A0A3Q0KKK2_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB (E7BBH9), UniProt , Accession A0A3Q0KKK2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,034 aa.

						>A0A3Q0KKK2_SCHMA|A0A3Q0KKK2
MDKAANQKPETVTSQLLPSLAVDRTQTTCLTSGNNLVKAHMSNQSYDSSYHCSTDFHQYPPSLPNQSSLKESIFLESNEDNNGDTKSTIGSSQQKHGLIKKLLNRTHSNNTNNSTSSNSSPEKLKILELRSHRRPQQAIDASQKVMGNVHHGNPNYGAGVGGGVPHSPDENVTNKITKNATNIKSHNKQLVIHSHPTNQQTLSTSSSNDGHLSSCSKTNSQSINSSHTITTTPSNNTNIINGVVNNASNPTTTNETIVQLQEMVAHLKALVNAKDQRIQELERDKDKLRSVLHQQLTSSWDDSTLSSPVEGLKVIHEDLPSINETNVNNNINDDKRNDDESHSPSSSSSTPAGSPPVTDVTTPPPAAALLLRKRLGVSGESMKCAQELVYHDKDANSRRQIREALRSNDLIKNLDAVQLQEVVSCMHEQTVPANCYIIREGDDGGHLYVGEEGEFEVSKGGKRLYIMGAGRCFGELALLYNCKRTASVKAVTDARVWVLERACFQAIMMKTGLERIEERKAFLRSVPLLKDLSPNRILRIADALEAQYHSAGDCIIRQGELADSFFLIQSGKVRVTISSPQNGSNETKETEIRQLTKGEYFGEKALLGEGRRTANVYAVGPGGVEVLCLYRKDFLELIGDIQELKNKEYTDEETRLLGHSSFSQNSSIATISTKDTGKLDLASSTKSQDELHTKLGLINQPLLPASLSLQPKIQCNILLKDLERICVLGVGGFGRVDLVTLTNDRTQAFALKRLQKAHIVQTRQQEHVYCEKLILSSVSSPFICRLFNTYRDNKYVYMLLEACLGGELWTILRDSHHLEERTTRFCLACCIEALDYLHRHGIVYRDLKPENMLVTSKGYIKLCDFGFAKYIGIGQKTWTFCGTPEYVAPEVILNQGHDFAADYWSLGILTFELLTGAPPFQASEPIKIYMKTLKGIDALGLAQNKYISLKALQFIRRLCRFNSSERLGVGKYGIQEIRSHKYFQGFDWAGIVKQTLTTPFRVKLNGPLDHSNFDRFTMDEQEAPDELSGWDANF
					

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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	38.3	Very low	41.5	Very low	225 Å²	225	150.9 Å²	150.9	100%	1.108	81%	0.812	S	S	*	*				0	70.4	0	-60.5	174.6	-174.1	0	0	106.3
2	D	36.5	Very low	41.2	Very low	123 Å²	123	147.8 Å²	147.8	66%	0.658	80%	0.801	S	S	*	*				73.2	137.3	66.1	-63.1	-81.1	0	0	0	112
3	K	40.3	Very low	41	Very low	186 Å²	186	147.2 Å²	147.2	81%	0.809	81%	0.806	S	S	*	*			cis	-169.8	161.3	-9.2	-110.1	-176.5	-179.2	90.6	0	106
4	A	45.1	Very low	40.8	Very low	85 Å²	85	143.6 Å²	143.6	70%	0.702	80%	0.797	S	S	*	*			cis	-158.6	140.1	-9.7	0	0	0	0	0	105.8
5	A	44.1	Very low	40.4	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	80%	0.795	S	S	*	*				73.5	108.7	65.1	0	0	0	0	0	116.4
6	N	46.5	Very low	40.1	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	79%	0.794	S	S	*	*			trans	175.1	113.7	145.7	-90.2	-19.5	0	0	0	108.6
7	Q	40.7	Very low	39.7	Very low	172 Å²	172	145.4 Å²	145.4	80%	0.804	79%	0.793	S	S	*	*				83	107.2	55	-75.1	-163.3	2.5	0	0	116
8	K	40.7	Very low	39.5	Very low	195 Å²	195	142.9 Å²	142.9	85%	0.848	79%	0.785	S	S	*	*				-172.3	163.5	114.7	-103.9	-173.5	175.3	-179.1	0	111.6
9	P	43.9	Very low	39.1	Very low	117 Å²	117	140.9 Å²	140.9	76%	0.76	78%	0.782	S	S	*	*				-124.5	-169.3	-115.3	44.6	-32	0	0	0	116.6
10	E	38.4	Very low	38.8	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	79%	0.791	S	S	*	*			trans	-88.5	166.1	-162.8	-50.1	157.2	123	0	0	115.7
11	T	41.9	Very low	38.5	Very low	151 Å²	151	139.9 Å²	139.9	93%	0.926	78%	0.784	S	S	*	*			trans	-132.6	147.4	139	-52.9	0	0	0	0	107.9
