N 3.34Å; A487-M489 PolarHBondContact O-N 2.86Å; A487-N490 CarbonylContact O-C 3.59Å; A487-N490 PolarHBondContact O-N 3.22Å; A487-T491 WeakPolarHBondContact O-CG2 3.49Å; A487-T491 PolarHBondContact O-N 3.48Å; A487-T491 PolarHBondContact O-OG1 2.89Å
488	I	87.2	Confident	83.6	Confident	79 Å²	79	108 Å²	108	41%	0.405	58%	0.583	S	S	.	*	H	α-helix	trans	-57	-46.7	179	-67	164	0	0	0	111.1	S484 R485 N490 T491 F492	S484-I488 VanDerWaalsContact O-CG1 3.31Å; S484-I488 WeakPolarHBondContact O-CG1 3.47Å; S484-I488 PolarHBondContact O-N 2.87Å; R485-I488 PolarHBondContact O-N 2.88Å; I488-N490 PolarHBondContact O-N 3.5Å; I488-T491 PolarHBondContact O-N 2.8Å; I488-F492 WeakPolarHBondContact O-CB 3.24Å; I488-F492 PolarHBondContact O-N 3.37Å
489	M	83.8	Confident	81.5	Confident	126 Å²	126	107.4 Å²	107.4	62%	0.621	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-28.1	178.9	-73.1	-179.4	62.5	0	0	113.3	R485 A487	R485-M489 HydrophobicContact CG-CG 4.49Å; R485-M489 HydrophobicContact CG-SD 3.98Å; R485-M489 WeakPolarHBondContact O-CB 3.28Å; R485-M489 WeakPolarHBondContact O-CG 3.45Å; R485-M489 PolarHBondContact O-N 3.08Å; A487-M489 PolarHBondContact O-N 2.86Å
490	N	81.3	Confident	79.2	Confident	121 Å²	121	110.9 Å²	110.9	65%	0.647	60%	0.604	S	S	*	*	H	α-helix	trans	-88.4	-19.7	177.4	-68.6	-17.3	0	0	0	113.6	L486 A487 I488	L486-N490 WeakPolarHBondContact O-CB 3.43Å; L486-N490 PolarHBondContact O-N 3.42Å; L486-N490 PolarHBondContact O-ND2 2.9Å; A487-N490 CarbonylContact O-C 3.59Å; A487-N490 PolarHBondContact O-N 3.22Å; I488-N490 PolarHBondContact O-N 3.5Å
491	T	82.6	Confident	76.8	Confident	97 Å²	97	113.1 Å²	113.1	60%	0.595	61%	0.614	S	S	*	*	H	α-helix	trans	-106.8	-18.3	-177	59.4	0	0	0	0	115.1	A487 I488 G493	A487-T491 WeakPolarHBondContact O-CG2 3.49Å; A487-T491 PolarHBondContact O-N 3.48Å; A487-T491 PolarHBondContact O-OG1 2.89Å; I488-T491 PolarHBondContact O-N 2.8Å; T491-G493 PolarHBondContact O-N 2.98Å
492	F	85.7	Confident	74.1	Confident	81 Å²	81	113.5 Å²	113.5	36%	0.355	63%	0.625	S	S	.	*	S	Bend	trans	-62.8	-22.5	-179.1	-165	-82.8	0	0	0	113.8	I380 A384 L387 I488	I380-F492 HydrophobicContact CG2-CE1 4.38Å; A384-F492 HydrophobicContact CB-CE2 4.06Å; A384-F492 HydrophobicContact CB-CZ 4.07Å; L387-F492 HydrophobicContact CD1-CB 4.48Å; L387-F492 HydrophobicContact CD1-CD2 3.47Å; L387-F492 VanDerWaalsContact CD1-CD2 3.47Å; L387-F492 HydrophobicContact CD1-CE2 4.07Å; L387-F492 HydrophobicContact CD1-CG 4.34Å; I488-F492 WeakPolarHBondContact O-CB 3.24Å; I488-F492 PolarHBondContact O-N 3.37Å
493	G	83.2	Confident	71.6	Confident	51 Å²	51	115.9 Å²	115.9	53%	0.526	63%	0.631	S	S	.	*			trans	90.3	-175.6	-178.7	0	0	0	0	0	113.9	T491	T491-G493 PolarHBondContact O-N 2.98Å
494	Y	87.4	Confident	69.3	Low	158 Å²	158	122 Å²	122	62%	0.62	66%	0.656	S	S	*	*			trans	-158	149.8	-175.1	61.6	-81.3	0	0	0	111.7	R496	Y494-R496 HydrophobicContact CD2-CG 4.04Å; Y494-R496 HydrophobicContact CE2-CG 3.55Å; Y494-R496 PolarHBondContact O-N 2.73Å; Y494-R496 PolarHBondContact OH-NE 3.28Å; Y494-R496 VanDerWaalsContact OH-NE 3.15Å; Y494-R496 PolarHBondContact OH-NH2 2.81Å
495	V	85.8	Confident	66.8	Low	105 Å²	105	122.4 Å²	122.4	64%	0.636	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-71.2	125	175.2	-179.1	0	0	0	0	109.7	I380	I380-V495 HydrophobicContact CD1-CG2 4.28Å
496	R	79.2	Confident	64.4	Low	198 Å²	198	123.4 Å²	123.4	75%	0.747	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-95.4	120.9	171	-71.6	-179.9	179	177.6	-0.5	110.1	Y494	Y494-R496 HydrophobicContact CD2-CG 4.04Å; Y494-R496 HydrophobicContact CE2-CG 3.55Å; Y494-R496 PolarHBondContact O-N 2.73Å; Y494-R496 PolarHBondContact OH-NE 3.28Å; Y494-R496 VanDerWaalsContact OH-NE 3.15Å; Y494-R496 PolarHBondContact OH-NH2 2.81Å
497	Q	75.4	Confident	61.9	Low	182 Å²	182	123.9 Å²	123.9	85%	0.85	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-89.3	138.7	164.9	-68.4	170.8	-15.5	0	0	108.6
498	C	60.3	Low	59.7	Low	125 Å²	125	128.1 Å²	128.1	85%	0.845	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-75.2	148.5	167.3	-158.9	0	0	0	0	108.6	D500	C498-D500 PolarHBondContact O-N 3.07Å
499	A	48.9	Very low	57.1	Low	94 Å²	94	132.8 Å²	132.8	78%	0.777	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.5	136.7	-177.8	0	0	0	0	0	111.3
500	D	39.5	Very low	54.4	Low	146 Å²	146	130.7 Å²	130.7	78%	0.781	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57.7	143	-171	-64.3	-68.5	0	0	0	113.3	C498 P502	C498-D500 PolarHBondContact O-N 3.07Å; D500-P502 WeakPolarHBondContact O-CD 3.42Å
501	I	40.7	Very low	52	Low	150 Å²	150	130.7 Å²	130.7	77%	0.769	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61	121.5	158.2	-59.1	171.7	0	0	0	105.9	L503	I501-L503 HydrophobicContact CG2-CB 4.43Å; I501-L503 PolarHBondContact O-N 3.3Å
502	P	31	Very low	49.5	Very low	127 Å²	127	133.2 Å²	133.2	83%	0.825	76%	0.756	S	S	*	*	S	Bend	trans	-77.1	69.2	-169.3	31	-36.6	0	0	0	111.9	D500	D500-P502 WeakPolarHBondContact O-CD 3.42Å
503	L	37.1	Very low	46.9	Very low	148 Å²	148	135 Å²	135	78%	0.775	78%	0.779	S	S	*	*	S	Bend	trans	-138.7	23.9	-175.6	-147.6	81.6	0	0	0	114.6	I501	I501-L503 HydrophobicContact CG2-CB 4.43Å; I501-L503 PolarHBondContact O-N 3.3Å
504	L	33.7	Very low	44.4	Very low	175 Å²	175	143 Å²	143	92%	0.916	79%	0.794	S	S	*	*	S	Bend	trans	-162.2	120.6	147.6	-131.2	75.9	0	0	0	109.6
505	G	30.7	Very low	41.6	Very low	77 Å²	77	140.9 Å²	140.9	79%	0.794	80%	0.799	S	S	*	*			trans	-91.7	115.2	-173.4	0	0	0	0	0	114.1
506	K	34.5	Very low	38.9	Very low	197 Å²	197	141.4 Å²	141.4	86%	0.857	80%	0.803	S	S	*	*			trans	-168.7	96.4	147.2	-108.8	161.9	-171.6	177.6	0	113.9
507	S	29.7	Very low	36.5	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	81%	0.806	S	S	*	*			trans	11.2	109.2	150.2	58.9	0	0	0	0	119.7
508	T	36.4	Very low	34.4	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	80%	0.797	S	S	*	*			trans	-125.2	152.6	141.4	48.2	0	0	0	0	109.1
509	L	32	Very low	33	Very low	177 Å²	177	132.9 Å²	132.9	93%	0.927	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-75.6	142.6	-170.3	-71.6	163.5	0	0	0	112.1
510	A	28	Very low	32.2	Very low	82 Å²	82	132.9 Å²	132.9	68%	0.678	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-64	141	175.1	0	0	0	0	0	111.6	I512	A510-I512 PolarHBondContact O-N 2.69Å
511	P	31.1	Very low	31.9	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.7	125.1	174.9	27.1	-33.4	0	0	0	110.5	S513	P511-S513 PolarHBondContact O-N 2.82Å
512	I	29.6	Very low	31.3	Very low	151 Å²	151	128.1 Å²	128.1	77%	0.774	79%	0.791	S	S	*	*			trans	-77.5	111.8	-175	-63.7	164.4	0	0	0	110.2	A510 R514	A510-I512 PolarHBondContact O-N 2.69Å; I512-R514 HydrophobicContact CG2-CB 4.1Å
513	S	29.9	Very low	31.4	Very low	119 Å²	119	130.6 Å²	130.6	83%	0.832	79%	0.791	S	S	*	*			trans	-110.3	60.4	163	50	0	0	0	0	110.7	P511	P511-S513 PolarHBondContact O-N 2.82Å
514	R	32.3	Very low	31	Very low	219 Å²	219	129.7 Å²	129.7	83%	0.826	78%	0.783	S	S	*	*			trans	-136.2	159.6	171.6	-86.5	-172.8	175.8	-173.8	-0.1	109.3	I512	I512-R514 HydrophobicContact CG2-CB 4.1Å
515	P	29	Very low	30.8	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	78%	0.776	S	S	*	*			cis	-117.7	169.3	1.6	39.4	-28.2	0	0	0	114.1
516	T	27.8	Very low	30.7	Very low	117 Å²	117	133.1 Å²	133.1	72%	0.718	78%	0.779	S	S	*	*			trans	-45.8	138.6	152.7	-29.8	0	0	0	0	110.5	S518	T516-S518 PolarHBondContact O-N 2.73Å
517	V	29.5	Very low	30.6	Very low	137 Å²	137	132.6 Å²	132.6	83%	0.83	78%	0.779	S	S	*	*			trans	-76.6	74.5	170.1	-175.1	0	0	0	0	109.2	A519	V517-A519 HydrophobicContact CG1-CB 4.21Å; V517-A519 PolarHBondContact O-N 2.84Å
518	S	30.4	Very low	30.7	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	78%	0.775	S	S	*	*			trans	-77.8	68.3	169.1	-63.5	0	0	0	0	109.6	T516 S520	T516-S518 PolarHBondContact O-N 2.73Å; S518-S520 PolarHBondContact O-N 3.11Å
519	A	30.7	Very low	30.5	Very low	95 Å²	95	131 Å²	131	79%	0.785	77%	0.771	S	S	*	*			trans	-73	92	173.6	0	0	0	0	0	109.7	V517	V517-A519 HydrophobicContact CG1-CB 4.21Å; V517-A519 PolarHBondContact O-N 2.84Å
520	S	33.4	Very low	30.6	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	77%	0.768	S	S	*	*			trans	-130.8	138.4	175.5	58.5	0	0	0	0	111.3	S518	S518-S520 PolarHBondContact O-N 3.11Å
521	S	32.7	Very low	31	Very low	130 Å²	130	127.4 Å²	127.4	91%	0.909	77%	0.767	S	S	*	*			trans	60.2	124.4	-171.6	71	0	0	0	0	115.3
522	G	29	Very low	31.2	Very low	66 Å²	66	128.6 Å²	128.6	68%	0.68	77%	0.767	S	S	*	*			cis	172.8	-177.6	-3.8	0	0	0	0	0	111.1
523	Q	31.3	Very low	31.4	Very low	178 Å²	178	128.7 Å²	128.7	83%	0.832	77%	0.768	S	S	*	*			trans	73.1	138.8	-173.5	-50.2	-175	2.7	0	0	113.1
524	Q	30.4	Very low	31.6	Very low	129 Å²	129	128.3 Å²	128.3	60%	0.603	76%	0.763	S	S	*	*			cis	-156	159.1	4.8	-134.8	165.5	16.9	0	0	112.7
525	Y	28.7	Very low	31.7	Very low	195 Å²	195	125.5 Å²	125.5	77%	0.765	76%	0.763	S	S	*	*			trans	64.9	93.2	168.3	-54.7	-65.5	0	0	0	119.5
526	C	28	Very low	32	Very low	129 Å²	129	124.9 Å²	124.9	87%	0.872	76%	0.761	S	S	*	*			trans	-124.9	167.1	142.7	-110.6	0	0	0	0	109.8
527	H	33	Very low	32.4	Very low	186 Å²	186	126.8 Å²	126.8	86%	0.861	77%	0.766	S	S	*	*			trans	-61.1	158.7	-159.2	-81.6	-100.1	0	0	0	117.5
528	P	31.1	Very low	32.7	Very low	108 Å²	108	125.8 Å²	125.8	70%	0.701	77%	0.765	S	S	*	*			trans	-90.6	145.6	-172.1	35.2	-35.2	0	0	0	114.6
529	S	33.1	Very low	33	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	77%	0.768	S	S	*	*				167.9	135.1	118.9	-74.6	0	0	0	0	112.6
530	A	34.6	Very low	33.3	Very low	104 Å²	104	128.4 Å²	128.4	86%	0.86	77%	0.769	S	S	*	*			trans	46.1	136.6	154.1	0	0	0	0	0	121.2
531	A	36.1	Very low	33.5	Very low	80 Å²	80	129.5 Å²	129.5	66%	0.661	77%	0.772	S	S	*	*			cis	-167.6	156.8	-10.9	0	0	0	0	0	110.1
532	N	33.8	Very low	33.6	Very low	146 Å²	146	130.6 Å²	130.6	78%	0.781	76%	0.764	S	S	*	*			trans	61.9	142.5	156.9	-61.4	-8.9	0	0	0	118.8
533	L	33.8	Very low	33.8	Very low	152 Å²	152	132.3 Å²	132.3	80%	0.796	77%	0.766	S	S	*	*			cis	-156.9	148.2	-7	-107.1	164.4	0	0	0	108.4
534	P	34.9	Very low	33.9	Very low	112 Å²	112	130.2 Å²	130.2	73%	0.727	77%	0.765	S	S	*	*			trans	-118.6	171.8	-173.6	42.2	-33	0	0	0	115.7
535	I	35.4	Very low	33.9	Very low	160 Å²	160	132 Å²	132	82%	0.821	78%	0.778	S	S	*	*			trans	-163.5	113.5	156.8	-96	141.6	0	0	0	106.6
536	S	35.2	Very low	34.1	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	78%	0.781	S	S	*	*				67.6	137.7	91.9	119.9	0	0	0	0	114.5
537	L	36	Very low	34.3	Very low	158 Å²	158	126.9 Å²	126.9	83%	0.827	78%	0.775	S	S	*	*			cis	-152.3	160.6	39.4	-165.8	61.1	0	0	0	115.4
538	S	35.6	Very low	34.4	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	77%	0.77	S	S	*	*			trans	-47.3	169.4	-179.6	-43.9	0	0	0	0	119.6
539	G	36.3	Very low	34.6	Very low	70 Å²	70	128 Å²	128	72%	0.722	77%	0.77	S	S	*	*			cis	-153.2	-137.8	5.1	0	0	0	0	0	110.5
540	H	37.8	Very low	34.6	Very low	175 Å²	175	131.2 Å²	131.2	81%	0.81	78%	0.775	S	S	*	*			cis	-172.3	170.4	-11.6	-141	17.5	0	0	0	106
541	V	36.4	Very low	34.4	Very low	117 Å²	117	129.9 Å²	129.9	71%	0.709	77%	0.772	S	S	*	*			cis	-148.7	-170.4	20.5	-171.8	0	0	0	0	109.6
542	M	35.3	Very low	34.2	Very low	152 Å²	152	132.4 Å²	132.4	75%	0.749	79%	0.785	S	S	*	*			trans	-45.6	151.7	178.3	-55.9	-42.7	158.4	0	0	119.4
543	S	32.3	Very low	34.1	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	79%	0.786	S	S	*	*			cis	99.7	138.4	36.4	-156.8	0	0	0	0	112.8
544	V	34.3	Very low	34	Very low	135 Å²	135	127.3 Å²	127.3	82%	0.818	79%	0.785	S	S	*	*				-163.2	162.6	74.2	165.1	0	0	0	0	113.1
545	N	30.6	Very low	33.9	Very low	165 Å²	165	126.7 Å²	126.7	88%	0.882	78%	0.784	S	S	*	*			trans	-89	168.7	-173	-79.8	-16.7	0	0	0	118.4
546	G	33.4	Very low	33.9	Very low	79 Å²	79	124.1 Å²	124.1	81%	0.814	78%	0.78	S	S	*	*			trans	-157.9	142	154.2	0	0	0	0	0	111.8
547	N	31.2	Very low	33.9	Very low	139 Å²	139	126.8 Å²	126.8	74%	0.743	79%	0.786	S	S	*	*			trans	-159.8	146.9	-165.1	-172	30.2	0	0	0	114.5
548	H	36.1	Very low	34.2	Very low	163 Å²	163	125.2 Å²	125.2	76%	0.755	79%	0.786	S	S	*	*			trans	173.1	132.9	157.4	-88.2	-61.5	0	0	0	107.7
549	Q	35.2	Very low	34	Very low	153 Å²	153	123.7 Å²	123.7	72%	0.715	79%	0.788	S	S	*	*				64.9	142.6	55.5	-67.6	-165.4	-17.5	0	0	114.8
550	M	31.8	Very low	33.8	Very low	180 Å²	180	123.8 Å²	123.8	89%	0.887	79%	0.789	S	S	*	*			cis	-170.4	158	-13.6	-109.7	-69.7	-149.5	0	0	107.3
551	G	31.6	Very low	33.7	Very low	76 Å²	76	123.2 Å²	123.2	78%	0.784	79%	0.791	S	S	*	*			trans	159.1	141.1	165.3	0	0	0	0	0	117.1
552	S	30.6	Very low	33.6	Very low	134 Å²	134	124.9 Å²	124.9	94%	0.937	80%	0.795	S	S	*	*			trans	-142.4	157.7	179.9	54.5	0	0	0	0	112.3
553	G	32.2	Very low	33.7	Very low	78 Å²	78	123.2 Å²	123.2	80%	0.804	80%	0.795	S	S	*	*			trans	-174.1	159.8	-179.9	0	0	0	0	0	111.9
554	S	32.6	Very low	33.8	Very low	112 Å²	112	123.7 Å²	123.7	78%	0.783	80%	0.798	S	S	*	*			trans	-144.3	168.1	-157.9	62.8	0	0	0	0	117.1
555	S	32.1	Very low	34.2	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	80%	0.796	S	S	*	*			trans	74	115.4	141.9	52.2	0	0	0	0	122.9
556	S	36.3	Very low	34.8	Very low	107 Å²	107	119.2 Å²	119.2	75%	0.748	78%	0.781	S	S	*	*				115.6	130.2	116.3	73.1	0	0	0	0	123.1
557	N	34.6	Very low	34.9	Very low	153 Å²	153	123.7 Å²	123.7	82%	0.818	78%	0.781	S	S	*	*			trans	86.9	152.6	135.4	-77.3	7.9	0	0	0	124.6
558	P	41.4	Very low	35	Very low	126 Å²	126	121.9 Å²	121.9	82%	0.818	78%	0.775	S	S	*	*			trans	-142.5	-169.5	-142.1	45.3	-25.7	0	0	0	117.4
559	G	32.7	Very low	34.9	Very low	82 Å²	82	123.5 Å²	123.5	85%	0.845	78%	0.78	S	S	*	*			trans	144.9	147.8	146.8	0	0	0	0	0	118.6
560	G	32.4	Very low	34.7	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	78%	0.778	S	S	*	*			trans	143.7	96.8	156.9	0	0	0	0	0	120.8
561	L	34.5	Very low	34.8	Very low	162 Å²	162	117.2 Å²	117.2	85%	0.848	77%	0.77	S	S	*	*			trans	47.7	127.2	139.1	-52.9	165.2	0	0	0	121.2
562	I	34.5	Very low	34.8	Very low	152 Å²	152	117.6 Å²	117.6	78%	0.779	76%	0.761	S	S	*	*			cis	79.6	135.6	45.7	-64.1	174.2	0	0	0	112.9
563	P	37.9	Very low	34.8	Very low	118 Å²	118	117.8 Å²	117.8	77%	0.766	75%	0.751	S	S	*	*			cis	-136.1	-176.6	21.8	31.7	-7.3	0	0	0	119.4
564	S	33.4	Very low	34.8	Very low	111 Å²	111	120.7 Å²	120.7	78%	0.776	75%	0.748	S	S	*	*			trans	-105.9	-148.1	173.7	-35.1	0	0	0	0	111.3
565	P	44.2	Very low	34.6	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	75%	0.749	S	S	*	*			cis	-122.2	-123.7	-15.3	31.4	-5.5	0	0	0	110.1
566	P	43.4	Very low	34.5	Very low	89 Å²	89	126.8 Å²	126.8	58%	0.578	76%	0.757	S	S	*	*			cis	-135.4	-171.4	-30.8	27.3	-1.9	0	0	0	116.3
567	H	34.7	Very low	34	Very low	172 Å²	172	126.7 Å²	126.7	80%	0.796	76%	0.757	S	S	*	*			trans	76.4	145.2	159.7	-64.1	-54	0	0	0	119.7
568	V	34.2	Very low	33.7	Very low	102 Å²	102	128 Å²	128	62%	0.618	76%	0.755	S	S	*	*			cis	-159.7	135.3	2.1	112.5	0	0	0	0	113
569	F	32.3	Very low	33	Very low	196 Å²	196	129.1 Å²	129.1	86%	0.86	75%	0.749	S	S	*	*			trans	56.3	166.7	162	-66.9	-125	0	0	0	116.5
570	G	31.7	Very low	32.7	Very low	66 Å²	66	136.3 Å²	136.3	68%	0.68	75%	0.752	S	S	*	*			cis	165.2	152.7	-4.5	0	0	0	0	0	108.1
571	D	34.2	Very low	32.5	Very low	136 Å²	136	136.6 Å²	136.6	73%	0.727	76%	0.755	S	S	*	*			cis	-162.9	154.5	1.3	-129.2	-98.7	0	0	0	112.8
572	S	31.1	Very low	32.1	Very low	84 Å²	84	136.6 Å²	136.6	59%	0.587	76%	0.756	S	S	*	*			trans	25.8	136.9	142.4	-50	0	0	0	0	122.5
573	N	31.8	Very low	31.7	Very low	137 Å²	137	135.3 Å²	135.3	73%	0.733	76%	0.761	S	S	*	*				-167	153.3	54.3	-90.2	-70.9	0	0	0	116.1
574	L	31.7	Very low	31.3	Very low	140 Å²	140	134.7 Å²	134.7	73%	0.733	76%	0.759	S	S	*	*			trans	31.3	123.5	141.1	-57.6	162.2	0	0	0	120.8
575	L	27.6	Very low	31.1	Very low	155 Å²	155	137.4 Å²	137.4	81%	0.812	76%	0.76	S	S	*	*				65	100.7	64.7	-77.8	160.6	0	0	0	117.1
576	Q	29.8	Very low	30.5	Very low	183 Å²	183	137 Å²	137	86%	0.855	76%	0.76	S	S	*	*				-177	123.1	113.7	-100.6	176	4.8	0	0	116.5
577	S	26.9	Very low	29.9	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	77%	0.773	S	S	*	*				50.5	126.5	129.1	-58	0	0	0	0	124.7
578	K	27.3	Very low	29.6	Very low	180 Å²	180	135.8 Å²	135.8	78%	0.783	77%	0.77	S	S	*	*			trans	93.1	121.5	139.9	-78.6	-179.9	167.5	-167.8	0	122.5
579	Q	27.4	Very low	29.7	Very low	149 Å²	149	136.4 Å²	136.4	70%	0.696	78%	0.776	S	S	*	*			trans	78.4	121.5	137.5	-67.6	176.4	-101.4	0	0	121.2
580	Y	26	Very low	29.7	Very low	233 Å²	233	137.5 Å²	137.5	91%	0.914	78%	0.781	S	S	*	*			trans	43.4	118.7	145.6	-77.1	-90.3	0	0	0	120.9
581	G	27.7	Very low	29.4	Very low	79 Å²	79	139.4 Å²	139.4	81%	0.814	78%	0.784	S	S	*	*			trans	169.2	133.2	158.1	0	0	0	0	0	112.7
582	D	25.4	Very low	29.1	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	79%	0.79	S	S	*	*			trans	-77.5	147.7	170.1	-65.6	-76.8	0	0	0	111.4
583	S	27.7	Very low	28.9	Very low	125 Å²	125	144.1 Å²	144.1	87%	0.874	80%	0.801	S	S	*	*				163.1	157.3	126.7	-74.4	0	0	0	0	112.7
584	S	28.9	Very low	28.6	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	80%	0.802	S	S	*	*			trans	-88	153.6	-179.8	50.9	0	0	0	0	113.3
585	Q	28.5	Very low	28.3	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	81%	0.81	S	S	*	*				163	176.4	117.7	-86.1	-146.6	45.7	0	0	113.4
586	S	32.2	Very low	28.2	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	81%	0.808	S	S	*	*			trans	84.4	143.1	-178.1	76.3	0	0	0	0	116.4
587	L	30.7	Very low	28	Very low	166 Å²	166	134.8 Å²	134.8	87%	0.869	80%	0.803	S	S	*	*			cis	157.8	131	-34.1	-95.7	166.8	0	0	0	106.3
588	G	29.1	Very low	27.9	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	81%	0.808	S	S	*	*			trans	-167	121.8	177	0	0	0	0	0	109.5
589	P	35.4	Very low	27.9	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	81%	0.805	S	S	*	*			trans	-115.4	153.7	-158.1	39.9	-32.5	0	0	0	115.4
590	F	32.3	Very low	27.8	Very low	219 Å²	219	132.3 Å²	132.3	96%	0.961	81%	0.805	S	S	*	*			trans	-149.5	163.3	143.9	-87.6	-62	0	0	0	110.3
591	S	26	Very low	28.2	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	77%	0.773	S	S	*	*			trans	-137.3	141	-158.1	55.7	0	0	0	0	113.5
592	N	28.3	Very low	28.3	Very low	159 Å²	159	127.6 Å²	127.6	85%	0.85	77%	0.768	S	S	*	*			trans	-154.7	159.9	140.6	-129.2	-21.2	0	0	0	115.2
593	I	25.6	Very low	28.7	Very low	160 Å²	160	127.3 Å²	127.3	82%	0.821	76%	0.759	S	S	*	*			trans	-81.5	143.5	-166.6	-67.6	148.6	0	0	0	112.8
594	G	25.9	Very low	29	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	74%	0.737	S	S	*	*			trans	-177.2	109.2	168.7	0	0	0	0	0	113.2
595	S	24.9	Very low	29.3	Very low	129 Å²	129	122.8 Å²	122.8	90%	0.902	71%	0.71	S	S	*	*			trans	-78	140.4	-169.2	-49.4	0	0	0	0	115
596	G	25.7	Very low	29.3	Very low	73 Å²	73	118.9 Å²	118.9	75%	0.753	70%	0.698	S	S	*	*			trans	175.9	132.4	167.2	0	0	0	0	0	112.2	A598	G596-A598 PolarHBondContact O-N 3.31Å
597	D	25.4	Very low	29.2	Very low	143 Å²	143	116.8 Å²	116.8	77%	0.765	69%	0.693	S	S	*	*			trans	-58.2	126.8	-166.2	-67	-60.9	0	0	0	115.5	Y599	D597-Y599 PolarHBondContact O-N 3.3Å
598	A	24.7	Very low	28.9	Very low	102 Å²	102	112 Å²	112	84%	0.843	68%	0.684	S	S	*	*			trans	-81.1	96.5	-179.9	0	0	0	0	0	112.3	G596 S600	G596-A598 PolarHBondContact O-N 3.31Å; A598-S600 PolarHBondContact O-N 3.46Å
599	Y	28.2	Very low	28.8	Very low	181 Å²	181	116.1 Å²	116.1	71%	0.71	69%	0.688	S	S	*	*			trans	-70.3	99.1	173.9	-71.7	-77.5	0	0	0	112.2	D597 Y601	D597-Y599 PolarHBondContact O-N 3.3Å; Y599-Y601 PolarHBondContact O-N 3.46Å
600	S	25.8	Very low	28.5	Very low	100 Å²	100	117.2 Å²	117.2	70%	0.699	69%	0.687	S	S	*	*			trans	-66.2	103.5	-179.6	-169.6	0	0	0	0	112.7	A598	A598-S600 PolarHBondContact O-N 3.46Å
601	Y	33.5	Very low	28.4	Very low	61 Å²	61	111.6 Å²	111.6	24%	0.239	68%	0.681	C	S	.	*			trans	-109.8	-7.5	173.5	-164.1	-90.4	0	0	0	113.5	Y599 K603 W604 R796	Y599-Y601 PolarHBondContact O-N 3.46Å; Y601-K603 PolarHBondContact O-N 2.98Å; Y601-W604 AromaticContact CD2-CE3 3.71Å; Y601-W604 HydrophobicContact CD2-CE3 3.71Å; Y601-W604 AromaticContact CD2-CZ3 3.85Å; Y601-W604 HydrophobicContact CD2-CZ3 3.85Å; Y601-W604 AromaticContact CE2-CE3 3.44Å; Y601-W604 HydrophobicContact CE2-CE3 3.44Å; Y601-W604 VanDerWaalsContact CE2-CE3 3.44Å; Y601-W604 AromaticContact CE2-CZ3 3.79Å; Y601-W604 HydrophobicContact CE2-CZ3 3.79Å; Y601-W604 PolarHBondContact O-N 3.5Å; Y601-R796 PolarHBondContact OH-NH1 3.31Å
602	E	31	Very low	28.4	Very low	151 Å²	151	112.7 Å²	112.7	71%	0.706	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-56.4	-20.8	-173	-64.6	-163.3	96.8	0	0	114.7	T606	E602-T606 PolarHBondContact O-OG1 2.97Å
603	K	32.6	Very low	28.5	Very low	157 Å²	157	108.6 Å²	108.6	68%	0.683	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-82.9	-4.9	-174.4	-140.6	171.4	-171.5	174.2	0	115.7	Y601	Y601-K603 PolarHBondContact O-N 2.98Å
604	W	35.5	Very low	28.5	Very low	111 Å²	111	110.2 Å²	110.2	42%	0.42	69%	0.686	S	S	.	*	G	3₁₀ helix	trans	-115.5	20.2	-178.9	-54.7	-30.6	0	0	0	114.4	Y601 K812	Y601-W604 AromaticContact CD2-CE3 3.71Å; Y601-W604 HydrophobicContact CD2-CE3 3.71Å; Y601-W604 AromaticContact CD2-CZ3 3.85Å; Y601-W604 HydrophobicContact CD2-CZ3 3.85Å; Y601-W604 AromaticContact CE2-CE3 3.44Å; Y601-W604 HydrophobicContact CE2-CE3 3.44Å; Y601-W604 VanDerWaalsContact CE2-CE3 3.44Å; Y601-W604 AromaticContact CE2-CZ3 3.79Å; Y601-W604 HydrophobicContact CE2-CZ3 3.79Å; Y601-W604 PolarHBondContact O-N 3.5Å; W604-K812 VanDerWaalsContact CZ3-NZ 3.26Å
605	S	34	Very low	28.8	Very low	24 Å²	24	113.8 Å²	113.8	17%	0.168	68%	0.682	C	S	.	*	T	Hydrogen-bonded Turn	trans	-111.9	-26.8	160.4	-68.2	0	0	0	0	111.1	G607 Q924	S605-G607 PolarHBondContact O-N 3.45Å; S605-G607 VanDerWaalsContact O-N 3.11Å; S605-Q924 PolarHBondContact O-NE2 3.05Å; S605-Q924 PolarHBondContact O-OE1 3.3Å
606	T	29	Very low	29	Very low	86 Å²	86	115.8 Å²	115.8	53%	0.528	68%	0.677	S	S	.	*			trans	-71.4	100.9	177.4	19.2	0	0	0	0	113.2	E602 G608	E602-T606 PolarHBondContact O-OG1 2.97Å; T606-G608 VanDerWaalsContact C-N 3.35Å; T606-G608 PolarHBondContact O-N 3.05Å
607	G	28.8	Very low	29.3	Very low	64 Å²	64	118.3 Å²	118.3	66%	0.66	68%	0.68	S	S	*	*			trans	-73.9	80.4	168.4	0	0	0	0	0	112.7	S605	S605-G607 PolarHBondContact O-N 3.45Å; S605-G607 VanDerWaalsContact O-N 3.11Å
608	G	25.5	Very low	29.6	Very low	65 Å²	65	117 Å²	117	67%	0.67	68%	0.682	S	S	*	*			trans	80.7	103.6	158.5	0	0	0	0	0	118.3	T606	T606-G608 VanDerWaalsContact C-N 3.35Å; T606-G608 PolarHBondContact O-N 3.05Å
609	I	26.8	Very low	29.9	Very low	157 Å²	157	117.8 Å²	117.8	81%	0.805	68%	0.682	S	S	*	*			trans	-151	177.9	143	30.7	170.3	0	0	0	108.1
610	D	29.3	Very low	30.2	Very low	138 Å²	138	113.1 Å²	113.1	74%	0.738	69%	0.689	S	S	*	*			trans	83	82.8	-173.1	-53.3	-17.7	0	0	0	113.3
611	A	30.5	Very low	30.5	Very low	101 Å²	101	116 Å²	116	84%	0.835	70%	0.697	S	S	*	*				84.1	113.9	65.5	0	0	0	0	0	113.7
612	S	25.1	Very low	30.8	Very low	130 Å²	130	117.6 Å²	117.6	91%	0.909	71%	0.714	S	S	*	*			trans	-81.7	120.2	176.3	52.2	0	0	0	0	111.7
613	G	29.7	Very low	30.9	Very low	73 Å²	73	117.7 Å²	117.7	75%	0.753	72%	0.719	S	S	*	*			trans	-165	119.4	176.3	0	0	0	0	0	114.1
614	F	26.8	Very low	30.9	Very low	194 Å²	194	115.3 Å²	115.3	85%	0.851	72%	0.722	S	S	*	*			trans	-50.7	142.1	170.7	-73.3	-125.1	0	0	0	111.6
615	H	31.4	Very low	30.7	Very low	149 Å²	149	115.9 Å²	115.9	69%	0.69	74%	0.742	S	S	*	*				-171.4	137	70.2	-110.1	-85.8	0	0	0	113.9
616	Q	29.2	Very low	30.7	Very low	172 Å²	172	118.7 Å²	118.7	80%	0.804	77%	0.766	S	S	*	*			trans	45	153.2	146.8	-78.1	170.1	-59.3	0	0	125
617	P	31.6	Very low	30.7	Very low	125 Å²	125	121.5 Å²	121.5	81%	0.812	78%	0.777	S	S	*	*			trans	-127.1	162	-168.1	42.5	-26.9	0	0	0	117.3
618	S	32.2	Very low	30.9	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	79%	0.787	S	S	*	*			trans	-164.6	156.4	156.8	58.2	0	0	0	0	109.6
619	S	31.5	Very low	31.3	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	79%	0.794	S	S	*	*			cis	-167.3	120.8	-28.9	50.2	0	0	0	0	108.3
620	G	33.8	Very low	31.8	Very low	84 Å²	84	130.7 Å²	130.7	87%	0.866	79%	0.791	S	S	*	*			trans	-177.3	110.8	-179	0	0	0	0	0	114.1
621	N	33.1	Very low	32.1	Very low	160 Å²	160	132.2 Å²	132.2	86%	0.856	80%	0.797	S	S	*	*			trans	-110.9	177.1	-174.9	-117.7	1.3	0	0	0	110
622	P	39.5	Very low	32.3	Very low	95 Å²	95	133.2 Å²	133.2	62%	0.617	80%	0.795	S	S	*	*			cis	-137.3	-171.9	-38.5	35.9	-17.1	0	0	0	112.4
623	L	33.4	Very low	32.8	Very low	153 Å²	153	130.3 Å²	130.3	80%	0.801	79%	0.785	S	S	*	*				171.7	129.7	116.2	-93	172.5	0	0	0	114.6
624	S	32	Very low	32.9	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	79%	0.79	S	S	*	*			trans	57.7	141.8	154.7	56.5	0	0	0	0	120.7
625	C	30.9	Very low	33.2	Very low	124 Å²	124	132.8 Å²	132.8	84%	0.838	79%	0.788	S	S	*	*			cis	-160.2	162.3	-5.6	-122.4	0	0	0	0	112.9
626	A	33.7	Very low	33.2	Very low	82 Å²	82	130.4 Å²	130.4	68%	0.678	79%	0.788	S	S	*	*			trans	50.8	107.7	163.4	0	0	0	0	0	118.8
627	I	29.1	Very low	33.4	Very low	146 Å²	146	129.7 Å²	129.7	75%	0.749	79%	0.79	S	S	*	*			cis	83.6	105.3	49.6	-59.2	164.4	0	0	0	114.7
628	H	34.1	Very low	33.4	Very low	190 Å²	190	129 Å²	129	88%	0.88	79%	0.788	S	S	*	*				-154.8	158.7	118.1	-121.2	-87	0	0	0	110.9
629	Q	34.4	Very low	33.5	Very low	176 Å²	176	127.3 Å²	127.3	82%	0.822	79%	0.789	S	S	*	*			trans	-107.9	159.3	-156.8	-76.2	-176.4	-37.7	0	0	117.2
630	P	37.3	Very low	33.5	Very low	112 Å²	112	128.8 Å²	128.8	73%	0.727	79%	0.785	S	S	*	*			trans	-106.5	176.6	173.8	42.1	-35.4	0	0	0	113.9
631	I	34.5	Very low	33.5	Very low	171 Å²	171	135.1 Å²	135.1	88%	0.877	79%	0.785	S	S	*	*			trans	-138.5	126.8	160.7	-57.8	-178.6	0	0	0	110.1
632	P	36	Very low	33.6	Very low	122 Å²	122	133.3 Å²	133.3	79%	0.792	78%	0.78	S	S	*	*			trans	-121.1	169.3	177.6	41.3	-31.6	0	0	0	114.9
633	G	34.2	Very low	33.6	Very low	68 Å²	68	134 Å²	134	70%	0.701	78%	0.784	S	S	*	*			trans	148.1	159.4	164.2	0	0	0	0	0	114.3
634	L	32.4	Very low	33.6	Very low	162 Å²	162	131.8 Å²	131.8	85%	0.848	78%	0.781	S	S	*	*			cis	-167.3	168.7	-13.4	-139.4	144	0	0	0	109.4
635	I	33.8	Very low	34.1	Very low	157 Å²	157	132.1 Å²	132.1	81%	0.805	78%	0.781	S	S	*	*			trans	83.2	123.1	165.4	-52.6	165.3	0	0	0	117
636	S	30.6	Very low	34.3	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	79%	0.786	S	S	*	*			trans	-106.7	160.5	165.3	52.1	0	0	0	0	110.4
637	D	33.8	Very low	34.5	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	79%	0.791	S	S	*	*				-157.7	177.5	124.7	-137.1	-28.5	0	0	0	113.8
638	S	32.2	Very low	34.7	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	80%	0.795	S	S	*	*			trans	-122.5	145.1	-161.3	-42.7	0	0	0	0	112.4
639	G	33.3	Very low	34.9	Very low	80 Å²	80	133.6 Å²	133.6	83%	0.825	79%	0.789	S	S	*	*			trans	-154.8	88.5	-176.6	0	0	0	0	0	114.6
640	I	32	Very low	35.1	Very low	149 Å²	149	132.3 Å²	132.3	76%	0.764	78%	0.783	S	S	*	*			trans	-65.1	138.8	177.2	-64.1	158.9	0	0	0	111.5
641	Y	33.5	Very low	34.8	Very low	217 Å²	217	134.3 Å²	134.3	85%	0.851	79%	0.788	S	S	*	*				-177.3	160.4	123.7	-104.1	-71.4	0	0	0	113.2
642	T	34.6	Very low	34.7	Very low	122 Å²	122	129.7 Å²	129.7	75%	0.748	78%	0.782	S	S	*	*			trans	-140.5	-177.3	-171.2	57.9	0	0	0	0	110.2
643	P	39.5	Very low	34.5	Very low	109 Å²	109	130.3 Å²	130.3	71%	0.708	78%	0.783	S	S	*	*				-132.7	-159	-73.9	39.8	-21.9	0	0	0	112.9
644	S	34.6	Very low	34.3	Very low	107 Å²	107	133 Å²	133	75%	0.748	79%	0.786	S	S	*	*			trans	98	166.2	159.1	-19.7	0	0	0	0	117
645	P	41.8	Very low	34.3	Very low	113 Å²	113	131.2 Å²	131.2	73%	0.734	79%	0.787	S	S	*	*				-138.3	-172	-116.4	36.1	-11.7	0	0	0	115.4
646	L	35.5	Very low	34.3	Very low	181 Å²	181	127.3 Å²	127.3	95%	0.948	79%	0.785	S	S	*	*			trans	165.6	154.5	142.9	-92.3	159.4	0	0	0	111.9
647	G	37.1	Very low	34.5	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	79%	0.789	S	S	*	*			trans	129.5	105.5	160.4	0	0	0	0	0	117.3
648	D	33.7	Very low	34.6	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	79%	0.791	S	S	*	*			trans	-86.4	151.3	170.7	-68.4	-78.2	0	0	0	113.2
649	H	38.9	Very low	34.8	Very low	164 Å²	164	132.4 Å²	132.4	76%	0.759	79%	0.788	S	S	*	*				179.2	113.6	118.9	-106.1	-81.7	0	0	0	116
650	Q	37.4	Very low	34.7	Very low	148 Å²	148	134.7 Å²	134.7	69%	0.692	79%	0.785	S	S	*	*			trans	33.9	129.2	134	-61.3	-175.4	16.8	0	0	124.8
651	N	31	Very low	34.7	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	78%	0.782	S	S	*	*			trans	78.1	139.6	133.6	-62.8	-17.1	0	0	0	123.6
652	G	32.1	Very low	34.6	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	79%	0.786	S	S	*	*			trans	113.6	88.1	166.6	0	0	0	0	0	114.7
653	V	32.2	Very low	34.5	Very low	136 Å²	136	131.3 Å²	131.3	82%	0.824	78%	0.78	S	S	*	*				82	91.3	64.3	-177.5	0	0	0	0	115.5
654	V	31.2	Very low	34.1	Very low	124 Å²	124	130.7 Å²	130.7	75%	0.752	79%	0.785	S	S	*	*			trans	73.7	104.7	137.2	-179.1	0	0	0	0	122
655	S	32	Very low	34.1	Very low	125 Å²	125	136 Å²	136	87%	0.874	79%	0.794	S	S	*	*			trans	63.5	134.1	134.3	-58.2	0	0	0	0	124.6
656	G	33.1	Very low	33.4	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	80%	0.802	S	S	*	*			trans	174	81.1	162.1	0	0	0	0	0	119.4
657	H	34.5	Very low	33	Very low	171 Å²	171	138.7 Å²	138.7	79%	0.792	80%	0.799	S	S	*	*			trans	38	122	150	-84.4	-113.6	0	0	0	123.7
658	Q	36	Very low	32.6	Very low	187 Å²	187	140.4 Å²	140.4	87%	0.874	80%	0.799	S	S	*	*				161.6	120.7	128.6	-88.3	154.9	106.2	0	0	108.8
659	V	35.8	Very low	32.3	Very low	116 Å²	116	139.1 Å²	139.1	70%	0.703	80%	0.797	S	S	*	*			cis	94.6	98.8	42.5	174	0	0	0	0	112.9
660	V	32.7	Very low	31.9	Very low	128 Å²	128	137.2 Å²	137.2	78%	0.776	80%	0.799	S	S	*	*			trans	58.4	135.9	137.5	-178	0	0	0	0	117.4
661	E	31.3	Very low	31.6	Very low	150 Å²	150	136.5 Å²	136.5	70%	0.701	80%	0.799	S	S	*	*			cis	-155.5	153.3	23.7	-154.8	173.5	145.3	0	0	112.5	S663	E661-S663 PolarHBondContact OE1-OG 3.32Å
662	L	30.9	Very low	31.9	Very low	176 Å²	176	133.9 Å²	133.9	92%	0.921	79%	0.788	S	S	*	*			trans	-161.1	142.3	132.5	-144.3	70.7	0	0	0	111.3
663	S	32.4	Very low	32.1	Very low	91 Å²	91	139.6 Å²	139.6	64%	0.636	79%	0.793	S	S	*	*			trans	-118.1	173.3	-164.8	-72.3	0	0	0	0	114.4	E661	E661-S663 PolarHBondContact OE1-OG 3.32Å
664	A	32.2	Very low	32.6	Very low	97 Å²	97	138.7 Å²	138.7	80%	0.802	78%	0.778	S	S	*	*			trans	80	73.6	162.5	0	0	0	0	0	120.1
665	K	34	Very low	32.7	Very low	217 Å²	217	137 Å²	137	94%	0.943	77%	0.769	S	S	*	*				-159.7	97	129.7	-112.1	169.8	-173	175.4	0	110.7
666	L	26.5	Very low	32.7	Very low	170 Å²	170	137 Å²	137	89%	0.89	77%	0.766	S	S	*	*			trans	-142.6	116.9	-174.9	-169.8	94.1	0	0	0	110.7
667	M	28.5	Very low	32.8	Very low	181 Å²	181	143.5 Å²	143.5	89%	0.892	77%	0.774	S	S	*	*			trans	-160	138.6	145.7	-80.6	-139.4	174.5	0	0	110
668	S	27.4	Very low	33.4	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	75%	0.749	S	S	*	*	S	Bend	trans	47.7	84	162.9	62.6	0	0	0	0	119.5
669	T	28.6	Very low	34.4	Very low	125 Å²	125	137.9 Å²	137.9	77%	0.767	75%	0.752	S	S	*	*			trans	-167	126.5	130.6	9.9	0	0	0	0	110.6	I671	T669-I671 PolarHBondContact O-N 3.17Å
670	P	30.4	Very low	36.3	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	73%	0.73	S	S	*	*			trans	-80.3	102.4	170.6	30.7	-30.5	0	0	0	109.9	T672	P670-T672 PolarHBondContact O-N 3.22Å
671	I	31.4	Very low	38.7	Very low	132 Å²	132	137.7 Å²	137.7	68%	0.677	73%	0.733	S	S	*	*			trans	-77.3	102.2	176.5	-57.8	175.5	0	0	0	109.1	T669 F673	T669-I671 PolarHBondContact O-N 3.17Å; I671-F673 HydrophobicContact CG2-CD2 3.99Å; I671-F673 HydrophobicContact CG2-CE2 4.15Å; I671-F673 PolarHBondContact O-N 2.93Å; I671-F673 VanDerWaalsContact O-N 3.13Å
672	T	37.2	Very low	41.4	Very low	100 Å²	100	132.4 Å²	132.4	61%	0.613	71%	0.707	S	S	*	*			trans	-73.6	98.2	169.5	38.8	0	0	0	0	110.1	P670 F674	P670-T672 PolarHBondContact O-N 3.22Å; T672-F674 WeakPolarHBondContact O-CD2 3.33Å; T672-F674 PolarHBondContact O-N 3.24Å
673	F	36.8	Very low	44.3	Very low	193 Å²	193	128.1 Å²	128.1	85%	0.846	69%	0.685	S	S	*	*			trans	-63.9	102.8	173	-99.8	-100.4	0	0	0	110.7	I671	I671-F673 HydrophobicContact CG2-CD2 3.99Å; I671-F673 HydrophobicContact CG2-CE2 4.15Å; I671-F673 PolarHBondContact O-N 2.93Å; I671-F673 VanDerWaalsContact O-N 3.13Å
674	F	42.3	Very low	47.2	Very low	118 Å²	118	128.5 Å²	128.5	52%	0.518	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-96.6	136.7	164.7	-73.1	-79.8	0	0	0	110.1	T672 L877	T672-F674 WeakPolarHBondContact O-CD2 3.33Å; T672-F674 PolarHBondContact O-N 3.24Å; F674-L877 HydrophobicContact CE1-CD2 4.49Å
675	P	32.2	Very low	50	Low	87 Å²	87	124 Å²	124	57%	0.565	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-72.5	141.1	-179.3	29.2	-34.1	0	0	0	111.2	K677	P675-K677 PolarHBondContact O-N 2.83Å
676	P	31.8	Very low	52.8	Low	125 Å²	125	117.7 Å²	117.7	81%	0.812	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	133.6	178.3	26.7	-33.8	0	0	0	111.1
677	K	36.8	Very low	55.9	Low	211 Å²	211	115 Å²	115	92%	0.917	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.8	53.9	180	-53.9	-177.9	-179.3	179.9	0	114.9	P675 Q679	P675-K677 PolarHBondContact O-N 2.83Å; K677-Q679 PolarHBondContact O-N 3.38Å
678	S	45.8	Very low	58.8	Low	39 Å²	39	110.8 Å²	110.8	27%	0.273	57%	0.57	S	S	.	*			trans	-73.4	105	175.5	53.5	0	0	0	0	113.1	I680	S678-I680 PolarHBondContact O-N 2.9Å
679	Q	58.4	Low	62	Low	201 Å²	201	106.8 Å²	106.8	94%	0.939	54%	0.541	S	S	*	.			trans	-71.5	77.1	164.7	-76.6	-171.6	-15.5	0	0	110.4	K677 K681	K677-Q679 PolarHBondContact O-N 3.38Å; Q679-K681 PolarHBondContact O-N 2.76Å; Q679-K681 VanDerWaalsContact O-N 3.16Å
680	I	74.8	Confident	65.1	Low	48 Å²	48	105.9 Å²	105.9	25%	0.246	53%	0.527	C	S	.	.			trans	-72.1	110.7	178.2	-69.1	168.3	0	0	0	109.1	S678 R682 L877 L912 A915	S678-I680 PolarHBondContact O-N 2.9Å; I680-R682 PolarHBondContact O-N 3.06Å; I680-L877 HydrophobicContact CD1-CD1 3.66Å; I680-L912 HydrophobicContact CD1-CD2 4.32Å; I680-A915 HydrophobicContact CG2-CB 3.98Å
681	K	82.5	Confident	68.3	Low	192 Å²	192	101.1 Å²	101.1	84%	0.835	49%	0.493	S	S	*	.			trans	-60.5	103.4	178.8	-177.5	-177.7	179.3	-177.7	0	110.2	Q679	Q679-K681 PolarHBondContact O-N 2.76Å; Q679-K681 VanDerWaalsContact O-N 3.16Å
682	R	89.5	Confident	71.3	Confident	39 Å²	39	95.8 Å²	95.8	15%	0.147	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-82.7	143.6	178.3	-74.3	165.6	158.1	54.9	-2	111.6	I680 L877 N902 T904 A915 E917	I680-R682 PolarHBondContact O-N 3.06Å; R682-L877 PolarHBondContact NH2-O 3.06Å; R682-N902 PolarHBondContact NE-OD1 3.48Å; R682-T904 PolarHBondContact NH2-OG1 3.46Å; R682-A915 CarbonylContact C-O 3.59Å; R682-A915 VanDerWaalsContact CA-O 3.24Å; R682-A915 WeakPolarHBondContact CA-O 3.39Å; R682-A915 HydrophobicContact CG-CB 3.78Å; R682-E917 HydrophobicContact CB-CB 4.21Å; R682-E917 HydrophobicContact CB-CG 3.74Å
683	L	91.4	Very high	74	Confident	87 Å²	87	95.7 Å²	95.7	46%	0.455	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	154.1	169.6	-59	179.7	0	0	0	110.2	A915 L916 E917	L683-A915 PolarHBondContact N-O 3.33Å; L683-L916 HydrophobicContact CB-CD2 4.27Å; L683-L916 HydrophobicContact CB-CG 4.2Å; L683-L916 CarbonylContact O-C 3.58Å; L683-L916 WeakPolarHBondContact O-CA 3.33Å; L683-L916 WeakPolarHBondContact O-CB 3.36Å; L683-E917 PolarHBondContact O-N 3.23Å
684	K	91.9	Very high	76.9	Confident	98 Å²	98	92.4 Å²	92.4	43%	0.426	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	122	176.7	-66.8	-50.6	-158.8	179.8	0	111.1	E917 S918 K919	K684-E917 WeakPolarHBondContact CA-O 3.34Å; K684-E917 HydrophobicContact CD-CG 3.71Å; K684-E917 WeakPolarHBondContact CE-OE1 3.48Å; K684-E917 IonicContact NZ-OE1 2.69Å; K684-E917 PolarHBondContact NZ-OE1 3.14Å; K684-E917 IonicContact NZ-OE2 3.11Å; K684-E917 PolarHBondContact NZ-OE2 2.97Å; K684-S918 PolarHBondContact NZ-O 3.39Å; K684-K919 HydrophobicContact CB-CG 4.12Å; K684-K919 HydrophobicContact CD-CG 4.2Å; K684-K919 HydrophobicContact CG-CG 4.15Å
685	M	92.3	Very high	79.4	Confident	3 Å²	3	87.2 Å²	87.2	2%	0.015	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-63.2	151.7	169.9	-67.6	-172.5	-89.8	0	0	111.4	F901 L903 L916 E917 Y948	M685-F901 HydrophobicContact CE-CD1 3.52Å; M685-F901 HydrophobicContact CE-CE1 3.67Å; M685-F901 HydrophobicContact CE-CG 4.36Å; M685-F901 VanDerWaalsContact CE-O 3.31Å; M685-F901 WeakPolarHBondContact CE-O 3.3Å; M685-F901 HydrophobicContact SD-CE1 4.15Å; M685-L903 HydrophobicContact CE-CG 4.08Å; M685-L903 HydrophobicContact SD-CB 4.34Å; M685-L903 HydrophobicContact SD-CD1 3.68Å; M685-L903 HydrophobicContact SD-CG 3.75Å; M685-L916 HydrophobicContact CG-CB 3.64Å; M685-L916 HydrophobicContact CG-CD2 4.04Å; M685-L916 HydrophobicContact CG-CG 4.47Å; M685-L916 HydrophobicContact SD-CB 4.39Å; M685-E917 PolarHBondContact N-O 3.19Å; M685-Y948 HydrophobicContact CB-CD1 3.98Å
686	I	91.8	Very high	82.3	Confident	84 Å²	84	88 Å²	88	43%	0.431	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.2	176	-58.7	175	0	0	0	107.9	Y948 R949 Q952	I686-Y948 CarbonylContact O-C 3.48Å; I686-Y948 VanDerWaalsContact O-CA 3.32Å; I686-Y948 WeakPolarHBondContact O-CA 3.3Å; I686-R949 HydrophobicContact CB-CB 4.36Å; I686-R949 PolarHBondContact N-O 2.87Å; I686-R949 PolarHBondContact O-N 2.91Å; I686-Q952 HydrophobicContact CD1-CG 4.49Å
687	Y	92	Very high	85.3	Confident	114 Å²	114	85.3 Å²	85.3	45%	0.447	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	131	169.3	169.8	-103.5	0	0	0	109.5	C689 K690 Y946 Y948	Y687-C689 VanDerWaalsContact CE2-C 3.48Å; Y687-C689 VanDerWaalsContact CE2-O 3.3Å; Y687-C689 WeakPolarHBondContact CE2-O 3.38Å; Y687-K690 HydrophobicContact CE2-CB 4.23Å; Y687-K690 WeakPolarHBondContact OH-CG 3.43Å; Y687-K690 PolarHBondContact OH-N 3.44Å; Y687-K690 VanDerWaalsContact OH-N 3.15Å; Y687-Y946 HydrophobicContact CE2-CD1 4.17Å; Y687-Y948 HydrophobicContact CD2-CE1 4.12Å; Y687-Y948 HydrophobicContact CD2-CE2 4.49Å; Y687-Y948 AromaticContact CD2-CZ 3.96Å; Y687-Y948 HydrophobicContact CG-CE1 4.46Å
688	H	90.4	Very high	88.1	Confident	93 Å²	93	80.9 Å²	80.9	43%	0.431	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-64.9	179.5	-175.6	-106	0	0	0	110.9	I947	H688-I947 HydrophobicContact CB-CB 4.15Å; H688-I947 HydrophobicContact CB-CG2 4.01Å; H688-I947 WeakPolarHBondContact CB-O 3.43Å; H688-I947 PolarHBondContact N-O 3.26Å
689	C	93.2	Very high	90.4	Very high	29 Å²	29	80.6 Å²	80.6	20%	0.196	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	173.7	177.9	63.6	0	0	0	0	111	Y687 I947	Y687-C689 VanDerWaalsContact CE2-C 3.48Å; Y687-C689 VanDerWaalsContact CE2-O 3.3Å; Y687-C689 WeakPolarHBondContact CE2-O 3.38Å; C689-I947 PolarHBondContact O-N 3.16Å
690	K	94.3	Very high	92.2	Very high	105 Å²	105	72.9 Å²	72.9	46%	0.457	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.2	165.2	76.2	-175.8	-174.5	172.6	0	108.9	Y687 L945 Y946	Y687-K690 HydrophobicContact CE2-CB 4.23Å; Y687-K690 WeakPolarHBondContact OH-CG 3.43Å; Y687-K690 PolarHBondContact OH-N 3.44Å; Y687-K690 VanDerWaalsContact OH-N 3.15Å; K690-L945 CarbonylContact C-O 3.59Å; K690-L945 WeakPolarHBondContact CA-O 3.16Å; K690-Y946 HydrophobicContact CB-CD1 3.56Å; K690-Y946 HydrophobicContact CB-CE1 3.78Å; K690-Y946 HydrophobicContact CB-CG 4.14Å; K690-Y946 HydrophobicContact CD-CD1 4.15Å; K690-Y946 HydrophobicContact CD-CE1 3.48Å; K690-Y946 VanDerWaalsContact CD-CE1 3.48Å; K690-Y946 HydrophobicContact CG-CD1 4.49Å; K690-Y946 HydrophobicContact CG-CE1 4.26Å
691	F	96.5	Very high	93.3	Very high	26 Å²	26	70.6 Å²	70.6	11%	0.114	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	163.5	174.3	59.8	-79.7	0	0	0	110.1	I715 F728 R944 L945 I947	F691-I715 HydrophobicContact CE1-CD1 4.2Å; F691-I715 HydrophobicContact CZ-CD1 3.96Å; F691-F728 AromaticContact CD2-CD1 3.86Å; F691-F728 HydrophobicContact CD2-CD1 3.86Å; F691-F728 AromaticContact CD2-CE1 3.91Å; F691-F728 HydrophobicContact CD2-CE1 3.91Å; F691-F728 HydrophobicContact CD2-CG 4.37Å; F691-F728 HydrophobicContact CD2-CZ 4.46Å; F691-F728 HydrophobicContact CE2-CB 4.21Å; F691-F728 AromaticContact CE2-CD1 3.52Å; F691-F728 HydrophobicContact CE2-CD1 3.52Å; F691-F728 AromaticContact CE2-CD2 3.85Å; F691-F728 HydrophobicContact CE2-CD2 3.85Å; F691-F728 AromaticContact CE2-CE1 3.81Å; F691-F728 HydrophobicContact CE2-CE1 3.81Å; F691-F728 HydrophobicContact CE2-CE2 4.12Å; F691-F728 AromaticContact CE2-CG 3.57Å; F691-F728 HydrophobicContact CE2-CG 3.57Å; F691-F728 HydrophobicContact CE2-CZ 4.13Å; F691-F728 HydrophobicContact CZ-CB 4.4Å; F691-F728 HydrophobicContact CZ-CD1 4.46Å; F691-F728 HydrophobicContact CZ-CG 4.2Å; F691-R944 WeakPolarHBondContact O-CA 3.42Å; F691-L945 HydrophobicContact CD1-CB 4.21Å; F691-L945 HydrophobicContact CD2-CB 4.35Å; F691-L945 HydrophobicContact CD2-CD1 4.17Å; F691-L945 HydrophobicContact CE1-CB 3.77Å; F691-L945 HydrophobicContact CE2-CB 3.94Å; F691-L945 HydrophobicContact CE2-CD1 3.38Å; F691-L945 HydrophobicContact CE2-CG 4.3Å; F691-L945 HydrophobicContact CG-CB 4.47Å; F691-L945 HydrophobicContact CZ-CB 3.63Å; F691-L945 HydrophobicContact CZ-CD1 3.64Å; F691-L945 HydrophobicContact CZ-CG 4.24Å; F691-L945 PolarHBondContact N-O 3.39Å; F691-L945 PolarHBondContact O-N 3.06Å; F691-I947 HydrophobicContact CE1-CD1 4.14Å; F691-I947 HydrophobicContact CE1-CG1 4.21Å
692	G	94.8	Very high	93.9	Very high	19 Å²	19	63 Å²	63	20%	0.196	32%	0.32	C	S	.	.			trans	93.2	160.5	-173.9	0	0	0	0	0	115.3	A699 Y943 R944	G692-A699 WeakPolarHBondContact CA-O 3.36Å; G692-Y943 CarbonylContact C-O 3.54Å; G692-R944 WeakPolarHBondContact O-CD 3.16Å; G692-R944 WeakPolarHBondContact O-CG 3.04Å; G692-R944 PolarHBondContact O-NE 3.05Å
693	E	95.4	Very high	94.2	Very high	98 Å²	98	62.6 Å²	62.6	46%	0.458	32%	0.32	S	S	.	.			trans	-162.3	176.2	174.4	60.5	179.3	-177.3	0	0	109	G695 Q700 F701 Y943	E693-G695 PolarHBondContact O-N 2.59Å; E693-Q700 HydrophobicContact CG-CB 4.49Å; E693-Q700 HydrophobicContact CG-CG 3.84Å; E693-Q700 PolarHBondContact OE1-NE2 2.75Å; E693-F701 PolarHBondContact O-N 2.93Å; E693-Y943 WeakPolarHBondContact CA-O 3.44Å; E693-Y943 PolarHBondContact N-O 2.81Å; E693-Y943 VanDerWaalsContact N-O 3.13Å
694	F	96.5	Very high	94.5	Very high	125 Å²	125	58.4 Å²	58.4	55%	0.548	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-67.6	127	177	177.3	-102.8	0	0	0	111.5	F701 T702 Y943	F694-F701 WeakPolarHBondContact CA-O 3.47Å; F694-T702 HydrophobicContact CE2-CG2 4.21Å; F694-Y943 HydrophobicContact CB-CD2 3.67Å; F694-Y943 HydrophobicContact CB-CE2 4.11Å; F694-Y943 HydrophobicContact CB-CG 3.91Å; F694-Y943 AromaticContact CD2-CD1 3.84Å; F694-Y943 HydrophobicContact CD2-CD1 3.84Å; F694-Y943 HydrophobicContact CD2-CD2 4.08Å; F694-Y943 AromaticContact CD2-CE1 3.68Å; F694-Y943 HydrophobicContact CD2-CE1 3.68Å; F694-Y943 AromaticContact CD2-CE2 3.92Å; F694-Y943 HydrophobicContact CD2-CE2 3.92Å; F694-Y943 HydrophobicContact CD2-CG 4.04Å; F694-Y943 AromaticContact CD2-CZ 3.72Å; F694-Y943 HydrophobicContact CE2-CE1 4.25Å; F694-Y943 HydrophobicContact CG-CD2 4.33Å; F694-Y943 HydrophobicContact CG-CE2 4.36Å; F694-Y943 HydrophobicContact CG-CG 4.5Å
695	G	94.6	Very high	94.7	Very high	8 Å²	8	53.8 Å²	53.8	8%	0.082	28%	0.278	C	S	.	.	S	Bend	trans	156.6	-169.9	168.3	0	0	0	0	0	115.6	E693 F701 T702 N722	E693-G695 PolarHBondContact O-N 2.59Å; G695-F701 PolarHBondContact N-O 3.26Å; G695-F701 CarbonylContact O-C 3.54Å; G695-F701 VanDerWaalsContact O-C 3.31Å; G695-F701 PolarHBondContact O-N 2.94Å; G695-T702 PolarHBondContact O-OG1 2.93Å; G695-N722 PolarHBondContact O-ND2 2.89Å
696	V	93.4	Very high	94.9	Very high	104 Å²	104	53.7 Å²	53.7	63%	0.63	28%	0.277	S	S	*	.	S	Bend	trans	-114.9	-9.2	-172.4	-59.6	0	0	0	0	113.6	R724	V696-R724 PolarHBondContact O-NH1 3.22Å; V696-R724 PolarHBondContact O-NH2 3.48Å
697	S	95.2	Very high	95.2	Very high	68 Å²	68	50 Å²	50	48%	0.476	26%	0.258	S	S	.	.	S	Bend	trans	-72.8	176.5	177.5	-51.1	0	0	0	0	111.7	Q700 R724	S697-Q700 PolarHBondContact O-N 3.29Å; S697-Q700 PolarHBondContact OG-OE1 2.97Å; S697-Q700 VanDerWaalsContact OG-OE1 3.09Å; S697-R724 PolarHBondContact O-NH1 2.83Å; S697-R724 PolarHBondContact O-NH2 2.87Å
698	E	94.5	Very high	95.5	Very high	118 Å²	118	45 Å²	45	55%	0.551	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	144.3	170.1	-56.3	-167.5	145.9	0	0	110.8	Q700 F734	E698-Q700 PolarHBondContact O-N 3.02Å; E698-F734 HydrophobicContact CB-CD1 4.13Å; E698-F734 HydrophobicContact CB-CD2 4.39Å; E698-F734 HydrophobicContact CB-CE1 3.86Å; E698-F734 HydrophobicContact CB-CE2 4.12Å; E698-F734 HydrophobicContact CB-CG 4.38Å; E698-F734 HydrophobicContact CB-CZ 3.83Å; E698-F734 HydrophobicContact CG-CE1 3.83Å; E698-F734 HydrophobicContact CG-CE2 4.48Å; E698-F734 HydrophobicContact CG-CZ 3.77Å; E698-F734 VanDerWaalsContact OE1-CE1 3.32Å; E698-F734 WeakPolarHBondContact OE1-CE1 3.39Å; E698-F734 WeakPolarHBondContact OE2-CE1 3.4Å
699	A	94.4	Very high	95.8	Very high	34 Å²	34	41.1 Å²	41.1	28%	0.281	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-6.9	-173.1	0	0	0	0	0	117.1	G692 F701 F728 F734	G692-A699 WeakPolarHBondContact CA-O 3.36Å; A699-F701 WeakPolarHBondContact O-CE2 3.47Å; A699-F728 HydrophobicContact CB-CE1 3.91Å; A699-F734 HydrophobicContact CB-CB 4.39Å
700	Q	97.5	Very high	95.9	Very high	39 Å²	39	40.1 Å²	40.1	18%	0.182	22%	0.217	C	C	.	.			trans	-88.4	157.2	171.7	-57.9	-174.5	-33.1	0	0	111.2	E693 S697 E698 R724 Q726	E693-Q700 HydrophobicContact CG-CB 4.49Å; E693-Q700 HydrophobicContact CG-CG 3.84Å; E693-Q700 PolarHBondContact OE1-NE2 2.75Å; S697-Q700 PolarHBondContact O-N 3.29Å; S697-Q700 PolarHBondContact OG-OE1 2.97Å; S697-Q700 VanDerWaalsContact OG-OE1 3.09Å; E698-Q700 PolarHBondContact O-N 3.02Å; Q700-R724 PolarHBondContact O-NH2 3.01Å; Q700-Q726 PolarHBondContact O-NE2 3Å
701	F	97.1	Very high	95.9	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-137.3	151.3	-178.8	-53.7	-79.8	0	0	0	112.4	E693 F694 G695 A699 P704 V717 D719 Q726 F728 L945	E693-F701 PolarHBondContact O-N 2.93Å; F694-F701 WeakPolarHBondContact CA-O 3.47Å; G695-F701 PolarHBondContact N-O 3.26Å; G695-F701 CarbonylContact O-C 3.54Å; G695-F701 VanDerWaalsContact O-C 3.31Å; G695-F701 PolarHBondContact O-N 2.94Å; A699-F701 WeakPolarHBondContact O-CE2 3.47Å; F701-P704 HydrophobicContact CB-CB 4.11Å; F701-P704 HydrophobicContact CB-CG 3.99Å; F701-P704 HydrophobicContact CD1-CB 3.93Å; F701-P704 HydrophobicContact CG-CB 3.97Å; F701-P704 HydrophobicContact CG-CG 4.21Å; F701-V717 HydrophobicContact CD1-CG1 4.2Å; F701-V717 HydrophobicContact CE1-CB 4.13Å; F701-V717 HydrophobicContact CE1-CG1 3.68Å; F701-V717 HydrophobicContact CE1-CG2 4.46Å; F701-V717 HydrophobicContact CZ-CG1 4.36Å; F701-D719 HydrophobicContact CD1-CB 4.09Å; F701-Q726 HydrophobicContact CE1-CB 4.39Å; F701-Q726 VanDerWaalsContact CE1-NE2 3.34Å; F701-F728 HydrophobicContact CE1-CE2 4Å; F701-F728 AromaticContact CE1-CZ 3.98Å; F701-F728 HydrophobicContact CE1-CZ 3.98Å; F701-F728 HydrophobicContact CE2-CZ 4.39Å; F701-F728 HydrophobicContact CZ-CE1 4.38Å; F701-F728 AromaticContact CZ-CE2 3.65Å; F701-F728 HydrophobicContact CZ-CE2 3.65Å; F701-F728 AromaticContact CZ-CZ 3.42Å; F701-F728 HydrophobicContact CZ-CZ 3.42Å; F701-F728 VanDerWaalsContact CZ-CZ 3.42Å; F701-L945 HydrophobicContact CE1-CD1 4.17Å; F701-L945 HydrophobicContact CE2-CD1 3.72Å; F701-L945 HydrophobicContact CE2-CG 4.49Å; F701-L945 HydrophobicContact CZ-CD1 3.38Å
702	T	95.9	Very high	95.7	Very high	31 Å²	31	41.3 Å²	41.3	19%	0.19	23%	0.232	C	C	.	.	S	Bend	trans	-111.3	-33.3	170.6	-58.9	0	0	0	0	111.3	F694 G695 D719 N721 N722 Y943	F694-T702 HydrophobicContact CE2-CG2 4.21Å; G695-T702 PolarHBondContact O-OG1 2.93Å; T702-D719 PolarHBondContact N-OD1 2.89Å; T702-N721 HydrophobicContact CG2-CB 3.62Å; T702-N722 VanDerWaalsContact CB-OD1 3.27Å; T702-N722 WeakPolarHBondContact CB-OD1 3.36Å; T702-N722 PolarHBondContact N-ND2 3.48Å; T702-N722 VanDerWaalsContact N-ND2 3.19Å; T702-N722 VanDerWaalsContact OG1-CG 3.23Å; T702-N722 PolarHBondContact OG1-ND2 3.39Å; T702-N722 VanDerWaalsContact OG1-ND2 3.1Å; T702-N722 PolarHBondContact OG1-OD1 3.22Å; T702-Y943 WeakPolarHBondContact O-CD1 3.39Å; T702-Y943 VanDerWaalsContact O-CE1 3.31Å; T702-Y943 WeakPolarHBondContact O-CE1 3.07Å
703	E	96	Very high	95.7	Very high	31 Å²	31	41.6 Å²	41.6	15%	0.145	23%	0.229	C	C	.	.			trans	-155.4	89	165.7	-168.9	-171.9	136.7	0	0	110	S705 D719 T720 N721 R768 F926	E703-S705 PolarHBondContact O-N 3.13Å; E703-D719 PolarHBondContact N-OD1 2.67Å; E703-D719 CarbonylContact O-C 3.49Å; E703-D719 WeakPolarHBondContact O-CA 3.31Å; E703-T720 PolarHBondContact O-N 3.32Å; E703-T720 PolarHBondContact O-OG1 3.33Å; E703-N721 HydrophobicContact CB-CB 4.2Å; E703-N721 VanDerWaalsContact CB-ND2 3.33Å; E703-N721 WeakPolarHBondContact CB-ND2 3.4Å; E703-N721 PolarHBondContact OE2-ND2 2.72Å; E703-R768 IonicContact OE1-CZ 2.86Å; E703-R768 IonicContact OE1-NH1 2.74Å; E703-R768 PolarHBondContact OE1-NH1 3.21Å; E703-R768 IonicContact OE1-NH2 3.58Å; E703-R768 PolarHBondContact OE1-NH2 3.46Å; E703-R768 IonicContact OE2-NH1 2.89Å; E703-F926 HydrophobicContact CG-CE2 4.07Å; E703-F926 HydrophobicContact CG-CZ 3.98Å
704	P	96.9	Very high	95.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	70.6	179.4	32.2	-33.1	0	0	0	109.4	F701 V717 A718 F926 A939	F701-P704 HydrophobicContact CB-CB 4.11Å; F701-P704 HydrophobicContact CB-CG 3.99Å; F701-P704 HydrophobicContact CD1-CB 3.93Å; F701-P704 HydrophobicContact CG-CB 3.97Å; F701-P704 HydrophobicContact CG-CG 4.21Å; P704-V717 HydrophobicContact CB-CG1 3.81Å; P704-A718 CarbonylContact C-O 3.58Å; P704-A718 WeakPolarHBondContact CA-O 3.27Å; P704-F926 WeakPolarHBondContact O-CD2 3.42Å; P704-A939 VanDerWaalsContact O-CB 3.31Å; P704-A939 WeakPolarHBondContact O-CB 3.4Å
705	S	95.5	Very high	95.9	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-26.2	-165	77	0	0	0	0	114.1	E703 A718 T720 N752 R753 R768 F926 D927	E703-S705 PolarHBondContact O-N 3.13Å; S705-A718 PolarHBondContact N-O 3.43Å; S705-T720 WeakPolarHBondContact CB-OG1 3.43Å; S705-T720 PolarHBondContact OG-OG1 3.31Å; S705-N752 WeakPolarHBondContact OG-CA 3.41Å; S705-N752 PolarHBondContact OG-O 3.16Å; S705-R753 PolarHBondContact O-NH1 3Å; S705-R768 VanDerWaalsContact CB-NH2 3.25Å; S705-R768 PolarHBondContact OG-NH2 3.36Å; S705-F926 WeakPolarHBondContact O-CB 3.19Å; S705-D927 WeakPolarHBondContact O-CB 3.46Å
706	G	96.6	Very high	96.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147	179.7	0	0	0	0	0	112.9	A718 D927	G706-A718 PolarHBondContact O-N 3.26Å; G706-D927 VanDerWaalsContact CA-OD2 3.28Å; G706-D927 WeakPolarHBondContact CA-OD2 3.27Å
707	V	98	Very high	96.3	Very high	6 Å²	6	27.1 Å²	27.1	4%	0.036	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	141.8	-177.9	64.6	0	0	0	0	112.5	I715 I716 V717 D927 A929 V937 A939 L945	V707-I715 HydrophobicContact CG2-CG2 3.72Å; V707-I716 CarbonylContact C-O 3.53Å; V707-I716 WeakPolarHBondContact CA-O 3.48Å; V707-V717 HydrophobicContact CG2-CG2 4.44Å; V707-D927 HydrophobicContact CG1-CB 4.21Å; V707-D927 PolarHBondContact N-OD2 2.91Å; V707-D927 VanDerWaalsContact N-OD2 3.16Å; V707-A929 HydrophobicContact CG1-CB 4.02Å; V707-A929 HydrophobicContact CG2-CB 4.23Å; V707-V937 HydrophobicContact CG2-CG1 3.84Å; V707-A939 HydrophobicContact CB-CB 4.48Å; V707-A939 HydrophobicContact CG1-CB 4.21Å; V707-L945 HydrophobicContact CG2-CD2 4.32Å
708	A	97.9	Very high	96.4	Very high	11 Å²	11	23.9 Å²	23.9	9%	0.091	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	167.5	174.9	0	0	0	0	0	111.3	I716 V754 V756	A708-I716 PolarHBondContact N-O 2.85Å; A708-I716 PolarHBondContact O-N 3.31Å; A708-V754 HydrophobicContact CB-CG1 3.93Å; A708-V754 HydrophobicContact CB-CG2 4.44Å; A708-V756 HydrophobicContact CB-CG2 4.12Å
709	V	97.2	Very high	96.6	Very high	11 Å²	11	18.3 Å²	18.3	7%	0.067	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.8	178.2	172.5	0	0	0	0	110.5	D714 A929 L931	V709-D714 CarbonylContact C-O 3.58Å; V709-D714 VanDerWaalsContact CA-O 3.23Å; V709-D714 WeakPolarHBondContact CA-O 3.32Å; V709-A929 HydrophobicContact CG2-CB 3.75Å; V709-L931 HydrophobicContact CG1-CG 4.35Å; V709-L931 HydrophobicContact CG2-CD1 4.25Å; V709-L931 HydrophobicContact CG2-CG 4.24Å
710	S	96	Very high	96.7	Very high	7 Å²	7	16.7 Å²	16.7	5%	0.049	9%	0.093	C	C	.	.			trans	-80.1	168.9	176.7	77.3	0	0	0	0	112.7	Q712 N713 D714	S710-Q712 PolarHBondContact O-N 3.3Å; S710-Q712 VanDerWaalsContact O-N 3.14Å; S710-Q712 PolarHBondContact OG-N 2.9Å; S710-Q712 VanDerWaalsContact OG-N 3.14Å; S710-Q712 PolarHBondContact OG-OE1 3.39Å; S710-N713 PolarHBondContact O-N 3.07Å; S710-D714 PolarHBondContact N-O 2.68Å; S710-D714 WeakPolarHBondContact OG-CB 3.29Å; S710-D714 PolarHBondContact OG-N 2.74Å; S710-D714 VanDerWaalsContact OG-N 3.08Å
711	A	93.3	Very high	96.6	Very high	41 Å²	41	17.7 Å²	17.7	34%	0.339	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-14.1	171.5	0	0	0	0	0	113.6	N713 R758	A711-N713 VanDerWaalsContact C-N 3.34Å; A711-R758 HydrophobicContact CB-CB 4.46Å
712	Q	93.9	Very high	96.5	Very high	115 Å²	115	19.1 Å²	19.1	54%	0.537	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	0.6	174.4	-63.5	71.7	23.9	0	0	112.2	S710 D714	S710-Q712 PolarHBondContact O-N 3.3Å; S710-Q712 VanDerWaalsContact O-N 3.14Å; S710-Q712 PolarHBondContact OG-N 2.9Å; S710-Q712 VanDerWaalsContact OG-N 3.14Å; S710-Q712 PolarHBondContact OG-OE1 3.39Å; Q712-D714 VanDerWaalsContact C-N 3.26Å
713	N	94.8	Very high	96.6	Very high	26 Å²	26	18.4 Å²	18.4	14%	0.139	10%	0.102	C	C	.	.			trans	63	25.7	-170.3	-66.6	-96.8	0	0	0	114.3	S710 A711 K730 L931 D932	S710-N713 PolarHBondContact O-N 3.07Å; A711-N713 VanDerWaalsContact C-N 3.34Å; N713-K730 HydrophobicContact CB-CB 4.07Å; N713-K730 HydrophobicContact CB-CD 4.4Å; N713-K730 WeakPolarHBondContact O-CA 3.19Å; N713-K730 WeakPolarHBondContact O-CB 3.47Å; N713-K730 PolarHBondContact O-N 2.94Å; N713-L931 HydrophobicContact CB-CD2 4.45Å; N713-D932 PolarHBondContact ND2-OD2 2.8Å; N713-D932 PolarHBondContact OD1-N 3.44Å
714	D	97	Very high	96.7	Very high	27 Å²	27	17.6 Å²	17.6	14%	0.144	10%	0.097	C	C	.	.			trans	-70.7	145.2	164	-63.9	-37.5	0	0	0	109.8	V709 S710 Q712 I716 I727 F728 K735	V709-D714 CarbonylContact C-O 3.58Å; V709-D714 VanDerWaalsContact CA-O 3.23Å; V709-D714 WeakPolarHBondContact CA-O 3.32Å; S710-D714 PolarHBondContact N-O 2.68Å; S710-D714 WeakPolarHBondContact OG-CB 3.29Å; S710-D714 PolarHBondContact OG-N 2.74Å; S710-D714 VanDerWaalsContact OG-N 3.08Å; Q712-D714 VanDerWaalsContact C-N 3.26Å; D714-I716 HydrophobicContact CB-CD1 4.34Å; D714-I716 WeakPolarHBondContact O-CD1 3.41Å; D714-I727 HydrophobicContact CB-CG2 4.15Å; D714-F728 CarbonylContact C-O 3.59Å; D714-F728 VanDerWaalsContact CA-O 3.25Å; D714-F728 WeakPolarHBondContact CA-O 3.48Å; D714-F728 WeakPolarHBondContact CB-O 3.28Å; D714-K735 WeakPolarHBondContact OD1-CD 3.38Å; D714-K735 IonicContact OD1-NZ 3.53Å; D714-K735 PolarHBondContact OD1-NZ 3.05Å; D714-K735 IonicContact OD2-NZ 2.67Å; D714-K735 PolarHBondContact OD2-NZ 2.88Å
715	I	97.9	Very high	96.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.3	178.6	-53	166.6	0	0	0	107.9	F691 V707 V717 I727 F728 D729 V937 I947	F691-I715 HydrophobicContact CE1-CD1 4.2Å; F691-I715 HydrophobicContact CZ-CD1 3.96Å; V707-I715 HydrophobicContact CG2-CG2 3.72Å; I715-V717 HydrophobicContact CG2-CG2 4.05Å; I715-I727 WeakPolarHBondContact O-CA 3.34Å; I715-F728 HydrophobicContact CB-CB 4.32Å; I715-F728 PolarHBondContact N-O 2.94Å; I715-F728 PolarHBondContact O-N 3.27Å; I715-D729 WeakPolarHBondContact CD1-O 3.41Å; I715-V937 HydrophobicContact CD1-CG2 3.57Å; I715-V937 HydrophobicContact CG1-CG2 4.04Å; I715-V937 HydrophobicContact CG2-CG1 4.08Å; I715-V937 HydrophobicContact CG2-CG2 4.3Å; I715-I947 HydrophobicContact CD1-CD1 3.88Å