12	V	38.4	Very low	38.3	Very low	113 Å²	113	135.6 Å²	135.6	69%	0.685	77%	0.771	S	S	*	*			trans	-104.8	141.3	-152.3	175.4	0	0	0	0	115.4
13	T	38.6	Very low	38.1	Very low	140 Å²	140	137 Å²	137	86%	0.859	78%	0.778	S	S	*	*			trans	-140.3	136.1	150	-27.5	0	0	0	0	110.3
14	S	37.6	Very low	37.7	Very low	98 Å²	98	138.8 Å²	138.8	69%	0.685	78%	0.78	S	S	*	*			trans	-67.9	134.2	-177.1	44.3	0	0	0	0	113.5
15	Q	35.4	Very low	37.2	Very low	165 Å²	165	141.9 Å²	141.9	77%	0.771	79%	0.79	S	S	*	*				57	133.3	80.4	-66.6	-172.4	2.5	0	0	113.8
16	L	35.8	Very low	36.5	Very low	146 Å²	146	146 Å²	146	76%	0.764	79%	0.794	S	S	*	*			cis	-131.6	148.2	8.8	-78.5	100.5	0	0	0	110
17	L	32	Very low	35.8	Very low	150 Å²	150	144.3 Å²	144.3	79%	0.785	79%	0.789	S	S	*	*				80.2	147.7	58.7	-75.9	176.7	0	0	0	114.8
18	P	37.5	Very low	35.3	Very low	101 Å²	101	142.5 Å²	142.5	66%	0.656	79%	0.79	S	S	*	*				-138.6	-172.3	-122.8	42.6	-23.7	0	0	0	116.9
19	S	31.4	Very low	34.6	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	79%	0.788	S	S	*	*			trans	22.7	132.2	148.8	64.7	0	0	0	0	121.5
20	L	33.6	Very low	33.9	Very low	181 Å²	181	141.5 Å²	141.5	95%	0.948	80%	0.795	S	S	*	*			trans	-156.4	171.1	136	-110.9	165	0	0	0	110.4
21	A	32.1	Very low	33.5	Very low	80 Å²	80	139.1 Å²	139.1	66%	0.661	79%	0.792	S	S	*	*			trans	-134.6	159.3	-158.6	0	0	0	0	0	114.4
22	V	33.2	Very low	32.9	Very low	135 Å²	135	137.9 Å²	137.9	82%	0.818	79%	0.789	S	S	*	*			trans	52.6	117.9	152.1	175.2	0	0	0	0	118.3
23	D	32.7	Very low	32.7	Very low	151 Å²	151	136 Å²	136	81%	0.807	79%	0.792	S	S	*	*				-155.6	167.3	107.2	-144.6	-14.2	0	0	0	113.3
24	R	31.1	Very low	32.3	Very low	225 Å²	225	136.3 Å²	136.3	85%	0.849	79%	0.789	S	S	*	*			trans	-98.5	145.2	171.5	-65.2	169	166.3	171.5	-5	110
25	T	35.4	Very low	32.2	Very low	150 Å²	150	139.6 Å²	139.6	92%	0.92	80%	0.799	S	S	*	*			trans	-160.3	169.4	142	-0.1	0	0	0	0	111.7
26	Q	29.1	Very low	31.7	Very low	175 Å²	175	139 Å²	139	82%	0.818	80%	0.8	S	S	*	*			trans	-103.3	178.5	-172.5	-63.6	176.7	-10.6	0	0	112.4
27	T	31.7	Very low	31.5	Very low	113 Å²	113	138.9 Å²	138.9	69%	0.693	81%	0.805	S	S	*	*			trans	105	118.9	138.5	-11.3	0	0	0	0	119.4
28	T	30.4	Very low	31.2	Very low	134 Å²	134	141 Å²	141	82%	0.822	81%	0.808	S	S	*	*			trans	67	136.5	147.3	35.5	0	0	0	0	122.2
29	C	26.3	Very low	30.9	Very low	119 Å²	119	140.9 Å²	140.9	80%	0.804	82%	0.816	S	S	*	*			trans	-72.1	158.4	167	-41.6	0	0	0	0	112
30	L	30.2	Very low	30.6	Very low	172 Å²	172	144.9 Å²	144.9	90%	0.901	82%	0.822	S	S	*	*			trans	-155.9	171.8	134.9	-110.8	170.1	0	0	0	110.4
31	T	29	Very low	30.5	Very low	119 Å²	119	145 Å²	145	73%	0.73	82%	0.82	S	S	*	*			trans	-116.1	157	-157.5	51.8	0	0	0	0	115.1
32	S	29.7	Very low	30.4	Very low	124 Å²	124	145.8 Å²	145.8	87%	0.867	82%	0.821	S	S	*	*			trans	78	136.1	155.3	-163	0	0	0	0	118