716	I	98.4	Very high	96.9	Very high	4 Å²	4	17.6 Å²	17.6	2%	0.021	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.8	179.5	-57.8	73.1	0	0	0	108.3	V707 A708 D714 I725 I727 V754 V756 I763	V707-I716 CarbonylContact C-O 3.53Å; V707-I716 WeakPolarHBondContact CA-O 3.48Å; A708-I716 PolarHBondContact N-O 2.85Å; A708-I716 PolarHBondContact O-N 3.31Å; D714-I716 HydrophobicContact CB-CD1 4.34Å; D714-I716 WeakPolarHBondContact O-CD1 3.41Å; I716-I725 HydrophobicContact CG2-CG2 3.35Å; I716-I727 HydrophobicContact CG1-CG1 4.33Å; I716-I727 HydrophobicContact CG1-CG2 4.45Å; I716-I727 HydrophobicContact CG2-CG1 4.44Å; I716-V754 HydrophobicContact CB-CG2 4.43Å; I716-V754 HydrophobicContact CG2-CG1 4.32Å; I716-V754 HydrophobicContact CG2-CG2 3.69Å; I716-V756 HydrophobicContact CD1-CG2 3.86Å; I716-V756 HydrophobicContact CG1-CG2 4.14Å; I716-I763 HydrophobicContact CG1-CD1 4.26Å; I716-I763 HydrophobicContact CG2-CD1 4.41Å; I716-I763 HydrophobicContact CG2-CG2 4.01Å
717	V	98.4	Very high	96.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.5	-171	-171.4	0	0	0	0	110.4	F701 P704 V707 I715 I725 Q726 F728 L945	F701-V717 HydrophobicContact CD1-CG1 4.2Å; F701-V717 HydrophobicContact CE1-CB 4.13Å; F701-V717 HydrophobicContact CE1-CG1 3.68Å; F701-V717 HydrophobicContact CE1-CG2 4.46Å; F701-V717 HydrophobicContact CZ-CG1 4.36Å; P704-V717 HydrophobicContact CB-CG1 3.81Å; V707-V717 HydrophobicContact CG2-CG2 4.44Å; I715-V717 HydrophobicContact CG2-CG2 4.05Å; V717-I725 WeakPolarHBondContact O-CA 3.47Å; V717-Q726 PolarHBondContact N-O 3.45Å; V717-Q726 PolarHBondContact O-N 3.01Å; V717-F728 HydrophobicContact CB-CE2 4.39Å; V717-F728 HydrophobicContact CG2-CD2 3.88Å; V717-F728 HydrophobicContact CG2-CE2 3.8Å; V717-L945 HydrophobicContact CB-CD1 4.44Å; V717-L945 HydrophobicContact CG1-CD1 4.11Å; V717-L945 HydrophobicContact CG2-CD1 3.51Å; V717-L945 HydrophobicContact CG2-CD2 4.4Å
718	A	98.2	Very high	96.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	105.9	171	0	0	0	0	0	110.2	P704 S705 G706 T720 I725 P751 V754	P704-A718 CarbonylContact C-O 3.58Å; P704-A718 WeakPolarHBondContact CA-O 3.27Å; S705-A718 PolarHBondContact N-O 3.43Å; G706-A718 PolarHBondContact O-N 3.26Å; A718-T720 PolarHBondContact O-N 3.42Å; A718-I725 HydrophobicContact CB-CD1 3.9Å; A718-P751 HydrophobicContact CB-CB 4.44Å; A718-V754 HydrophobicContact CB-CB 4.49Å; A718-V754 HydrophobicContact CB-CG1 4.33Å
719	D	97.3	Very high	96.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	82.9	-177.7	-174.1	11.9	0	0	0	109	F701 T702 E703 N721 N722 H723 R724 Q726	F701-D719 HydrophobicContact CD1-CB 4.09Å; T702-D719 PolarHBondContact N-OD1 2.89Å; E703-D719 PolarHBondContact N-OD1 2.67Å; E703-D719 CarbonylContact O-C 3.49Å; E703-D719 WeakPolarHBondContact O-CA 3.31Å; D719-N721 PolarHBondContact O-N 3.01Å; D719-N722 HydrophobicContact CB-CB 4.45Å; D719-N722 CarbonylContact O-C 3.57Å; D719-N722 PolarHBondContact O-N 3.13Å; D719-N722 VanDerWaalsContact O-N 3.15Å; D719-N722 PolarHBondContact OD1-ND2 3.26Å; D719-N722 WeakPolarHBondContact OD2-CB 3.1Å; D719-N722 PolarHBondContact OD2-ND2 3.31Å; D719-H723 PolarHBondContact O-N 3.01Å; D719-H723 VanDerWaalsContact O-N 3.15Å; D719-R724 HydrophobicContact CB-CG 3.9Å; D719-R724 PolarHBondContact N-O 3.21Å; D719-R724 IonicContact OD2-CZ 3.68Å; D719-R724 IonicContact OD2-NE 2.74Å; D719-R724 PolarHBondContact OD2-NE 3.37Å; D719-R724 IonicContact OD2-NH2 3.87Å; D719-R724 PolarHBondContact OD2-NH2 3Å; D719-Q726 PolarHBondContact OD2-NE2 3.37Å; D719-Q726 VanDerWaalsContact OD2-NE2 3.14Å
720	T	96.9	Very high	96.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-54.9	-50.3	-160.7	-57.6	0	0	0	0	113	E703 S705 A718 N722 H723 Y750 P751	E703-T720 PolarHBondContact O-N 3.32Å; E703-T720 PolarHBondContact O-OG1 3.33Å; S705-T720 WeakPolarHBondContact CB-OG1 3.43Å; S705-T720 PolarHBondContact OG-OG1 3.31Å; A718-T720 PolarHBondContact O-N 3.42Å; T720-N722 VanDerWaalsContact C-N 3.3Å; T720-N722 PolarHBondContact O-N 2.82Å; T720-H723 PolarHBondContact O-N 3.28Å; T720-Y750 HydrophobicContact CG2-CD1 4.21Å; T720-P751 VanDerWaalsContact CA-O 3.28Å; T720-P751 WeakPolarHBondContact CA-O 3.44Å; T720-P751 VanDerWaalsContact CB-O 3.29Å; T720-P751 WeakPolarHBondContact CB-O 3.48Å; T720-P751 PolarHBondContact OG1-O 3.43Å
721	N	95.3	Very high	96.5	Very high	60 Å²	60	26.2 Å²	26.2	32%	0.321	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-85.2	-6.3	-173.2	-62.2	-17.4	0	0	0	113	T702 E703 D719	T702-N721 HydrophobicContact CG2-CB 3.62Å; E703-N721 HydrophobicContact CB-CB 4.2Å; E703-N721 VanDerWaalsContact CB-ND2 3.33Å; E703-N721 WeakPolarHBondContact CB-ND2 3.4Å; E703-N721 PolarHBondContact OE2-ND2 2.72Å; D719-N721 PolarHBondContact O-N 3.01Å
722	N	96.3	Very high	96.5	Very high	30 Å²	30	24.8 Å²	24.8	16%	0.16	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-100.3	5.3	167.8	-68.1	-23.5	0	0	0	112.5	G695 T702 D719 T720 R724	G695-N722 PolarHBondContact O-ND2 2.89Å; T702-N722 VanDerWaalsContact CB-OD1 3.27Å; T702-N722 WeakPolarHBondContact CB-OD1 3.36Å; T702-N722 PolarHBondContact N-ND2 3.48Å; T702-N722 VanDerWaalsContact N-ND2 3.19Å; T702-N722 VanDerWaalsContact OG1-CG 3.23Å; T702-N722 PolarHBondContact OG1-ND2 3.39Å; T702-N722 VanDerWaalsContact OG1-ND2 3.1Å; T702-N722 PolarHBondContact OG1-OD1 3.22Å; D719-N722 HydrophobicContact CB-CB 4.45Å; D719-N722 CarbonylContact O-C 3.57Å; D719-N722 PolarHBondContact O-N 3.13Å; D719-N722 VanDerWaalsContact O-N 3.15Å; D719-N722 PolarHBondContact OD1-ND2 3.26Å; D719-N722 WeakPolarHBondContact OD2-CB 3.1Å; D719-N722 PolarHBondContact OD2-ND2 3.31Å; T720-N722 VanDerWaalsContact C-N 3.3Å; T720-N722 PolarHBondContact O-N 2.82Å; N722-R724 VanDerWaalsContact C-N 3.27Å; N722-R724 HydrophobicContact CB-CG 3.92Å; N722-R724 PolarHBondContact ND2-NH2 2.97Å; N722-R724 PolarHBondContact O-N 3.28Å
723	H	97.1	Very high	96.5	Very high	17 Å²	17	26.5 Å²	26.5	8%	0.079	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	36.8	173.2	-64.4	-102.1	0	0	0	114.6	D719 T720 G739 C741 L748 Y750	D719-H723 PolarHBondContact O-N 3.01Å; D719-H723 VanDerWaalsContact O-N 3.15Å; T720-H723 PolarHBondContact O-N 3.28Å; H723-G739 CarbonylContact O-C 3.34Å; H723-C741 HydrophobicContact CB-CB 3.77Å; H723-C741 VanDerWaalsContact CE1-SG 3.54Å; H723-C741 PolarHBondContact ND1-SG 2.87Å; H723-C741 VanDerWaalsContact ND1-SG 3.43Å; H723-L748 PolarHBondContact ND1-O 3.12Å; H723-L748 VanDerWaalsContact ND1-O 3.16Å; H723-L748 WeakPolarHBondContact O-CB 3.45Å; H723-Y750 AromaticContact CE1-CD1 3.71Å; H723-Y750 AromaticContact CE1-CE1 3.62Å; H723-Y750 AromaticContact CE1-CE2 3.96Å; H723-Y750 AromaticContact CE1-CG 3.93Å; H723-Y750 AromaticContact CE1-CZ 3.75Å; H723-Y750 PolarHBondContact ND1-N 3.35Å; H723-Y750 AromaticContact NE2-CD1 3.72Å; H723-Y750 AromaticContact NE2-CE1 3.36Å; H723-Y750 WeakPolarHBondContact NE2-CE1 3.39Å; H723-Y750 AromaticContact NE2-CZ 3.76Å
724	R	97.5	Very high	96.6	Very high	14 Å²	14	27.8 Å²	27.8	5%	0.053	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	161.5	-172.1	65.8	-178.3	177.1	-175	-6.6	113.3	V696 S697 Q700 D719 N722 Q726 Q737 F738	V696-R724 PolarHBondContact O-NH1 3.22Å; V696-R724 PolarHBondContact O-NH2 3.48Å; S697-R724 PolarHBondContact O-NH1 2.83Å; S697-R724 PolarHBondContact O-NH2 2.87Å; Q700-R724 PolarHBondContact O-NH2 3.01Å; D719-R724 HydrophobicContact CB-CG 3.9Å; D719-R724 PolarHBondContact N-O 3.21Å; D719-R724 IonicContact OD2-CZ 3.68Å; D719-R724 IonicContact OD2-NE 2.74Å; D719-R724 PolarHBondContact OD2-NE 3.37Å; D719-R724 IonicContact OD2-NH2 3.87Å; D719-R724 PolarHBondContact OD2-NH2 3Å; N722-R724 VanDerWaalsContact C-N 3.27Å; N722-R724 HydrophobicContact CB-CG 3.92Å; N722-R724 PolarHBondContact ND2-NH2 2.97Å; N722-R724 PolarHBondContact O-N 3.28Å; R724-Q726 HydrophobicContact CG-CG 4.33Å; R724-Q726 VanDerWaalsContact CZ-NE2 3.33Å; R724-Q737 VanDerWaalsContact CD-OE1 3.25Å; R724-F738 WeakPolarHBondContact CA-O 3.34Å
725	I	98.5	Very high	96.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.5	161.7	-54.7	-54.6	0	0	0	108.2	I716 V717 A718 I727 Q737 F738 L748 P751 V765	I716-I725 HydrophobicContact CG2-CG2 3.35Å; V717-I725 WeakPolarHBondContact O-CA 3.47Å; A718-I725 HydrophobicContact CB-CD1 3.9Å; I725-I727 HydrophobicContact CG2-CD1 4.06Å; I725-I727 HydrophobicContact CG2-CG1 4.49Å; I725-Q737 CarbonylContact O-C 3.56Å; I725-Q737 VanDerWaalsContact O-CA 3.23Å; I725-Q737 WeakPolarHBondContact O-CA 3.3Å; I725-Q737 WeakPolarHBondContact O-CB 3.26Å; I725-F738 HydrophobicContact CB-CD1 4.24Å; I725-F738 HydrophobicContact CB-CD2 4.19Å; I725-F738 HydrophobicContact CB-CE1 3.88Å; I725-F738 HydrophobicContact CB-CE2 3.78Å; I725-F738 HydrophobicContact CB-CG 4.41Å; I725-F738 HydrophobicContact CB-CZ 3.64Å; I725-F738 HydrophobicContact CG1-CD2 4.28Å; I725-F738 HydrophobicContact CG1-CE1 4.47Å; I725-F738 HydrophobicContact CG1-CE2 3.59Å; I725-F738 HydrophobicContact CG1-CZ 3.73Å; I725-F738 HydrophobicContact CG2-CE1 3.86Å; I725-F738 HydrophobicContact CG2-CE2 4.46Å; I725-F738 HydrophobicContact CG2-CZ 3.82Å; I725-F738 PolarHBondContact N-O 3.11Å; I725-F738 PolarHBondContact O-N 3.08Å; I725-L748 HydrophobicContact CD1-CD1 4.27Å; I725-L748 HydrophobicContact CG1-CD1 3.84Å; I725-P751 HydrophobicContact CD1-CB 4.19Å; I725-P751 HydrophobicContact CD1-CG 4.5Å; I725-V765 HydrophobicContact CD1-CG1 3.96Å; I725-V765 HydrophobicContact CD1-CG2 3.8Å; I725-V765 HydrophobicContact CG1-CG2 3.89Å
726	Q	98.1	Very high	96.6	Very high	0 Å²	0	34 Å²	34	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.5	170.9	-66.3	-170.9	69.2	0	0	110.2	Q700 F701 V717 D719 R724 F728 F734 Q737	Q700-Q726 PolarHBondContact O-NE2 3Å; F701-Q726 HydrophobicContact CE1-CB 4.39Å; F701-Q726 VanDerWaalsContact CE1-NE2 3.34Å; V717-Q726 PolarHBondContact N-O 3.45Å; V717-Q726 PolarHBondContact O-N 3.01Å; D719-Q726 PolarHBondContact OD2-NE2 3.37Å; D719-Q726 VanDerWaalsContact OD2-NE2 3.14Å; R724-Q726 HydrophobicContact CG-CG 4.33Å; R724-Q726 VanDerWaalsContact CZ-NE2 3.33Å; Q726-F728 HydrophobicContact CB-CE2 3.53Å; Q726-F728 HydrophobicContact CB-CZ 3.89Å; Q726-F734 HydrophobicContact CB-CE2 4.32Å; Q726-F734 HydrophobicContact CG-CE2 4.26Å; Q726-Q737 HydrophobicContact CG-CB 3.99Å
727	I	98.1	Very high	96.6	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.9	-176.5	-54.7	81.6	0	0	0	108.9	D714 I715 I716 I725 K735 F736 F738	D714-I727 HydrophobicContact CB-CG2 4.15Å; I715-I727 WeakPolarHBondContact O-CA 3.34Å; I716-I727 HydrophobicContact CG1-CG1 4.33Å; I716-I727 HydrophobicContact CG1-CG2 4.45Å; I716-I727 HydrophobicContact CG2-CG1 4.44Å; I725-I727 HydrophobicContact CG2-CD1 4.06Å; I725-I727 HydrophobicContact CG2-CG1 4.49Å; I727-K735 HydrophobicContact CG2-CD 4.3Å; I727-K735 WeakPolarHBondContact O-CB 3.44Å; I727-K735 PolarHBondContact O-N 3.5Å; I727-F736 HydrophobicContact CB-CD1 4.21Å; I727-F736 HydrophobicContact CB-CE1 3.98Å; I727-F736 HydrophobicContact CB-CZ 4.3Å; I727-F736 HydrophobicContact CD1-CD2 3.86Å; I727-F736 HydrophobicContact CD1-CE1 4.27Å; I727-F736 HydrophobicContact CD1-CE2 3.6Å; I727-F736 HydrophobicContact CD1-CG 4.31Å; I727-F736 HydrophobicContact CD1-CZ 3.81Å; I727-F736 WeakPolarHBondContact CD1-O 3.5Å; I727-F736 HydrophobicContact CG1-CE1 4.14Å; I727-F736 HydrophobicContact CG1-CE2 4.25Å; I727-F736 HydrophobicContact CG1-CZ 3.93Å; I727-F736 HydrophobicContact CG2-CE1 4.1Å; I727-F736 PolarHBondContact N-O 3.36Å; I727-F736 PolarHBondContact O-N 3.28Å; I727-F738 HydrophobicContact CD1-CD1 3.69Å; I727-F738 HydrophobicContact CD1-CE1 3.72Å
728	F	98	Very high	96.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	162.5	179.3	-53.2	-100.2	0	0	0	109.5	F691 A699 F701 D714 I715 V717 Q726 R733 F734	F691-F728 AromaticContact CD2-CD1 3.86Å; F691-F728 HydrophobicContact CD2-CD1 3.86Å; F691-F728 AromaticContact CD2-CE1 3.91Å; F691-F728 HydrophobicContact CD2-CE1 3.91Å; F691-F728 HydrophobicContact CD2-CG 4.37Å; F691-F728 HydrophobicContact CD2-CZ 4.46Å; F691-F728 HydrophobicContact CE2-CB 4.21Å; F691-F728 AromaticContact CE2-CD1 3.52Å; F691-F728 HydrophobicContact CE2-CD1 3.52Å; F691-F728 AromaticContact CE2-CD2 3.85Å; F691-F728 HydrophobicContact CE2-CD2 3.85Å; F691-F728 AromaticContact CE2-CE1 3.81Å; F691-F728 HydrophobicContact CE2-CE1 3.81Å; F691-F728 HydrophobicContact CE2-CE2 4.12Å; F691-F728 AromaticContact CE2-CG 3.57Å; F691-F728 HydrophobicContact CE2-CG 3.57Å; F691-F728 HydrophobicContact CE2-CZ 4.13Å; F691-F728 HydrophobicContact CZ-CB 4.4Å; F691-F728 HydrophobicContact CZ-CD1 4.46Å; F691-F728 HydrophobicContact CZ-CG 4.2Å; A699-F728 HydrophobicContact CB-CE1 3.91Å; F701-F728 HydrophobicContact CE1-CE2 4Å; F701-F728 AromaticContact CE1-CZ 3.98Å; F701-F728 HydrophobicContact CE1-CZ 3.98Å; F701-F728 HydrophobicContact CE2-CZ 4.39Å; F701-F728 HydrophobicContact CZ-CE1 4.38Å; F701-F728 AromaticContact CZ-CE2 3.65Å; F701-F728 HydrophobicContact CZ-CE2 3.65Å; F701-F728 AromaticContact CZ-CZ 3.42Å; F701-F728 HydrophobicContact CZ-CZ 3.42Å; F701-F728 VanDerWaalsContact CZ-CZ 3.42Å; D714-F728 CarbonylContact C-O 3.59Å; D714-F728 VanDerWaalsContact CA-O 3.25Å; D714-F728 WeakPolarHBondContact CA-O 3.48Å; D714-F728 WeakPolarHBondContact CB-O 3.28Å; I715-F728 HydrophobicContact CB-CB 4.32Å; I715-F728 PolarHBondContact N-O 2.94Å; I715-F728 PolarHBondContact O-N 3.27Å; V717-F728 HydrophobicContact CB-CE2 4.39Å; V717-F728 HydrophobicContact CG2-CD2 3.88Å; V717-F728 HydrophobicContact CG2-CE2 3.8Å; Q726-F728 HydrophobicContact CB-CE2 3.53Å; Q726-F728 HydrophobicContact CB-CZ 3.89Å; F728-R733 CarbonylContact C-O 3.49Å; F728-R733 WeakPolarHBondContact CA-O 3.44Å; F728-R733 WeakPolarHBondContact CB-O 3.3Å; F728-F734 HydrophobicContact CD1-CB 4.06Å; F728-F734 HydrophobicContact CD1-CD2 4.43Å; F728-F734 HydrophobicContact CE1-CB 3.95Å; F728-F734 AromaticContact CE1-CD2 3.85Å; F728-F734 HydrophobicContact CE1-CD2 3.85Å; F728-F734 HydrophobicContact CE1-CG 4.41Å; F728-F734 AromaticContact CZ-CD2 4Å; F728-F734 HydrophobicContact CZ-CD2 4Å
729	D	95.4	Very high	96.3	Very high	23 Å²	23	39.7 Å²	39.7	12%	0.123	19%	0.189	C	C	.	.			trans	-83.5	175.4	164.1	61.4	31	0	0	0	112	I715 E731 G732 R733 K735	I715-D729 WeakPolarHBondContact CD1-O 3.41Å; D729-E731 PolarHBondContact O-N 2.79Å; D729-E731 VanDerWaalsContact O-N 3.15Å; D729-E731 WeakPolarHBondContact OD1-CA 3.43Å; D729-E731 WeakPolarHBondContact OD1-CB 3.43Å; D729-E731 PolarHBondContact OD1-N 2.97Å; D729-G732 PolarHBondContact O-N 2.94Å; D729-G732 PolarHBondContact OD1-N 2.87Å; D729-R733 PolarHBondContact N-O 3.37Å; D729-R733 PolarHBondContact OD1-N 2.8Å; D729-R733 IonicContact OD1-NE 3.01Å; D729-R733 IonicContact OD2-CZ 2.7Å; D729-R733 IonicContact OD2-NE 3.83Å; D729-R733 PolarHBondContact OD2-NE 2.95Å; D729-R733 IonicContact OD2-NH2 3.13Å; D729-R733 PolarHBondContact OD2-NH2 3Å; D729-K735 HydrophobicContact CB-CD 4.15Å; D729-K735 HydrophobicContact CB-CG 4.49Å
730	K	93.4	Very high	96	Very high	103 Å²	103	44.6 Å²	44.6	45%	0.448	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	178.1	72.6	-172.6	-172.5	-179.2	0	115	N713 G732 L931 I947	N713-K730 HydrophobicContact CB-CB 4.07Å; N713-K730 HydrophobicContact CB-CD 4.4Å; N713-K730 WeakPolarHBondContact O-CA 3.19Å; N713-K730 WeakPolarHBondContact O-CB 3.47Å; N713-K730 PolarHBondContact O-N 2.94Å; K730-G732 VanDerWaalsContact C-N 3.35Å; K730-L931 HydrophobicContact CB-CD2 3.7Å; K730-I947 WeakPolarHBondContact O-CD1 3.43Å
731	E	92.6	Very high	95.9	Very high	86 Å²	86	48.3 Å²	48.3	40%	0.402	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-14	174	-76.3	90.9	-132.3	0	0	112.1	D729 R733	D729-E731 PolarHBondContact O-N 2.79Å; D729-E731 VanDerWaalsContact O-N 3.15Å; D729-E731 WeakPolarHBondContact OD1-CA 3.43Å; D729-E731 WeakPolarHBondContact OD1-CB 3.43Å; D729-E731 PolarHBondContact OD1-N 2.97Å; E731-R733 HydrophobicContact CB-CG 4.48Å; E731-R733 IonicContact OE2-CZ 3.81Å; E731-R733 IonicContact OE2-NH1 3.9Å; E731-R733 IonicContact OE2-NH2 2.82Å; E731-R733 PolarHBondContact OE2-NH2 2.81Å
732	G	93.3	Very high	95.7	Very high	11 Å²	11	46.2 Å²	46.2	11%	0.113	23%	0.229	C	C	.	.			trans	92.8	13.7	-176.5	0	0	0	0	0	114	D729 K730	D729-G732 PolarHBondContact O-N 2.94Å; D729-G732 PolarHBondContact OD1-N 2.87Å; K730-G732 VanDerWaalsContact C-N 3.35Å
733	R	95.3	Very high	95.4	Very high	151 Å²	151	51.3 Å²	51.3	57%	0.57	25%	0.25	S	C	*	.			trans	-82.3	136	175.6	-56	175.7	-62.3	-145.4	-7.5	109.7	F728 D729 E731	F728-R733 CarbonylContact C-O 3.49Å; F728-R733 WeakPolarHBondContact CA-O 3.44Å; F728-R733 WeakPolarHBondContact CB-O 3.3Å; D729-R733 PolarHBondContact N-O 3.37Å; D729-R733 PolarHBondContact OD1-N 2.8Å; D729-R733 IonicContact OD1-NE 3.01Å; D729-R733 IonicContact OD2-CZ 2.7Å; D729-R733 IonicContact OD2-NE 3.83Å; D729-R733 PolarHBondContact OD2-NE 2.95Å; D729-R733 IonicContact OD2-NH2 3.13Å; D729-R733 PolarHBondContact OD2-NH2 3Å; E731-R733 HydrophobicContact CB-CG 4.48Å; E731-R733 IonicContact OE2-CZ 3.81Å; E731-R733 IonicContact OE2-NH1 3.9Å; E731-R733 IonicContact OE2-NH2 2.82Å; E731-R733 PolarHBondContact OE2-NH2 2.81Å
734	F	96.8	Very high	95.2	Very high	54 Å²	54	58.3 Å²	58.3	24%	0.237	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	138.9	177.7	-179.1	-100.2	0	0	0	111.3	E698 A699 Q726 F728 F736 Q737	E698-F734 HydrophobicContact CB-CD1 4.13Å; E698-F734 HydrophobicContact CB-CD2 4.39Å; E698-F734 HydrophobicContact CB-CE1 3.86Å; E698-F734 HydrophobicContact CB-CE2 4.12Å; E698-F734 HydrophobicContact CB-CG 4.38Å; E698-F734 HydrophobicContact CB-CZ 3.83Å; E698-F734 HydrophobicContact CG-CE1 3.83Å; E698-F734 HydrophobicContact CG-CE2 4.48Å; E698-F734 HydrophobicContact CG-CZ 3.77Å; E698-F734 VanDerWaalsContact OE1-CE1 3.32Å; E698-F734 WeakPolarHBondContact OE1-CE1 3.39Å; E698-F734 WeakPolarHBondContact OE2-CE1 3.4Å; A699-F734 HydrophobicContact CB-CB 4.39Å; Q726-F734 HydrophobicContact CB-CE2 4.32Å; Q726-F734 HydrophobicContact CG-CE2 4.26Å; F728-F734 HydrophobicContact CD1-CB 4.06Å; F728-F734 HydrophobicContact CD1-CD2 4.43Å; F728-F734 HydrophobicContact CE1-CB 3.95Å; F728-F734 AromaticContact CE1-CD2 3.85Å; F728-F734 HydrophobicContact CE1-CD2 3.85Å; F728-F734 HydrophobicContact CE1-CG 4.41Å; F728-F734 AromaticContact CZ-CD2 4Å; F728-F734 HydrophobicContact CZ-CD2 4Å; F734-F736 WeakPolarHBondContact CE2-O 3.36Å; F734-Q737 HydrophobicContact CE2-CB 4.07Å; F734-Q737 HydrophobicContact CZ-CB 3.92Å; F734-Q737 HydrophobicContact CZ-CG 4.06Å
735	K	97	Very high	94.9	Very high	97 Å²	97	62.6 Å²	62.6	42%	0.422	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-51.7	177.7	-60.3	-179.5	67.8	173.9	0	111.7	D714 I727 D729	D714-K735 WeakPolarHBondContact OD1-CD 3.38Å; D714-K735 IonicContact OD1-NZ 3.53Å; D714-K735 PolarHBondContact OD1-NZ 3.05Å; D714-K735 IonicContact OD2-NZ 2.67Å; D714-K735 PolarHBondContact OD2-NZ 2.88Å; I727-K735 HydrophobicContact CG2-CD 4.3Å; I727-K735 WeakPolarHBondContact O-CB 3.44Å; I727-K735 PolarHBondContact O-N 3.5Å; D729-K735 HydrophobicContact CB-CD 4.15Å; D729-K735 HydrophobicContact CB-CG 4.49Å
736	F	97.2	Very high	94.4	Very high	60 Å²	60	63.5 Å²	63.5	26%	0.263	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	173	175.8	65.3	-76.5	0	0	0	110.6	I727 F734 F738 Q779	I727-F736 HydrophobicContact CB-CD1 4.21Å; I727-F736 HydrophobicContact CB-CE1 3.98Å; I727-F736 HydrophobicContact CB-CZ 4.3Å; I727-F736 HydrophobicContact CD1-CD2 3.86Å; I727-F736 HydrophobicContact CD1-CE1 4.27Å; I727-F736 HydrophobicContact CD1-CE2 3.6Å; I727-F736 HydrophobicContact CD1-CG 4.31Å; I727-F736 HydrophobicContact CD1-CZ 3.81Å; I727-F736 WeakPolarHBondContact CD1-O 3.5Å; I727-F736 HydrophobicContact CG1-CE1 4.14Å; I727-F736 HydrophobicContact CG1-CE2 4.25Å; I727-F736 HydrophobicContact CG1-CZ 3.93Å; I727-F736 HydrophobicContact CG2-CE1 4.1Å; I727-F736 PolarHBondContact N-O 3.36Å; I727-F736 PolarHBondContact O-N 3.28Å; F734-F736 WeakPolarHBondContact CE2-O 3.36Å; F736-F738 HydrophobicContact CD2-CD1 4.47Å; F736-F738 AromaticContact CE2-CD1 3.95Å; F736-F738 HydrophobicContact CE2-CD1 3.95Å; F736-F738 HydrophobicContact CE2-CE1 4.48Å; F736-Q779 WeakPolarHBondContact CZ-O 3.42Å
737	Q	97.2	Very high	94.3	Very high	74 Å²	74	64.4 Å²	64.4	35%	0.346	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	160.8	171.5	65.6	179.4	-2.9	0	0	111.3	R724 I725 Q726 F734	R724-Q737 VanDerWaalsContact CD-OE1 3.25Å; I725-Q737 CarbonylContact O-C 3.56Å; I725-Q737 VanDerWaalsContact O-CA 3.23Å; I725-Q737 WeakPolarHBondContact O-CA 3.3Å; I725-Q737 WeakPolarHBondContact O-CB 3.26Å; Q726-Q737 HydrophobicContact CG-CB 3.99Å; F734-Q737 HydrophobicContact CE2-CB 4.07Å; F734-Q737 HydrophobicContact CZ-CB 3.92Å; F734-Q737 HydrophobicContact CZ-CG 4.06Å
738	F	97.4	Very high	94.2	Very high	19 Å²	19	64.2 Å²	64.2	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.4	169.9	66.4	-98.4	0	0	0	112.4	R724 I725 I727 F736 I763 Y777	R724-F738 WeakPolarHBondContact CA-O 3.34Å; I725-F738 HydrophobicContact CB-CD1 4.24Å; I725-F738 HydrophobicContact CB-CD2 4.19Å; I725-F738 HydrophobicContact CB-CE1 3.88Å; I725-F738 HydrophobicContact CB-CE2 3.78Å; I725-F738 HydrophobicContact CB-CG 4.41Å; I725-F738 HydrophobicContact CB-CZ 3.64Å; I725-F738 HydrophobicContact CG1-CD2 4.28Å; I725-F738 HydrophobicContact CG1-CE1 4.47Å; I725-F738 HydrophobicContact CG1-CE2 3.59Å; I725-F738 HydrophobicContact CG1-CZ 3.73Å; I725-F738 HydrophobicContact CG2-CE1 3.86Å; I725-F738 HydrophobicContact CG2-CE2 4.46Å; I725-F738 HydrophobicContact CG2-CZ 3.82Å; I725-F738 PolarHBondContact N-O 3.11Å; I725-F738 PolarHBondContact O-N 3.08Å; I727-F738 HydrophobicContact CD1-CD1 3.69Å; I727-F738 HydrophobicContact CD1-CE1 3.72Å; F736-F738 HydrophobicContact CD2-CD1 4.47Å; F736-F738 AromaticContact CE2-CD1 3.95Å; F736-F738 HydrophobicContact CE2-CD1 3.95Å; F736-F738 HydrophobicContact CE2-CE1 4.48Å; F738-I763 HydrophobicContact CE1-CD1 3.84Å; F738-I763 HydrophobicContact CZ-CD1 4.08Å; F738-I763 HydrophobicContact CZ-CG2 4.28Å; F738-Y777 AromaticContact CD2-CD1 3.64Å; F738-Y777 HydrophobicContact CD2-CD1 3.64Å; F738-Y777 AromaticContact CD2-CE1 3.61Å; F738-Y777 HydrophobicContact CD2-CE1 3.61Å; F738-Y777 HydrophobicContact CD2-CG 4.14Å; F738-Y777 AromaticContact CE2-CD1 3.4Å; F738-Y777 HydrophobicContact CE2-CD1 3.4Å; F738-Y777 AromaticContact CE2-CD2 3.62Å; F738-Y777 HydrophobicContact CE2-CD2 3.62Å; F738-Y777 AromaticContact CE2-CE1 3.62Å; F738-Y777 HydrophobicContact CE2-CE1 3.62Å; F738-Y777 AromaticContact CE2-CE2 3.84Å; F738-Y777 HydrophobicContact CE2-CE2 3.84Å; F738-Y777 AromaticContact CE2-CG 3.41Å; F738-Y777 HydrophobicContact CE2-CG 3.41Å; F738-Y777 VanDerWaalsContact CE2-CG 3.41Å; F738-Y777 AromaticContact CE2-CZ 3.84Å; F738-Y777 HydrophobicContact CZ-CD1 4.16Å; F738-Y777 HydrophobicContact CZ-CD2 4.18Å; F738-Y777 AromaticContact CZ-CG 3.86Å; F738-Y777 HydrophobicContact CZ-CG 3.86Å
739	G	93.6	Very high	94.1	Very high	31 Å²	31	65 Å²	65	32%	0.32	32%	0.316	S	S	.	.			trans	95.5	147.2	-174.1	0	0	0	0	0	112.7	H723	H723-G739 CarbonylContact O-C 3.34Å
740	E	91.4	Very high	94.2	Very high	102 Å²	102	67.8 Å²	67.8	48%	0.477	33%	0.325	S	S	.	.			trans	-140.2	156.5	173.4	61.7	175.3	-159.6	0	0	108	G742 R744 Q747 L748	E740-G742 PolarHBondContact O-N 3.47Å; E740-R744 IonicContact OE1-CZ 2.9Å; E740-R744 IonicContact OE1-NH2 3.64Å; E740-R744 PolarHBondContact OE1-NH2 3.41Å; E740-Q747 HydrophobicContact CG-CB 4.25Å; E740-Q747 HydrophobicContact CG-CG 3.73Å; E740-Q747 CarbonylContact O-C 3.58Å; E740-Q747 WeakPolarHBondContact O-CA 3.26Å; E740-Q747 WeakPolarHBondContact O-CB 3.16Å; E740-Q747 WeakPolarHBondContact OE1-CG 3.39Å; E740-Q747 PolarHBondContact OE1-NE2 2.84Å; E740-L748 PolarHBondContact O-N 3.13Å
741	C	94.6	Very high	94.4	Very high	79 Å²	79	62.9 Å²	62.9	53%	0.534	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-63.2	122.3	-179.9	-175.5	0	0	0	0	111.8	H723 L748	H723-C741 HydrophobicContact CB-CB 3.77Å; H723-C741 VanDerWaalsContact CE1-SG 3.54Å; H723-C741 PolarHBondContact ND1-SG 2.87Å; H723-C741 VanDerWaalsContact ND1-SG 3.43Å; C741-L748 WeakPolarHBondContact CA-O 3.42Å
742	G	91	Very high	94.5	Very high	16 Å²	16	59 Å²	59	17%	0.165	29%	0.286	C	S	.	.	S	Bend	trans	166.8	-154.5	175.3	0	0	0	0	0	115.1	E740 L748	E740-G742 PolarHBondContact O-N 3.47Å; G742-L748 PolarHBondContact N-O 3.19Å
743	K	90.6	Very high	94.7	Very high	136 Å²	136	58.8 Å²	58.8	59%	0.591	28%	0.282	S	S	*	.	S	Bend	trans	-139.1	-10.2	-175.2	-64.6	-177.9	-178.4	177.5	0	114.4	L749 K786	K743-L749 HydrophobicContact CG-CD2 4.14Å; K743-K786 PolarHBondContact O-NZ 3.25Å
744	R	92.5	Very high	94.9	Very high	164 Å²	164	51.9 Å²	51.9	62%	0.619	26%	0.256	S	S	*	.	S	Bend	trans	-67.4	165.3	172.8	-54.8	178.3	-63.9	167.4	5.4	109.6	E740 G746 Q747	E740-R744 IonicContact OE1-CZ 2.9Å; E740-R744 IonicContact OE1-NH2 3.64Å; E740-R744 PolarHBondContact OE1-NH2 3.41Å; R744-G746 PolarHBondContact O-N 3.27Å; R744-Q747 HydrophobicContact CB-CG 3.95Å; R744-Q747 VanDerWaalsContact CB-OE1 3.25Å; R744-Q747 VanDerWaalsContact CG-OE1 3.28Å; R744-Q747 VanDerWaalsContact NE-CD 3.32Å; R744-Q747 VanDerWaalsContact NE-NE2 3.17Å; R744-Q747 VanDerWaalsContact NH2-NE2 3.12Å; R744-Q747 WeakPolarHBondContact O-CB 3.41Å; R744-Q747 PolarHBondContact O-N 3.32Å
745	D	91.9	Very high	94.9	Very high	105 Å²	105	49.7 Å²	49.7	56%	0.561	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	129.9	178.1	-72.5	4.8	0	0	0	110.9	Q747 F783 K786	D745-Q747 VanDerWaalsContact C-N 3.29Å; D745-Q747 PolarHBondContact O-N 3.29Å; D745-F783 HydrophobicContact CB-CD1 3.81Å; D745-F783 HydrophobicContact CB-CE1 3.43Å; D745-F783 VanDerWaalsContact CB-CE1 3.43Å; D745-F783 HydrophobicContact CB-CE2 4.43Å; D745-F783 HydrophobicContact CB-CG 4.45Å; D745-F783 HydrophobicContact CB-CZ 3.75Å; D745-K786 VanDerWaalsContact OD1-CE 3.23Å; D745-K786 WeakPolarHBondContact OD1-CE 3.39Å; D745-K786 IonicContact OD1-NZ 3.05Å; D745-K786 PolarHBondContact OD1-NZ 3.41Å
746	G	88.2	Confident	95	Very high	18 Å²	18	45.8 Å²	45.8	19%	0.186	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-18.6	-173.7	0	0	0	0	0	116	R744 Y777 F783	R744-G746 PolarHBondContact O-N 3.27Å; G746-Y777 PolarHBondContact O-OH 3.25Å; G746-F783 VanDerWaalsContact N-CD2 3.3Å
747	Q	95.4	Very high	95	Very high	20 Å²	20	43.7 Å²	43.7	9%	0.093	22%	0.224	C	C	.	.			trans	-76.9	150.1	170.3	-54.9	-170.1	-55.6	0	0	110.6	E740 R744 D745 Q775	E740-Q747 HydrophobicContact CG-CB 4.25Å; E740-Q747 HydrophobicContact CG-CG 3.73Å; E740-Q747 CarbonylContact O-C 3.58Å; E740-Q747 WeakPolarHBondContact O-CA 3.26Å; E740-Q747 WeakPolarHBondContact O-CB 3.16Å; E740-Q747 WeakPolarHBondContact OE1-CG 3.39Å; E740-Q747 PolarHBondContact OE1-NE2 2.84Å; R744-Q747 HydrophobicContact CB-CG 3.95Å; R744-Q747 VanDerWaalsContact CB-OE1 3.25Å; R744-Q747 VanDerWaalsContact CG-OE1 3.28Å; R744-Q747 VanDerWaalsContact NE-CD 3.32Å; R744-Q747 VanDerWaalsContact NE-NE2 3.17Å; R744-Q747 VanDerWaalsContact NH2-NE2 3.12Å; R744-Q747 WeakPolarHBondContact O-CB 3.41Å; R744-Q747 PolarHBondContact O-N 3.32Å; D745-Q747 VanDerWaalsContact C-N 3.29Å; D745-Q747 PolarHBondContact O-N 3.29Å; Q747-Q775 PolarHBondContact O-NE2 3.46Å
748	L	95.9	Very high	94.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-120.1	148	-177.6	-69.1	171.5	0	0	0	112.6	H723 I725 E740 C741 G742 P751 V765 E767 Q775 Y777	H723-L748 PolarHBondContact ND1-O 3.12Å; H723-L748 VanDerWaalsContact ND1-O 3.16Å; H723-L748 WeakPolarHBondContact O-CB 3.45Å; I725-L748 HydrophobicContact CD1-CD1 4.27Å; I725-L748 HydrophobicContact CG1-CD1 3.84Å; E740-L748 PolarHBondContact O-N 3.13Å; C741-L748 WeakPolarHBondContact CA-O 3.42Å; G742-L748 PolarHBondContact N-O 3.19Å; L748-P751 HydrophobicContact CB-CG 4.28Å; L748-P751 HydrophobicContact CD1-CB 4.37Å; L748-P751 HydrophobicContact CD1-CG 4.18Å; L748-V765 HydrophobicContact CD2-CG1 4.14Å; L748-E767 VanDerWaalsContact CA-OE1 3.3Å; L748-E767 WeakPolarHBondContact CA-OE1 3.44Å; L748-E767 WeakPolarHBondContact CD2-OE1 3.42Å; L748-Q775 HydrophobicContact CD2-CG 4.4Å; L748-Y777 HydrophobicContact CD2-CE2 4.09Å; L748-Y777 VanDerWaalsContact CD2-OH 3.27Å; L748-Y777 WeakPolarHBondContact CD2-OH 3.18Å; L748-Y777 WeakPolarHBondContact CG-OH 3.37Å
749	L	95.8	Very high	94.6	Very high	16 Å²	16	50.7 Å²	50.7	8%	0.084	26%	0.26	C	S	.	.	S	Bend	trans	-130.6	101.2	177.1	-151.4	66.4	0	0	0	110.9	K743 E767 P770 T771	K743-L749 HydrophobicContact CG-CD2 4.14Å; L749-E767 PolarHBondContact N-OE1 3.35Å; L749-E767 WeakPolarHBondContact O-CB 3.36Å; L749-P770 HydrophobicContact CD2-CG 3.54Å; L749-T771 HydrophobicContact CB-CG2 4.32Å; L749-T771 HydrophobicContact CD2-CG2 3.92Å
750	Y	96.8	Very high	94.6	Very high	82 Å²	82	51.3 Å²	51.3	32%	0.322	26%	0.26	S	S	.	.	S	Bend	trans	49.7	59.5	-177	-55.8	-67	0	0	0	114.1	T720 H723 N752 R768	T720-Y750 HydrophobicContact CG2-CD1 4.21Å; H723-Y750 AromaticContact CE1-CD1 3.71Å; H723-Y750 AromaticContact CE1-CE1 3.62Å; H723-Y750 AromaticContact CE1-CE2 3.96Å; H723-Y750 AromaticContact CE1-CG 3.93Å; H723-Y750 AromaticContact CE1-CZ 3.75Å; H723-Y750 PolarHBondContact ND1-N 3.35Å; H723-Y750 AromaticContact NE2-CD1 3.72Å; H723-Y750 AromaticContact NE2-CE1 3.36Å; H723-Y750 WeakPolarHBondContact NE2-CE1 3.39Å; H723-Y750 AromaticContact NE2-CZ 3.76Å; Y750-N752 PolarHBondContact O-N 2.8Å; Y750-R768 PolarHBondContact O-N 3.33Å; Y750-R768 VanDerWaalsContact O-N 3.08Å
751	P	97.5	Very high	94.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	128.1	177.7	28.4	-35.4	0	0	0	110.8	A718 T720 I725 L748 V765 T766	A718-P751 HydrophobicContact CB-CB 4.44Å; T720-P751 VanDerWaalsContact CA-O 3.28Å; T720-P751 WeakPolarHBondContact CA-O 3.44Å; T720-P751 VanDerWaalsContact CB-O 3.29Å; T720-P751 WeakPolarHBondContact CB-O 3.48Å; T720-P751 PolarHBondContact OG1-O 3.43Å; I725-P751 HydrophobicContact CD1-CB 4.19Å; I725-P751 HydrophobicContact CD1-CG 4.5Å; L748-P751 HydrophobicContact CB-CG 4.28Å; L748-P751 HydrophobicContact CD1-CB 4.37Å; L748-P751 HydrophobicContact CD1-CG 4.18Å; P751-V765 HydrophobicContact CB-CG1 3.53Å; P751-T766 CarbonylContact C-O 3.57Å; P751-T766 VanDerWaalsContact CA-O 3.32Å; P751-T766 WeakPolarHBondContact CA-O 3.2Å
752	N	96	Very high	95	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	-18.9	-165.8	73.7	-49	0	0	0	117.4	S705 Y750 T766 R768 P795	S705-N752 WeakPolarHBondContact OG-CA 3.41Å; S705-N752 PolarHBondContact OG-O 3.16Å; Y750-N752 PolarHBondContact O-N 2.8Å; N752-T766 PolarHBondContact N-O 3.16Å; N752-T766 PolarHBondContact OD1-O 3.24Å; N752-T766 PolarHBondContact OD1-OG1 3.09Å; N752-R768 HydrophobicContact CB-CG 3.66Å; N752-R768 VanDerWaalsContact CB-NE 3.26Å; N752-P795 PolarHBondContact ND2-O 3.27Å
753	R	97.2	Very high	95.3	Very high	8 Å²	8	44.3 Å²	44.3	3%	0.03	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.3	166.2	-64.9	-71.6	178	-119.1	32.3	108.4	S705 T766 R796 V798 N839 F926 D927	S705-R753 PolarHBondContact O-NH1 3Å; R753-T766 WeakPolarHBondContact CB-OG1 3.49Å; R753-T766 PolarHBondContact N-OG1 3.23Å; R753-T766 PolarHBondContact O-N 2.97Å; R753-R796 WeakPolarHBondContact CD-O 3.43Å; R753-R796 VanDerWaalsContact CG-O 3.24Å; R753-R796 WeakPolarHBondContact CG-O 3.33Å; R753-R796 PolarHBondContact NE-O 2.96Å; R753-V798 HydrophobicContact CB-CG1 3.61Å; R753-N839 PolarHBondContact NH2-OD1 3.32Å; R753-N839 VanDerWaalsContact NH2-OD1 3.12Å; R753-F926 PolarHBondContact NH2-O 3.14Å; R753-D927 VanDerWaalsContact CD-OD2 3.31Å; R753-D927 WeakPolarHBondContact CD-OD2 3.23Å; R753-D927 IonicContact CZ-OD2 3.25Å; R753-D927 IonicContact NE-OD2 2.61Å; R753-D927 IonicContact NH1-OD2 3.06Å
754	V	98.2	Very high	95.7	Very high	6 Å²	6	37.9 Å²	37.9	4%	0.036	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.3	174.9	58	0	0	0	0	108.4	A708 I716 A718 I763 V764 V765	A708-V754 HydrophobicContact CB-CG1 3.93Å; A708-V754 HydrophobicContact CB-CG2 4.44Å; I716-V754 HydrophobicContact CB-CG2 4.43Å; I716-V754 HydrophobicContact CG2-CG1 4.32Å; I716-V754 HydrophobicContact CG2-CG2 3.69Å; A718-V754 HydrophobicContact CB-CB 4.49Å; A718-V754 HydrophobicContact CB-CG1 4.33Å; V754-I763 HydrophobicContact CG2-CG2 3.43Å; V754-I763 VanDerWaalsContact CG2-CG2 3.43Å; V754-V764 CarbonylContact C-O 3.54Å; V754-V764 VanDerWaalsContact CA-O 3.28Å; V754-V764 WeakPolarHBondContact CA-O 3.36Å; V754-V765 HydrophobicContact CG2-CG2 4.33Å
755	A	98.3	Very high	96	Very high	8 Å²	8	30 Å²	30	7%	0.066	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	161.8	168.7	0	0	0	0	0	108.7	V764 V798 V800	A755-V764 PolarHBondContact N-O 3.45Å; A755-V764 PolarHBondContact O-N 3.47Å; A755-V798 HydrophobicContact CB-CG1 4.04Å; A755-V798 HydrophobicContact CB-CG2 4.33Å; A755-V800 HydrophobicContact CB-CG2 4.06Å
756	V	97.7	Very high	96.3	Very high	15 Å²	15	25 Å²	25	9%	0.091	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.1	178.8	-177.9	0	0	0	0	109.2	A708 I716 R758 D762 I763	A708-V756 HydrophobicContact CB-CG2 4.12Å; I716-V756 HydrophobicContact CD1-CG2 3.86Å; I716-V756 HydrophobicContact CG1-CG2 4.14Å; V756-R758 PolarHBondContact O-N 3.5Å; V756-D762 CarbonylContact C-O 3.49Å; V756-D762 WeakPolarHBondContact CA-O 3.41Å; V756-I763 HydrophobicContact CG2-CG1 4.47Å
757	N	97	Very high	96.7	Very high	15 Å²	15	24.2 Å²	24.2	8%	0.08	13%	0.126	C	C	.	.			trans	-68.4	100.8	163.9	-177	-15.8	0	0	0	108.2	V759 S760 G761 D762 V800 M821	N757-V759 PolarHBondContact O-N 2.97Å; N757-V759 PolarHBondContact OD1-N 3.32Å; N757-V759 VanDerWaalsContact OD1-N 3.07Å; N757-S760 WeakPolarHBondContact CB-OG 3.49Å; N757-S760 VanDerWaalsContact CG-OG 3.23Å; N757-S760 PolarHBondContact ND2-OG 3.41Å; N757-S760 VanDerWaalsContact ND2-OG 3.11Å; N757-S760 PolarHBondContact O-N 2.96Å; N757-G761 WeakPolarHBondContact O-CA 3.36Å; N757-G761 PolarHBondContact O-N 3.35Å; N757-D762 HydrophobicContact CB-CB 4.28Å; N757-D762 PolarHBondContact N-O 2.93Å; N757-V800 HydrophobicContact CB-CG1 3.94Å; N757-M821 HydrophobicContact CB-CE 4.06Å
758	R	92.9	Very high	96.5	Very high	115 Å²	115	24.5 Å²	24.5	43%	0.434	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.7	-177.6	-80.4	-177.8	167.3	-114.3	9	114.5	A711 V756 D932	A711-R758 HydrophobicContact CB-CB 4.46Å; V756-R758 PolarHBondContact O-N 3.5Å; R758-D932 IonicContact CZ-OD1 2.72Å; R758-D932 VanDerWaalsContact CZ-OD1 3.29Å; R758-D932 IonicContact CZ-OD2 3.99Å; R758-D932 VanDerWaalsContact NH1-CG 3.29Å; R758-D932 IonicContact NH1-OD1 3.34Å; R758-D932 PolarHBondContact NH1-OD1 3Å; R758-D932 IonicContact NH1-OD2 2.85Å; R758-D932 PolarHBondContact NH1-OD2 3.4Å; R758-D932 IonicContact NH2-OD1 3.59Å; R758-D932 PolarHBondContact NH2-OD1 3.44Å; R758-D932 IonicContact NH2-OD2 2.67Å
759	V	93.6	Very high	96.3	Very high	125 Å²	125	27.5 Å²	27.5	76%	0.758	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-45.4	178.7	-175	0	0	0	0	112.3	N757	N757-V759 PolarHBondContact O-N 2.97Å; N757-V759 PolarHBondContact OD1-N 3.32Å; N757-V759 VanDerWaalsContact OD1-N 3.07Å
760	S	95.2	Very high	96.1	Very high	45 Å²	45	30.2 Å²	30.2	32%	0.315	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-19.7	-178.9	59.4	0	0	0	0	114.4	N757 D762 Q779	N757-S760 WeakPolarHBondContact CB-OG 3.49Å; N757-S760 VanDerWaalsContact CG-OG 3.23Å; N757-S760 PolarHBondContact ND2-OG 3.41Å; N757-S760 VanDerWaalsContact ND2-OG 3.11Å; N757-S760 PolarHBondContact O-N 2.96Å; S760-D762 VanDerWaalsContact C-N 3.3Å; S760-D762 WeakPolarHBondContact CB-OD2 3.46Å; S760-D762 PolarHBondContact OG-N 3.5Å; S760-D762 PolarHBondContact OG-OD2 3.11Å; S760-Q779 PolarHBondContact O-NE2 3.12Å; S760-Q779 VanDerWaalsContact O-NE2 3.16Å
761	G	95.8	Very high	95.9	Very high	10 Å²	10	27.3 Å²	27.3	10%	0.103	16%	0.157	C	C	.	.			trans	80.1	6.4	-169.3	0	0	0	0	0	114.1	N757 Q779	N757-G761 WeakPolarHBondContact O-CA 3.36Å; N757-G761 PolarHBondContact O-N 3.35Å; G761-Q779 WeakPolarHBondContact O-CA 3.32Å; G761-Q779 WeakPolarHBondContact O-CB 3.45Å; G761-Q779 PolarHBondContact O-N 2.76Å
762	D	97.7	Very high	95.8	Very high	34 Å²	34	29.3 Å²	29.3	18%	0.182	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-67.4	133.7	179.9	-61	-44.7	0	0	0	111.6	V756 N757 S760 V776 Y777 L784	V756-D762 CarbonylContact C-O 3.49Å; V756-D762 WeakPolarHBondContact CA-O 3.41Å; N757-D762 HydrophobicContact CB-CB 4.28Å; N757-D762 PolarHBondContact N-O 2.93Å; S760-D762 VanDerWaalsContact C-N 3.3Å; S760-D762 WeakPolarHBondContact CB-OD2 3.46Å; S760-D762 PolarHBondContact OG-N 3.5Å; S760-D762 PolarHBondContact OG-OD2 3.11Å; D762-V776 HydrophobicContact CB-CG1 4.12Å; D762-Y777 CarbonylContact C-O 3.47Å; D762-Y777 VanDerWaalsContact CA-O 3.31Å; D762-Y777 WeakPolarHBondContact CA-O 3.41Å; D762-L784 WeakPolarHBondContact OD1-CD1 3.23Å
763	I	98.2	Very high	95.8	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.4	-177.5	-55.8	173.4	0	0	0	108.3	I716 F738 V754 V756 V765 V776 Y777	I716-I763 HydrophobicContact CG1-CD1 4.26Å; I716-I763 HydrophobicContact CG2-CD1 4.41Å; I716-I763 HydrophobicContact CG2-CG2 4.01Å; F738-I763 HydrophobicContact CE1-CD1 3.84Å; F738-I763 HydrophobicContact CZ-CD1 4.08Å; F738-I763 HydrophobicContact CZ-CG2 4.28Å; V754-I763 HydrophobicContact CG2-CG2 3.43Å; V754-I763 VanDerWaalsContact CG2-CG2 3.43Å; V756-I763 HydrophobicContact CG2-CG1 4.47Å; I763-V765 HydrophobicContact CG2-CG2 4.1Å; I763-V776 WeakPolarHBondContact O-CA 3Å; I763-Y777 PolarHBondContact N-O 3.47Å; I763-Y777 PolarHBondContact O-N 3.01Å
764	V	98.4	Very high	95.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.9	179.4	-177.5	0	0	0	0	108.9	V754 A755 I774 V776 V798 V800 V806 M821	V754-V764 CarbonylContact C-O 3.54Å; V754-V764 VanDerWaalsContact CA-O 3.28Å; V754-V764 WeakPolarHBondContact CA-O 3.36Å; A755-V764 PolarHBondContact N-O 3.45Å; A755-V764 PolarHBondContact O-N 3.47Å; V764-I774 HydrophobicContact CG1-CG2 3.58Å; V764-V776 HydrophobicContact CG1-CG2 4.5Å; V764-V776 HydrophobicContact CG2-CG1 4.27Å; V764-V776 HydrophobicContact CG2-CG2 4.29Å; V764-V798 HydrophobicContact CG1-CG2 4.23Å; V764-V800 HydrophobicContact CB-CG2 4.31Å; V764-V800 HydrophobicContact CG2-CG2 3.8Å; V764-V806 HydrophobicContact CG1-CG1 3.85Å; V764-V806 HydrophobicContact CG1-CG2 4.29Å; V764-V806 HydrophobicContact CG2-CG2 4.3Å; V764-M821 HydrophobicContact CG2-CE 3.98Å; V764-M821 HydrophobicContact CG2-SD 4.17Å
765	V	98.2	Very high	95.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.3	-175.7	-178.6	0	0	0	0	109.6	I725 L748 P751 V754 I763 I774 Q775 Y777	I725-V765 HydrophobicContact CD1-CG1 3.96Å; I725-V765 HydrophobicContact CD1-CG2 3.8Å; I725-V765 HydrophobicContact CG1-CG2 3.89Å; L748-V765 HydrophobicContact CD2-CG1 4.14Å; P751-V765 HydrophobicContact CB-CG1 3.53Å; V754-V765 HydrophobicContact CG2-CG2 4.33Å; I763-V765 HydrophobicContact CG2-CG2 4.1Å; V765-I774 CarbonylContact O-C 3.53Å; V765-I774 VanDerWaalsContact O-CA 3.31Å; V765-I774 WeakPolarHBondContact O-CA 3.36Å; V765-Q775 PolarHBondContact N-O 3.09Å; V765-Q775 PolarHBondContact O-N 3.18Å; V765-Y777 HydrophobicContact CG2-CD2 4.27Å; V765-Y777 HydrophobicContact CG2-CE2 4.37Å
766	T	97.7	Very high	95.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	151	167.4	63.7	0	0	0	0	111.5	P751 N752 R753 Q773 I774 P795 V798	P751-T766 CarbonylContact C-O 3.57Å; P751-T766 VanDerWaalsContact CA-O 3.32Å; P751-T766 WeakPolarHBondContact CA-O 3.2Å; N752-T766 PolarHBondContact N-O 3.16Å; N752-T766 PolarHBondContact OD1-O 3.24Å; N752-T766 PolarHBondContact OD1-OG1 3.09Å; R753-T766 WeakPolarHBondContact CB-OG1 3.49Å; R753-T766 PolarHBondContact N-OG1 3.23Å; R753-T766 PolarHBondContact O-N 2.97Å; T766-Q773 WeakPolarHBondContact CA-O 3.48Å; T766-I774 HydrophobicContact CG2-CG1 4.23Å; T766-P795 HydrophobicContact CG2-CB 4.22Å; T766-V798 HydrophobicContact CG2-CB 3.89Å; T766-V798 HydrophobicContact CG2-CG1 4.01Å; T766-V798 HydrophobicContact CG2-CG2 4.27Å
767	E	96.4	Very high	95.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	152	178.3	-66.8	-173	155.9	0	0	113.2	L748 L749 T771 Q773 Q775 P795	L748-E767 VanDerWaalsContact CA-OE1 3.3Å; L748-E767 WeakPolarHBondContact CA-OE1 3.44Å; L748-E767 WeakPolarHBondContact CD2-OE1 3.42Å; L749-E767 PolarHBondContact N-OE1 3.35Å; L749-E767 WeakPolarHBondContact O-CB 3.36Å; E767-T771 WeakPolarHBondContact CB-OG1 3.49Å; E767-T771 VanDerWaalsContact OE2-CB 3.26Å; E767-T771 WeakPolarHBondContact OE2-CB 3.49Å; E767-T771 PolarHBondContact OE2-OG1 3.3Å; E767-Q773 HydrophobicContact CB-CG 4.45Å; E767-Q773 HydrophobicContact CG-CG 4.44Å; E767-Q773 PolarHBondContact N-O 3.16Å; E767-Q773 WeakPolarHBondContact OE2-CG 3.5Å; E767-Q773 PolarHBondContact OE2-NE2 3.06Å; E767-Q775 PolarHBondContact OE1-NE2 3.35Å; E767-P795 WeakPolarHBondContact O-CG 3.42Å
768	R	93.2	Very high	95.7	Very high	27 Å²	27	28.8 Å²	28.8	10%	0.102	16%	0.161	C	C	.	.			trans	-78.6	-169.5	172.1	-64.5	178.1	-172.4	177.6	8.4	111.1	E703 S705 Y750 N752 T771 H772	E703-R768 IonicContact OE1-CZ 2.86Å; E703-R768 IonicContact OE1-NH1 2.74Å; E703-R768 PolarHBondContact OE1-NH1 3.21Å; E703-R768 IonicContact OE1-NH2 3.58Å; E703-R768 PolarHBondContact OE1-NH2 3.46Å; E703-R768 IonicContact OE2-NH1 2.89Å; S705-R768 VanDerWaalsContact CB-NH2 3.25Å; S705-R768 PolarHBondContact OG-NH2 3.36Å; Y750-R768 PolarHBondContact O-N 3.33Å; Y750-R768 VanDerWaalsContact O-N 3.08Å; N752-R768 HydrophobicContact CB-CG 3.66Å; N752-R768 VanDerWaalsContact CB-NE 3.26Å; R768-T771 PolarHBondContact O-N 2.81Å; R768-H772 PolarHBondContact O-N 3.3Å
769	S	90.4	Very high	95.8	Very high	63 Å²	63	27.1 Å²	27.1	44%	0.441	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	141.7	164.2	-176.4	0	0	0	0	109.6	H772	S769-H772 VanDerWaalsContact CA-CE1 3.41Å; S769-H772 WeakPolarHBondContact CA-CE1 3.5Å; S769-H772 WeakPolarHBondContact CA-NE2 3.45Å; S769-H772 WeakPolarHBondContact CB-NE2 3.29Å; S769-H772 PolarHBondContact N-CE1 3.44Å; S769-H772 PolarHBondContact N-ND1 3.34Å
770	P	92.2	Very high	95.9	Very high	72 Å²	72	28.7 Å²	28.7	47%	0.468	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	cis	-92.6	-4.4	6.7	35.5	-38.2	0	0	0	116.7	L749	L749-P770 HydrophobicContact CD2-CG 3.54Å
771	T	92.7	Very high	95.9	Very high	22 Å²	22	27.1 Å²	27.1	14%	0.135	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-34.3	-172.7	45.4	0	0	0	0	114.1	L749 E767 R768 Q773	L749-T771 HydrophobicContact CB-CG2 4.32Å; L749-T771 HydrophobicContact CD2-CG2 3.92Å; E767-T771 WeakPolarHBondContact CB-OG1 3.49Å; E767-T771 VanDerWaalsContact OE2-CB 3.26Å; E767-T771 WeakPolarHBondContact OE2-CB 3.49Å; E767-T771 PolarHBondContact OE2-OG1 3.3Å; R768-T771 PolarHBondContact O-N 2.81Å; T771-Q773 PolarHBondContact O-N 3.05Å
772	H	94.2	Very high	95.9	Very high	41 Å²	41	32.5 Å²	32.5	19%	0.19	17%	0.165	C	C	.	.			trans	50.3	29.3	178.6	-64	-62.9	0	0	0	114.9	R768 S769 L792 Q793	R768-H772 PolarHBondContact O-N 3.3Å; S769-H772 VanDerWaalsContact CA-CE1 3.41Å; S769-H772 WeakPolarHBondContact CA-CE1 3.5Å; S769-H772 WeakPolarHBondContact CA-NE2 3.45Å; S769-H772 WeakPolarHBondContact CB-NE2 3.29Å; S769-H772 PolarHBondContact N-CE1 3.44Å; S769-H772 PolarHBondContact N-ND1 3.34Å; H772-L792 WeakPolarHBondContact O-CB 3.43Å; H772-Q793 PolarHBondContact CE1-O 3.17Å; H772-Q793 PolarHBondContact ND1-O 3.01Å
773	Q	96.1	Very high	95.9	Very high	15 Å²	15	33.5 Å²	33.5	7%	0.07	17%	0.168	C	C	.	.			trans	-106.5	171.9	-171.1	69.9	-173.8	-16.1	0	0	112.8	T766 E767 T771 Q775 F787 A789	T766-Q773 WeakPolarHBondContact CA-O 3.48Å; E767-Q773 HydrophobicContact CB-CG 4.45Å; E767-Q773 HydrophobicContact CG-CG 4.44Å; E767-Q773 PolarHBondContact N-O 3.16Å; E767-Q773 WeakPolarHBondContact OE2-CG 3.5Å; E767-Q773 PolarHBondContact OE2-NE2 3.06Å; T771-Q773 PolarHBondContact O-N 3.05Å; Q773-Q775 HydrophobicContact CG-CG 4.27Å; Q773-F787 WeakPolarHBondContact CB-O 3.43Å; Q773-A789 HydrophobicContact CB-CB 3.89Å
774	I	97.9	Very high	95.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.6	166.5	-62	157.3	0	0	0	107.4	V764 V765 T766 V776 K786 F787 L792 V806 V808 F819	V764-I774 HydrophobicContact CG1-CG2 3.58Å; V765-I774 CarbonylContact O-C 3.53Å; V765-I774 VanDerWaalsContact O-CA 3.31Å; V765-I774 WeakPolarHBondContact O-CA 3.36Å; T766-I774 HydrophobicContact CG2-CG1 4.23Å; I774-V776 HydrophobicContact CG2-CG2 4.24Å; I774-K786 CarbonylContact O-C 3.46Å; I774-K786 WeakPolarHBondContact O-CA 3.29Å; I774-K786 WeakPolarHBondContact O-CB 3.47Å; I774-F787 HydrophobicContact CB-CD2 4.05Å; I774-F787 HydrophobicContact CB-CE2 3.89Å; I774-F787 HydrophobicContact CB-CG 4.5Å; I774-F787 HydrophobicContact CB-CZ 4.18Å; I774-F787 HydrophobicContact CD1-CD2 3.81Å; I774-F787 HydrophobicContact CD1-CE2 3.33Å; I774-F787 HydrophobicContact CD1-CZ 4.17Å; I774-F787 HydrophobicContact CG1-CE2 4.23Å; I774-F787 HydrophobicContact CG2-CD2 4.5Å; I774-F787 HydrophobicContact CG2-CE1 4.12Å; I774-F787 HydrophobicContact CG2-CE2 3.94Å; I774-F787 HydrophobicContact CG2-CZ 3.73Å; I774-F787 PolarHBondContact N-O 3.17Å; I774-F787 PolarHBondContact O-N 2.61Å; I774-L792 HydrophobicContact CD1-CD1 3.88Å; I774-L792 HydrophobicContact CG1-CD1 3.83Å; I774-V806 HydrophobicContact CD1-CG1 4.46Å; I774-V808 HydrophobicContact CD1-CG2 3.92Å; I774-V808 HydrophobicContact CG1-CG2 4.48Å; I774-F819 HydrophobicContact CD1-CD2 3.84Å; I774-F819 HydrophobicContact CD1-CE2 3.67Å; I774-F819 HydrophobicContact CD1-CG 4.47Å; I774-F819 HydrophobicContact CD1-CZ 4.16Å
775	Q	97.6	Very high	95.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.9	166.8	-54.9	-148.6	48.6	0	0	109.1	Q747 L748 V765 E767 Q773 Y777 K786	Q747-Q775 PolarHBondContact O-NE2 3.46Å; L748-Q775 HydrophobicContact CD2-CG 4.4Å; V765-Q775 PolarHBondContact N-O 3.09Å; V765-Q775 PolarHBondContact O-N 3.18Å; E767-Q775 PolarHBondContact OE1-NE2 3.35Å; Q773-Q775 HydrophobicContact CG-CG 4.27Å; Q775-Y777 HydrophobicContact CB-CD2 4.41Å; Q775-Y777 HydrophobicContact CB-CE2 3.66Å; Q775-K786 HydrophobicContact CB-CB 4.42Å; Q775-K786 HydrophobicContact CG-CB 3.87Å
776	V	98	Very high	95.7	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.4	177.7	-170.3	0	0	0	0	109.5	D762 I763 V764 I774 L784 R785 F787	D762-V776 HydrophobicContact CB-CG1 4.12Å; I763-V776 WeakPolarHBondContact O-CA 3Å; V764-V776 HydrophobicContact CG1-CG2 4.5Å; V764-V776 HydrophobicContact CG2-CG1 4.27Å; V764-V776 HydrophobicContact CG2-CG2 4.29Å; I774-V776 HydrophobicContact CG2-CG2 4.24Å; V776-L784 HydrophobicContact CG1-CD1 4.38Å; V776-L784 WeakPolarHBondContact O-CB 3.4Å; V776-L784 PolarHBondContact O-N 2.87Å; V776-R785 HydrophobicContact CB-CG 3.98Å; V776-R785 HydrophobicContact CG2-CG 4.17Å; V776-R785 PolarHBondContact N-O 2.99Å; V776-R785 PolarHBondContact O-N 3.12Å; V776-F787 HydrophobicContact CG2-CE1 3.71Å; V776-F787 HydrophobicContact CG2-CZ 4.3Å
777	Y	98.2	Very high	95.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	156.1	179.1	-62.4	-105	0	0	0	109.2	F738 G746 L748 D762 I763 V765 Q775 G781 Q782 F783	F738-Y777 AromaticContact CD2-CD1 3.64Å; F738-Y777 HydrophobicContact CD2-CD1 3.64Å; F738-Y777 AromaticContact CD2-CE1 3.61Å; F738-Y777 HydrophobicContact CD2-CE1 3.61Å; F738-Y777 HydrophobicContact CD2-CG 4.14Å; F738-Y777 AromaticContact CE2-CD1 3.4Å; F738-Y777 HydrophobicContact CE2-CD1 3.4Å; F738-Y777 AromaticContact CE2-CD2 3.62Å; F738-Y777 HydrophobicContact CE2-CD2 3.62Å; F738-Y777 AromaticContact CE2-CE1 3.62Å; F738-Y777 HydrophobicContact CE2-CE1 3.62Å; F738-Y777 AromaticContact CE2-CE2 3.84Å; F738-Y777 HydrophobicContact CE2-CE2 3.84Å; F738-Y777 AromaticContact CE2-CG 3.41Å; F738-Y777 HydrophobicContact CE2-CG 3.41Å; F738-Y777 VanDerWaalsContact CE2-CG 3.41Å; F738-Y777 AromaticContact CE2-CZ 3.84Å; F738-Y777 HydrophobicContact CZ-CD1 4.16Å; F738-Y777 HydrophobicContact CZ-CD2 4.18Å; F738-Y777 AromaticContact CZ-CG 3.86Å; F738-Y777 HydrophobicContact CZ-CG 3.86Å; G746-Y777 PolarHBondContact O-OH 3.25Å; L748-Y777 HydrophobicContact CD2-CE2 4.09Å; L748-Y777 VanDerWaalsContact CD2-OH 3.27Å; L748-Y777 WeakPolarHBondContact CD2-OH 3.18Å; L748-Y777 WeakPolarHBondContact CG-OH 3.37Å; D762-Y777 CarbonylContact C-O 3.47Å; D762-Y777 VanDerWaalsContact CA-O 3.31Å; D762-Y777 WeakPolarHBondContact CA-O 3.41Å; I763-Y777 PolarHBondContact N-O 3.47Å; I763-Y777 PolarHBondContact O-N 3.01Å; V765-Y777 HydrophobicContact CG2-CD2 4.27Å; V765-Y777 HydrophobicContact CG2-CE2 4.37Å; Q775-Y777 HydrophobicContact CB-CD2 4.41Å; Q775-Y777 HydrophobicContact CB-CE2 3.66Å; Y777-G781 WeakPolarHBondContact CD1-O 3.42Å; Y777-Q782 CarbonylContact C-O 3.55Å; Y777-Q782 WeakPolarHBondContact CA-O 3.43Å; Y777-F783 HydrophobicContact CD1-CB 4.06Å; Y777-F783 HydrophobicContact CE1-CB 3.92Å; Y777-F783 HydrophobicContact CE1-CD2 4.27Å
778	N	96.2	Very high	95.6	Very high	24 Å²	24	45 Å²	45	13%	0.128	22%	0.221	C	C	.	.			trans	-79.2	173.7	169.6	70.3	14.2	0	0	0	111.7	Y780 G781 Q782 L784	N778-Y780 PolarHBondContact O-N 2.97Å; N778-Y780 WeakPolarHBondContact OD1-CA 3.43Å; N778-Y780 WeakPolarHBondContact OD1-CB 3.45Å; N778-Y780 PolarHBondContact OD1-N 2.93Å; N778-G781 PolarHBondContact O-N 3.08Å; N778-G781 PolarHBondContact OD1-N 3.09Å; N778-Q782 PolarHBondContact N-O 3.26Å; N778-Q782 PolarHBondContact ND2-OE1 3.26Å; N778-Q782 WeakPolarHBondContact OD1-CB 3.38Å; N778-Q782 PolarHBondContact OD1-N 3.41Å; N778-L784 HydrophobicContact CB-CD1 4.11Å; N778-L784 HydrophobicContact CB-CD2 4.28Å; N778-L784 HydrophobicContact CB-CG 4.36Å
779	Q	94.9	Very high	95.6	Very high	81 Å²	81	45.8 Å²	45.8	38%	0.379	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-9.6	177.1	69.3	-174.3	-93	0	0	115.4	F736 S760 G761	F736-Q779 WeakPolarHBondContact CZ-O 3.42Å; S760-Q779 PolarHBondContact O-NE2 3.12Å; S760-Q779 VanDerWaalsContact O-NE2 3.16Å; G761-Q779 WeakPolarHBondContact O-CA 3.32Å; G761-Q779 WeakPolarHBondContact O-CB 3.45Å; G761-Q779 PolarHBondContact O-N 2.76Å
780	Y	95.1	Very high	95.7	Very high	157 Å²	157	50.8 Å²	50.8	62%	0.616	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	9.4	177.6	-49.2	-69.1	0	0	0	112.9	N778 Q782	N778-Y780 PolarHBondContact O-N 2.97Å; N778-Y780 WeakPolarHBondContact OD1-CA 3.43Å; N778-Y780 WeakPolarHBondContact OD1-CB 3.45Å; N778-Y780 PolarHBondContact OD1-N 2.93Å; Y780-Q782 VanDerWaalsContact C-N 3.33Å; Y780-Q782 PolarHBondContact O-N 2.98Å
781	G	94.7	Very high	95.8	Very high	13 Å²	13	49.9 Å²	49.9	13%	0.134	25%	0.245	C	C	.	.	S	Bend	trans	75.7	14.1	179.6	0	0	0	0	0	115.3	Y777 N778	Y777-G781 WeakPolarHBondContact CD1-O 3.42Å; N778-G781 PolarHBondContact O-N 3.08Å; N778-G781 PolarHBondContact OD1-N 3.09Å
782	Q	96.5	Very high	95.9	Very high	123 Å²	123	49.1 Å²	49.1	58%	0.575	24%	0.241	S	C	*	.			trans	-85.5	130.4	175.8	-56.2	173.8	-36	0	0	109.9	Y777 N778 Y780	Y777-Q782 CarbonylContact C-O 3.55Å; Y777-Q782 WeakPolarHBondContact CA-O 3.43Å; N778-Q782 PolarHBondContact N-O 3.26Å; N778-Q782 PolarHBondContact ND2-OE1 3.26Å; N778-Q782 WeakPolarHBondContact OD1-CB 3.38Å; N778-Q782 PolarHBondContact OD1-N 3.41Å; Y780-Q782 VanDerWaalsContact C-N 3.33Å; Y780-Q782 PolarHBondContact O-N 2.98Å
783	F	97.4	Very high	95.9	Very high	54 Å²	54	51.4 Å²	51.4	24%	0.237	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	136.5	178.6	174.5	-95.5	0	0	0	112.1	D745 G746 Y777 R785 K786	D745-F783 HydrophobicContact CB-CD1 3.81Å; D745-F783 HydrophobicContact CB-CE1 3.43Å; D745-F783 VanDerWaalsContact CB-CE1 3.43Å; D745-F783 HydrophobicContact CB-CE2 4.43Å; D745-F783 HydrophobicContact CB-CG 4.45Å; D745-F783 HydrophobicContact CB-CZ 3.75Å; G746-F783 VanDerWaalsContact N-CD2 3.3Å; Y777-F783 HydrophobicContact CD1-CB 4.06Å; Y777-F783 HydrophobicContact CE1-CB 3.92Å; Y777-F783 HydrophobicContact CE1-CD2 4.27Å; F783-R785 VanDerWaalsContact CE2-O 3.26Å; F783-R785 WeakPolarHBondContact CE2-O 3.3Å; F783-R785 VanDerWaalsContact CZ-CA 3.44Å; F783-K786 HydrophobicContact CE2-CB 4.06Å; F783-K786 HydrophobicContact CE2-CD 4.39Å; F783-K786 HydrophobicContact CZ-CB 4.17Å; F783-K786 HydrophobicContact CZ-CD 4.22Å; F783-K786 HydrophobicContact CZ-CG 4.21Å
784	L	96.8	Very high	95.8	Very high	66 Å²	66	53.1 Å²	53.1	35%	0.346	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-30.7	178.9	-58.5	-179	0	0	0	114	D762 V776 N778	D762-L784 WeakPolarHBondContact OD1-CD1 3.23Å; V776-L784 HydrophobicContact CG1-CD1 4.38Å; V776-L784 WeakPolarHBondContact O-CB 3.4Å; V776-L784 PolarHBondContact O-N 2.87Å; N778-L784 HydrophobicContact CB-CD1 4.11Å; N778-L784 HydrophobicContact CB-CD2 4.28Å; N778-L784 HydrophobicContact CB-CG 4.36Å
785	R	96.8	Very high	95.7	Very high	81 Å²	81	53.4 Å²	53.4	31%	0.306	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.4	164.6	-177.3	55.4	-155.6	63.3	165.1	-0.8	112.1	V776 F783 F787 M821 Y822	V776-R785 HydrophobicContact CB-CG 3.98Å; V776-R785 HydrophobicContact CG2-CG 4.17Å; V776-R785 PolarHBondContact N-O 2.99Å; V776-R785 PolarHBondContact O-N 3.12Å; F783-R785 VanDerWaalsContact CE2-O 3.26Å; F783-R785 WeakPolarHBondContact CE2-O 3.3Å; F783-R785 VanDerWaalsContact CZ-CA 3.44Å; R785-F787 HydrophobicContact CG-CD1 4.38Å; R785-F787 HydrophobicContact CG-CE1 4.46Å; R785-M821 WeakPolarHBondContact CD-O 3.48Å; R785-M821 PolarHBondContact NH1-O 2.83Å; R785-Y822 VanDerWaalsContact NH1-CD1 3.26Å
786	K	96.3	Very high	95.5	Very high	71 Å²	71	54.2 Å²	54.2	31%	0.309	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.7	164.7	68.1	-160.8	-170.7	-160.1	0	111.7	K743 D745 I774 Q775 F783	K743-K786 PolarHBondContact O-NZ 3.25Å; D745-K786 VanDerWaalsContact OD1-CE 3.23Å; D745-K786 WeakPolarHBondContact OD1-CE 3.39Å; D745-K786 IonicContact OD1-NZ 3.05Å; D745-K786 PolarHBondContact OD1-NZ 3.41Å; I774-K786 CarbonylContact O-C 3.46Å; I774-K786 WeakPolarHBondContact O-CA 3.29Å; I774-K786 WeakPolarHBondContact O-CB 3.47Å; Q775-K786 HydrophobicContact CB-CB 4.42Å; Q775-K786 HydrophobicContact CG-CB 3.87Å; F783-K786 HydrophobicContact CE2-CB 4.06Å; F783-K786 HydrophobicContact CE2-CD 4.39Å; F783-K786 HydrophobicContact CZ-CB 4.17Å; F783-K786 HydrophobicContact CZ-CD 4.22Å; F783-K786 HydrophobicContact CZ-CG 4.21Å
787	F	97.4	Very high	95.4	Very high	23 Å²	23	54.1 Å²	54.1	10%	0.101	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	177.8	-177.9	57.7	-97.5	0	0	0	112.5	Q773 I774 V776 R785 A789 F819	Q773-F787 WeakPolarHBondContact CB-O 3.43Å; I774-F787 HydrophobicContact CB-CD2 4.05Å; I774-F787 HydrophobicContact CB-CE2 3.89Å; I774-F787 HydrophobicContact CB-CG 4.5Å; I774-F787 HydrophobicContact CB-CZ 4.18Å; I774-F787 HydrophobicContact CD1-CD2 3.81Å; I774-F787 HydrophobicContact CD1-CE2 3.33Å; I774-F787 HydrophobicContact CD1-CZ 4.17Å; I774-F787 HydrophobicContact CG1-CE2 4.23Å; I774-F787 HydrophobicContact CG2-CD2 4.5Å; I774-F787 HydrophobicContact CG2-CE1 4.12Å; I774-F787 HydrophobicContact CG2-CE2 3.94Å; I774-F787 HydrophobicContact CG2-CZ 3.73Å; I774-F787 PolarHBondContact N-O 3.17Å; I774-F787 PolarHBondContact O-N 2.61Å; V776-F787 HydrophobicContact CG2-CE1 3.71Å; V776-F787 HydrophobicContact CG2-CZ 4.3Å; R785-F787 HydrophobicContact CG-CD1 4.38Å; R785-F787 HydrophobicContact CG-CE1 4.46Å; F787-A789 VanDerWaalsContact C-N 3.34Å; F787-A789 PolarHBondContact O-N 2.8Å; F787-F819 HydrophobicContact CD2-CD1 4.06Å; F787-F819 HydrophobicContact CD2-CE1 4.33Å; F787-F819 HydrophobicContact CD2-CG 4.4Å; F787-F819 HydrophobicContact CE2-CB 3.91Å; F787-F819 AromaticContact CE2-CD1 3.97Å; F787-F819 HydrophobicContact CE2-CD1 3.97Å; F787-F819 HydrophobicContact CE2-CD2 4.33Å; F787-F819 AromaticContact CE2-CG 3.85Å; F787-F819 HydrophobicContact CE2-CG 3.85Å
788	G	94.9	Very high	95.4	Very high	8 Å²	8	54.6 Å²	54.6	8%	0.082	27%	0.267	C	S	.	.			trans	84.7	-13.1	171	0	0	0	0	0	117	N790 I791 L792	G788-N790 VanDerWaalsContact C-N 3.27Å; G788-N790 PolarHBondContact O-N 3.32Å; G788-N790 VanDerWaalsContact O-N 3.13Å; G788-I791 WeakPolarHBondContact O-CA 3.4Å; G788-I791 WeakPolarHBondContact O-CB 3.42Å; G788-I791 PolarHBondContact O-N 3.13Å; G788-L792 PolarHBondContact O-N 2.94Å