33	G	33	Very low	30.1	Very low	73 Å²	73	147.1 Å²	147.1	75%	0.753	82%	0.824	S	S	*	*			trans	169.9	87	176.4	0	0	0	0	0	112.3
34	N	31.7	Very low	29.9	Very low	147 Å²	147	148.9 Å²	148.9	79%	0.786	83%	0.827	S	S	*	*			trans	-69.7	149.5	175.7	-70.2	-41.4	0	0	0	111.9
35	N	33.7	Very low	29.7	Very low	167 Å²	167	143.2 Å²	143.2	89%	0.893	82%	0.822	S	S	*	*				-164.4	141.8	127.1	-99.6	-34.5	0	0	0	112.6
36	L	26.7	Very low	29.5	Very low	152 Å²	152	146.5 Å²	146.5	80%	0.796	82%	0.819	S	S	*	*			trans	-89.2	141.1	172.6	-76.2	73	0	0	0	110.3
37	V	31.4	Very low	29.4	Very low	144 Å²	144	144.9 Å²	144.9	87%	0.873	82%	0.816	S	S	*	*			trans	-137.7	127.4	142.8	-177.7	0	0	0	0	108.5
38	K	25	Very low	29.4	Very low	195 Å²	195	143.9 Å²	143.9	85%	0.848	81%	0.814	S	S	*	*			trans	-89.2	139.1	167	-74.9	-178.3	175.1	-179.3	0	109.5
39	A	31.2	Very low	29.2	Very low	99 Å²	99	142.6 Å²	142.6	82%	0.818	81%	0.81	S	S	*	*			trans	-142.6	127.5	158.7	0	0	0	0	0	110.1
40	H	25.7	Very low	29.4	Very low	187 Å²	187	147.4 Å²	147.4	87%	0.866	81%	0.813	S	S	*	*			trans	-83.8	139.6	165.6	-88.8	-100.8	0	0	0	109.4
41	M	30.7	Very low	29.4	Very low	183 Å²	183	147.7 Å²	147.7	90%	0.901	81%	0.809	S	S	*	*			trans	165.8	146.1	140.1	-95.5	168.3	-177.8	0	0	107.8
42	S	29.5	Very low	29.3	Very low	97 Å²	97	148 Å²	148	68%	0.678	82%	0.815	S	S	*	*			cis	169.3	136.6	-19.5	46	0	0	0	0	104.6
43	N	26.9	Very low	29.2	Very low	164 Å²	164	147.1 Å²	147.1	88%	0.877	81%	0.809	S	S	*	*			trans	0.4	119.5	170.7	-58.7	-9.1	0	0	0	118.5
44	Q	30	Very low	28.9	Very low	188 Å²	188	149.8 Å²	149.8	88%	0.879	81%	0.81	S	S	*	*			trans	-135	123.8	135.5	-108.8	174.3	23.6	0	0	109.9
45	S	26.3	Very low	28.6	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	81%	0.81	S	S	*	*			trans	-82.7	135.3	173.7	48.9	0	0	0	0	110
46	Y	31.9	Very low	28.4	Very low	219 Å²	219	151.5 Å²	151.5	86%	0.859	81%	0.81	S	S	*	*			trans	-111.1	114.6	153.3	-100.7	-86.8	0	0	0	109
47	D	26.3	Very low	28.4	Very low	141 Å²	141	152.6 Å²	152.6	75%	0.754	81%	0.811	S	S	*	*			trans	-97.7	128	170.5	-176.5	6.4	0	0	0	107.8
48	S	32.4	Very low	28.2	Very low	92 Å²	92	154.4 Å²	154.4	64%	0.643	81%	0.81	S	S	*	*			trans	-152.8	79.4	171.9	62	0	0	0	0	109.1	Y50	S48-Y50 PolarHBondContact O-N 2.76Å
49	S	25.7	Very low	28.5	Very low	107 Å²	107	155 Å²	155	75%	0.748	81%	0.808	S	S	*	*			trans	-56.2	124.6	168.1	49.5	0	0	0	0	110.9
50	Y	30.9	Very low	28.4	Very low	220 Å²	220	155 Å²	155	86%	0.863	80%	0.8	S	S	*	*			trans	-126.2	136.2	166.4	-92.4	-82.8	0	0	0	110.5	S48	S48-Y50 PolarHBondContact O-N 2.76Å
51	H	30.1	Very low	28.4	Very low	177 Å²	177	152.1 Å²	152.1	82%	0.819	80%	0.798	S	S	*	*			trans	-68.7	141.2	-169	-96.3	-88.3	0	0	0	113	S53	H51-S53 PolarHBondContact O-N 2.77Å
52	C	25.6	Very low	28.3	Very low	127 Å²	127	147.3 Å²	147.3	86%	0.858	78%	0.783	S	S	*	*			trans	-67.1	93.4	158.8	173.7	0	0	0	0	109.7