789	A	93.3	Very high	95.5	Very high	42 Å²	42	54.5 Å²	54.5	35%	0.347	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-38.9	-177.1	0	0	0	0	0	114.8	Q773 F787 I791	Q773-A789 HydrophobicContact CB-CB 3.89Å; F787-A789 VanDerWaalsContact C-N 3.34Å; F787-A789 PolarHBondContact O-N 2.8Å; A789-I791 VanDerWaalsContact C-N 3.32Å; A789-I791 PolarHBondContact O-N 3.5Å
790	N	92.3	Very high	95.7	Very high	168 Å²	168	51.5 Å²	51.5	90%	0.898	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	5.7	-179.2	-63.3	-17.1	0	0	0	113.6	G788	G788-N790 VanDerWaalsContact C-N 3.27Å; G788-N790 PolarHBondContact O-N 3.32Å; G788-N790 VanDerWaalsContact O-N 3.13Å
791	I	94.7	Very high	95.7	Very high	53 Å²	53	44.2 Å²	44.2	27%	0.272	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-46.7	-165.8	-58.3	173.2	0	0	0	110.5	G788 A789 R815 I817 F819 V825	G788-I791 WeakPolarHBondContact O-CA 3.4Å; G788-I791 WeakPolarHBondContact O-CB 3.42Å; G788-I791 PolarHBondContact O-N 3.13Å; A789-I791 VanDerWaalsContact C-N 3.32Å; A789-I791 PolarHBondContact O-N 3.5Å; I791-R815 PolarHBondContact O-NH2 3.28Å; I791-I817 HydrophobicContact CG2-CD1 3.84Å; I791-F819 HydrophobicContact CD1-CE1 4.16Å; I791-F819 HydrophobicContact CG2-CE1 4.36Å; I791-F819 HydrophobicContact CG2-CZ 4.2Å; I791-V825 HydrophobicContact CD1-CG2 3.81Å; I791-V825 HydrophobicContact CG2-CG2 4.13Å
792	L	95.5	Very high	95.6	Very high	7 Å²	7	49.4 Å²	49.4	4%	0.037	24%	0.242	C	C	.	.			trans	-78.9	159.4	173.6	-70.6	169.9	0	0	0	111.2	H772 I774 G788 P795 V808 E810 I817 F819	H772-L792 WeakPolarHBondContact O-CB 3.43Å; I774-L792 HydrophobicContact CD1-CD1 3.88Å; I774-L792 HydrophobicContact CG1-CD1 3.83Å; G788-L792 PolarHBondContact O-N 2.94Å; L792-P795 HydrophobicContact CD1-CB 4.46Å; L792-V808 HydrophobicContact CD2-CB 4.31Å; L792-V808 HydrophobicContact CD2-CG1 3.72Å; L792-E810 HydrophobicContact CD2-CG 3.94Å; L792-I817 HydrophobicContact CD2-CD1 3.98Å; L792-F819 HydrophobicContact CG-CZ 4.3Å
793	Q	93.8	Very high	95.5	Very high	89 Å²	89	48.7 Å²	48.7	42%	0.416	24%	0.238	S	C	.	.	S	Bend	trans	-140.5	-37.4	178.6	-60.8	179.8	-3.5	0	0	111.3	H772 E810	H772-Q793 PolarHBondContact CE1-O 3.17Å; H772-Q793 PolarHBondContact ND1-O 3.01Å; Q793-E810 PolarHBondContact N-OE1 3.49Å
794	H	93.3	Very high	95.4	Very high	51 Å²	51	46.7 Å²	46.7	24%	0.236	23%	0.232	C	C	.	.			trans	-146.2	55.2	-175	-70.1	92.8	0	0	0	113	R796 E810 C811 K812	H794-R796 PolarHBondContact O-N 3.47Å; H794-E810 PolarHBondContact N-OE1 3.32Å; H794-E810 WeakPolarHBondContact O-CA 3.47Å; H794-E810 WeakPolarHBondContact O-CB 3.49Å; H794-C811 PolarHBondContact O-N 3.02Å; H794-C811 VanDerWaalsContact O-N 3.15Å; H794-K812 HydrophobicContact CB-CB 4.2Å; H794-K812 HydrophobicContact CB-CG 4.27Å; H794-K812 VanDerWaalsContact CD2-CE 3.45Å; H794-K812 WeakPolarHBondContact CD2-CE 3.47Å; H794-K812 PolarHBondContact CD2-NZ 3.5Å; H794-K812 WeakPolarHBondContact NE2-CD 3.25Å; H794-K812 WeakPolarHBondContact NE2-CE 3.13Å; H794-K812 PolarHBondContact NE2-NZ 2.89Å
795	P	96.1	Very high	95.4	Very high	6 Å²	6	45.6 Å²	45.6	4%	0.039	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	125.3	-179.5	26.8	-34.9	0	0	0	111.4	N752 T766 E767 L792 V808	N752-P795 PolarHBondContact ND2-O 3.27Å; T766-P795 HydrophobicContact CG2-CB 4.22Å; E767-P795 WeakPolarHBondContact O-CG 3.42Å; L792-P795 HydrophobicContact CD1-CB 4.46Å; P795-V808 HydrophobicContact CB-CG1 3.85Å
796	R	94.2	Very high	95.5	Very high	16 Å²	16	41.7 Å²	41.7	6%	0.06	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	-23.1	-176	-174.8	60	-176.5	-125.2	-7.1	114.4	Y601 R753 H794 V809 C811 N839	Y601-R796 PolarHBondContact OH-NH1 3.31Å; R753-R796 WeakPolarHBondContact CD-O 3.43Å; R753-R796 VanDerWaalsContact CG-O 3.24Å; R753-R796 WeakPolarHBondContact CG-O 3.33Å; R753-R796 PolarHBondContact NE-O 2.96Å; H794-R796 PolarHBondContact O-N 3.47Å; R796-V809 PolarHBondContact N-O 2.95Å; R796-C811 HydrophobicContact CB-CB 3.67Å; R796-C811 HydrophobicContact CG-CB 3.83Å; R796-N839 CarbonylContact C-O 3.1Å; R796-N839 PolarHBondContact NE-OD1 3.21Å; R796-N839 PolarHBondContact NH2-OD1 3.49Å
797	G	95.7	Very high	95.6	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.3	166.7	0	0	0	0	0	110.1	V808 V809 N839	G797-V808 CarbonylContact O-C 3.56Å; G797-V808 WeakPolarHBondContact O-CA 3.27Å; G797-V809 PolarHBondContact N-O 2.94Å; G797-V809 VanDerWaalsContact N-O 3.14Å; G797-V809 PolarHBondContact O-N 3.22Å; G797-N839 WeakPolarHBondContact CA-O 3.46Å; G797-N839 PolarHBondContact N-O 3.38Å
798	V	98.1	Very high	95.6	Very high	13 Å²	13	37.2 Å²	37.2	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.7	170.1	62.6	0	0	0	0	109.5	R753 A755 V764 T766 V806 V807 V808	R753-V798 HydrophobicContact CB-CG1 3.61Å; A755-V798 HydrophobicContact CB-CG1 4.04Å; A755-V798 HydrophobicContact CB-CG2 4.33Å; V764-V798 HydrophobicContact CG1-CG2 4.23Å; T766-V798 HydrophobicContact CG2-CB 3.89Å; T766-V798 HydrophobicContact CG2-CG1 4.01Å; T766-V798 HydrophobicContact CG2-CG2 4.27Å; V798-V806 HydrophobicContact CG2-CG1 3.69Å; V798-V807 CarbonylContact C-O 3.57Å; V798-V807 WeakPolarHBondContact CA-O 3.42Å; V798-V808 HydrophobicContact CB-CG2 4.3Å; V798-V808 HydrophobicContact CG2-CG2 3.9Å
799	T	98	Very high	95.7	Very high	21 Å²	21	36.9 Å²	36.9	13%	0.129	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	161.8	170.5	-167.2	0	0	0	0	109.8	V807 V841 T843	T799-V807 HydrophobicContact CG2-CB 3.92Å; T799-V807 PolarHBondContact N-O 3.02Å; T799-V807 PolarHBondContact O-N 3.29Å; T799-V841 WeakPolarHBondContact CB-O 3Å; T799-V841 HydrophobicContact CG2-CG1 3.98Å; T799-V841 HydrophobicContact CG2-CG2 4.07Å; T799-T843 HydrophobicContact CG2-CG2 3.92Å
800	V	97.7	Very high	95.8	Very high	19 Å²	19	34.9 Å²	34.9	12%	0.115	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.8	175.7	-178.7	0	0	0	0	107.9	A755 N757 V764 R805 V806 M821	A755-V800 HydrophobicContact CB-CG2 4.06Å; N757-V800 HydrophobicContact CB-CG1 3.94Å; V764-V800 HydrophobicContact CB-CG2 4.31Å; V764-V800 HydrophobicContact CG2-CG2 3.8Å; V800-R805 WeakPolarHBondContact CA-O 3.48Å; V800-V806 HydrophobicContact CG2-CG2 4.44Å; V800-M821 HydrophobicContact CB-CE 4.29Å; V800-M821 HydrophobicContact CG1-CE 3.39Å; V800-M821 HydrophobicContact CG2-CE 3.84Å
801	D	95.7	Very high	95.8	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	13%	0.128	C	C	.	.			trans	-83.6	172.6	178.8	79.1	11.5	0	0	0	113.2	K803 G804 R805 T843 Y864	D801-K803 PolarHBondContact O-N 3.06Å; D801-K803 WeakPolarHBondContact OD1-CA 3.49Å; D801-K803 WeakPolarHBondContact OD1-CB 3.36Å; D801-K803 PolarHBondContact OD1-N 3.32Å; D801-G804 PolarHBondContact O-N 3.09Å; D801-G804 PolarHBondContact OD1-N 3.21Å; D801-R805 PolarHBondContact N-O 3.5Å; D801-R805 PolarHBondContact OD1-N 3.04Å; D801-R805 IonicContact OD1-NE 3.33Å; D801-R805 IonicContact OD2-CZ 2.67Å; D801-R805 IonicContact OD2-NE 3.4Å; D801-R805 PolarHBondContact OD2-NE 2.91Å; D801-R805 IonicContact OD2-NH2 2.74Å; D801-R805 PolarHBondContact OD2-NH2 3.13Å; D801-T843 WeakPolarHBondContact CB-OG1 3.5Å; D801-Y864 WeakPolarHBondContact CB-OH 3.47Å; D801-Y864 WeakPolarHBondContact OD2-CE1 3.21Å; D801-Y864 PolarHBondContact OD2-OH 2.76Å
802	Y	92.7	Very high	95.6	Very high	121 Å²	121	29.1 Å²	29.1	48%	0.475	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10	-178.8	70.5	-90.8	0	0	0	114.8	D845 Q847	Y802-D845 VanDerWaalsContact CE1-O 3.23Å; Y802-D845 WeakPolarHBondContact CE1-O 3.34Å; Y802-D845 PolarHBondContact OH-O 3.36Å; Y802-Q847 HydrophobicContact CE1-CG 4.26Å
803	K	94.5	Very high	95.5	Very high	109 Å²	109	31.2 Å²	31.2	47%	0.474	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	2.9	173.2	-57.9	-174.5	-176.8	172.5	0	112.1	D801 R805 Q847	D801-K803 PolarHBondContact O-N 3.06Å; D801-K803 WeakPolarHBondContact OD1-CA 3.49Å; D801-K803 WeakPolarHBondContact OD1-CB 3.36Å; D801-K803 PolarHBondContact OD1-N 3.32Å; K803-R805 HydrophobicContact CB-CG 4.42Å; K803-Q847 VanDerWaalsContact NZ-CD 3.28Å
804	G	94.8	Very high	95.5	Very high	11 Å²	11	28.4 Å²	28.4	11%	0.113	14%	0.135	C	C	.	.			trans	74.5	21.9	-175.4	0	0	0	0	0	113.7	D801 M821	D801-G804 PolarHBondContact O-N 3.09Å; D801-G804 PolarHBondContact OD1-N 3.21Å; G804-M821 WeakPolarHBondContact O-CE 3.38Å; G804-M821 WeakPolarHBondContact O-CG 3.38Å
805	R	97.6	Very high	95.7	Very high	43 Å²	43	27.6 Å²	27.6	16%	0.162	13%	0.13	C	C	.	.			trans	-84.6	132.2	173.9	-59.4	176.8	-66.7	-168.5	-0.4	109.7	V800 D801 K803 I818 F819 L826 Q847	V800-R805 WeakPolarHBondContact CA-O 3.48Å; D801-R805 PolarHBondContact N-O 3.5Å; D801-R805 PolarHBondContact OD1-N 3.04Å; D801-R805 IonicContact OD1-NE 3.33Å; D801-R805 IonicContact OD2-CZ 2.67Å; D801-R805 IonicContact OD2-NE 3.4Å; D801-R805 PolarHBondContact OD2-NE 2.91Å; D801-R805 IonicContact OD2-NH2 2.74Å; D801-R805 PolarHBondContact OD2-NH2 3.13Å; K803-R805 HydrophobicContact CB-CG 4.42Å; R805-I818 HydrophobicContact CB-CG2 3.98Å; R805-F819 CarbonylContact C-O 3.6Å; R805-F819 VanDerWaalsContact CA-O 3.3Å; R805-F819 WeakPolarHBondContact CA-O 3.48Å; R805-L826 HydrophobicContact CB-CD1 4.35Å; R805-L826 HydrophobicContact CG-CD1 3.65Å; R805-Q847 VanDerWaalsContact NH1-OE1 3.15Å
806	V	98.2	Very high	95.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.5	177.8	-175.4	0	0	0	0	108.6	V764 I774 V798 V800 V808 I818 F819 M821	V764-V806 HydrophobicContact CG1-CG1 3.85Å; V764-V806 HydrophobicContact CG1-CG2 4.29Å; V764-V806 HydrophobicContact CG2-CG2 4.3Å; I774-V806 HydrophobicContact CD1-CG1 4.46Å; V798-V806 HydrophobicContact CG2-CG1 3.69Å; V800-V806 HydrophobicContact CG2-CG2 4.44Å; V806-V808 HydrophobicContact CG1-CG2 4.01Å; V806-I818 WeakPolarHBondContact O-CA 3.48Å; V806-F819 HydrophobicContact CB-CB 4.35Å; V806-F819 PolarHBondContact N-O 3.42Å; V806-F819 PolarHBondContact O-N 3.22Å; V806-M821 HydrophobicContact CG2-CE 3.6Å; V806-M821 HydrophobicContact CG2-SD 3.92Å
807	V	98.4	Very high	95.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.1	177.8	179.9	0	0	0	0	108.6	V798 T799 V816 I818 V841 T843 I849 Y864	V798-V807 CarbonylContact C-O 3.57Å; V798-V807 WeakPolarHBondContact CA-O 3.42Å; T799-V807 HydrophobicContact CG2-CB 3.92Å; T799-V807 PolarHBondContact N-O 3.02Å; T799-V807 PolarHBondContact O-N 3.29Å; V807-V816 HydrophobicContact CG1-CG1 3.79Å; V807-I818 HydrophobicContact CG2-CD1 4.46Å; V807-I818 HydrophobicContact CG2-CG1 4.23Å; V807-I818 HydrophobicContact CG2-CG2 4.12Å; V807-V841 HydrophobicContact CG1-CG2 4.37Å; V807-T843 HydrophobicContact CG2-CG2 4.21Å; V807-I849 HydrophobicContact CG1-CD1 4.19Å; V807-I849 HydrophobicContact CG1-CG2 4Å; V807-Y864 HydrophobicContact CG2-CE1 4.31Å
808	V	98.1	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.9	179.6	-178	0	0	0	0	110.4	I774 L792 P795 G797 V798 V806 V816 I817 F819	I774-V808 HydrophobicContact CD1-CG2 3.92Å; I774-V808 HydrophobicContact CG1-CG2 4.48Å; L792-V808 HydrophobicContact CD2-CB 4.31Å; L792-V808 HydrophobicContact CD2-CG1 3.72Å; P795-V808 HydrophobicContact CB-CG1 3.85Å; G797-V808 CarbonylContact O-C 3.56Å; G797-V808 WeakPolarHBondContact O-CA 3.27Å; V798-V808 HydrophobicContact CB-CG2 4.3Å; V798-V808 HydrophobicContact CG2-CG2 3.9Å; V806-V808 HydrophobicContact CG1-CG2 4.01Å; V808-V816 WeakPolarHBondContact O-CA 3.42Å; V808-I817 PolarHBondContact N-O 3.23Å; V808-I817 PolarHBondContact O-N 3.14Å; V808-F819 HydrophobicContact CG2-CD2 4.47Å; V808-F819 HydrophobicContact CG2-CE2 4.29Å
809	V	97.3	Very high	96	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.9	176	-171.5	0	0	0	0	110.3	R796 G797 R815 V816 P838 V841 V851	R796-V809 PolarHBondContact N-O 2.95Å; G797-V809 PolarHBondContact N-O 2.94Å; G797-V809 VanDerWaalsContact N-O 3.14Å; G797-V809 PolarHBondContact O-N 3.22Å; V809-R815 WeakPolarHBondContact CA-O 3.48Å; V809-V816 HydrophobicContact CG2-CG2 4.23Å; V809-P838 HydrophobicContact CG1-CB 3.72Å; V809-P838 HydrophobicContact CG1-CG 3.86Å; V809-V841 HydrophobicContact CG2-CB 3.73Å; V809-V841 HydrophobicContact CG2-CG1 3.98Å; V809-V841 HydrophobicContact CG2-CG2 3.72Å; V809-V851 HydrophobicContact CG1-CG1 3.97Å; V809-V851 HydrophobicContact CG2-CG1 4.47Å; V809-V851 HydrophobicContact CG2-CG2 4.07Å
810	E	95.4	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.9	-174.5	-63.1	-178.4	87.1	0	0	113.5	L792 Q793 H794 K812 V813 M814 R815 I817	L792-E810 HydrophobicContact CD2-CG 3.94Å; Q793-E810 PolarHBondContact N-OE1 3.49Å; H794-E810 PolarHBondContact N-OE1 3.32Å; H794-E810 WeakPolarHBondContact O-CA 3.47Å; H794-E810 WeakPolarHBondContact O-CB 3.49Å; E810-K812 PolarHBondContact O-N 3.42Å; E810-V813 HydrophobicContact CB-CG2 3.6Å; E810-V813 HydrophobicContact CG-CG2 4.4Å; E810-M814 WeakPolarHBondContact O-CA 3.14Å; E810-M814 PolarHBondContact O-N 3.14Å; E810-M814 VanDerWaalsContact O-N 3.13Å; E810-R815 HydrophobicContact CB-CB 4.47Å; E810-R815 PolarHBondContact N-O 3.1Å; E810-R815 PolarHBondContact O-N 3.42Å; E810-R815 IonicContact OE1-NH2 3.65Å; E810-R815 PolarHBondContact OE1-NH2 3.31Å; E810-R815 IonicContact OE2-CZ 2.69Å; E810-R815 IonicContact OE2-NE 3.63Å; E810-R815 PolarHBondContact OE2-NE 3.21Å; E810-R815 IonicContact OE2-NH2 2.66Å; E810-R815 PolarHBondContact OE2-NH2 3.25Å; E810-I817 WeakPolarHBondContact OE2-CD1 3.34Å
811	C	92.3	Very high	95.8	Very high	8 Å²	8	26.8 Å²	26.8	5%	0.054	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.7	-164.6	64.9	0	0	0	0	117	H794 R796 M814 P838	H794-C811 PolarHBondContact O-N 3.02Å; H794-C811 VanDerWaalsContact O-N 3.15Å; R796-C811 HydrophobicContact CB-CB 3.67Å; R796-C811 HydrophobicContact CG-CB 3.83Å; C811-M814 WeakPolarHBondContact O-CE 3.44Å; C811-P838 WeakPolarHBondContact CB-O 3.5Å
812	K	89.6	Confident	95.7	Very high	93 Å²	93	34.8 Å²	34.8	40%	0.404	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-30.6	175.6	-63.7	-162.1	-164.5	156	0	114.3	W604 H794 E810	W604-K812 VanDerWaalsContact CZ3-NZ 3.26Å; H794-K812 HydrophobicContact CB-CB 4.2Å; H794-K812 HydrophobicContact CB-CG 4.27Å; H794-K812 VanDerWaalsContact CD2-CE 3.45Å; H794-K812 WeakPolarHBondContact CD2-CE 3.47Å; H794-K812 PolarHBondContact CD2-NZ 3.5Å; H794-K812 WeakPolarHBondContact NE2-CD 3.25Å; H794-K812 WeakPolarHBondContact NE2-CE 3.13Å; H794-K812 PolarHBondContact NE2-NZ 2.89Å; E810-K812 PolarHBondContact O-N 3.42Å
813	V	93.5	Very high	95.8	Very high	51 Å²	51	29.7 Å²	29.7	31%	0.309	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	0.3	178.6	-70.9	0	0	0	0	112.9	E810 R815	E810-V813 HydrophobicContact CB-CG2 3.6Å; E810-V813 HydrophobicContact CG-CG2 4.4Å; V813-R815 VanDerWaalsContact C-N 3.3Å; V813-R815 HydrophobicContact CB-CB 4.27Å; V813-R815 HydrophobicContact CG2-CB 3.68Å; V813-R815 PolarHBondContact O-N 2.93Å
814	M	94.9	Very high	95.9	Very high	30 Å²	30	29.1 Å²	29.1	15%	0.148	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	51.2	-179.9	-49.8	-48.2	168.5	0	0	111.6	E810 C811 C831 L835 E836 P838	E810-M814 WeakPolarHBondContact O-CA 3.14Å; E810-M814 PolarHBondContact O-N 3.14Å; E810-M814 VanDerWaalsContact O-N 3.13Å; C811-M814 WeakPolarHBondContact O-CE 3.44Å; M814-C831 WeakPolarHBondContact O-CA 3.31Å; M814-C831 WeakPolarHBondContact O-CB 3.48Å; M814-C831 PolarHBondContact O-N 2.98Å; M814-L835 HydrophobicContact CB-CB 4.29Å; M814-L835 HydrophobicContact SD-CB 4.4Å; M814-E836 WeakPolarHBondContact CE-O 3.28Å; M814-P838 WeakPolarHBondContact SD-CD 3.46Å; M814-P838 HydrophobicContact SD-CG 4.02Å
815	R	96.3	Very high	96	Very high	34 Å²	34	31.7 Å²	31.7	13%	0.128	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.8	-165.1	-167.2	169.4	65.4	178.7	4.1	110.6	I791 V809 E810 V813 I817 F829	I791-R815 PolarHBondContact O-NH2 3.28Å; V809-R815 WeakPolarHBondContact CA-O 3.48Å; E810-R815 HydrophobicContact CB-CB 4.47Å; E810-R815 PolarHBondContact N-O 3.1Å; E810-R815 PolarHBondContact O-N 3.42Å; E810-R815 IonicContact OE1-NH2 3.65Å; E810-R815 PolarHBondContact OE1-NH2 3.31Å; E810-R815 IonicContact OE2-CZ 2.69Å; E810-R815 IonicContact OE2-NE 3.63Å; E810-R815 PolarHBondContact OE2-NE 3.21Å; E810-R815 IonicContact OE2-NH2 2.66Å; E810-R815 PolarHBondContact OE2-NH2 3.25Å; V813-R815 VanDerWaalsContact C-N 3.3Å; V813-R815 HydrophobicContact CB-CB 4.27Å; V813-R815 HydrophobicContact CG2-CB 3.68Å; V813-R815 PolarHBondContact O-N 2.93Å; R815-I817 HydrophobicContact CG-CG1 4.34Å; R815-F829 WeakPolarHBondContact CG-O 3.32Å
816	V	97.7	Very high	96	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.4	169.7	-172.8	0	0	0	0	108.2	V807 V808 V809 I818 K828 F829 I849	V807-V816 HydrophobicContact CG1-CG1 3.79Å; V808-V816 WeakPolarHBondContact O-CA 3.42Å; V809-V816 HydrophobicContact CG2-CG2 4.23Å; V816-I818 HydrophobicContact CG1-CG1 4.43Å; V816-K828 WeakPolarHBondContact O-CA 3.43Å; V816-F829 HydrophobicContact CB-CD2 4.08Å; V816-F829 HydrophobicContact CB-CE1 4.11Å; V816-F829 HydrophobicContact CB-CE2 3.57Å; V816-F829 HydrophobicContact CB-CZ 3.59Å; V816-F829 HydrophobicContact CG1-CE1 4.19Å; V816-F829 HydrophobicContact CG1-CE2 4.26Å; V816-F829 HydrophobicContact CG1-CZ 3.78Å; V816-F829 HydrophobicContact CG2-CD2 4.25Å; V816-F829 HydrophobicContact CG2-CE2 3.55Å; V816-F829 HydrophobicContact CG2-CZ 3.92Å; V816-F829 PolarHBondContact N-O 3.45Å; V816-F829 PolarHBondContact O-N 2.66Å; V816-I849 HydrophobicContact CG1-CD1 4.37Å
817	I	97.7	Very high	95.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.8	172.9	-44.1	-168	0	0	0	108.4	I791 L792 V808 E810 R815 F819 V825 K828	I791-I817 HydrophobicContact CG2-CD1 3.84Å; L792-I817 HydrophobicContact CD2-CD1 3.98Å; V808-I817 PolarHBondContact N-O 3.23Å; V808-I817 PolarHBondContact O-N 3.14Å; E810-I817 WeakPolarHBondContact OE2-CD1 3.34Å; R815-I817 HydrophobicContact CG-CG1 4.34Å; I817-F819 HydrophobicContact CB-CE2 3.84Å; I817-F819 HydrophobicContact CB-CZ 4.24Å; I817-F819 HydrophobicContact CG2-CD2 4.1Å; I817-F819 HydrophobicContact CG2-CE1 4.18Å; I817-F819 HydrophobicContact CG2-CE2 3.52Å; I817-F819 HydrophobicContact CG2-CZ 3.58Å; I817-V825 HydrophobicContact CG2-CG1 4.04Å; I817-V825 HydrophobicContact CG2-CG2 4.31Å; I817-K828 HydrophobicContact CD1-CD 4.23Å; I817-K828 HydrophobicContact CD1-CG 4.43Å; I817-K828 HydrophobicContact CG1-CG 4.18Å; I817-K828 HydrophobicContact CG2-CB 4.41Å
818	I	98.1	Very high	95.8	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.8	-179.9	-48.8	-173.7	0	0	0	107.7	R805 V806 V807 V816 L826 Q827 F829 I849 Y864	R805-I818 HydrophobicContact CB-CG2 3.98Å; V806-I818 WeakPolarHBondContact O-CA 3.48Å; V807-I818 HydrophobicContact CG2-CD1 4.46Å; V807-I818 HydrophobicContact CG2-CG1 4.23Å; V807-I818 HydrophobicContact CG2-CG2 4.12Å; V816-I818 HydrophobicContact CG1-CG1 4.43Å; I818-L826 HydrophobicContact CG2-CB 4.42Å; I818-L826 HydrophobicContact CG2-CD1 4.44Å; I818-L826 PolarHBondContact O-N 3.06Å; I818-Q827 HydrophobicContact CB-CB 4.32Å; I818-Q827 HydrophobicContact CD1-CB 4.36Å; I818-Q827 HydrophobicContact CG1-CB 4.47Å; I818-Q827 PolarHBondContact N-O 2.9Å; I818-Q827 PolarHBondContact O-N 3.19Å; I818-F829 HydrophobicContact CD1-CE1 4.31Å; I818-I849 HydrophobicContact CD1-CD1 3.81Å; I818-Y864 HydrophobicContact CD1-CD1 3.41Å; I818-Y864 VanDerWaalsContact CD1-CD1 3.41Å; I818-Y864 HydrophobicContact CD1-CE1 3.93Å; I818-Y864 HydrophobicContact CD1-CG 3.93Å; I818-Y864 HydrophobicContact CG2-CE1 4.41Å
819	F	98.2	Very high	95.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	161.7	176.7	-54.8	-98.4	0	0	0	111	I774 F787 I791 L792 R805 V806 V808 I817 N824 V825	I774-F819 HydrophobicContact CD1-CD2 3.84Å; I774-F819 HydrophobicContact CD1-CE2 3.67Å; I774-F819 HydrophobicContact CD1-CG 4.47Å; I774-F819 HydrophobicContact CD1-CZ 4.16Å; F787-F819 HydrophobicContact CD2-CD1 4.06Å; F787-F819 HydrophobicContact CD2-CE1 4.33Å; F787-F819 HydrophobicContact CD2-CG 4.4Å; F787-F819 HydrophobicContact CE2-CB 3.91Å; F787-F819 AromaticContact CE2-CD1 3.97Å; F787-F819 HydrophobicContact CE2-CD1 3.97Å; F787-F819 HydrophobicContact CE2-CD2 4.33Å; F787-F819 AromaticContact CE2-CG 3.85Å; F787-F819 HydrophobicContact CE2-CG 3.85Å; I791-F819 HydrophobicContact CD1-CE1 4.16Å; I791-F819 HydrophobicContact CG2-CE1 4.36Å; I791-F819 HydrophobicContact CG2-CZ 4.2Å; L792-F819 HydrophobicContact CG-CZ 4.3Å; R805-F819 CarbonylContact C-O 3.6Å; R805-F819 VanDerWaalsContact CA-O 3.3Å; R805-F819 WeakPolarHBondContact CA-O 3.48Å; V806-F819 HydrophobicContact CB-CB 4.35Å; V806-F819 PolarHBondContact N-O 3.42Å; V806-F819 PolarHBondContact O-N 3.22Å; V808-F819 HydrophobicContact CG2-CD2 4.47Å; V808-F819 HydrophobicContact CG2-CE2 4.29Å; I817-F819 HydrophobicContact CB-CE2 3.84Å; I817-F819 HydrophobicContact CB-CZ 4.24Å; I817-F819 HydrophobicContact CG2-CD2 4.1Å; I817-F819 HydrophobicContact CG2-CE1 4.18Å; I817-F819 HydrophobicContact CG2-CE2 3.52Å; I817-F819 HydrophobicContact CG2-CZ 3.58Å; F819-N824 CarbonylContact C-O 3.54Å; F819-N824 WeakPolarHBondContact CA-O 3.42Å; F819-V825 HydrophobicContact CD1-CG2 3.84Å; F819-V825 HydrophobicContact CE1-CG2 3.57Å; F819-V825 HydrophobicContact CZ-CG2 4.42Å
820	D	96.3	Very high	95.6	Very high	33 Å²	33	45.7 Å²	45.7	18%	0.176	24%	0.238	C	C	.	.			trans	-83.1	177.2	157.3	69.3	10.9	0	0	0	111.4	Y822 G823 N824 L826	D820-Y822 PolarHBondContact O-N 3.42Å; D820-Y822 WeakPolarHBondContact OD1-CA 3.48Å; D820-Y822 WeakPolarHBondContact OD1-CB 3.45Å; D820-Y822 PolarHBondContact OD1-N 3.46Å; D820-G823 PolarHBondContact O-N 3.04Å; D820-G823 PolarHBondContact OD1-N 2.98Å; D820-N824 PolarHBondContact N-O 2.78Å; D820-N824 PolarHBondContact OD1-N 3.46Å; D820-N824 PolarHBondContact OD1-ND2 3.41Å; D820-N824 PolarHBondContact OD2-ND2 3.31Å; D820-L826 HydrophobicContact CB-CD1 4.17Å; D820-L826 HydrophobicContact CB-CD2 4.38Å; D820-L826 HydrophobicContact CB-CG 4.36Å
821	M	94	Very high	95.5	Very high	24 Å²	24	45.8 Å²	45.8	12%	0.118	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.6	174.3	-76.6	-65.5	162.2	0	0	114.4	N757 V764 R785 V800 G804 V806	N757-M821 HydrophobicContact CB-CE 4.06Å; V764-M821 HydrophobicContact CG2-CE 3.98Å; V764-M821 HydrophobicContact CG2-SD 4.17Å; R785-M821 WeakPolarHBondContact CD-O 3.48Å; R785-M821 PolarHBondContact NH1-O 2.83Å; V800-M821 HydrophobicContact CB-CE 4.29Å; V800-M821 HydrophobicContact CG1-CE 3.39Å; V800-M821 HydrophobicContact CG2-CE 3.84Å; G804-M821 WeakPolarHBondContact O-CE 3.38Å; G804-M821 WeakPolarHBondContact O-CG 3.38Å; V806-M821 HydrophobicContact CG2-CE 3.6Å; V806-M821 HydrophobicContact CG2-SD 3.92Å
822	Y	94.8	Very high	95.4	Very high	172 Å²	172	49.5 Å²	49.5	68%	0.675	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-15.1	177.7	-59.5	-84	0	0	0	112	R785 D820	R785-Y822 VanDerWaalsContact NH1-CD1 3.26Å; D820-Y822 PolarHBondContact O-N 3.42Å; D820-Y822 WeakPolarHBondContact OD1-CA 3.48Å; D820-Y822 WeakPolarHBondContact OD1-CB 3.45Å; D820-Y822 PolarHBondContact OD1-N 3.46Å
823	G	94.5	Very high	95.6	Very high	14 Å²	14	53.7 Å²	53.7	14%	0.144	28%	0.283	C	S	.	.	S	Bend	trans	103.4	7.1	177.3	0	0	0	0	0	114.7	D820	D820-G823 PolarHBondContact O-N 3.04Å; D820-G823 PolarHBondContact OD1-N 2.98Å
824	N	96.9	Very high	95.6	Very high	97 Å²	97	56.2 Å²	56.2	52%	0.519	29%	0.288	S	S	.	.			trans	-73.4	134.5	174.5	-56.5	-61.5	0	0	0	109.7	F819 D820 L826	F819-N824 CarbonylContact C-O 3.54Å; F819-N824 WeakPolarHBondContact CA-O 3.42Å; D820-N824 PolarHBondContact N-O 2.78Å; D820-N824 PolarHBondContact OD1-N 3.46Å; D820-N824 PolarHBondContact OD1-ND2 3.41Å; D820-N824 PolarHBondContact OD2-ND2 3.31Å; N824-L826 PolarHBondContact O-N 2.96Å
825	V	97	Very high	95.5	Very high	64 Å²	64	55 Å²	55	39%	0.388	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	115	172.9	178.4	0	0	0	0	108.8	I791 I817 F819 K828	I791-V825 HydrophobicContact CD1-CG2 3.81Å; I791-V825 HydrophobicContact CG2-CG2 4.13Å; I817-V825 HydrophobicContact CG2-CG1 4.04Å; I817-V825 HydrophobicContact CG2-CG2 4.31Å; F819-V825 HydrophobicContact CD1-CG2 3.84Å; F819-V825 HydrophobicContact CE1-CG2 3.57Å; F819-V825 HydrophobicContact CZ-CG2 4.42Å; V825-K828 HydrophobicContact CG1-CB 4.26Å
826	L	96.9	Very high	95.4	Very high	91 Å²	91	58 Å²	58	48%	0.476	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-38.8	173.5	-59.7	178.2	0	0	0	111.3	R805 I818 D820 N824	R805-L826 HydrophobicContact CB-CD1 4.35Å; R805-L826 HydrophobicContact CG-CD1 3.65Å; I818-L826 HydrophobicContact CG2-CB 4.42Å; I818-L826 HydrophobicContact CG2-CD1 4.44Å; I818-L826 PolarHBondContact O-N 3.06Å; D820-L826 HydrophobicContact CB-CD1 4.17Å; D820-L826 HydrophobicContact CB-CD2 4.38Å; D820-L826 HydrophobicContact CB-CG 4.36Å; N824-L826 PolarHBondContact O-N 2.96Å
827	Q	96.5	Very high	95.3	Very high	74 Å²	74	60.5 Å²	60.5	35%	0.346	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	153.4	-178	177.5	53.3	-34.2	0	0	112.2	I818 F829 Y864	I818-Q827 HydrophobicContact CB-CB 4.32Å; I818-Q827 HydrophobicContact CD1-CB 4.36Å; I818-Q827 HydrophobicContact CG1-CB 4.47Å; I818-Q827 PolarHBondContact N-O 2.9Å; I818-Q827 PolarHBondContact O-N 3.19Å; Q827-F829 HydrophobicContact CG-CD1 4.04Å; Q827-F829 HydrophobicContact CG-CE1 4.41Å; Q827-Y864 VanDerWaalsContact CG-O 3.23Å; Q827-Y864 WeakPolarHBondContact CG-O 3.37Å
828	K	95.9	Very high	95.2	Very high	92 Å²	92	60.5 Å²	60.5	40%	0.4	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	120.4	-176.7	175.6	174.2	178.3	178.9	0	111.5	V816 I817 V825	V816-K828 WeakPolarHBondContact O-CA 3.43Å; I817-K828 HydrophobicContact CD1-CD 4.23Å; I817-K828 HydrophobicContact CD1-CG 4.43Å; I817-K828 HydrophobicContact CG1-CG 4.18Å; I817-K828 HydrophobicContact CG2-CB 4.41Å; V825-K828 HydrophobicContact CG1-CB 4.26Å
829	F	96.8	Very high	95	Very high	21 Å²	21	60.6 Å²	60.6	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151	-178.6	56.1	-95.6	0	0	0	113.9	R815 V816 I818 Q827 C831 I849 F862 Y864 G866	R815-F829 WeakPolarHBondContact CG-O 3.32Å; V816-F829 HydrophobicContact CB-CD2 4.08Å; V816-F829 HydrophobicContact CB-CE1 4.11Å; V816-F829 HydrophobicContact CB-CE2 3.57Å; V816-F829 HydrophobicContact CB-CZ 3.59Å; V816-F829 HydrophobicContact CG1-CE1 4.19Å; V816-F829 HydrophobicContact CG1-CE2 4.26Å; V816-F829 HydrophobicContact CG1-CZ 3.78Å; V816-F829 HydrophobicContact CG2-CD2 4.25Å; V816-F829 HydrophobicContact CG2-CE2 3.55Å; V816-F829 HydrophobicContact CG2-CZ 3.92Å; V816-F829 PolarHBondContact N-O 3.45Å; V816-F829 PolarHBondContact O-N 2.66Å; I818-F829 HydrophobicContact CD1-CE1 4.31Å; Q827-F829 HydrophobicContact CG-CD1 4.04Å; Q827-F829 HydrophobicContact CG-CE1 4.41Å; F829-C831 WeakPolarHBondContact CD2-SG 3.37Å; F829-C831 WeakPolarHBondContact CE2-SG 3.44Å; F829-I849 HydrophobicContact CE1-CD1 4.45Å; F829-I849 HydrophobicContact CZ-CD1 4.04Å; F829-F862 HydrophobicContact CE2-CB 4.41Å; F829-F862 HydrophobicContact CE2-CG 4.46Å; F829-Y864 WeakPolarHBondContact CE1-O 3.45Å; F829-G866 VanDerWaalsContact CD2-CA 3.4Å; F829-G866 VanDerWaalsContact CG-CA 3.45Å
830	G	94.3	Very high	94.8	Very high	60 Å²	60	60.9 Å²	60.9	62%	0.619	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	127	179.6	0	0	0	0	0	112.2
831	C	93.4	Very high	94.9	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	31%	0.306	C	S	.	.			trans	-110.1	12.8	-176.1	-64	0	0	0	0	113.4	M814 F829 K833 Y834 L835 F862	M814-C831 WeakPolarHBondContact O-CA 3.31Å; M814-C831 WeakPolarHBondContact O-CB 3.48Å; M814-C831 PolarHBondContact O-N 2.98Å; F829-C831 WeakPolarHBondContact CD2-SG 3.37Å; F829-C831 WeakPolarHBondContact CE2-SG 3.44Å; C831-K833 PolarHBondContact O-N 3.26Å; C831-Y834 PolarHBondContact O-N 3Å; C831-L835 HydrophobicContact CB-CB 4.44Å; C831-L835 HydrophobicContact CB-CD1 3.5Å; C831-L835 VanDerWaalsContact CB-CD1 3.5Å; C831-L835 HydrophobicContact CB-CG 3.9Å; C831-L835 PolarHBondContact O-N 2.9Å; C831-F862 HydrophobicContact CB-CE1 4.15Å; C831-F862 HydrophobicContact CB-CZ 3.91Å
832	S	91	Very high	95.1	Very high	87 Å²	87	59.6 Å²	59.6	61%	0.608	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-7.5	-176.4	54	0	0	0	0	115.9
833	K	91.8	Very high	95.2	Very high	181 Å²	181	52.3 Å²	52.3	79%	0.787	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-13.2	169.7	-63.9	-179.4	179.1	179	0	113.8	C831	C831-K833 PolarHBondContact O-N 3.26Å
834	Y	93.6	Very high	95.3	Very high	103 Å²	103	52 Å²	52	40%	0.404	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-21.7	-168.2	-56.1	-72.9	0	0	0	114	C831 K860 F862 Y868	C831-Y834 PolarHBondContact O-N 3Å; Y834-K860 VanDerWaalsContact O-CE 3.24Å; Y834-K860 WeakPolarHBondContact O-CE 3.38Å; Y834-F862 AromaticContact CD2-CE1 3.94Å; Y834-F862 HydrophobicContact CD2-CE1 3.94Å; Y834-F862 HydrophobicContact CG-CE1 4.31Å; Y834-Y868 AromaticContact CD1-CD1 3.99Å; Y834-Y868 HydrophobicContact CD1-CD1 3.99Å; Y834-Y868 HydrophobicContact CD1-CD2 4.01Å; Y834-Y868 HydrophobicContact CD1-CE1 4.4Å; Y834-Y868 HydrophobicContact CD1-CE2 4.43Å; Y834-Y868 AromaticContact CD1-CG 3.75Å; Y834-Y868 HydrophobicContact CD1-CG 3.75Å; Y834-Y868 HydrophobicContact CD2-CG 4.41Å; Y834-Y868 AromaticContact CE1-CD1 3.67Å; Y834-Y868 HydrophobicContact CE1-CD1 3.67Å; Y834-Y868 HydrophobicContact CE1-CD2 4.45Å; Y834-Y868 HydrophobicContact CE1-CE1 4.31Å; Y834-Y868 AromaticContact CE1-CG 3.74Å; Y834-Y868 HydrophobicContact CE1-CG 3.74Å; Y834-Y868 HydrophobicContact CE2-CG 4.4Å; Y834-Y868 HydrophobicContact CG-CD2 4.15Å; Y834-Y868 HydrophobicContact CG-CG 4.1Å
835	L	94.8	Very high	95	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.031	28%	0.276	C	S	.	.			trans	-113	139.4	178.4	-63.6	176	0	0	0	111	M814 C831 P838 V851 D853 K860 F862	M814-L835 HydrophobicContact CB-CB 4.29Å; M814-L835 HydrophobicContact SD-CB 4.4Å; C831-L835 HydrophobicContact CB-CB 4.44Å; C831-L835 HydrophobicContact CB-CD1 3.5Å; C831-L835 VanDerWaalsContact CB-CD1 3.5Å; C831-L835 HydrophobicContact CB-CG 3.9Å; C831-L835 PolarHBondContact O-N 2.9Å; L835-P838 HydrophobicContact CB-CG 4.41Å; L835-P838 HydrophobicContact CD1-CB 4.02Å; L835-P838 HydrophobicContact CD1-CG 4.06Å; L835-P838 HydrophobicContact CD2-CB 4.32Å; L835-V851 HydrophobicContact CD1-CG1 4.1Å; L835-V851 HydrophobicContact CD2-CB 4.33Å; L835-V851 HydrophobicContact CD2-CG1 4Å; L835-D853 VanDerWaalsContact CA-OD2 3.29Å; L835-D853 WeakPolarHBondContact CA-OD2 3.45Å; L835-D853 HydrophobicContact CD2-CB 4.02Å; L835-D853 WeakPolarHBondContact CD2-OD2 3.23Å; L835-K860 HydrophobicContact CD2-CB 3.97Å; L835-K860 HydrophobicContact CD2-CG 3.66Å; L835-F862 HydrophobicContact CD1-CE2 4.34Å; L835-F862 HydrophobicContact CD1-CZ 4.42Å; L835-F862 HydrophobicContact CD2-CE2 4.4Å; L835-F862 HydrophobicContact CG-CE2 4.4Å; L835-F862 HydrophobicContact CG-CZ 4.21Å
836	E	94.1	Very high	94.9	Very high	97 Å²	97	55.5 Å²	55.5	45%	0.453	28%	0.282	S	S	.	.	S	Bend	trans	-117.1	-35.6	178.7	-75.2	-171	-121.6	0	0	112.8	M814 D853 R855	M814-E836 WeakPolarHBondContact CE-O 3.28Å; E836-D853 PolarHBondContact N-OD2 3.28Å; E836-R855 HydrophobicContact CB-CB 3.87Å; E836-R855 HydrophobicContact CB-CG 4.04Å; E836-R855 WeakPolarHBondContact OE2-CD 3.46Å; E836-R855 WeakPolarHBondContact OE2-CG 3.36Å; E836-R855 IonicContact OE2-CZ 3.42Å; E836-R855 IonicContact OE2-NE 3.48Å; E836-R855 PolarHBondContact OE2-NE 2.95Å
837	F	94	Very high	94.7	Very high	51 Å²	51	54.1 Å²	54.1	22%	0.224	27%	0.273	C	S	.	.	S	Bend	trans	-159	79.5	172.2	-160.9	-99	0	0	0	111.6	D853 N854 R855	F837-D853 VanDerWaalsContact N-CG 3.34Å; F837-D853 PolarHBondContact N-OD1 2.99Å; F837-D853 VanDerWaalsContact N-OD1 3.09Å; F837-D853 PolarHBondContact N-OD2 3.22Å; F837-N854 HydrophobicContact CB-CB 4.42Å; F837-N854 HydrophobicContact CD1-CB 3.88Å; F837-N854 PolarHBondContact O-N 2.9Å; F837-R855 HydrophobicContact CB-CB 3.77Å
838	P	96	Very high	94.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	141.3	-178.2	29.4	-33.7	0	0	0	112.3	V809 C811 M814 L835 V851 S852	V809-P838 HydrophobicContact CG1-CB 3.72Å; V809-P838 HydrophobicContact CG1-CG 3.86Å; C811-P838 WeakPolarHBondContact CB-O 3.5Å; M814-P838 WeakPolarHBondContact SD-CD 3.46Å; M814-P838 HydrophobicContact SD-CG 4.02Å; L835-P838 HydrophobicContact CB-CG 4.41Å; L835-P838 HydrophobicContact CD1-CB 4.02Å; L835-P838 HydrophobicContact CD1-CG 4.06Å; L835-P838 HydrophobicContact CD2-CB 4.32Å; P838-V851 HydrophobicContact CB-CG1 3.45Å; P838-V851 VanDerWaalsContact CB-CG1 3.45Å; P838-S852 WeakPolarHBondContact CA-O 3.28Å
839	N	94	Very high	94.9	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-91.6	-175.3	-159.6	12	0	0	0	111.8	R753 R796 G797 S852 I882	R753-N839 PolarHBondContact NH2-OD1 3.32Å; R753-N839 VanDerWaalsContact NH2-OD1 3.12Å; R796-N839 CarbonylContact C-O 3.1Å; R796-N839 PolarHBondContact NE-OD1 3.21Å; R796-N839 PolarHBondContact NH2-OD1 3.49Å; G797-N839 WeakPolarHBondContact CA-O 3.46Å; G797-N839 PolarHBondContact N-O 3.38Å; N839-S852 PolarHBondContact N-O 3.01Å; N839-I882 PolarHBondContact ND2-O 2.98Å
840	G	95.5	Very high	95	Very high	5 Å²	5	46.2 Å²	46.2	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	160.5	173.8	0	0	0	0	0	114.2	S852	G840-S852 WeakPolarHBondContact CA-OG 3.45Å; G840-S852 PolarHBondContact N-OG 2.88Å; G840-S852 PolarHBondContact O-N 2.95Å; G840-S852 PolarHBondContact O-OG 3.37Å
841	V	98	Very high	95.1	Very high	11 Å²	11	43.3 Å²	43.3	7%	0.067	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	142.4	177.6	60.3	0	0	0	0	110.9	T799 V807 V809 I849 F850 V851	T799-V841 WeakPolarHBondContact CB-O 3Å; T799-V841 HydrophobicContact CG2-CG1 3.98Å; T799-V841 HydrophobicContact CG2-CG2 4.07Å; V807-V841 HydrophobicContact CG1-CG2 4.37Å; V809-V841 HydrophobicContact CG2-CB 3.73Å; V809-V841 HydrophobicContact CG2-CG1 3.98Å; V809-V841 HydrophobicContact CG2-CG2 3.72Å; V841-I849 HydrophobicContact CG2-CG2 3.69Å; V841-F850 CarbonylContact C-O 3.53Å; V841-F850 VanDerWaalsContact CA-O 3.29Å; V841-F850 WeakPolarHBondContact CA-O 3.29Å; V841-V851 HydrophobicContact CG2-CG2 4.16Å
842	V	97.8	Very high	95.3	Very high	20 Å²	20	43.3 Å²	43.3	12%	0.121	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160.5	172.1	68.5	0	0	0	0	110.3	F850 V884 I886	V842-F850 HydrophobicContact CG1-CB 3.83Å; V842-F850 HydrophobicContact CG1-CG 4.44Å; V842-F850 PolarHBondContact N-O 2.95Å; V842-F850 PolarHBondContact O-N 3.03Å; V842-V884 HydrophobicContact CG1-CB 4.49Å; V842-V884 HydrophobicContact CG1-CG1 4.11Å; V842-V884 HydrophobicContact CG1-CG2 3.95Å; V842-I886 HydrophobicContact CG1-CD1 4.13Å; V842-I886 HydrophobicContact CG1-CG1 3.93Å; V842-I886 HydrophobicContact CG2-CB 4.38Å; V842-I886 HydrophobicContact CG2-CD1 4.34Å; V842-I886 HydrophobicContact CG2-CG1 4.17Å
843	T	97.5	Very high	95.6	Very high	18 Å²	18	39.1 Å²	39.1	11%	0.11	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.8	178.5	54.7	0	0	0	0	111.3	T799 D801 V807 E848 I849 Y864	T799-T843 HydrophobicContact CG2-CG2 3.92Å; D801-T843 WeakPolarHBondContact CB-OG1 3.5Å; V807-T843 HydrophobicContact CG2-CG2 4.21Å; T843-E848 VanDerWaalsContact CA-O 3.3Å; T843-E848 WeakPolarHBondContact CA-O 3.42Å; T843-I849 HydrophobicContact CG2-CB 4.49Å; T843-I849 HydrophobicContact CG2-CG1 4.05Å; T843-Y864 HydrophobicContact CG2-CE2 4.42Å; T843-Y864 WeakPolarHBondContact CG2-OH 3.22Å
844	N	95.7	Very high	95.7	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.043	15%	0.148	C	C	.	.			trans	-110.2	173.3	174.1	69.3	-3.6	0	0	0	112.9	R846 Q847 E848 F850 I886 Q908	N844-R846 VanDerWaalsContact C-N 3.26Å; N844-R846 PolarHBondContact O-N 3.4Å; N844-R846 PolarHBondContact OD1-N 3.13Å; N844-Q847 PolarHBondContact O-N 3.3Å; N844-Q847 PolarHBondContact OD1-N 2.86Å; N844-E848 PolarHBondContact N-O 2.93Å; N844-E848 PolarHBondContact ND2-OE2 2.74Å; N844-E848 WeakPolarHBondContact OD1-CA 3.35Å; N844-E848 WeakPolarHBondContact OD1-CB 3.45Å; N844-E848 PolarHBondContact OD1-N 3.07Å; N844-E848 PolarHBondContact OD1-O 3.04Å; N844-F850 HydrophobicContact CB-CE2 4.04Å; N844-I886 HydrophobicContact CB-CD1 3.85Å; N844-Q908 PolarHBondContact ND2-OE1 3.42Å
845	D	91.1	Very high	95.7	Very high	103 Å²	103	34.8 Å²	34.8	55%	0.551	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-38.7	170.6	59.6	-31.3	0	0	0	113.1	Y802 Q847	Y802-D845 VanDerWaalsContact CE1-O 3.23Å; Y802-D845 WeakPolarHBondContact CE1-O 3.34Å; Y802-D845 PolarHBondContact OH-O 3.36Å; D845-Q847 PolarHBondContact O-N 2.96Å; D845-Q847 VanDerWaalsContact O-N 3.09Å
846	R	93.9	Very high	95.7	Very high	131 Å²	131	35.4 Å²	35.4	49%	0.494	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-5.4	177.7	-50.7	-178.1	-177.9	177.9	1.4	114.7	N844 E848 D909	N844-R846 VanDerWaalsContact C-N 3.26Å; N844-R846 PolarHBondContact O-N 3.4Å; N844-R846 PolarHBondContact OD1-N 3.13Å; R846-E848 HydrophobicContact CB-CG 4.17Å; R846-D909 IonicContact CZ-OD1 3.31Å; R846-D909 IonicContact NH1-OD1 2.73Å; R846-D909 PolarHBondContact NH1-OD1 3.3Å; R846-D909 IonicContact NH2-OD1 2.72Å
847	Q	94.2	Very high	95.7	Very high	63 Å²	63	32 Å²	32	29%	0.294	15%	0.149	S	C	.	.			trans	62.2	51.9	-172.4	-56.2	-178.2	102.3	0	0	113	Y802 K803 R805 N844 D845 Y864	Y802-Q847 HydrophobicContact CE1-CG 4.26Å; K803-Q847 VanDerWaalsContact NZ-CD 3.28Å; R805-Q847 VanDerWaalsContact NH1-OE1 3.15Å; N844-Q847 PolarHBondContact O-N 3.3Å; N844-Q847 PolarHBondContact OD1-N 2.86Å; D845-Q847 PolarHBondContact O-N 2.96Å; D845-Q847 VanDerWaalsContact O-N 3.09Å; Q847-Y864 VanDerWaalsContact C-CE2 3.5Å; Q847-Y864 HydrophobicContact CB-CD2 3.86Å; Q847-Y864 HydrophobicContact CB-CE2 3.85Å; Q847-Y864 WeakPolarHBondContact O-CD2 3.37Å
848	E	97.6	Very high	95.9	Very high	20 Å²	20	29.6 Å²	29.6	9%	0.093	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.9	169.1	-53.7	177	114.7	0	0	109.6	T843 N844 R846 F850 V861 F862 L869 R870	T843-E848 VanDerWaalsContact CA-O 3.3Å; T843-E848 WeakPolarHBondContact CA-O 3.42Å; N844-E848 PolarHBondContact N-O 2.93Å; N844-E848 PolarHBondContact ND2-OE2 2.74Å; N844-E848 WeakPolarHBondContact OD1-CA 3.35Å; N844-E848 WeakPolarHBondContact OD1-CB 3.45Å; N844-E848 PolarHBondContact OD1-N 3.07Å; N844-E848 PolarHBondContact OD1-O 3.04Å; R846-E848 HydrophobicContact CB-CG 4.17Å; E848-F850 HydrophobicContact CB-CD2 4.49Å; E848-F850 HydrophobicContact CB-CE2 3.78Å; E848-F850 HydrophobicContact CB-CZ 4.27Å; E848-V861 HydrophobicContact CB-CG1 3.92Å; E848-F862 CarbonylContact C-O 3.54Å; E848-F862 WeakPolarHBondContact CA-O 3.38Å; E848-L869 HydrophobicContact CB-CD1 4.46Å; E848-L869 HydrophobicContact CG-CD1 3.94Å; E848-L869 VanDerWaalsContact OE1-CD1 3.31Å; E848-L869 WeakPolarHBondContact OE1-CD1 3.36Å; E848-R870 IonicContact OE1-CZ 2.69Å; E848-R870 VanDerWaalsContact OE1-CZ 3.29Å; E848-R870 IonicContact OE1-NH1 2.81Å; E848-R870 PolarHBondContact OE1-NH1 3.4Å; E848-R870 IonicContact OE1-NH2 2.68Å; E848-R870 PolarHBondContact OE1-NH2 3.44Å; E848-R870 IonicContact OE2-CZ 3.69Å; E848-R870 IonicContact OE2-NH1 3.53Å; E848-R870 IonicContact OE2-NH2 3.81Å; E848-R870 PolarHBondContact OE2-NH2 2.91Å
849	I	98.2	Very high	96	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113	-176.1	-54.8	171.3	0	0	0	107.9	V807 V816 I818 F829 V841 T843 V851 V861 F862 Y864	V807-I849 HydrophobicContact CG1-CD1 4.19Å; V807-I849 HydrophobicContact CG1-CG2 4Å; V816-I849 HydrophobicContact CG1-CD1 4.37Å; I818-I849 HydrophobicContact CD1-CD1 3.81Å; F829-I849 HydrophobicContact CE1-CD1 4.45Å; F829-I849 HydrophobicContact CZ-CD1 4.04Å; V841-I849 HydrophobicContact CG2-CG2 3.69Å; T843-I849 HydrophobicContact CG2-CB 4.49Å; T843-I849 HydrophobicContact CG2-CG1 4.05Å; I849-V851 HydrophobicContact CG2-CG2 4.06Å; I849-V861 WeakPolarHBondContact O-CA 3.48Å; I849-F862 PolarHBondContact N-O 2.75Å; I849-F862 PolarHBondContact O-N 3.33Å; I849-Y864 HydrophobicContact CD1-CD2 3.77Å; I849-Y864 HydrophobicContact CD1-CE2 3.92Å; I849-Y864 HydrophobicContact CD1-CG 4.11Å; I849-Y864 HydrophobicContact CG1-CD2 3.71Å; I849-Y864 HydrophobicContact CG1-CE2 3.49Å; I849-Y864 VanDerWaalsContact CG1-CE2 3.49Å
850	F	98.3	Very high	96.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.6	-178.5	-62.7	-105.6	0	0	0	108.7	V841 V842 N844 E848 V859 V861 I872 V884 I886 V892 Q908	V841-F850 CarbonylContact C-O 3.53Å; V841-F850 VanDerWaalsContact CA-O 3.29Å; V841-F850 WeakPolarHBondContact CA-O 3.29Å; V842-F850 HydrophobicContact CG1-CB 3.83Å; V842-F850 HydrophobicContact CG1-CG 4.44Å; V842-F850 PolarHBondContact N-O 2.95Å; V842-F850 PolarHBondContact O-N 3.03Å; N844-F850 HydrophobicContact CB-CE2 4.04Å; E848-F850 HydrophobicContact CB-CD2 4.49Å; E848-F850 HydrophobicContact CB-CE2 3.78Å; E848-F850 HydrophobicContact CB-CZ 4.27Å; F850-V859 HydrophobicContact CB-CG1 3.9Å; F850-V859 HydrophobicContact CD1-CG1 4.28Å; F850-V861 HydrophobicContact CD1-CB 4.41Å; F850-V861 HydrophobicContact CD1-CG1 4.06Å; F850-V861 HydrophobicContact CD1-CG2 3.51Å; F850-V861 HydrophobicContact CD2-CG1 4.42Å; F850-V861 HydrophobicContact CE1-CB 4.48Å; F850-V861 HydrophobicContact CE1-CG1 3.89Å; F850-V861 HydrophobicContact CE1-CG2 3.69Å; F850-V861 HydrophobicContact CE2-CG1 4.26Å; F850-V861 HydrophobicContact CG-CG1 4.31Å; F850-V861 HydrophobicContact CG-CG2 4.28Å; F850-V861 HydrophobicContact CZ-CG1 3.99Å; F850-I872 HydrophobicContact CD1-CD1 4.11Å; F850-I872 HydrophobicContact CE1-CD1 3.79Å; F850-V884 HydrophobicContact CB-CG2 4.49Å; F850-I886 HydrophobicContact CD2-CD1 4.2Å; F850-I886 HydrophobicContact CE2-CD1 4.15Å; F850-V892 HydrophobicContact CD1-CG1 4.41Å; F850-V892 HydrophobicContact CD1-CG2 4.14Å; F850-V892 HydrophobicContact CE1-CG2 3.82Å; F850-V892 HydrophobicContact CZ-CG2 4.39Å; F850-Q908 HydrophobicContact CZ-CB 4.45Å
851	V	97.9	Very high	96.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.1	-177.5	-176	0	0	0	0	109.3	V809 L835 P838 V841 I849 D853 V859 K860 F862	V809-V851 HydrophobicContact CG1-CG1 3.97Å; V809-V851 HydrophobicContact CG2-CG1 4.47Å; V809-V851 HydrophobicContact CG2-CG2 4.07Å; L835-V851 HydrophobicContact CD1-CG1 4.1Å; L835-V851 HydrophobicContact CD2-CB 4.33Å; L835-V851 HydrophobicContact CD2-CG1 4Å; P838-V851 HydrophobicContact CB-CG1 3.45Å; P838-V851 VanDerWaalsContact CB-CG1 3.45Å; V841-V851 HydrophobicContact CG2-CG2 4.16Å; I849-V851 HydrophobicContact CG2-CG2 4.06Å; V851-D853 PolarHBondContact O-N 3.08Å; V851-V859 CarbonylContact O-C 3.38Å; V851-V859 VanDerWaalsContact O-CA 3.29Å; V851-V859 WeakPolarHBondContact O-CA 3.49Å; V851-K860 PolarHBondContact N-O 2.8Å; V851-K860 PolarHBondContact O-N 2.93Å; V851-F862 HydrophobicContact CG2-CD2 4.32Å; V851-F862 HydrophobicContact CG2-CE2 4.33Å
852	S	97.2	Very high	96.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.9	173.2	62.2	0	0	0	0	109.9	P838 N839 G840	P838-S852 WeakPolarHBondContact CA-O 3.28Å; N839-S852 PolarHBondContact N-O 3.01Å; G840-S852 WeakPolarHBondContact CA-OG 3.45Å; G840-S852 PolarHBondContact N-OG 2.88Å; G840-S852 PolarHBondContact O-N 2.95Å; G840-S852 PolarHBondContact O-OG 3.37Å
853	D	96.1	Very high	96.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.1	175	-163.9	-66.2	0	0	0	110.7	L835 E836 F837 V851 R855 A856 H857 S858 P881	L835-D853 VanDerWaalsContact CA-OD2 3.29Å; L835-D853 WeakPolarHBondContact CA-OD2 3.45Å; L835-D853 HydrophobicContact CD2-CB 4.02Å; L835-D853 WeakPolarHBondContact CD2-OD2 3.23Å; E836-D853 PolarHBondContact N-OD2 3.28Å; F837-D853 VanDerWaalsContact N-CG 3.34Å; F837-D853 PolarHBondContact N-OD1 2.99Å; F837-D853 VanDerWaalsContact N-OD1 3.09Å; F837-D853 PolarHBondContact N-OD2 3.22Å; V851-D853 PolarHBondContact O-N 3.08Å; D853-R855 PolarHBondContact OD1-N 2.88Å; D853-A856 HydrophobicContact CB-CB 4.07Å; D853-A856 PolarHBondContact OD1-N 3.45Å; D853-H857 PolarHBondContact O-N 2.94Å; D853-S858 PolarHBondContact N-O 2.9Å; D853-S858 PolarHBondContact O-N 2.91Å; D853-P881 WeakPolarHBondContact O-CD 3.34Å; D853-P881 WeakPolarHBondContact O-CG 3.45Å
854	N	94.6	Very high	96.1	Very high	28 Å²	28	30.2 Å²	30.2	15%	0.15	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-41.9	-175.7	-164.4	-101.5	0	0	0	111.5	F837 Y880 P881	F837-N854 HydrophobicContact CB-CB 4.42Å; F837-N854 HydrophobicContact CD1-CB 3.88Å; F837-N854 PolarHBondContact O-N 2.9Å; N854-Y880 PolarHBondContact ND2-O 2.87Å; N854-Y880 WeakPolarHBondContact O-CA 3.42Å; N854-Y880 WeakPolarHBondContact O-CD1 3.22Å; N854-P881 PolarHBondContact ND2-O 3.26Å
855	R	93.3	Very high	96.1	Very high	165 Å²	165	35.8 Å²	35.8	62%	0.623	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-26.3	-171.2	-176.4	173.2	166.6	143.8	11.9	112.7	E836 F837 D853 H857	E836-R855 HydrophobicContact CB-CB 3.87Å; E836-R855 HydrophobicContact CB-CG 4.04Å; E836-R855 WeakPolarHBondContact OE2-CD 3.46Å; E836-R855 WeakPolarHBondContact OE2-CG 3.36Å; E836-R855 IonicContact OE2-CZ 3.42Å; E836-R855 IonicContact OE2-NE 3.48Å; E836-R855 PolarHBondContact OE2-NE 2.95Å; F837-R855 HydrophobicContact CB-CB 3.77Å; D853-R855 PolarHBondContact OD1-N 2.88Å; R855-H857 VanDerWaalsContact C-N 3.3Å; R855-H857 PolarHBondContact O-CD2 3.48Å; R855-H857 VanDerWaalsContact O-CD2 3.27Å
856	A	94.4	Very high	96.3	Very high	19 Å²	19	31.9 Å²	31.9	16%	0.157	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	12	170.5	0	0	0	0	0	113.8	D853 S858	D853-A856 HydrophobicContact CB-CB 4.07Å; D853-A856 PolarHBondContact OD1-N 3.45Å; A856-S858 WeakPolarHBondContact O-CB 3.39Å; A856-S858 PolarHBondContact O-N 2.96Å; A856-S858 PolarHBondContact O-OG 3Å
857	H	95.5	Very high	96.4	Very high	25 Å²	25	29.5 Å²	29.5	12%	0.116	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	30.8	176.9	-63.4	-122	0	0	0	114.6	D853 R855 G874 E875 T878 N879 Y880	D853-H857 PolarHBondContact O-N 2.94Å; R855-H857 VanDerWaalsContact C-N 3.3Å; R855-H857 PolarHBondContact O-CD2 3.48Å; R855-H857 VanDerWaalsContact O-CD2 3.27Å; H857-G874 CarbonylContact O-C 3.55Å; H857-G874 WeakPolarHBondContact O-CA 3.42Å; H857-G874 PolarHBondContact O-N 3.39Å; H857-G874 VanDerWaalsContact O-N 3.17Å; H857-E875 HydrophobicContact CB-CB 4.21Å; H857-T878 CarbonylContact C-O 3.47Å; H857-T878 WeakPolarHBondContact CA-O 3.24Å; H857-T878 PolarHBondContact O-OG1 3.32Å; H857-N879 PolarHBondContact ND1-OD1 2.72Å; H857-Y880 AromaticContact CE1-CE1 3.6Å; H857-Y880 AromaticContact CE1-CE2 3.57Å; H857-Y880 AromaticContact CE1-CZ 3.29Å; H857-Y880 PolarHBondContact CE1-OH 3.47Å; H857-Y880 AromaticContact NE2-CE1 3.41Å; H857-Y880 WeakPolarHBondContact NE2-CE1 3.46Å; H857-Y880 AromaticContact NE2-CZ 3.5Å
858	S	96.7	Very high	96.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	165.5	-167.7	55.9	0	0	0	0	113.4	D853 A856 K860	D853-S858 PolarHBondContact N-O 2.9Å; D853-S858 PolarHBondContact O-N 2.91Å; A856-S858 WeakPolarHBondContact O-CB 3.39Å; A856-S858 PolarHBondContact O-N 2.96Å; A856-S858 PolarHBondContact O-OG 3Å; S858-K860 WeakPolarHBondContact OG-CE 2.85Å
859	V	97.9	Very high	96.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129	168.6	177	0	0	0	0	108.8	F850 V851 Q871 I872 V884 V894	F850-V859 HydrophobicContact CB-CG1 3.9Å; F850-V859 HydrophobicContact CD1-CG1 4.28Å; V851-V859 CarbonylContact O-C 3.38Å; V851-V859 VanDerWaalsContact O-CA 3.29Å; V851-V859 WeakPolarHBondContact O-CA 3.49Å; V859-Q871 CarbonylContact O-C 3.49Å; V859-Q871 WeakPolarHBondContact O-CA 3.3Å; V859-I872 HydrophobicContact CB-CB 4.31Å; V859-I872 PolarHBondContact N-O 3.09Å; V859-I872 PolarHBondContact O-N 2.98Å; V859-V884 HydrophobicContact CG1-CG2 4.34Å; V859-V884 HydrophobicContact CG2-CB 4.1Å; V859-V884 HydrophobicContact CG2-CG2 4Å; V859-V894 HydrophobicContact CG2-CB 4.46Å; V859-V894 HydrophobicContact CG2-CG1 3.94Å; V859-V894 HydrophobicContact CG2-CG2 3.65Å
860	K	97.5	Very high	96.4	Very high	25 Å²	25	34.4 Å²	34.4	11%	0.109	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138	171	-51.3	-63.4	176.7	165.8	0	109.1	Y834 L835 V851 S858 F862 Y868 Q871	Y834-K860 VanDerWaalsContact O-CE 3.24Å; Y834-K860 WeakPolarHBondContact O-CE 3.38Å; L835-K860 HydrophobicContact CD2-CB 3.97Å; L835-K860 HydrophobicContact CD2-CG 3.66Å; V851-K860 PolarHBondContact N-O 2.8Å; V851-K860 PolarHBondContact O-N 2.93Å; S858-K860 WeakPolarHBondContact OG-CE 2.85Å; K860-F862 HydrophobicContact CB-CE2 3.66Å; K860-F862 HydrophobicContact CB-CZ 3.97Å; K860-Y868 HydrophobicContact CB-CE2 4.23Å; K860-Y868 HydrophobicContact CD-CE2 4.09Å; K860-Q871 HydrophobicContact CD-CB 4.43Å; K860-Q871 HydrophobicContact CD-CG 4.34Å
861	V	97.9	Very high	96.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.7	-178	-167.3	0	0	0	0	109.7	E848 I849 F850 L869 R870 I872	E848-V861 HydrophobicContact CB-CG1 3.92Å; I849-V861 WeakPolarHBondContact O-CA 3.48Å; F850-V861 HydrophobicContact CD1-CB 4.41Å; F850-V861 HydrophobicContact CD1-CG1 4.06Å; F850-V861 HydrophobicContact CD1-CG2 3.51Å; F850-V861 HydrophobicContact CD2-CG1 4.42Å; F850-V861 HydrophobicContact CE1-CB 4.48Å; F850-V861 HydrophobicContact CE1-CG1 3.89Å; F850-V861 HydrophobicContact CE1-CG2 3.69Å; F850-V861 HydrophobicContact CE2-CG1 4.26Å; F850-V861 HydrophobicContact CG-CG1 4.31Å; F850-V861 HydrophobicContact CG-CG2 4.28Å; F850-V861 HydrophobicContact CZ-CG1 3.99Å; V861-L869 HydrophobicContact CG1-CD1 4.36Å; V861-L869 PolarHBondContact O-N 2.78Å; V861-R870 HydrophobicContact CB-CG 3.85Å; V861-R870 HydrophobicContact CG2-CG 3.83Å; V861-R870 PolarHBondContact N-O 3.32Å; V861-I872 HydrophobicContact CG2-CD1 4.08Å; V861-I872 HydrophobicContact CG2-CG1 4.16Å
862	F	98	Very high	96.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157.1	178.6	-55.3	-93.5	0	0	0	110.7	F829 C831 Y834 L835 E848 I849 V851 K860 V867 Y868	F829-F862 HydrophobicContact CE2-CB 4.41Å; F829-F862 HydrophobicContact CE2-CG 4.46Å; C831-F862 HydrophobicContact CB-CE1 4.15Å; C831-F862 HydrophobicContact CB-CZ 3.91Å; Y834-F862 AromaticContact CD2-CE1 3.94Å; Y834-F862 HydrophobicContact CD2-CE1 3.94Å; Y834-F862 HydrophobicContact CG-CE1 4.31Å; L835-F862 HydrophobicContact CD1-CE2 4.34Å; L835-F862 HydrophobicContact CD1-CZ 4.42Å; L835-F862 HydrophobicContact CD2-CE2 4.4Å; L835-F862 HydrophobicContact CG-CE2 4.4Å; L835-F862 HydrophobicContact CG-CZ 4.21Å; E848-F862 CarbonylContact C-O 3.54Å; E848-F862 WeakPolarHBondContact CA-O 3.38Å; I849-F862 PolarHBondContact N-O 2.75Å; I849-F862 PolarHBondContact O-N 3.33Å; V851-F862 HydrophobicContact CG2-CD2 4.32Å; V851-F862 HydrophobicContact CG2-CE2 4.33Å; K860-F862 HydrophobicContact CB-CE2 3.66Å; K860-F862 HydrophobicContact CB-CZ 3.97Å; F862-V867 CarbonylContact C-O 3.54Å; F862-V867 VanDerWaalsContact CA-O 3.24Å; F862-V867 WeakPolarHBondContact CA-O 3.39Å; F862-Y868 HydrophobicContact CD1-CD2 4.49Å; F862-Y868 HydrophobicContact CE1-CD2 4.05Å; F862-Y868 HydrophobicContact CE1-CG 4.46Å; F862-Y868 HydrophobicContact CZ-CD2 4.3Å
863	N	96.7	Very high	96.1	Very high	34 Å²	34	39.2 Å²	39.2	18%	0.182	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	175.7	160.4	68.7	0	0	0	0	110.8	E865 G866 V867 L869	N863-E865 WeakPolarHBondContact CB-OE2 3.49Å; N863-E865 PolarHBondContact ND2-OE2 2.83Å; N863-E865 PolarHBondContact O-N 2.9Å; N863-E865 PolarHBondContact OD1-N 3.06Å; N863-G866 PolarHBondContact O-N 3.13Å; N863-G866 VanDerWaalsContact O-N 3.15Å; N863-G866 PolarHBondContact OD1-N 3.01Å; N863-V867 PolarHBondContact N-O 3.17Å; N863-V867 WeakPolarHBondContact OD1-CA 3.19Å; N863-V867 VanDerWaalsContact OD1-CB 3.31Å; N863-V867 WeakPolarHBondContact OD1-CB 3.34Å; N863-V867 PolarHBondContact OD1-N 3.46Å; N863-V867 PolarHBondContact OD1-O 3.32Å; N863-L869 HydrophobicContact CB-CD1 4.21Å; N863-L869 HydrophobicContact CB-CD2 4.36Å
864	Y	96.5	Very high	96	Very high	13 Å²	13	39.8 Å²	39.8	5%	0.051	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-20.9	-179.1	-82.6	-125.3	0	0	0	112	D801 V807 I818 Q827 F829 T843 Q847 I849 G866	D801-Y864 WeakPolarHBondContact CB-OH 3.47Å; D801-Y864 WeakPolarHBondContact OD2-CE1 3.21Å; D801-Y864 PolarHBondContact OD2-OH 2.76Å; V807-Y864 HydrophobicContact CG2-CE1 4.31Å; I818-Y864 HydrophobicContact CD1-CD1 3.41Å; I818-Y864 VanDerWaalsContact CD1-CD1 3.41Å; I818-Y864 HydrophobicContact CD1-CE1 3.93Å; I818-Y864 HydrophobicContact CD1-CG 3.93Å; I818-Y864 HydrophobicContact CG2-CE1 4.41Å; Q827-Y864 VanDerWaalsContact CG-O 3.23Å; Q827-Y864 WeakPolarHBondContact CG-O 3.37Å; F829-Y864 WeakPolarHBondContact CE1-O 3.45Å; T843-Y864 HydrophobicContact CG2-CE2 4.42Å; T843-Y864 WeakPolarHBondContact CG2-OH 3.22Å; Q847-Y864 VanDerWaalsContact C-CE2 3.5Å; Q847-Y864 HydrophobicContact CB-CD2 3.86Å; Q847-Y864 HydrophobicContact CB-CE2 3.85Å; Q847-Y864 WeakPolarHBondContact O-CD2 3.37Å; I849-Y864 HydrophobicContact CD1-CD2 3.77Å; I849-Y864 HydrophobicContact CD1-CE2 3.92Å; I849-Y864 HydrophobicContact CD1-CG 4.11Å; I849-Y864 HydrophobicContact CG1-CD2 3.71Å; I849-Y864 HydrophobicContact CG1-CE2 3.49Å; I849-Y864 VanDerWaalsContact CG1-CE2 3.49Å; Y864-G866 PolarHBondContact O-N 2.9Å
865	E	95.6	Very high	95.9	Very high	126 Å²	126	46.3 Å²	46.3	59%	0.589	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-13.3	174	-60.9	64.7	-140.1	0	0	112.5	N863 V867	N863-E865 WeakPolarHBondContact CB-OE2 3.49Å; N863-E865 PolarHBondContact ND2-OE2 2.83Å; N863-E865 PolarHBondContact O-N 2.9Å; N863-E865 PolarHBondContact OD1-N 3.06Å; E865-V867 HydrophobicContact CB-CG2 4.48Å
866	G	94.4	Very high	95.5	Very high	20 Å²	20	40.1 Å²	40.1	21%	0.206	22%	0.216	C	C	.	.			trans	92.7	9.9	178.7	0	0	0	0	0	115.3	F829 N863 Y864	F829-G866 VanDerWaalsContact CD2-CA 3.4Å; F829-G866 VanDerWaalsContact CG-CA 3.45Å; N863-G866 PolarHBondContact O-N 3.13Å; N863-G866 VanDerWaalsContact O-N 3.15Å; N863-G866 PolarHBondContact OD1-N 3.01Å; Y864-G866 PolarHBondContact O-N 2.9Å
867	V	96.6	Very high	95.4	Very high	82 Å²	82	39.6 Å²	39.6	50%	0.497	21%	0.211	S	C	.	.			trans	-75.8	127.4	172.9	-172	0	0	0	0	109.3	F862 N863 E865	F862-V867 CarbonylContact C-O 3.54Å; F862-V867 VanDerWaalsContact CA-O 3.24Å; F862-V867 WeakPolarHBondContact CA-O 3.39Å; N863-V867 PolarHBondContact N-O 3.17Å; N863-V867 WeakPolarHBondContact OD1-CA 3.19Å; N863-V867 VanDerWaalsContact OD1-CB 3.31Å; N863-V867 WeakPolarHBondContact OD1-CB 3.34Å; N863-V867 PolarHBondContact OD1-N 3.46Å; N863-V867 PolarHBondContact OD1-O 3.32Å; E865-V867 HydrophobicContact CB-CG2 4.48Å
868	Y	96.9	Very high	95.3	Very high	69 Å²	69	38.4 Å²	38.4	27%	0.271	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.1	171.6	169.7	-100.9	0	0	0	110.8	Y834 K860 F862 R870 Q871	Y834-Y868 AromaticContact CD1-CD1 3.99Å; Y834-Y868 HydrophobicContact CD1-CD1 3.99Å; Y834-Y868 HydrophobicContact CD1-CD2 4.01Å; Y834-Y868 HydrophobicContact CD1-CE1 4.4Å; Y834-Y868 HydrophobicContact CD1-CE2 4.43Å; Y834-Y868 AromaticContact CD1-CG 3.75Å; Y834-Y868 HydrophobicContact CD1-CG 3.75Å; Y834-Y868 HydrophobicContact CD2-CG 4.41Å; Y834-Y868 AromaticContact CE1-CD1 3.67Å; Y834-Y868 HydrophobicContact CE1-CD1 3.67Å; Y834-Y868 HydrophobicContact CE1-CD2 4.45Å; Y834-Y868 HydrophobicContact CE1-CE1 4.31Å; Y834-Y868 AromaticContact CE1-CG 3.74Å; Y834-Y868 HydrophobicContact CE1-CG 3.74Å; Y834-Y868 HydrophobicContact CE2-CG 4.4Å; Y834-Y868 HydrophobicContact CG-CD2 4.15Å; Y834-Y868 HydrophobicContact CG-CG 4.1Å; K860-Y868 HydrophobicContact CB-CE2 4.23Å; K860-Y868 HydrophobicContact CD-CE2 4.09Å; F862-Y868 HydrophobicContact CD1-CD2 4.49Å; F862-Y868 HydrophobicContact CE1-CD2 4.05Å; F862-Y868 HydrophobicContact CE1-CG 4.46Å; F862-Y868 HydrophobicContact CZ-CD2 4.3Å; Y868-R870 VanDerWaalsContact CE2-O 3.26Å; Y868-R870 WeakPolarHBondContact CE2-O 3.33Å; Y868-R870 VanDerWaalsContact OH-C 3.31Å; Y868-Q871 WeakPolarHBondContact OH-CB 3.23Å; Y868-Q871 PolarHBondContact OH-N 3.48Å
869	L	96.6	Very high	95.1	Very high	68 Å²	68	39.4 Å²	39.4	36%	0.356	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	-53.4	-175.2	-54.5	-179.3	0	0	0	112.3	E848 V861 N863	E848-L869 HydrophobicContact CB-CD1 4.46Å; E848-L869 HydrophobicContact CG-CD1 3.94Å; E848-L869 VanDerWaalsContact OE1-CD1 3.31Å; E848-L869 WeakPolarHBondContact OE1-CD1 3.36Å; V861-L869 HydrophobicContact CG1-CD1 4.36Å; V861-L869 PolarHBondContact O-N 2.78Å; N863-L869 HydrophobicContact CB-CD1 4.21Å; N863-L869 HydrophobicContact CB-CD2 4.36Å