53	S	27.7	Very low	28.4	Very low	104 Å²	104	150.4 Å²	150.4	73%	0.727	79%	0.791	S	S	*	*			trans	-116.7	136.5	163	-73.3	0	0	0	0	109.5	H51 D55	H51-S53 PolarHBondContact O-N 2.77Å; S53-D55 PolarHBondContact O-N 3.05Å
54	T	28	Very low	28.4	Very low	129 Å²	129	147.9 Å²	147.9	79%	0.791	78%	0.783	S	S	*	*			trans	-81.9	111.1	-178.8	47.3	0	0	0	0	111.3
55	D	25.7	Very low	28.3	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	78%	0.776	S	S	*	*			trans	-156.8	110.5	153.3	-99.5	-41.6	0	0	0	110.3	S53	S53-D55 PolarHBondContact O-N 3.05Å
56	F	28.3	Very low	28.6	Very low	204 Å²	204	148.9 Å²	148.9	90%	0.895	78%	0.781	S	S	*	*			trans	-129.3	53.4	175.4	-105	-74.8	0	0	0	110.8
57	H	28	Very low	28.4	Very low	175 Å²	175	143.4 Å²	143.4	81%	0.81	77%	0.774	S	S	*	*			trans	-93.3	150.7	158.8	-90.5	-74.7	0	0	0	109.8
58	Q	27.2	Very low	28.4	Very low	182 Å²	182	141.2 Å²	141.2	85%	0.85	77%	0.77	S	S	*	*			trans	83.3	69	-176.6	-51.5	-179.3	-3.3	0	0	116.7
59	Y	31.3	Very low	28.3	Very low	207 Å²	207	144 Å²	144	81%	0.812	78%	0.777	S	S	*	*			trans	-72.8	135.6	131.9	-84.9	-89.9	0	0	0	108.1	P61	Y59-P61 VanDerWaalsContact O-CD 3.27Å; Y59-P61 WeakPolarHBondContact O-CD 3.19Å
60	P	28.4	Very low	28.4	Very low	100 Å²	100	147.9 Å²	147.9	65%	0.649	78%	0.78	S	S	*	*			trans	-71.4	116.4	174.8	27.8	-32.8	0	0	0	110.3	S62	P60-S62 PolarHBondContact O-N 2.79Å
61	P	26.4	Very low	28.2	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	78%	0.782	S	S	*	*			trans	-84.9	52.3	-179	37.2	-35	0	0	0	110.6	Y59	Y59-P61 VanDerWaalsContact O-CD 3.27Å; Y59-P61 WeakPolarHBondContact O-CD 3.19Å
62	S	28.2	Very low	28.1	Very low	83 Å²	83	143.5 Å²	143.5	58%	0.58	78%	0.78	S	S	*	*			trans	-139.6	90.7	-171.6	55.5	0	0	0	0	112	P60	P60-S62 PolarHBondContact O-N 2.79Å
63	L	31.1	Very low	28.2	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	78%	0.779	S	S	*	*			trans	-49.9	134.5	134.8	-81	160	0	0	0	107.6	N65	L63-N65 PolarHBondContact O-N 2.78Å
64	P	27.9	Very low	28.1	Very low	110 Å²	110	150.4 Å²	150.4	71%	0.714	79%	0.789	S	S	*	*			trans	-57.4	135.2	167.3	-20.1	31.9	0	0	0	108.8	Q66	P64-Q66 PolarHBondContact O-N 2.76Å
65	N	27.5	Very low	28.2	Very low	138 Å²	138	151.8 Å²	151.8	74%	0.738	79%	0.791	S	S	*	*			trans	-57.6	109.4	174.4	-82.1	-28	0	0	0	109.2	L63 S67	L63-N65 PolarHBondContact O-N 2.78Å; N65-S67 PolarHBondContact O-N 2.8Å
66	Q	32.2	Very low	28.2	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	79%	0.792	S	S	*	*			trans	-76.1	57	168.3	-72.5	-167.2	-16.1	0	0	110.6	P64	P64-Q66 PolarHBondContact O-N 2.76Å
67	S	27	Very low	28.4	Very low	104 Å²	104	149 Å²	149	73%	0.727	79%	0.789	S	S	*	*			trans	-115.5	30.7	171.3	66.1	0	0	0	0	110.8	N65	N65-S67 PolarHBondContact O-N 2.8Å
68	S	27.5	Very low	28.4	Very low	94 Å²	94	147.9 Å²	147.9	66%	0.657	79%	0.789	S	S	*	*			trans	-147.2	40.7	-179.9	66	0	0	0	0	112.2
69	L	29.5	Very low	28.7	Very low	151 Å²	151	147.7 Å²	147.7	79%	0.791	79%	0.788	S	S	*	*			trans	-122.1	52.7	166.5	-78.4	174.6	0	0	0	110.7
70	K	28.9	Very low	28.8	Very low	189 Å²	189	144.2 Å²	144.2	82%	0.822	78%	0.783	S	S	*	*	S	Bend	trans	-134.1	156.2	153.4	-69.4	-177.5	178	177.3	0	105.6
71	E	25.9	Very low	29	Very low	192 Å²	192	145 Å²	145	90%	0.897	78%	0.782	S	S	*	*	S	Bend	trans	72.6	76.6	-178.3	-55.8	174.6	-175.9	0	0	115
72	S	27.3	Very low	29.4	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	78%	0.783	S	S	*	*			trans	-166.5	163.8	145.9	13.6	0	0	0	0	109.5
73	I	29.3	Very low	29.6	Very low	164 Å²	164	146.1 Å²	146.1	84%	0.841	79%	0.793	S	S	*	*			trans	67.2	68	-176.8	-42.7	174.1	0	0	0	113.8
74	F	25.4	Very low	29.8	Very low	212 Å²	212	146.3 Å²	146.3	93%	0.93	80%	0.795	S	S	*	*			trans	-158.7	81.4	153.6	-119.2	-72.5	0	0	0	110
75	L	28.5	Very low	29.8	Very low	159 Å²	159	146.8 Å²	146.8	83%	0.832	80%	0.796	S	S	*	*			trans	178.1	132	179.3	-93.9	173.8	0	0	0	104
76	E	27	Very low	30	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	80%	0.802	S	S	*	*			cis	-145.4	144.4	-4.5	-69.7	172	133.8	0	0	109.3
77	S	32.6	Very low	29.8	Very low	117 Å²	117	146.3 Å²	146.3	82%	0.818	80%	0.798	S	S	*	*			trans	-169.2	121.3	149.1	56	0	0	0	0	109.4
78	N	28	Very low	29.9	Very low	152 Å²	152	147.6 Å²	147.6	81%	0.813	80%	0.801	S	S	*	*			trans	-79.8	142.8	-178.4	-53.3	-58.1	0	0	0	111.1
79	E	31.9	Very low	29.9	Very low	179 Å²	179	150.7 Å²	150.7	84%	0.836	81%	0.809	S	S	*	*				-176.8	158.2	96	-95.5	173.1	178.9	0	0	112.2
80	D	33.5	Very low	29.8	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	81%	0.809	S	S	*	*			trans	63	98.1	158.5	-78.3	21.1	0	0	0	123.8
81	N	34.4	Very low	29.7	Very low	116 Å²	116	143.4 Å²	143.4	62%	0.62	81%	0.806	S	S	*	*				92.3	105	121.3	-74.5	-56.1	0	0	0	122.4
82	N	34.3	Very low	29.8	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	81%	0.808	S	S	*	*			trans	63.9	123.6	137.9	-58.9	-38.3	0	0	0	121.1
83	G	32.4	Very low	29.8	Very low	77 Å²	77	143.3 Å²	143.3	79%	0.794	81%	0.808	S	S	*	*			trans	159.9	63.8	162	0	0	0	0	0	118.3
84	D	33.9	Very low	29.7	Very low	165 Å²	165	144.8 Å²	144.8	88%	0.882	81%	0.812	S	S	*	*			trans	39.1	124.9	158.1	-68.1	-23.5	0	0	0	123.1
85	T	28.1	Very low	29.9	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	81%	0.807	S	S	*	*			trans	-53.5	143.8	169.6	58.8	0	0	0	0	115.8
86	K	33	Very low	30.1	Very low	200 Å²	200	142.8 Å²	142.8	87%	0.87	80%	0.798	S	S	*	*				-178	157.3	114.6	-99	158.7	-172.6	169.7	0	115.8
87	S	26.5	Very low	30.2	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	80%	0.797	S	S	*	*			trans	-74.5	136.3	-170.5	52.9	0	0	0	0	118.3
88	T	30.2	Very low	30.1	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	80%	0.801	S	S	*	*			trans	-159.7	126	147.3	6	0	0	0	0	107