870	R	96.8	Very high	94.9	Very high	48 Å²	48	44 Å²	44	18%	0.181	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	167.4	-174.4	58.7	-174	173.5	-74.9	0.2	112.8	E848 V861 Y868 Q908	E848-R870 IonicContact OE1-CZ 2.69Å; E848-R870 VanDerWaalsContact OE1-CZ 3.29Å; E848-R870 IonicContact OE1-NH1 2.81Å; E848-R870 PolarHBondContact OE1-NH1 3.4Å; E848-R870 IonicContact OE1-NH2 2.68Å; E848-R870 PolarHBondContact OE1-NH2 3.44Å; E848-R870 IonicContact OE2-CZ 3.69Å; E848-R870 IonicContact OE2-NH1 3.53Å; E848-R870 IonicContact OE2-NH2 3.81Å; E848-R870 PolarHBondContact OE2-NH2 2.91Å; V861-R870 HydrophobicContact CB-CG 3.85Å; V861-R870 HydrophobicContact CG2-CG 3.83Å; V861-R870 PolarHBondContact N-O 3.32Å; Y868-R870 VanDerWaalsContact CE2-O 3.26Å; Y868-R870 WeakPolarHBondContact CE2-O 3.33Å; Y868-R870 VanDerWaalsContact OH-C 3.31Å; R870-Q908 VanDerWaalsContact CZ-O 3.26Å; R870-Q908 PolarHBondContact NE-O 3.41Å; R870-Q908 PolarHBondContact NH2-O 3Å
871	Q	96.7	Very high	94.9	Very high	83 Å²	83	42.8 Å²	42.8	39%	0.388	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142.6	168	178.1	178.2	-51.1	0	0	109.3	V859 K860 Y868 G873	V859-Q871 CarbonylContact O-C 3.49Å; V859-Q871 WeakPolarHBondContact O-CA 3.3Å; K860-Q871 HydrophobicContact CD-CB 4.43Å; K860-Q871 HydrophobicContact CD-CG 4.34Å; Y868-Q871 WeakPolarHBondContact OH-CB 3.23Å; Y868-Q871 PolarHBondContact OH-N 3.48Å; Q871-G873 PolarHBondContact NE2-O 3.44Å
872	I	97.1	Very high	94.7	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134	170.5	-56.8	-177.4	0	0	0	108	F850 V859 V861 V892 F906	F850-I872 HydrophobicContact CD1-CD1 4.11Å; F850-I872 HydrophobicContact CE1-CD1 3.79Å; V859-I872 HydrophobicContact CB-CB 4.31Å; V859-I872 PolarHBondContact N-O 3.09Å; V859-I872 PolarHBondContact O-N 2.98Å; V861-I872 HydrophobicContact CG2-CD1 4.08Å; V861-I872 HydrophobicContact CG2-CG1 4.16Å; I872-V892 HydrophobicContact CD1-CG2 4.45Å; I872-F906 HydrophobicContact CG2-CB 3.78Å; I872-F906 HydrophobicContact CG2-CD1 3.57Å; I872-F906 HydrophobicContact CG2-CD2 3.6Å; I872-F906 HydrophobicContact CG2-CE1 3.93Å; I872-F906 HydrophobicContact CG2-CE2 3.96Å; I872-F906 HydrophobicContact CG2-CG 3.38Å; I872-F906 HydrophobicContact CG2-CZ 4.1Å
873	G	93.5	Very high	94.6	Very high	16 Å²	16	43.4 Å²	43.4	17%	0.165	23%	0.227	C	C	.	.			trans	73.1	-172.4	-173.6	0	0	0	0	0	114.2	Q871 T878	Q871-G873 PolarHBondContact NE2-O 3.44Å; G873-T878 WeakPolarHBondContact CA-OG1 3.28Å
874	G	93	Very high	94.6	Very high	13 Å²	13	42.4 Å²	42.4	13%	0.134	22%	0.222	C	C	.	.			trans	170.3	178.2	-174	0	0	0	0	0	112	H857 L877 T878	H857-G874 CarbonylContact O-C 3.55Å; H857-G874 WeakPolarHBondContact O-CA 3.42Å; H857-G874 PolarHBondContact O-N 3.39Å; H857-G874 VanDerWaalsContact O-N 3.17Å; G874-L877 PolarHBondContact O-N 2.9Å; G874-T878 PolarHBondContact N-OG1 2.95Å; G874-T878 PolarHBondContact O-N 3.48Å; G874-T878 PolarHBondContact O-OG1 2.77Å
875	E	91.5	Very high	94.6	Very high	165 Å²	165	42.5 Å²	42.5	77%	0.771	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	141.3	174.4	-164.9	-172.6	162.7	0	0	111.3	H857 L877	H857-E875 HydrophobicContact CB-CB 4.21Å; E875-L877 PolarHBondContact O-N 3.41Å
876	G	86.4	Confident	94.6	Very high	35 Å²	35	38.3 Å²	38.3	36%	0.361	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	-29.1	-171.7	0	0	0	0	0	114.3	N879	G876-N879 WeakPolarHBondContact CA-ND2 3.47Å; G876-N879 PolarHBondContact N-ND2 3.11Å; G876-N879 PolarHBondContact N-OD1 3.39Å
877	L	91.4	Very high	94.6	Very high	7 Å²	7	38 Å²	38	4%	0.037	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-46.4	-176.2	-178.8	51.7	0	0	0	113.4	F674 I680 R682 G874 E875 T904 F906 L912	F674-L877 HydrophobicContact CE1-CD2 4.49Å; I680-L877 HydrophobicContact CD1-CD1 3.66Å; R682-L877 PolarHBondContact NH2-O 3.06Å; G874-L877 PolarHBondContact O-N 2.9Å; E875-L877 PolarHBondContact O-N 3.41Å; L877-T904 HydrophobicContact CD1-CG2 3.65Å; L877-T904 HydrophobicContact CG-CG2 4.21Å; L877-T904 PolarHBondContact O-OG1 2.65Å; L877-F906 HydrophobicContact CD2-CE1 3.77Å; L877-F906 HydrophobicContact CD2-CZ 3.78Å; L877-F906 HydrophobicContact CG-CE1 4.46Å; L877-F906 HydrophobicContact CG-CZ 3.98Å; L877-L912 HydrophobicContact CD1-CD1 4.24Å; L877-L912 HydrophobicContact CD1-CD2 4.33Å
878	T	93.7	Very high	94.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-135.2	71.8	-177.3	45.2	0	0	0	0	109.5	H857 G873 G874 P881 V894 T904 F906	H857-T878 CarbonylContact C-O 3.47Å; H857-T878 WeakPolarHBondContact CA-O 3.24Å; H857-T878 PolarHBondContact O-OG1 3.32Å; G873-T878 WeakPolarHBondContact CA-OG1 3.28Å; G874-T878 PolarHBondContact N-OG1 2.95Å; G874-T878 PolarHBondContact O-N 3.48Å; G874-T878 PolarHBondContact O-OG1 2.77Å; T878-P881 WeakPolarHBondContact O-CD 3.29Å; T878-V894 HydrophobicContact CG2-CB 3.91Å; T878-V894 HydrophobicContact CG2-CG1 3.73Å; T878-V894 HydrophobicContact CG2-CG2 4.43Å; T878-T904 HydrophobicContact CG2-CG2 4.3Å; T878-F906 HydrophobicContact CG2-CE2 3.89Å; T878-F906 HydrophobicContact CG2-CZ 3.96Å
879	N	92.9	Very high	93.9	Very high	22 Å²	22	40.7 Å²	40.7	12%	0.118	21%	0.214	C	C	.	.			trans	-82.1	122.5	-168.7	-67.9	-58.9	0	0	0	111.8	H857 G876 D896 H898	H857-N879 PolarHBondContact ND1-OD1 2.72Å; G876-N879 WeakPolarHBondContact CA-ND2 3.47Å; G876-N879 PolarHBondContact N-ND2 3.11Å; G876-N879 PolarHBondContact N-OD1 3.39Å; N879-D896 WeakPolarHBondContact O-CB 3.31Å; N879-H898 HydrophobicContact CB-CB 3.74Å
880	Y	94.2	Very high	93.7	Very high	96 Å²	96	38.6 Å²	38.6	38%	0.376	21%	0.208	S	C	.	.	S	Bend	trans	52.6	58.2	-177.9	-49.9	-72.7	0	0	0	113.3	N854 H857 I882 H898	N854-Y880 PolarHBondContact ND2-O 2.87Å; N854-Y880 WeakPolarHBondContact O-CA 3.42Å; N854-Y880 WeakPolarHBondContact O-CD1 3.22Å; H857-Y880 AromaticContact CE1-CE1 3.6Å; H857-Y880 AromaticContact CE1-CE2 3.57Å; H857-Y880 AromaticContact CE1-CZ 3.29Å; H857-Y880 PolarHBondContact CE1-OH 3.47Å; H857-Y880 AromaticContact NE2-CE1 3.41Å; H857-Y880 WeakPolarHBondContact NE2-CE1 3.46Å; H857-Y880 AromaticContact NE2-CZ 3.5Å; Y880-I882 PolarHBondContact O-N 3.39Å; Y880-H898 AromaticContact CD2-ND1 3.66Å; Y880-H898 AromaticContact CE2-ND1 3.81Å
881	P	96.4	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	135.9	-176.3	28.3	-36.7	0	0	0	110.9	D853 N854 T878 V894 A895	D853-P881 WeakPolarHBondContact O-CD 3.34Å; D853-P881 WeakPolarHBondContact O-CG 3.45Å; N854-P881 PolarHBondContact ND2-O 3.26Å; T878-P881 WeakPolarHBondContact O-CD 3.29Å; P881-V894 HydrophobicContact CB-CG1 3.8Å; P881-A895 CarbonylContact C-O 3.5Å; P881-A895 VanDerWaalsContact CA-O 3.29Å; P881-A895 WeakPolarHBondContact CA-O 3.24Å
882	I	94.7	Very high	93.6	Very high	12 Å²	12	34 Å²	34	6%	0.062	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-28.8	-179	59.2	174.9	0	0	0	111.8	N839 Y880 A895 C925 V928 L938	N839-I882 PolarHBondContact ND2-O 2.98Å; Y880-I882 PolarHBondContact O-N 3.39Å; I882-A895 HydrophobicContact CG1-CB 4.08Å; I882-A895 WeakPolarHBondContact CG1-O 3.22Å; I882-A895 PolarHBondContact N-O 2.93Å; I882-C925 HydrophobicContact CD1-CB 3.59Å; I882-V928 HydrophobicContact CD1-CG1 4.02Å; I882-L938 HydrophobicContact CD1-CD1 3.97Å
883	G	94.9	Very high	93.5	Very high	1 Å²	1	34 Å²	34	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	168.5	177.4	0	0	0	0	0	112.1	A895	G883-A895 PolarHBondContact O-N 3.41Å
884	V	97.6	Very high	93.7	Very high	12 Å²	12	33.2 Å²	33.2	7%	0.073	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	135	176.7	55.6	0	0	0	0	108.4	V842 F850 V859 V892 V893 V894	V842-V884 HydrophobicContact CG1-CB 4.49Å; V842-V884 HydrophobicContact CG1-CG1 4.11Å; V842-V884 HydrophobicContact CG1-CG2 3.95Å; F850-V884 HydrophobicContact CB-CG2 4.49Å; V859-V884 HydrophobicContact CG1-CG2 4.34Å; V859-V884 HydrophobicContact CG2-CB 4.1Å; V859-V884 HydrophobicContact CG2-CG2 4Å; V884-V892 HydrophobicContact CG2-CG1 3.7Å; V884-V893 WeakPolarHBondContact CA-O 3.28Å; V884-V894 HydrophobicContact CG2-CG2 4.36Å
885	G	96.3	Very high	93.9	Very high	15 Å²	15	32.7 Å²	32.7	16%	0.155	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	169.6	176	0	0	0	0	0	111.1	V893	G885-V893 PolarHBondContact N-O 3.12Å; G885-V893 PolarHBondContact O-N 2.89Å
886	I	95.6	Very high	94	Very high	39 Å²	39	24.9 Å²	24.9	20%	0.2	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.1	170.7	-65.2	173.5	0	0	0	107	V842 N844 F850 E891 V892	V842-I886 HydrophobicContact CG1-CD1 4.13Å; V842-I886 HydrophobicContact CG1-CG1 3.93Å; V842-I886 HydrophobicContact CG2-CB 4.38Å; V842-I886 HydrophobicContact CG2-CD1 4.34Å; V842-I886 HydrophobicContact CG2-CG1 4.17Å; N844-I886 HydrophobicContact CB-CD1 3.85Å; F850-I886 HydrophobicContact CD2-CD1 4.2Å; F850-I886 HydrophobicContact CE2-CD1 4.15Å; I886-E891 VanDerWaalsContact CA-O 3.31Å; I886-E891 WeakPolarHBondContact CA-O 3.32Å; I886-V892 HydrophobicContact CG1-CG2 4.21Å
887	N	93.2	Very high	94.1	Very high	12 Å²	12	25 Å²	25	6%	0.064	13%	0.131	C	C	.	.			trans	-85.8	177.4	-179.3	73	9.3	0	0	0	112	L889 G890 E891 V893 L930	N887-L889 PolarHBondContact O-N 3.31Å; N887-L889 VanDerWaalsContact O-N 3.12Å; N887-L889 WeakPolarHBondContact OD1-CA 3.18Å; N887-L889 WeakPolarHBondContact OD1-CB 3.26Å; N887-L889 PolarHBondContact OD1-N 2.92Å; N887-G890 PolarHBondContact O-N 3.2Å; N887-G890 PolarHBondContact OD1-N 2.8Å; N887-E891 PolarHBondContact N-O 3.14Å; N887-E891 VanDerWaalsContact N-O 3.08Å; N887-E891 PolarHBondContact ND2-OE2 3.37Å; N887-E891 WeakPolarHBondContact OD1-CB 3.3Å; N887-E891 PolarHBondContact OD1-N 3.32Å; N887-V893 HydrophobicContact CB-CG2 4.21Å; N887-L930 HydrophobicContact CB-CD1 4.15Å
888	H	88.5	Confident	93.8	Very high	102 Å²	102	28.1 Å²	28.1	47%	0.472	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.4	-180	63.6	-111.5	0	0	0	114.5	D932	H888-D932 PolarHBondContact CE1-O 3.14Å; H888-D932 PolarHBondContact ND1-O 3.22Å
889	L	90.8	Very high	93.4	Very high	107 Å²	107	32.9 Å²	32.9	56%	0.56	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-3.4	173	-57.1	176.1	0	0	0	112.3	N887 E891	N887-L889 PolarHBondContact O-N 3.31Å; N887-L889 VanDerWaalsContact O-N 3.12Å; N887-L889 WeakPolarHBondContact OD1-CA 3.18Å; N887-L889 WeakPolarHBondContact OD1-CB 3.26Å; N887-L889 PolarHBondContact OD1-N 2.92Å; L889-E891 VanDerWaalsContact C-N 3.34Å; L889-E891 HydrophobicContact CB-CG 4.02Å
890	G	91.9	Very high	93.3	Very high	23 Å²	23	33.3 Å²	33.3	24%	0.237	17%	0.174	C	C	.	.	S	Bend	trans	80.8	9.8	-175.6	0	0	0	0	0	114.3	N887 Q908	N887-G890 PolarHBondContact O-N 3.2Å; N887-G890 PolarHBondContact OD1-N 2.8Å; G890-Q908 WeakPolarHBondContact O-CG 3.44Å; G890-Q908 PolarHBondContact O-NE2 2.89Å
891	E	94.8	Very high	93.2	Very high	34 Å²	34	28.8 Å²	28.8	16%	0.159	16%	0.156	C	C	.	.			trans	-80.1	138	179.1	-53.8	173.3	133	0	0	110.9	I886 N887 L889 V893 F906 I913	I886-E891 VanDerWaalsContact CA-O 3.31Å; I886-E891 WeakPolarHBondContact CA-O 3.32Å; N887-E891 PolarHBondContact N-O 3.14Å; N887-E891 VanDerWaalsContact N-O 3.08Å; N887-E891 PolarHBondContact ND2-OE2 3.37Å; N887-E891 WeakPolarHBondContact OD1-CB 3.3Å; N887-E891 PolarHBondContact OD1-N 3.32Å; L889-E891 VanDerWaalsContact C-N 3.34Å; L889-E891 HydrophobicContact CB-CG 4.02Å; E891-V893 PolarHBondContact O-N 2.98Å; E891-F906 CarbonylContact C-O 3.58Å; E891-F906 WeakPolarHBondContact CA-O 3.28Å; E891-I913 HydrophobicContact CB-CD1 4.17Å; E891-I913 HydrophobicContact CG-CD1 3.71Å; E891-I913 WeakPolarHBondContact OE1-CD1 3.33Å
892	V	96.5	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	110.9	176.5	179.4	0	0	0	0	108.8	F850 I872 V884 I886 V894 M905 F906 Q908	F850-V892 HydrophobicContact CD1-CG1 4.41Å; F850-V892 HydrophobicContact CD1-CG2 4.14Å; F850-V892 HydrophobicContact CE1-CG2 3.82Å; F850-V892 HydrophobicContact CZ-CG2 4.39Å; I872-V892 HydrophobicContact CD1-CG2 4.45Å; V884-V892 HydrophobicContact CG2-CG1 3.7Å; I886-V892 HydrophobicContact CG1-CG2 4.21Å; V892-V894 HydrophobicContact CG1-CG2 4.17Å; V892-M905 CarbonylContact O-C 3.52Å; V892-M905 WeakPolarHBondContact O-CA 3.4Å; V892-F906 HydrophobicContact CB-CB 4.39Å; V892-F906 PolarHBondContact N-O 3.21Å; V892-F906 PolarHBondContact O-N 3.19Å; V892-Q908 HydrophobicContact CG2-CG 4.23Å
893	V	96.7	Very high	93.2	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.018	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	112	177.7	-168.2	0	0	0	0	108.8	V884 G885 N887 E891 L903 M905 L930	V884-V893 WeakPolarHBondContact CA-O 3.28Å; G885-V893 PolarHBondContact N-O 3.12Å; G885-V893 PolarHBondContact O-N 2.89Å; N887-V893 HydrophobicContact CB-CG2 4.21Å; E891-V893 PolarHBondContact O-N 2.98Å; V893-L903 HydrophobicContact CG1-CB 4.23Å; V893-L903 HydrophobicContact CG1-CD1 4.11Å; V893-L903 HydrophobicContact CG1-CD2 3.99Å; V893-L903 HydrophobicContact CG1-CG 4.35Å; V893-M905 HydrophobicContact CG1-CE 4.5Å; V893-M905 HydrophobicContact CG1-CG 4.32Å; V893-M905 HydrophobicContact CG2-CG 4.32Å; V893-L930 HydrophobicContact CB-CD1 4.03Å; V893-L930 HydrophobicContact CB-CD2 4.3Å; V893-L930 HydrophobicContact CG1-CD2 4.22Å; V893-L930 HydrophobicContact CG2-CD1 3.83Å; V893-L930 HydrophobicContact CG2-CD2 4.47Å
894	V	97.1	Very high	93.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.9	175.7	-170.8	0	0	0	0	109	V859 T878 P881 V884 V892 L903 T904 F906	V859-V894 HydrophobicContact CG2-CB 4.46Å; V859-V894 HydrophobicContact CG2-CG1 3.94Å; V859-V894 HydrophobicContact CG2-CG2 3.65Å; T878-V894 HydrophobicContact CG2-CB 3.91Å; T878-V894 HydrophobicContact CG2-CG1 3.73Å; T878-V894 HydrophobicContact CG2-CG2 4.43Å; P881-V894 HydrophobicContact CB-CG1 3.8Å; V884-V894 HydrophobicContact CG2-CG2 4.36Å; V892-V894 HydrophobicContact CG1-CG2 4.17Å; V894-L903 WeakPolarHBondContact O-CA 3.31Å; V894-T904 PolarHBondContact N-O 3.4Å; V894-T904 PolarHBondContact O-N 2.95Å; V894-F906 HydrophobicContact CB-CE2 4.29Å; V894-F906 HydrophobicContact CG2-CD2 3.91Å; V894-F906 HydrophobicContact CG2-CE2 3.77Å
895	A	96.3	Very high	93.1	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.017	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.1	179.1	0	0	0	0	0	111.4	P881 I882 G883 F901 N902 L903 V928	P881-A895 CarbonylContact C-O 3.5Å; P881-A895 VanDerWaalsContact CA-O 3.29Å; P881-A895 WeakPolarHBondContact CA-O 3.24Å; I882-A895 HydrophobicContact CG1-CB 4.08Å; I882-A895 WeakPolarHBondContact CG1-O 3.22Å; I882-A895 PolarHBondContact N-O 2.93Å; G883-A895 PolarHBondContact O-N 3.41Å; A895-F901 HydrophobicContact CB-CE2 4.16Å; A895-N902 WeakPolarHBondContact CA-O 3.06Å; A895-L903 HydrophobicContact CB-CD2 3.73Å; A895-V928 HydrophobicContact CB-CB 4.31Å; A895-V928 HydrophobicContact CB-CG1 3.91Å; A895-V928 HydrophobicContact CB-CG2 3.57Å
896	D	93.9	Very high	93.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	165.1	170.4	81.5	66.3	0	0	0	112.1	N879 H898 F901 N902	N879-D896 WeakPolarHBondContact O-CB 3.31Å; D896-H898 PolarHBondContact OD1-N 3.42Å; D896-F901 WeakPolarHBondContact O-CD2 3.36Å; D896-N902 PolarHBondContact N-O 3.42Å; D896-N902 PolarHBondContact O-N 2.91Å; D896-N902 PolarHBondContact OD1-ND2 2.74Å
897	N	87.9	Confident	93.1	Very high	37 Å²	37	27.8 Å²	27.8	20%	0.198	15%	0.148	C	C	.	.			trans	-128.1	45.4	174.5	-170.4	11.4	0	0	0	110.6	N900 A923 C925	N897-N900 CarbonylContact C-O 3.47Å; N897-N900 WeakPolarHBondContact CA-O 3.32Å; N897-N900 PolarHBondContact OD1-O 3.28Å; N897-A923 PolarHBondContact ND2-O 2.72Å; N897-C925 HydrophobicContact CB-CB 4.41Å; N897-C925 PolarHBondContact ND2-N 3.18Å; N897-C925 PolarHBondContact ND2-SG 3.16Å
898	H	86.3	Confident	93.2	Very high	73 Å²	73	28.2 Å²	28.2	34%	0.338	15%	0.15	S	C	.	.	S	Bend	trans	-89.5	113.4	174.7	-173	74.8	0	0	0	110.4	N879 Y880 D896 N900 N902	N879-H898 HydrophobicContact CB-CB 3.74Å; Y880-H898 AromaticContact CD2-ND1 3.66Å; Y880-H898 AromaticContact CE2-ND1 3.81Å; D896-H898 PolarHBondContact OD1-N 3.42Å; H898-N900 PolarHBondContact N-O 2.9Å; H898-N900 PolarHBondContact O-N 2.97Å; H898-N902 PolarHBondContact O-ND2 3.05Å; H898-N902 VanDerWaalsContact O-ND2 3.09Å
899	N	84.4	Confident	93.5	Very high	100 Å²	100	27.7 Å²	27.7	54%	0.535	15%	0.15	S	C	.	.	S	Bend	trans	64	-48.5	-170.6	-73	-69.1	0	0	0	116.1	K921	N899-K921 VanDerWaalsContact O-CD 3.22Å; N899-K921 WeakPolarHBondContact O-CD 3.28Å; N899-K921 WeakPolarHBondContact O-CE 3.07Å; N899-K921 VanDerWaalsContact O-CG 3.31Å; N899-K921 WeakPolarHBondContact O-CG 3.39Å
900	N	90.5	Very high	93.6	Very high	32 Å²	32	23.3 Å²	23.3	17%	0.171	13%	0.132	C	C	.	.	S	Bend	trans	-129.3	168.5	173.1	-71.1	-31	0	0	0	108.2	N897 H898 N902 E917	N897-N900 CarbonylContact C-O 3.47Å; N897-N900 WeakPolarHBondContact CA-O 3.32Å; N897-N900 PolarHBondContact OD1-O 3.28Å; H898-N900 PolarHBondContact N-O 2.9Å; H898-N900 PolarHBondContact O-N 2.97Å; N900-N902 PolarHBondContact O-N 3.39Å; N900-N902 PolarHBondContact O-ND2 3.16Å; N900-E917 HydrophobicContact CB-CB 4.37Å; N900-E917 PolarHBondContact ND2-OE2 3.06Å
901	F	94	Very high	93.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.			trans	-76.3	119.3	165.9	170.4	-120.3	0	0	0	109	M685 A895 D896 L903 E917 S918 V928 V936 L938 Y948	M685-F901 HydrophobicContact CE-CD1 3.52Å; M685-F901 HydrophobicContact CE-CE1 3.67Å; M685-F901 HydrophobicContact CE-CG 4.36Å; M685-F901 VanDerWaalsContact CE-O 3.31Å; M685-F901 WeakPolarHBondContact CE-O 3.3Å; M685-F901 HydrophobicContact SD-CE1 4.15Å; A895-F901 HydrophobicContact CB-CE2 4.16Å; D896-F901 WeakPolarHBondContact O-CD2 3.36Å; F901-L903 HydrophobicContact CE1-CD2 4.44Å; F901-L903 HydrophobicContact CE1-CG 4.43Å; F901-L903 HydrophobicContact CE2-CD2 4.16Å; F901-L903 HydrophobicContact CZ-CD2 3.69Å; F901-L903 HydrophobicContact CZ-CG 4.15Å; F901-E917 CarbonylContact O-C 3.5Å; F901-E917 VanDerWaalsContact O-CA 3.31Å; F901-E917 WeakPolarHBondContact O-CA 3.48Å; F901-S918 PolarHBondContact N-OG 2.97Å; F901-S918 VanDerWaalsContact N-OG 3.12Å; F901-S918 PolarHBondContact O-N 2.04Å; F901-S918 PolarHBondContact O-OG 2.84Å; F901-V928 HydrophobicContact CE2-CG1 3.99Å; F901-V928 HydrophobicContact CZ-CG1 4.2Å; F901-V936 HydrophobicContact CE1-CG1 3.88Å; F901-V936 HydrophobicContact CZ-CG1 4.03Å; F901-V936 HydrophobicContact CZ-CG2 4.28Å; F901-L938 HydrophobicContact CB-CD2 4.04Å; F901-L938 HydrophobicContact CD1-CD2 3.69Å; F901-L938 HydrophobicContact CD2-CD1 3.67Å; F901-L938 HydrophobicContact CD2-CD2 3.77Å; F901-L938 HydrophobicContact CD2-CG 4.33Å; F901-L938 HydrophobicContact CE1-CB 4.49Å; F901-L938 HydrophobicContact CE1-CD2 4.03Å; F901-L938 HydrophobicContact CE2-CD1 3.44Å; F901-L938 VanDerWaalsContact CE2-CD1 3.44Å; F901-L938 HydrophobicContact CE2-CD2 4.12Å; F901-L938 HydrophobicContact CE2-CG 4.29Å; F901-L938 HydrophobicContact CG-CD1 4.33Å; F901-L938 HydrophobicContact CG-CD2 3.54Å; F901-L938 HydrophobicContact CZ-CB 4.37Å; F901-L938 HydrophobicContact CZ-CD1 3.91Å; F901-L938 HydrophobicContact CZ-CD2 4.23Å; F901-L938 HydrophobicContact CZ-CG 4.42Å; F901-Y948 HydrophobicContact CD1-CD2 4.29Å; F901-Y948 HydrophobicContact CD1-CE2 4.5Å; F901-Y948 HydrophobicContact CE1-CD2 4.27Å
902	N	94.6	Very high	93.6	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.064	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143.5	-174.5	-57.5	-57.4	0	0	0	111.1	R682 A895 D896 H898 N900 L916 E917	R682-N902 PolarHBondContact NE-OD1 3.48Å; A895-N902 WeakPolarHBondContact CA-O 3.06Å; D896-N902 PolarHBondContact N-O 3.42Å; D896-N902 PolarHBondContact O-N 2.91Å; D896-N902 PolarHBondContact OD1-ND2 2.74Å; H898-N902 PolarHBondContact O-ND2 3.05Å; H898-N902 VanDerWaalsContact O-ND2 3.09Å; N900-N902 PolarHBondContact O-N 3.39Å; N900-N902 PolarHBondContact O-ND2 3.16Å; N902-L916 CarbonylContact C-O 3.54Å; N902-L916 VanDerWaalsContact CA-O 3.31Å; N902-L916 WeakPolarHBondContact CA-O 3.36Å; N902-E917 VanDerWaalsContact OD1-CB 3.28Å; N902-E917 WeakPolarHBondContact OD1-CB 3.39Å
903	L	95.3	Very high	93.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.5	163.6	-66.8	-172.7	0	0	0	109.3	M685 V893 V894 A895 F901 M905 L916 V936 Y950	M685-L903 HydrophobicContact CE-CG 4.08Å; M685-L903 HydrophobicContact SD-CB 4.34Å; M685-L903 HydrophobicContact SD-CD1 3.68Å; M685-L903 HydrophobicContact SD-CG 3.75Å; V893-L903 HydrophobicContact CG1-CB 4.23Å; V893-L903 HydrophobicContact CG1-CD1 4.11Å; V893-L903 HydrophobicContact CG1-CD2 3.99Å; V893-L903 HydrophobicContact CG1-CG 4.35Å; V894-L903 WeakPolarHBondContact O-CA 3.31Å; A895-L903 HydrophobicContact CB-CD2 3.73Å; F901-L903 HydrophobicContact CE1-CD2 4.44Å; F901-L903 HydrophobicContact CE1-CG 4.43Å; F901-L903 HydrophobicContact CE2-CD2 4.16Å; F901-L903 HydrophobicContact CZ-CD2 3.69Å; F901-L903 HydrophobicContact CZ-CG 4.15Å; L903-M905 HydrophobicContact CD1-CE 4.42Å; L903-L916 HydrophobicContact CB-CD1 4.49Å; L903-L916 PolarHBondContact N-O 3.4Å; L903-L916 PolarHBondContact O-N 3.49Å; L903-V936 HydrophobicContact CD1-CB 4.31Å; L903-V936 HydrophobicContact CD1-CG1 3.94Å; L903-Y950 HydrophobicContact CD1-CD1 3.64Å; L903-Y950 HydrophobicContact CD1-CE1 4.4Å; L903-Y950 HydrophobicContact CD1-CG 3.84Å
904	T	95.3	Very high	93.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.4	174.3	-50.2	0	0	0	0	109.1	R682 L877 T878 V894 F906 L912 A915	R682-T904 PolarHBondContact NH2-OG1 3.46Å; L877-T904 HydrophobicContact CD1-CG2 3.65Å; L877-T904 HydrophobicContact CG-CG2 4.21Å; L877-T904 PolarHBondContact O-OG1 2.65Å; T878-T904 HydrophobicContact CG2-CG2 4.3Å; V894-T904 PolarHBondContact N-O 3.4Å; V894-T904 PolarHBondContact O-N 2.95Å; T904-F906 HydrophobicContact CG2-CD2 4.3Å; T904-F906 HydrophobicContact CG2-CE1 4.4Å; T904-F906 HydrophobicContact CG2-CE2 3.45Å; T904-F906 VanDerWaalsContact CG2-CE2 3.45Å; T904-F906 HydrophobicContact CG2-CZ 3.52Å; T904-L912 HydrophobicContact CG2-CD1 3.47Å; T904-L912 VanDerWaalsContact CG2-CD1 3.47Å; T904-A915 HydrophobicContact CG2-CB 4.36Å
905	M	95	Very high	93	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.9	-171.3	-65.1	162.9	-178.7	0	0	110.5	V892 V893 L903 I913 N914 L916 Y950	V892-M905 CarbonylContact O-C 3.52Å; V892-M905 WeakPolarHBondContact O-CA 3.4Å; V893-M905 HydrophobicContact CG1-CE 4.5Å; V893-M905 HydrophobicContact CG1-CG 4.32Å; V893-M905 HydrophobicContact CG2-CG 4.32Å; L903-M905 HydrophobicContact CD1-CE 4.42Å; M905-I913 HydrophobicContact CB-CB 4.34Å; M905-I913 PolarHBondContact O-N 3.37Å; M905-N914 HydrophobicContact CB-CB 4.31Å; M905-N914 PolarHBondContact N-O 3.04Å; M905-N914 PolarHBondContact O-N 3.28Å; M905-N914 HydrophobicContact SD-CB 3.99Å; M905-L916 HydrophobicContact CE-CD1 3.43Å; M905-L916 VanDerWaalsContact CE-CD1 3.43Å; M905-L916 HydrophobicContact SD-CD1 3.69Å; M905-Y950 HydrophobicContact CE-CD2 3.19Å; M905-Y950 HydrophobicContact CE-CE2 3.81Å; M905-Y950 HydrophobicContact CE-CG 3.76Å
906	F	96.6	Very high	92.8	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.2	-177.7	-58.4	-97.6	0	0	0	111.9	I872 L877 T878 E891 V892 V894 T904 G910 N911 L912 I913	I872-F906 HydrophobicContact CG2-CB 3.78Å; I872-F906 HydrophobicContact CG2-CD1 3.57Å; I872-F906 HydrophobicContact CG2-CD2 3.6Å; I872-F906 HydrophobicContact CG2-CE1 3.93Å; I872-F906 HydrophobicContact CG2-CE2 3.96Å; I872-F906 HydrophobicContact CG2-CG 3.38Å; I872-F906 HydrophobicContact CG2-CZ 4.1Å; L877-F906 HydrophobicContact CD2-CE1 3.77Å; L877-F906 HydrophobicContact CD2-CZ 3.78Å; L877-F906 HydrophobicContact CG-CE1 4.46Å; L877-F906 HydrophobicContact CG-CZ 3.98Å; T878-F906 HydrophobicContact CG2-CE2 3.89Å; T878-F906 HydrophobicContact CG2-CZ 3.96Å; E891-F906 CarbonylContact C-O 3.58Å; E891-F906 WeakPolarHBondContact CA-O 3.28Å; V892-F906 HydrophobicContact CB-CB 4.39Å; V892-F906 PolarHBondContact N-O 3.21Å; V892-F906 PolarHBondContact O-N 3.19Å; V894-F906 HydrophobicContact CB-CE2 4.29Å; V894-F906 HydrophobicContact CG2-CD2 3.91Å; V894-F906 HydrophobicContact CG2-CE2 3.77Å; T904-F906 HydrophobicContact CG2-CD2 4.3Å; T904-F906 HydrophobicContact CG2-CE1 4.4Å; T904-F906 HydrophobicContact CG2-CE2 3.45Å; T904-F906 VanDerWaalsContact CG2-CE2 3.45Å; T904-F906 HydrophobicContact CG2-CZ 3.52Å; F906-G910 WeakPolarHBondContact CD1-O 3.32Å; F906-N911 CarbonylContact C-O 3.48Å; F906-N911 WeakPolarHBondContact CA-O 3.32Å; F906-L912 HydrophobicContact CD1-CB 4.35Å; F906-L912 HydrophobicContact CD1-CD1 4.45Å; F906-L912 HydrophobicContact CE1-CB 4.36Å; F906-L912 HydrophobicContact CE1-CD1 4.18Å; F906-L912 HydrophobicContact CZ-CD1 4.44Å; F906-I913 VanDerWaalsContact C-CD1 3.46Å
907	T	96.3	Very high	92.8	Very high	41 Å²	41	37.1 Å²	37.1	25%	0.252	20%	0.199	S	C	.	.			trans	-64.8	156.9	159.7	72.4	0	0	0	0	109.2	D909 G910 N911 I913	T907-D909 PolarHBondContact O-N 3.31Å; T907-D909 VanDerWaalsContact O-N 3.08Å; T907-G910 PolarHBondContact O-N 2.87Å; T907-G910 PolarHBondContact OG1-N 3.45Å; T907-N911 HydrophobicContact CG2-CB 4.13Å; T907-N911 PolarHBondContact N-O 3.26Å; T907-N911 PolarHBondContact OG1-N 2.81Å; T907-N911 VanDerWaalsContact OG1-N 3.15Å; T907-I913 HydrophobicContact CG2-CD1 3.92Å; T907-I913 HydrophobicContact CG2-CG1 3.96Å
908	Q	94.6	Very high	93.1	Very high	22 Å²	22	35.3 Å²	35.3	10%	0.103	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.6	177.1	-59.6	-171.4	10.2	0	0	113	N844 F850 R870 G890 V892 G910	N844-Q908 PolarHBondContact ND2-OE1 3.42Å; F850-Q908 HydrophobicContact CZ-CB 4.45Å; R870-Q908 VanDerWaalsContact CZ-O 3.26Å; R870-Q908 PolarHBondContact NE-O 3.41Å; R870-Q908 PolarHBondContact NH2-O 3Å; G890-Q908 WeakPolarHBondContact O-CG 3.44Å; G890-Q908 PolarHBondContact O-NE2 2.89Å; V892-Q908 HydrophobicContact CG2-CG 4.23Å; Q908-G910 VanDerWaalsContact C-N 3.34Å
909	D	94.2	Very high	93.2	Very high	90 Å²	90	39.4 Å²	39.4	48%	0.481	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.6	178.6	-38.8	-69.5	0	0	0	112.7	R846 T907	R846-D909 IonicContact CZ-OD1 3.31Å; R846-D909 IonicContact NH1-OD1 2.73Å; R846-D909 PolarHBondContact NH1-OD1 3.3Å; R846-D909 IonicContact NH2-OD1 2.72Å; T907-D909 PolarHBondContact O-N 3.31Å; T907-D909 VanDerWaalsContact O-N 3.08Å
910	G	92.8	Very high	93.4	Very high	16 Å²	16	38.4 Å²	38.4	17%	0.165	20%	0.203	C	C	.	.	S	Bend	trans	110	5.4	169.3	0	0	0	0	0	116.8	F906 T907 Q908	F906-G910 WeakPolarHBondContact CD1-O 3.32Å; T907-G910 PolarHBondContact O-N 2.87Å; T907-G910 PolarHBondContact OG1-N 3.45Å; Q908-G910 VanDerWaalsContact C-N 3.34Å
911	N	94.5	Very high	93.3	Very high	105 Å²	105	43.6 Å²	43.6	56%	0.561	22%	0.224	S	C	*	.			trans	-78.6	134.8	178.9	-63.1	-51	0	0	0	111	F906 T907 I913	F906-N911 CarbonylContact C-O 3.48Å; F906-N911 WeakPolarHBondContact CA-O 3.32Å; T907-N911 HydrophobicContact CG2-CB 4.13Å; T907-N911 PolarHBondContact N-O 3.26Å; T907-N911 PolarHBondContact OG1-N 2.81Å; T907-N911 VanDerWaalsContact OG1-N 3.15Å; N911-I913 PolarHBondContact O-N 2.86Å
912	L	93.5	Very high	93.1	Very high	69 Å²	69	44.9 Å²	44.9	36%	0.361	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	128.1	178	179.3	64.8	0	0	0	111.1	I680 L877 T904 F906	I680-L912 HydrophobicContact CD1-CD2 4.32Å; L877-L912 HydrophobicContact CD1-CD1 4.24Å; L877-L912 HydrophobicContact CD1-CD2 4.33Å; T904-L912 HydrophobicContact CG2-CD1 3.47Å; T904-L912 VanDerWaalsContact CG2-CD1 3.47Å; F906-L912 HydrophobicContact CD1-CB 4.35Å; F906-L912 HydrophobicContact CD1-CD1 4.45Å; F906-L912 HydrophobicContact CE1-CB 4.36Å; F906-L912 HydrophobicContact CE1-CD1 4.18Å; F906-L912 HydrophobicContact CZ-CD1 4.44Å
913	I	92.7	Very high	92.9	Very high	76 Å²	76	46.3 Å²	46.3	39%	0.39	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-54.6	175.6	-57.5	176.6	0	0	0	110.1	E891 M905 F906 T907 N911	E891-I913 HydrophobicContact CB-CD1 4.17Å; E891-I913 HydrophobicContact CG-CD1 3.71Å; E891-I913 WeakPolarHBondContact OE1-CD1 3.33Å; M905-I913 HydrophobicContact CB-CB 4.34Å; M905-I913 PolarHBondContact O-N 3.37Å; F906-I913 VanDerWaalsContact C-CD1 3.46Å; T907-I913 HydrophobicContact CG2-CD1 3.92Å; T907-I913 HydrophobicContact CG2-CG1 3.96Å; N911-I913 PolarHBondContact O-N 2.86Å