89	I	28	Very low	30.2	Very low	159 Å²	159	141 Å²	141	82%	0.815	80%	0.801	S	S	*	*				52.4	99.8	58.3	-54.3	-177.2	0	0	0	113.3
90	G	25.9	Very low	30.1	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	80%	0.801	S	S	*	*			trans	59.3	102.4	143.4	0	0	0	0	0	119.9
91	S	28.3	Very low	29.9	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	81%	0.81	S	S	*	*			trans	-148.1	68.6	165.8	53.7	0	0	0	0	113.8	Q93	S91-Q93 PolarHBondContact O-N 3.25Å
92	S	27.2	Very low	29.7	Very low	132 Å²	132	148.1 Å²	148.1	92%	0.923	82%	0.824	S	S	*	*			trans	-73.3	55.3	165.4	45.2	0	0	0	0	112.3
93	Q	27.8	Very low	29.4	Very low	171 Å²	171	147.4 Å²	147.4	80%	0.799	82%	0.82	S	S	*	*			trans	-146	91.3	177.5	-72.7	-166	-2.9	0	0	112.2	S91	S91-Q93 PolarHBondContact O-N 3.25Å
94	Q	27.2	Very low	29.3	Very low	195 Å²	195	151.3 Å²	151.3	91%	0.911	82%	0.822	S	S	*	*			trans	-177.7	93.2	152.3	-107.4	174.5	44.1	0	0	110.7
95	K	29	Very low	29.1	Very low	190 Å²	190	153.6 Å²	153.6	83%	0.826	82%	0.819	S	S	*	*			trans	-170.5	31.6	160.4	-110.6	160.4	-169.5	179.7	0	117.3
96	H	32.8	Very low	29.4	Very low	138 Å²	138	154.4 Å²	154.4	64%	0.639	82%	0.823	S	S	*	*			trans	-128.8	130.2	161.9	-88.6	-87.4	0	0	0	110.6
97	G	29.5	Very low	29.4	Very low	78 Å²	78	154.1 Å²	154.1	80%	0.804	83%	0.825	S	S	*	*			trans	128.9	55.4	174.2	0	0	0	0	0	116.7
98	L	29.8	Very low	29.7	Very low	171 Å²	171	153.9 Å²	153.9	90%	0.895	82%	0.823	S	S	*	*			trans	-144.4	33.2	174.4	-124.9	157.4	0	0	0	115.8
99	I	31.2	Very low	30	Very low	156 Å²	156	153.9 Å²	153.9	80%	0.8	82%	0.818	S	S	*	*	S	Bend	trans	-132.4	67	165.3	-49.3	-178.6	0	0	0	110.1
100	K	28.7	Very low	30.2	Very low	197 Å²	197	153.2 Å²	153.2	86%	0.857	82%	0.816	S	S	*	*	S	Bend	trans	-168.5	58.9	166.2	-117	167.9	-174.3	172.1	0	113.3
101	K	30.2	Very low	30.7	Very low	206 Å²	206	154.6 Å²	154.6	90%	0.896	81%	0.81	S	S	*	*			trans	-158.1	31	175.1	-126.4	172	-171.7	178.4	0	117.3
102	L	30.3	Very low	31	Very low	174 Å²	174	155.9 Å²	155.9	91%	0.911	81%	0.808	S	S	*	*			trans	-128.7	29.4	-179	-90.6	171	0	0	0	114.9
103	L	28.4	Very low	31.4	Very low	143 Å²	143	156.5 Å²	156.5	75%	0.749	80%	0.801	S	S	*	*	S	Bend	trans	-121	148.6	153.5	-93.7	84.2	0	0	0	108.5
104	N	29.3	Very low	31.7	Very low	159 Å²	159	153.1 Å²	153.1	85%	0.85	80%	0.796	S	S	*	*	S	Bend	trans	77.5	136.4	-175.6	-55.1	-16.4	0	0	0	116.2
105	R	30.7	Very low	32.1	Very low	212 Å²	212	149.6 Å²	149.6	80%	0.8	79%	0.788	S	S	*	*			trans	74	77.2	176.7	-63.5	-174.6	170.9	172.5	-2.1	118.7
106	T	33.3	Very low	32.4	Very low	137 Å²	137	145.6 Å²	145.6	84%	0.84	78%	0.784	S	S	*	*			trans	-139.8	98.3	138.7	32.6	0	0	0	0	110.5
107	H	32.4	Very low	32.5	Very low	195 Å²	195	143.9 Å²	143.9	90%	0.903	79%	0.788	S	S	*	*			trans	-147.6	101.9	169.7	-102.6	32.1	0	0	0	108.3
108	S	34	Very low	32.6	Very low	101 Å²	101	147.8 Å²	147.8	71%	0.706	79%	0.79	S	S	*	*				176.3	147.3	127.2	-135.7	0	0	0	0	111
109	N	35.4	Very low	32.9	Very low	130 Å²	130	145.6 Å²	145.6	70%	0.695	79%	0.789	S	S	*	*			trans	67.9	109.5	153.8	-54	-0.4	0	0	0	116.2
110	N	33.7	Very low	32.9	Very low	145 Å²	145	143.7 Å²	143.7	78%	0.775	79%	0.79	S	S	*	*				77.8	132.6	89.7	-75	-1.8	0	0	0	113.4
111	T	35.3	Very low	33	Very low	106 Å²	106	139.8 Å²	139.8	65%	0.65	78%	0.784	S	S	*	*			cis	-160.1	149.4	9.9	4.6	0	0	0	0	112.9
112	N	35.3	Very low	33.1	Very low	137 Å²	137	138.5 Å²	138.5	73%	0.733	78%	0.781	S	S	*	*			trans	72.1	144.3	146.4	-61	-10.2	0	0	0	123.3
113	N	34.8	Very low	33.2	Very low	145 Å²	145	140.1 Å²	140.1	78%	0.775	78%	0.781	S	S	*	*			trans	66.9	102.9	156.6	-64.9	4.6	0	0	0	118.1
114	S	34.2	Very low	33.1	Very low	101 Å²	101	140.7 Å²	140.7	71%	0.706	78%	0.784	S	S	*	*				88.5	132.5	72	73.6	0	0	0	0	112.3
115	T	35.4	Very low	33.1	Very low	120 Å²	120	141.1 Å²	141.1	74%	0.736	78%	0.778	S	S	*	*			cis	-149.1	169.7	21.8	48.9	0	0	0	0	112.3
116	S	35	Very low	33	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	78%	0.78	S	S	*	*			trans	33.7	140.8	149.5	51.4	0	0	0	0	122.4
117	S	34.9	Very low	32.7	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	77%	0.774	S	S	*	*			cis	-170	148.6	4	47.5	0	0	0	0	113.8
118	N	32.6	Very low	32.4	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	77%	0.77	S	S	*	*			trans	41.7	106.2	145.8	-58.8	-7.7	0	0	0	121.6
119	S	35	Very low	32.1	Very low	125 Å²	125	140.4 Å²	140.4	87%	0.874	78%	0.775	S	S	*	*				-161.5	158.3	117.7	59.2	0	0	0	0	112
120	S	31.7	Very low	31.6	Very low	116 Å²	116	146.5 Å²	146.5	81%	0.811	79%	0.789	S	S	*	*			trans	-70.9	149.1	-164	-164.1	0	0	0	0	115
121	P	31.7	Very low	31.4	Very low	115 Å²	115	143.8 Å²	143.8	75%	0.747	78%	0.781	S	S	*	*			trans	-94.1	153.7	-178.5	37	-35.3	0	0	0	114
122	E	32.4	Very low	31.2	Very low	179 Å²	179	146.9 Å²	146.9	84%	0.836	79%	0.788	S	S	*	*			trans	-178.2	119.5	136.9	-111.8	-169.9	-174.2	0	0	113
123	K	30.8	Very low	30.9	Very low	209 Å²	209	152.4 Å²	152.4	91%	0.909	80%	0.799	S	S	*	*			trans	164.7	83.8	137.8	-91.7	162.6	-172.5	170.5	0	112
124	L	28.3	Very low	30.6	Very low	154 Å²	154	153.4 Å²	153.4	81%	0.806	79%	0.791	S	S	*	*			trans	-86.3	142.3	166.4	-94.5	159.7	0	0	0	110.9
125	K	27.4	Very low	30.5	Very low	168 Å²	168	154.8 Å²	154.8	73%	0.73	80%	0.798	S	S	*	*			trans	39.9	99.5	153.5	-64.4	175.8	178.1	177.1	0	118
126	I	29.2	Very low	30.1	Very low	163 Å²	163	156.4 Å²	156.4	84%	0.836	80%	0.797	S	S	*	*			trans	-126.3	91.1	133	-56.7	-178.2	0	0	0	108
127	L	26.7	Very low	29.9	Very low	137 Å²	137	160.3 Å²	160.3	72%	0.717	80%	0.804	S	S	*	*			trans	-93.7	160.4	153.5	-149.3	78.1	0	0	0	107
128	E	26.7	Very low	29.6	Very low	173 Å²	173	160.2 Å²	160.2	81%	0.808	81%	0.809	S	S	*	*			trans	60.2	95	174.8	-56.9	178.7	136.6	0	0	115.8
129	L	27.2	Very low	29.4	Very low	157 Å²	157	160.9 Å²	160.9	82%	0.822	81%	0.811	S	S	*	*			trans	-174.4	57.2	147.6	-104.5	169.4	0	0	0	111.4