914	N	91.3	Very high	92.7	Very high	52 Å²	52	49.4 Å²	49.4	28%	0.278	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	158.3	-173.6	-164.4	1.1	0	0	0	110.6	M905 L916	M905-N914 HydrophobicContact CB-CB 4.31Å; M905-N914 PolarHBondContact N-O 3.04Å; M905-N914 PolarHBondContact O-N 3.28Å; M905-N914 HydrophobicContact SD-CB 3.99Å; N914-L916 HydrophobicContact CB-CD1 4.47Å
915	A	92.7	Very high	92.5	Very high	5 Å²	5	49.6 Å²	49.6	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.8	173.7	0	0	0	0	0	109.7	I680 R682 L683 T904	I680-A915 HydrophobicContact CG2-CB 3.98Å; R682-A915 CarbonylContact C-O 3.59Å; R682-A915 VanDerWaalsContact CA-O 3.24Å; R682-A915 WeakPolarHBondContact CA-O 3.39Å; R682-A915 HydrophobicContact CG-CB 3.78Å; L683-A915 PolarHBondContact N-O 3.33Å; T904-A915 HydrophobicContact CG2-CB 4.36Å
916	L	93.6	Very high	92.4	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.4	-176.4	-49	92.4	0	0	0	111.3	L683 M685 N902 L903 M905 N914	L683-L916 HydrophobicContact CB-CD2 4.27Å; L683-L916 HydrophobicContact CB-CG 4.2Å; L683-L916 CarbonylContact O-C 3.58Å; L683-L916 WeakPolarHBondContact O-CA 3.33Å; L683-L916 WeakPolarHBondContact O-CB 3.36Å; M685-L916 HydrophobicContact CG-CB 3.64Å; M685-L916 HydrophobicContact CG-CD2 4.04Å; M685-L916 HydrophobicContact CG-CG 4.47Å; M685-L916 HydrophobicContact SD-CB 4.39Å; N902-L916 CarbonylContact C-O 3.54Å; N902-L916 VanDerWaalsContact CA-O 3.31Å; N902-L916 WeakPolarHBondContact CA-O 3.36Å; L903-L916 HydrophobicContact CB-CD1 4.49Å; L903-L916 PolarHBondContact N-O 3.4Å; L903-L916 PolarHBondContact O-N 3.49Å; M905-L916 HydrophobicContact CE-CD1 3.43Å; M905-L916 VanDerWaalsContact CE-CD1 3.43Å; M905-L916 HydrophobicContact SD-CD1 3.69Å; N914-L916 HydrophobicContact CB-CD1 4.47Å
917	E	93.6	Very high	92.3	Very high	38 Å²	38	50.8 Å²	50.8	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	158.8	174.7	57.7	176	172.4	0	0	111.9	R682 L683 K684 M685 N900 F901 N902	R682-E917 HydrophobicContact CB-CB 4.21Å; R682-E917 HydrophobicContact CB-CG 3.74Å; L683-E917 PolarHBondContact O-N 3.23Å; K684-E917 WeakPolarHBondContact CA-O 3.34Å; K684-E917 HydrophobicContact CD-CG 3.71Å; K684-E917 WeakPolarHBondContact CE-OE1 3.48Å; K684-E917 IonicContact NZ-OE1 2.69Å; K684-E917 PolarHBondContact NZ-OE1 3.14Å; K684-E917 IonicContact NZ-OE2 3.11Å; K684-E917 PolarHBondContact NZ-OE2 2.97Å; M685-E917 PolarHBondContact N-O 3.19Å; N900-E917 HydrophobicContact CB-CB 4.37Å; N900-E917 PolarHBondContact ND2-OE2 3.06Å; F901-E917 CarbonylContact O-C 3.5Å; F901-E917 VanDerWaalsContact O-CA 3.31Å; F901-E917 WeakPolarHBondContact O-CA 3.48Å; N902-E917 VanDerWaalsContact OD1-CB 3.28Å; N902-E917 WeakPolarHBondContact OD1-CB 3.39Å
918	S	93.3	Very high	92.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.			trans	-66	162	168.4	57.6	0	0	0	0	112.1	K684 F901 V920	K684-S918 PolarHBondContact NZ-O 3.39Å; F901-S918 PolarHBondContact N-OG 2.97Å; F901-S918 VanDerWaalsContact N-OG 3.12Å; F901-S918 PolarHBondContact O-N 2.04Å; F901-S918 PolarHBondContact O-OG 2.84Å; S918-V920 VanDerWaalsContact CB-O 3.3Å; S918-V920 WeakPolarHBondContact CB-O 3.32Å; S918-V920 PolarHBondContact OG-O 2.85Å
919	K	89.2	Confident	92.5	Very high	159 Å²	159	49.3 Å²	49.3	69%	0.691	26%	0.259	S	S	*	.	S	Bend	trans	-84	-17.2	167.1	-66.3	-175.1	-177.6	179	0	112.8	K684	K684-K919 HydrophobicContact CB-CG 4.12Å; K684-K919 HydrophobicContact CD-CG 4.2Å; K684-K919 HydrophobicContact CG-CG 4.15Å
920	V	87.1	Confident	92.5	Very high	78 Å²	78	46.1 Å²	46.1	47%	0.473	24%	0.241	S	C	.	.	S	Bend	trans	-124.9	148	-176.7	-62.7	0	0	0	0	110.5	S918 Y948	S918-V920 VanDerWaalsContact CB-O 3.3Å; S918-V920 WeakPolarHBondContact CB-O 3.32Å; S918-V920 PolarHBondContact OG-O 2.85Å; V920-Y948 WeakPolarHBondContact CG2-OH 3.41Å
921	K	90.2	Very high	92.6	Very high	142 Å²	142	45.5 Å²	45.5	62%	0.617	23%	0.234	S	C	*	.			trans	-71.5	148.8	166.8	-60.8	-159.7	169.4	-164.5	0	109.7	N899	N899-K921 VanDerWaalsContact O-CD 3.22Å; N899-K921 WeakPolarHBondContact O-CD 3.28Å; N899-K921 WeakPolarHBondContact O-CE 3.07Å; N899-K921 VanDerWaalsContact O-CG 3.31Å; N899-K921 WeakPolarHBondContact O-CG 3.39Å
922	H	89.6	Confident	92.5	Very high	26 Å²	26	43 Å²	43	12%	0.12	22%	0.221	C	C	.	.			trans	-107.4	161.7	172.7	-74.6	-82.6	0	0	0	110.5	Y946 Y948	H922-Y946 AromaticContact CE1-CD1 3.64Å; H922-Y946 AromaticContact CE1-CD2 3.85Å; H922-Y946 AromaticContact CE1-CE1 3.93Å; H922-Y946 AromaticContact CE1-CG 3.61Å; H922-Y946 AromaticContact ND1-CD2 3.78Å; H922-Y946 AromaticContact ND1-CE2 3.77Å; H922-Y948 AromaticContact CE1-CE2 3.79Å; H922-Y948 AromaticContact CE1-CZ 4Å; H922-Y948 PolarHBondContact CE1-OH 2.91Å; H922-Y948 AromaticContact NE2-CE2 3.53Å; H922-Y948 AromaticContact NE2-CZ 3.56Å; H922-Y948 PolarHBondContact NE2-OH 3.01Å
923	A	89.4	Confident	92.3	Very high	43 Å²	43	42.8 Å²	42.8	36%	0.355	22%	0.22	S	C	.	.	S	Bend	trans	-60.8	173.8	155.6	0	0	0	0	0	109.6	N897 C925 K941 D942	N897-A923 PolarHBondContact ND2-O 2.72Å; A923-C925 PolarHBondContact O-N 2.98Å; A923-C925 PolarHBondContact O-SG 2.86Å; A923-C925 VanDerWaalsContact O-SG 3.42Å; A923-K941 HydrophobicContact CB-CB 4.46Å; A923-D942 HydrophobicContact CB-CB 4Å
924	Q	90.4	Very high	92.1	Very high	66 Å²	66	39.1 Å²	39.1	31%	0.308	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-52.6	133.3	175.2	168.8	161.5	28.8	0	0	110.9	S605 K941	S605-Q924 PolarHBondContact O-NE2 3.05Å; S605-Q924 PolarHBondContact O-OE1 3.3Å; Q924-K941 HydrophobicContact CB-CD 4.27Å; Q924-K941 HydrophobicContact CB-CB 4.1Å; Q924-K941 PolarHBondContact O-N 3.03Å; Q924-K941 WeakPolarHBondContact O-CB 3.44Å
925	C	92.5	Very high	92.3	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.7	175	-57.8	0	0	0	0	110.8	I882 N897 A923 L938 A939	I882-C925 HydrophobicContact CD1-CB 3.59Å; N897-C925 HydrophobicContact CB-CB 4.41Å; N897-C925 PolarHBondContact ND2-N 3.18Å; N897-C925 PolarHBondContact ND2-SG 3.16Å; A923-C925 PolarHBondContact O-N 2.98Å; A923-C925 PolarHBondContact O-SG 2.86Å; A923-C925 VanDerWaalsContact O-SG 3.42Å; C925-L938 HydrophobicContact CB-CD1 3.53Å; C925-L938 VanDerWaalsContact SG-CD1 3.55Å; C925-L938 HydrophobicContact CB-CG 4.2Å; C925-A939 CarbonylContact C-O 3.18Å; C925-A939 VanDerWaalsContact CA-O 3.29Å; C925-A939 WeakPolarHBondContact CA-O 3.46Å; C925-A939 WeakPolarHBondContact CB-O 3.41Å
926	F	92.7	Very high	92.4	Very high	17 Å²	17	36.5 Å²	36.5	8%	0.075	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-38.8	-174.3	-60.4	-59.4	0	0	0	112.9	E703 P704 S705 R753 A939 K941	E703-F926 HydrophobicContact CG-CE2 4.07Å; E703-F926 HydrophobicContact CG-CZ 3.98Å; P704-F926 WeakPolarHBondContact O-CD2 3.42Å; S705-F926 WeakPolarHBondContact O-CB 3.19Å; R753-F926 PolarHBondContact NH2-O 3.14Å; F926-A939 PolarHBondContact N-O 3.35Å; F926-K941 HydrophobicContact CZ-CB 3.64Å; F926-K941 HydrophobicContact CZ-CG 3.8Å; F926-K941 HydrophobicContact CZ-CD 4.29Å; F926-K941 HydrophobicContact CE2-CG 4.49Å; F926-K941 HydrophobicContact CE2-CB 3.98Å; F926-K941 HydrophobicContact CE1-CG 4.46Å; F926-K941 HydrophobicContact CE1-CB 4.26Å
927	D	95.4	Very high	92.6	Very high	13 Å²	13	36.2 Å²	36.2	7%	0.07	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	166.8	-171.5	-156.5	7.7	0	0	0	111.3	S705 G706 V707 R753 A939	S705-D927 WeakPolarHBondContact O-CB 3.46Å; G706-D927 VanDerWaalsContact CA-OD2 3.28Å; G706-D927 WeakPolarHBondContact CA-OD2 3.27Å; V707-D927 HydrophobicContact CG1-CB 4.21Å; V707-D927 PolarHBondContact N-OD2 2.91Å; V707-D927 VanDerWaalsContact N-OD2 3.16Å; R753-D927 VanDerWaalsContact CD-OD2 3.31Å; R753-D927 WeakPolarHBondContact CD-OD2 3.23Å; R753-D927 IonicContact CZ-OD2 3.25Å; R753-D927 IonicContact NE-OD2 2.61Å; R753-D927 IonicContact NH1-OD2 3.06Å; D927-A939 PolarHBondContact O-N 3.31Å; D927-A939 VanDerWaalsContact O-N 3.1Å
928	V	96.3	Very high	92.7	Very high	20 Å²	20	34.4 Å²	34.4	12%	0.121	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.1	179	-72.6	0	0	0	0	112.4	I882 A895 F901 V936 V937 L938	I882-V928 HydrophobicContact CD1-CG1 4.02Å; A895-V928 HydrophobicContact CB-CB 4.31Å; A895-V928 HydrophobicContact CB-CG1 3.91Å; A895-V928 HydrophobicContact CB-CG2 3.57Å; F901-V928 HydrophobicContact CE2-CG1 3.99Å; F901-V928 HydrophobicContact CZ-CG1 4.2Å; V928-V936 HydrophobicContact CB-CG2 4.19Å; V928-V936 HydrophobicContact CG1-CG2 4.33Å; V928-V937 WeakPolarHBondContact CA-O 3.33Å; V928-L938 HydrophobicContact CG1-CD1 3.51Å
929	A	96.9	Very high	92.8	Very high	11 Å²	11	34.4 Å²	34.4	9%	0.091	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.3	169.6	0	0	0	0	0	111.6	V707 V709 V936 V937	V707-A929 HydrophobicContact CG1-CB 4.02Å; V707-A929 HydrophobicContact CG2-CB 4.23Å; V709-A929 HydrophobicContact CG2-CB 3.75Å; A929-V936 WeakPolarHBondContact O-CA 3.38Å; A929-V936 WeakPolarHBondContact O-CG2 3.29Å; A929-V937 PolarHBondContact N-O 3.1Å; A929-V937 PolarHBondContact O-N 2.8Å
930	L	95.7	Very high	93.1	Very high	23 Å²	23	26.9 Å²	26.9	12%	0.12	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.5	177.8	-54.1	177.2	0	0	0	110.1	N887 V893 V936 Y950	N887-L930 HydrophobicContact CB-CD1 4.15Å; V893-L930 HydrophobicContact CB-CD1 4.03Å; V893-L930 HydrophobicContact CB-CD2 4.3Å; V893-L930 HydrophobicContact CG1-CD2 4.22Å; V893-L930 HydrophobicContact CG2-CD1 3.83Å; V893-L930 HydrophobicContact CG2-CD2 4.47Å; L930-V936 HydrophobicContact CD2-CB 4.24Å; L930-V936 HydrophobicContact CD2-CG2 4.09Å; L930-Y950 HydrophobicContact CD2-CE1 3.85Å
931	L	94.9	Very high	93.4	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	14%	0.14	C	C	.	.			trans	-89.8	150.4	165.4	-71	84.9	0	0	0	109.6	V709 N713 K730 D933 G934 S935 V937	V709-L931 HydrophobicContact CG1-CG 4.35Å; V709-L931 HydrophobicContact CG2-CD1 4.25Å; V709-L931 HydrophobicContact CG2-CG 4.24Å; N713-L931 HydrophobicContact CB-CD2 4.45Å; K730-L931 HydrophobicContact CB-CD2 3.7Å; L931-D933 PolarHBondContact O-N 2.81Å; L931-G934 PolarHBondContact O-N 3.5Å; L931-S935 PolarHBondContact N-O 2.96Å; L931-V937 HydrophobicContact CD1-CG2 3.53Å; L931-V937 HydrophobicContact CD1-CB 4.35Å
932	D	91.2	Very high	93.5	Very high	52 Å²	52	22.1 Å²	22.1	28%	0.278	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.3	-178.8	-58.3	-21.9	0	0	0	111.8	N713 R758 H888 G934	N713-D932 PolarHBondContact ND2-OD2 2.8Å; N713-D932 PolarHBondContact OD1-N 3.44Å; R758-D932 IonicContact CZ-OD1 2.72Å; R758-D932 VanDerWaalsContact CZ-OD1 3.29Å; R758-D932 IonicContact CZ-OD2 3.99Å; R758-D932 VanDerWaalsContact NH1-CG 3.29Å; R758-D932 IonicContact NH1-OD1 3.34Å; R758-D932 PolarHBondContact NH1-OD1 3Å; R758-D932 IonicContact NH1-OD2 2.85Å; R758-D932 PolarHBondContact NH1-OD2 3.4Å; R758-D932 IonicContact NH2-OD1 3.59Å; R758-D932 PolarHBondContact NH2-OD1 3.44Å; R758-D932 IonicContact NH2-OD2 2.67Å; H888-D932 PolarHBondContact CE1-O 3.14Å; H888-D932 PolarHBondContact ND1-O 3.22Å; D932-G934 VanDerWaalsContact C-N 3.33Å; D932-G934 PolarHBondContact O-N 2.81Å
933	D	89.3	Confident	93.8	Very high	65 Å²	65	25 Å²	25	35%	0.348	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4.6	178.5	95.6	-41.6	0	0	0	114.7	L931 S935 R949	L931-D933 PolarHBondContact O-N 2.81Å; D933-S935 WeakPolarHBondContact OD1-CB 3.49Å; D933-S935 PolarHBondContact OD1-N 3.01Å; D933-S935 VanDerWaalsContact OD1-N 3.12Å; D933-S935 PolarHBondContact OD1-OG 3.2Å; D933-S935 PolarHBondContact OD2-OG 2.88Å; D933-R949 PolarHBondContact OD2-NH2 3.06Å; D933-R949 IonicContact OD2-NH2 3.18Å; D933-R949 PolarHBondContact OD2-NH1 3.29Å; D933-R949 IonicContact OD2-CZ 3.89Å; D933-R949 IonicContact OD2-NH1 3.49Å; D933-R949 PolarHBondContact O-NH1 3.09Å; D933-R949 IonicContact OD1-NH1 2.77Å
934	G	89.9	Confident	94.1	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	85.6	21.5	-177	0	0	0	0	0	114.6	L931 D932 Y950 L951	L931-G934 PolarHBondContact O-N 3.5Å; D932-G934 VanDerWaalsContact C-N 3.33Å; D932-G934 PolarHBondContact O-N 2.81Å; G934-Y950 WeakPolarHBondContact O-CD1 3.14Å; G934-Y950 PolarHBondContact O-N 3.11Å; G934-L951 PolarHBondContact O-N 3.37Å
935	S	94.4	Very high	94.5	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.014	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	157.1	172.2	-47	0	0	0	0	112.3	L931 D933 Y948 Y950	L931-S935 PolarHBondContact N-O 2.96Å; D933-S935 WeakPolarHBondContact OD1-CB 3.49Å; D933-S935 PolarHBondContact OD1-N 3.01Å; D933-S935 VanDerWaalsContact OD1-N 3.12Å; D933-S935 PolarHBondContact OD1-OG 3.2Å; D933-S935 PolarHBondContact OD2-OG 2.88Å; S935-Y948 CarbonylContact C-O 3.59Å; S935-Y948 VanDerWaalsContact CA-O 3.23Å; S935-Y948 WeakPolarHBondContact CA-O 3.5Å; S935-Y950 VanDerWaalsContact O-CE1 3.32Å; S935-Y950 WeakPolarHBondContact O-CE1 3.34Å
936	V	95.3	Very high	94.6	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.9	171.8	64	0	0	0	0	109.4	F901 L903 V928 A929 L930 I947 Y948 Y950	F901-V936 HydrophobicContact CE1-CG1 3.88Å; F901-V936 HydrophobicContact CZ-CG1 4.03Å; F901-V936 HydrophobicContact CZ-CG2 4.28Å; L903-V936 HydrophobicContact CD1-CB 4.31Å; L903-V936 HydrophobicContact CD1-CG1 3.94Å; V928-V936 HydrophobicContact CB-CG2 4.19Å; V928-V936 HydrophobicContact CG1-CG2 4.33Å; A929-V936 WeakPolarHBondContact O-CA 3.38Å; A929-V936 WeakPolarHBondContact O-CG2 3.29Å; L930-V936 HydrophobicContact CD2-CB 4.24Å; L930-V936 HydrophobicContact CD2-CG2 4.09Å; V936-I947 WeakPolarHBondContact O-CA 3.26Å; V936-Y948 PolarHBondContact O-N 2.56Å; V936-Y948 PolarHBondContact N-O 3.42Å; V936-Y950 HydrophobicContact CB-CD1 3.97Å; V936-Y950 HydrophobicContact CB-CE1 4.04Å; V936-Y950 HydrophobicContact CG1-CD1 4.17Å
937	V	96.6	Very high	94.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.1	164	168	0	0	0	0	108.9	V707 I715 V928 A929 L931 L945 Y946 I947	V707-V937 HydrophobicContact CG2-CG1 3.84Å; I715-V937 HydrophobicContact CD1-CG2 3.57Å; I715-V937 HydrophobicContact CG1-CG2 4.04Å; I715-V937 HydrophobicContact CG2-CG1 4.08Å; I715-V937 HydrophobicContact CG2-CG2 4.3Å; V928-V937 WeakPolarHBondContact CA-O 3.33Å; A929-V937 PolarHBondContact N-O 3.1Å; A929-V937 PolarHBondContact O-N 2.8Å; L931-V937 HydrophobicContact CD1-CG2 3.53Å; L931-V937 HydrophobicContact CD1-CB 4.35Å; V937-L945 HydrophobicContact CG1-CB 4.41Å; V937-L945 HydrophobicContact CG1-CD2 3.57Å; V937-Y946 WeakPolarHBondContact CA-O 3.46Å; V937-I947 HydrophobicContact CG2-CD1 4.05Å; V937-I947 HydrophobicContact CG2-CG1 3.88Å
938	L	96.1	Very high	94.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.3	-179.3	178.3	66	0	0	0	109.8	I882 F901 C925 V928 L945 Y946	I882-L938 HydrophobicContact CD1-CD1 3.97Å; F901-L938 HydrophobicContact CB-CD2 4.04Å; F901-L938 HydrophobicContact CD1-CD2 3.69Å; F901-L938 HydrophobicContact CD2-CD1 3.67Å; F901-L938 HydrophobicContact CD2-CD2 3.77Å; F901-L938 HydrophobicContact CD2-CG 4.33Å; F901-L938 HydrophobicContact CE1-CB 4.49Å; F901-L938 HydrophobicContact CE1-CD2 4.03Å; F901-L938 HydrophobicContact CE2-CD1 3.44Å; F901-L938 VanDerWaalsContact CE2-CD1 3.44Å; F901-L938 HydrophobicContact CE2-CD2 4.12Å; F901-L938 HydrophobicContact CE2-CG 4.29Å; F901-L938 HydrophobicContact CG-CD1 4.33Å; F901-L938 HydrophobicContact CG-CD2 3.54Å; F901-L938 HydrophobicContact CZ-CB 4.37Å; F901-L938 HydrophobicContact CZ-CD1 3.91Å; F901-L938 HydrophobicContact CZ-CD2 4.23Å; F901-L938 HydrophobicContact CZ-CG 4.42Å; C925-L938 HydrophobicContact CB-CD1 3.53Å; C925-L938 VanDerWaalsContact SG-CD1 3.55Å; C925-L938 HydrophobicContact CB-CG 4.2Å; V928-L938 HydrophobicContact CG1-CD1 3.51Å; L938-L945 WeakPolarHBondContact O-CA 3.23Å; L938-Y946 PolarHBondContact O-N 3.02Å; L938-Y946 PolarHBondContact N-O 3.25Å
939	A	96.5	Very high	94.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.9	177.3	0	0	0	0	0	111.1	P704 V707 C925 F926 D927 L945	P704-A939 VanDerWaalsContact O-CB 3.31Å; P704-A939 WeakPolarHBondContact O-CB 3.4Å; V707-A939 HydrophobicContact CB-CB 4.48Å; V707-A939 HydrophobicContact CG1-CB 4.21Å; C925-A939 CarbonylContact C-O 3.18Å; C925-A939 VanDerWaalsContact CA-O 3.29Å; C925-A939 WeakPolarHBondContact CA-O 3.46Å; C925-A939 WeakPolarHBondContact CB-O 3.41Å; F926-A939 PolarHBondContact N-O 3.35Å; D927-A939 PolarHBondContact O-N 3.31Å; D927-A939 VanDerWaalsContact O-N 3.1Å; A939-L945 HydrophobicContact CB-CD2 3.69Å
940	S	94.4	Very high	94.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	150.8	-165.1	-177.5	0	0	0	0	114.2	D942 Y943 R944	S940-D942 WeakPolarHBondContact CB-OD1 3.29Å; S940-D942 PolarHBondContact O-N 3.01Å; S940-D942 PolarHBondContact OG-OD1 3.45Å; S940-Y943 PolarHBondContact O-N 3.44Å; S940-R944 PolarHBondContact N-O 3.08Å
941	K	93.3	Very high	93	Very high	89 Å²	89	25.6 Å²	25.6	39%	0.387	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.7	-178.9	-172.1	170.7	-178.1	-177	0	113.7	A923 Q924 F926 Y943	A923-K941 HydrophobicContact CB-CB 4.46Å; Q924-K941 HydrophobicContact CB-CD 4.27Å; Q924-K941 HydrophobicContact CB-CB 4.1Å; Q924-K941 PolarHBondContact O-N 3.03Å; Q924-K941 WeakPolarHBondContact O-CB 3.44Å; F926-K941 HydrophobicContact CZ-CB 3.64Å; F926-K941 HydrophobicContact CZ-CG 3.8Å; F926-K941 HydrophobicContact CZ-CD 4.29Å; F926-K941 HydrophobicContact CE2-CG 4.49Å; F926-K941 HydrophobicContact CE2-CB 3.98Å; F926-K941 HydrophobicContact CE1-CG 4.46Å; F926-K941 HydrophobicContact CE1-CB 4.26Å; K941-Y943 PolarHBondContact O-N 2.77Å
942	D	93.8	Very high	91.1	Very high	32 Å²	32	32.9 Å²	32.9	17%	0.171	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	17	168.3	74.7	-59.2	0	0	0	113.6	A923 S940 R944 Y946	A923-D942 HydrophobicContact CB-CB 4Å; S940-D942 WeakPolarHBondContact CB-OD1 3.29Å; S940-D942 PolarHBondContact O-N 3.01Å; S940-D942 PolarHBondContact OG-OD1 3.45Å; D942-R944 IonicContact OD2-NH1 3.29Å; D942-R944 PolarHBondContact OD2-NH1 3.34Å; D942-R944 IonicContact OD2-CZ 3.95Å; D942-R944 WeakPolarHBondContact OD2-CG 3.48Å; D942-R944 WeakPolarHBondContact OD2-CD 3.24Å; D942-R944 PolarHBondContact O-NH1 2.96Å; D942-Y946 WeakPolarHBondContact OD1-CE2 3.43Å; D942-Y946 PolarHBondContact OD2-OH 3.26Å
943	Y	95.8	Very high	88.8	Confident	85 Å²	85	35.9 Å²	35.9	33%	0.333	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	33.2	178.9	-40.6	-76.9	0	0	0	113.5	G692 E693 F694 T702 S940 K941	G692-Y943 CarbonylContact C-O 3.54Å; E693-Y943 WeakPolarHBondContact CA-O 3.44Å; E693-Y943 PolarHBondContact N-O 2.81Å; E693-Y943 VanDerWaalsContact N-O 3.13Å; F694-Y943 HydrophobicContact CB-CD2 3.67Å; F694-Y943 HydrophobicContact CB-CE2 4.11Å; F694-Y943 HydrophobicContact CB-CG 3.91Å; F694-Y943 AromaticContact CD2-CD1 3.84Å; F694-Y943 HydrophobicContact CD2-CD1 3.84Å; F694-Y943 HydrophobicContact CD2-CD2 4.08Å; F694-Y943 AromaticContact CD2-CE1 3.68Å; F694-Y943 HydrophobicContact CD2-CE1 3.68Å; F694-Y943 AromaticContact CD2-CE2 3.92Å; F694-Y943 HydrophobicContact CD2-CE2 3.92Å; F694-Y943 HydrophobicContact CD2-CG 4.04Å; F694-Y943 AromaticContact CD2-CZ 3.72Å; F694-Y943 HydrophobicContact CE2-CE1 4.25Å; F694-Y943 HydrophobicContact CG-CD2 4.33Å; F694-Y943 HydrophobicContact CG-CE2 4.36Å; F694-Y943 HydrophobicContact CG-CG 4.5Å; T702-Y943 WeakPolarHBondContact O-CD1 3.39Å; T702-Y943 VanDerWaalsContact O-CE1 3.31Å; T702-Y943 WeakPolarHBondContact O-CE1 3.07Å; S940-Y943 PolarHBondContact O-N 3.44Å; K941-Y943 PolarHBondContact O-N 2.77Å
944	R	95.6	Very high	86	Confident	66 Å²	66	37.3 Å²	37.3	25%	0.249	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.2	-174.3	-60.3	-159.6	173.7	74.3	11.5	114.2	F691 G692 S940 D942 Y946	F691-R944 WeakPolarHBondContact O-CA 3.42Å; G692-R944 WeakPolarHBondContact O-CD 3.16Å; G692-R944 WeakPolarHBondContact O-CG 3.04Å; G692-R944 PolarHBondContact O-NE 3.05Å; S940-R944 PolarHBondContact N-O 3.08Å; D942-R944 IonicContact OD2-NH1 3.29Å; D942-R944 PolarHBondContact OD2-NH1 3.34Å; D942-R944 IonicContact OD2-CZ 3.95Å; D942-R944 WeakPolarHBondContact OD2-CG 3.48Å; D942-R944 WeakPolarHBondContact OD2-CD 3.24Å; D942-R944 PolarHBondContact O-NH1 2.96Å; R944-Y946 HydrophobicContact CB-CD2 4.2Å; R944-Y946 HydrophobicContact CB-CE2 3.6Å
945	L	97	Very high	83.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.5	166.5	-69.4	150.3	0	0	0	108.6	K690 F691 F701 V707 V717 V937 L938 A939	K690-L945 CarbonylContact C-O 3.59Å; K690-L945 WeakPolarHBondContact CA-O 3.16Å; F691-L945 HydrophobicContact CD1-CB 4.21Å; F691-L945 HydrophobicContact CD2-CB 4.35Å; F691-L945 HydrophobicContact CD2-CD1 4.17Å; F691-L945 HydrophobicContact CE1-CB 3.77Å; F691-L945 HydrophobicContact CE2-CB 3.94Å; F691-L945 HydrophobicContact CE2-CD1 3.38Å; F691-L945 HydrophobicContact CE2-CG 4.3Å; F691-L945 HydrophobicContact CG-CB 4.47Å; F691-L945 HydrophobicContact CZ-CB 3.63Å; F691-L945 HydrophobicContact CZ-CD1 3.64Å; F691-L945 HydrophobicContact CZ-CG 4.24Å; F691-L945 PolarHBondContact N-O 3.39Å; F691-L945 PolarHBondContact O-N 3.06Å; F701-L945 HydrophobicContact CE1-CD1 4.17Å; F701-L945 HydrophobicContact CE2-CD1 3.72Å; F701-L945 HydrophobicContact CE2-CG 4.49Å; F701-L945 HydrophobicContact CZ-CD1 3.38Å; V707-L945 HydrophobicContact CG2-CD2 4.32Å; V717-L945 HydrophobicContact CB-CD1 4.44Å; V717-L945 HydrophobicContact CG1-CD1 4.11Å; V717-L945 HydrophobicContact CG2-CD1 3.51Å; V717-L945 HydrophobicContact CG2-CD2 4.4Å; V937-L945 HydrophobicContact CG1-CB 4.41Å; V937-L945 HydrophobicContact CG1-CD2 3.57Å; L938-L945 WeakPolarHBondContact O-CA 3.23Å; A939-L945 HydrophobicContact CB-CD2 3.69Å
946	Y	96.2	Very high	80.4	Confident	26 Å²	26	51.2 Å²	51.2	10%	0.102	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.6	178.1	-66.4	-98	0	0	0	110	Y687 K690 H922 V937 L938 D942 R944 Y948	Y687-Y946 HydrophobicContact CE2-CD1 4.17Å; K690-Y946 HydrophobicContact CB-CD1 3.56Å; K690-Y946 HydrophobicContact CB-CE1 3.78Å; K690-Y946 HydrophobicContact CB-CG 4.14Å; K690-Y946 HydrophobicContact CD-CD1 4.15Å; K690-Y946 HydrophobicContact CD-CE1 3.48Å; K690-Y946 VanDerWaalsContact CD-CE1 3.48Å; K690-Y946 HydrophobicContact CG-CD1 4.49Å; K690-Y946 HydrophobicContact CG-CE1 4.26Å; H922-Y946 AromaticContact CE1-CD1 3.64Å; H922-Y946 AromaticContact CE1-CD2 3.85Å; H922-Y946 AromaticContact CE1-CE1 3.93Å; H922-Y946 AromaticContact CE1-CG 3.61Å; H922-Y946 AromaticContact ND1-CD2 3.78Å; H922-Y946 AromaticContact ND1-CE2 3.77Å; V937-Y946 WeakPolarHBondContact CA-O 3.46Å; L938-Y946 PolarHBondContact O-N 3.02Å; L938-Y946 PolarHBondContact N-O 3.25Å; D942-Y946 WeakPolarHBondContact OD1-CE2 3.43Å; D942-Y946 PolarHBondContact OD2-OH 3.26Å; R944-Y946 HydrophobicContact CB-CD2 4.2Å; R944-Y946 HydrophobicContact CB-CE2 3.6Å; Y946-Y948 HydrophobicContact CG-CE2 4.49Å
947	I	95.6	Very high	77.5	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.1	174	-50.1	-164.2	0	0	0	109.7	H688 C689 F691 I715 K730 V936 V937	H688-I947 HydrophobicContact CB-CB 4.15Å; H688-I947 HydrophobicContact CB-CG2 4.01Å; H688-I947 WeakPolarHBondContact CB-O 3.43Å; H688-I947 PolarHBondContact N-O 3.26Å; C689-I947 PolarHBondContact O-N 3.16Å; F691-I947 HydrophobicContact CE1-CD1 4.14Å; F691-I947 HydrophobicContact CE1-CG1 4.21Å; I715-I947 HydrophobicContact CD1-CD1 3.88Å; K730-I947 WeakPolarHBondContact O-CD1 3.43Å; V936-I947 WeakPolarHBondContact O-CA 3.26Å; V937-I947 HydrophobicContact CG2-CD1 4.05Å; V937-I947 HydrophobicContact CG2-CG1 3.88Å
948	Y	94.6	Very high	74.2	Confident	5 Å²	5	65.1 Å²	65.1	2%	0.02	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130	174	-75.2	-90	0	0	0	110.5	M685 I686 Y687 F901 V920 H922 S935 V936 Y946	M685-Y948 HydrophobicContact CB-CD1 3.98Å; I686-Y948 CarbonylContact O-C 3.48Å; I686-Y948 VanDerWaalsContact O-CA 3.32Å; I686-Y948 WeakPolarHBondContact O-CA 3.3Å; Y687-Y948 HydrophobicContact CD2-CE1 4.12Å; Y687-Y948 HydrophobicContact CD2-CE2 4.49Å; Y687-Y948 AromaticContact CD2-CZ 3.96Å; Y687-Y948 HydrophobicContact CG-CE1 4.46Å; F901-Y948 HydrophobicContact CD1-CD2 4.29Å; F901-Y948 HydrophobicContact CD1-CE2 4.5Å; F901-Y948 HydrophobicContact CE1-CD2 4.27Å; V920-Y948 WeakPolarHBondContact CG2-OH 3.41Å; H922-Y948 AromaticContact CE1-CE2 3.79Å; H922-Y948 AromaticContact CE1-CZ 4Å; H922-Y948 PolarHBondContact CE1-OH 2.91Å; H922-Y948 AromaticContact NE2-CE2 3.53Å; H922-Y948 AromaticContact NE2-CZ 3.56Å; H922-Y948 PolarHBondContact NE2-OH 3.01Å; S935-Y948 CarbonylContact C-O 3.59Å; S935-Y948 VanDerWaalsContact CA-O 3.23Å; S935-Y948 WeakPolarHBondContact CA-O 3.5Å; V936-Y948 PolarHBondContact O-N 2.56Å; V936-Y948 PolarHBondContact N-O 3.42Å; Y946-Y948 HydrophobicContact CG-CE2 4.49Å
949	R	92.3	Very high	73.1	Confident	57 Å²	57	68.4 Å²	68.4	22%	0.215	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.4	169	-172.4	176.2	-61.5	-73.8	-8.7	109.2	I686 D933 L951	I686-R949 HydrophobicContact CB-CB 4.36Å; I686-R949 PolarHBondContact N-O 2.87Å; I686-R949 PolarHBondContact O-N 2.91Å; D933-R949 PolarHBondContact OD2-NH2 3.06Å; D933-R949 IonicContact OD2-NH2 3.18Å; D933-R949 PolarHBondContact OD2-NH1 3.29Å; D933-R949 IonicContact OD2-CZ 3.89Å; D933-R949 IonicContact OD2-NH1 3.49Å; D933-R949 PolarHBondContact O-NH1 3.09Å; D933-R949 IonicContact OD1-NH1 2.77Å; R949-L951 WeakPolarHBondContact CG-O 3.23Å
950	Y	87.1	Confident	71.9	Confident	9 Å²	9	71.9 Å²	71.9	4%	0.035	40%	0.4	C	S	.	.			trans	-109	-28.3	-177.5	61.9	-106.3	0	0	0	113.2	L903 M905 L930 G934 S935 V936	L903-Y950 HydrophobicContact CD1-CD1 3.64Å; L903-Y950 HydrophobicContact CD1-CE1 4.4Å; L903-Y950 HydrophobicContact CD1-CG 3.84Å; M905-Y950 HydrophobicContact CE-CD2 3.19Å; M905-Y950 HydrophobicContact CE-CE2 3.81Å; M905-Y950 HydrophobicContact CE-CG 3.76Å; L930-Y950 HydrophobicContact CD2-CE1 3.85Å; G934-Y950 WeakPolarHBondContact O-CD1 3.14Å; G934-Y950 PolarHBondContact O-N 3.11Å; S935-Y950 VanDerWaalsContact O-CE1 3.32Å; S935-Y950 WeakPolarHBondContact O-CE1 3.34Å; V936-Y950 HydrophobicContact CB-CD1 3.97Å; V936-Y950 HydrophobicContact CB-CE1 4.04Å; V936-Y950 HydrophobicContact CG1-CD1 4.17Å
951	L	74.1	Confident	70.7	Confident	45 Å²	45	75.9 Å²	75.9	24%	0.236	42%	0.422	C	S	.	.	S	Bend	trans	-83.1	119	166.2	-62.4	-177.3	0	0	0	109.4	G934 R949 V953	G934-L951 PolarHBondContact O-N 3.37Å; R949-L951 WeakPolarHBondContact CG-O 3.23Å; L951-V953 PolarHBondContact O-N 3.13Å
952	Q	53.6	Low	69.3	Low	157 Å²	157	75.2 Å²	75.2	73%	0.734	42%	0.424	S	S	*	.			trans	-71.4	113.6	163.1	-72.6	-172.7	-61.2	0	0	108.1	I686 S954	I686-Q952 HydrophobicContact CD1-CG 4.49Å; Q952-S954 PolarHBondContact O-N 3.09Å; Q952-S954 VanDerWaalsContact O-N 3.1Å
953	V	43.7	Very low	67.8	Low	114 Å²	114	77.9 Å²	77.9	69%	0.691	44%	0.44	S	S	*	.			trans	-62.1	111.4	158.9	-178.7	0	0	0	0	105.9	L951	L951-V953 PolarHBondContact O-N 3.13Å
954	S	30.4	Very low	65.9	Low	96 Å²	96	77.4 Å²	77.4	67%	0.671	45%	0.447	S	S	*	.			trans	-53.6	128.7	170.7	-65.5	0	0	0	0	108.2	Q952 L956	Q952-S954 PolarHBondContact O-N 3.09Å; Q952-S954 VanDerWaalsContact O-N 3.1Å; S954-L956 PolarHBondContact O-N 2.97Å
955	P	31.1	Very low	63.8	Low	123 Å²	123	78.2 Å²	78.2	80%	0.799	46%	0.461	S	S	*	.			trans	-59.7	114.6	173.1	25.3	-32.2	0	0	0	107.4	G957	P955-G957 PolarHBondContact O-N 3.5Å
956	L	34.7	Very low	61.3	Low	170 Å²	170	84.2 Å²	84.2	89%	0.89	50%	0.497	S	S	*	.			trans	-57.2	125.4	170.2	-82.1	160.9	0	0	0	106.9	S954	S954-L956 PolarHBondContact O-N 2.97Å
957	G	34.2	Very low	58.4	Low	69 Å²	69	89.1 Å²	89.1	71%	0.711	53%	0.53	S	S	*	.			trans	-71.9	148.7	-175.6	0	0	0	0	0	111.8	P955	P955-G957 PolarHBondContact O-N 3.5Å
958	V	29.1	Very low	55	Low	223 Å²	223	97.1 Å²	97.1	100%	1.352	58%	0.578	S	S	*	*			trans	78.9	0	-173.6	-165.9	0	0	0	0	113.2

Retrieved 958 of 958 residues in 229.6 ms (Link to these results)

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