130	R	26.3	Very low	29.1	Very low	258 Å²	258	162.8 Å²	162.8	97%	0.974	81%	0.811	S	S	*	*			trans	-136.4	40.2	171.2	-79.9	-161.5	176	-166.5	-1	113.5
131	S	28.9	Very low	28.9	Very low	89 Å²	89	161.7 Å²	161.7	62%	0.622	81%	0.809	S	S	*	*	S	Bend	trans	-106.1	144	150.1	49.3	0	0	0	0	108.5
132	H	30.7	Very low	28.8	Very low	171 Å²	171	162.1 Å²	162.1	79%	0.792	82%	0.815	S	S	*	*			trans	58.8	80.8	165.4	-56.8	8.7	0	0	0	117.1
133	R	29.4	Very low	28.7	Very low	253 Å²	253	163 Å²	163	96%	0.955	82%	0.819	S	S	*	*			trans	-113.2	89	143.4	-83.1	-163.7	176.4	-151.1	-0.8	109.8
134	R	28.8	Very low	28.7	Very low	165 Å²	165	163.1 Å²	163.1	62%	0.623	82%	0.819	S	S	*	*			trans	-63.6	139.2	162.1	-77.3	-177.6	174.7	158.8	-2.8	108.9	Q136 D563	R134-Q136 VanDerWaalsContact C-N 3.3Å; R134-Q136 PolarHBondContact O-N 2.89Å; R134-D563 IonicContact CZ-OD2 3.95Å; R134-D563 IonicContact NH2-OD2 3.78Å; R134-D563 PolarHBondContact NH2-OD2 3.49Å
135	P	31.9	Very low	28.9	Very low	131 Å²	131	162.7 Å²	162.7	85%	0.851	82%	0.823	S	S	*	*			trans	-72.4	86.7	165.6	-10.1	26.4	0	0	0	109.1	Q137	P135-Q137 VanDerWaalsContact C-N 3.3Å; P135-Q137 PolarHBondContact O-N 2.8Å
136	Q	26.4	Very low	29	Very low	154 Å²	154	164 Å²	164	72%	0.72	83%	0.834	S	S	*	*			trans	-84.1	64.7	-173.1	-157.6	94.7	10.9	0	0	111.6	R134	R134-Q136 VanDerWaalsContact C-N 3.3Å; R134-Q136 PolarHBondContact O-N 2.89Å
137	Q	30.8	Very low	29.1	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.883	83%	0.826	S	S	*	*			trans	-154.7	148.2	174.6	-106.8	162.3	24.3	0	0	112	P135	P135-Q137 VanDerWaalsContact C-N 3.3Å; P135-Q137 PolarHBondContact O-N 2.8Å
138	A	28	Very low	29.5	Very low	100 Å²	100	160.3 Å²	160.3	83%	0.826	83%	0.832	S	S	*	*			trans	67.2	55.2	172.4	0	0	0	0	0	118.6
139	I	29.2	Very low	29.7	Very low	173 Å²	173	158 Å²	158	89%	0.887	83%	0.83	S	S	*	*			trans	-130.9	87.7	144.8	-55.2	179.3	0	0	0	108.2
140	D	27.8	Very low	30	Very low	164 Å²	164	159.5 Å²	159.5	88%	0.877	83%	0.832	S	S	*	*			trans	-152.9	65.7	174.5	-155.9	2.2	0	0	0	111.7
141	A	29	Very low	30.4	Very low	94 Å²	94	156.6 Å²	156.6	78%	0.777	83%	0.829	S	S	*	*	S	Bend	trans	-168.1	48.6	176.2	0	0	0	0	0	114.2
142	S	29.2	Very low	30.6	Very low	123 Å²	123	156.1 Å²	156.1	86%	0.86	84%	0.838	S	S	*	*			trans	-161.3	52.2	171.8	-82.6	0	0	0	0	114.9
143	Q	29.7	Very low	30.8	Very low	198 Å²	198	155.9 Å²	155.9	93%	0.925	84%	0.842	S	S	*	*			trans	-157.4	74.1	163.3	-119.6	167.1	19	0	0	113.5
144	K	30.7	Very low	31.2	Very low	211 Å²	211	148.7 Å²	148.7	92%	0.917	83%	0.828	S	S	*	*			trans	-147.4	92.4	163	-112.2	-177.3	-178.2	177.8	0	110.4
145	V	32.2	Very low	31.6	Very low	146 Å²	146	147.2 Å²	147.2	89%	0.885	83%	0.833	S	S	*	*			trans	170.4	101.3	144.1	156.2	0	0	0	0	105.9
146	M	29.7	Very low	31.9	Very low	196 Å²	196	151.4 Å²	151.4	97%	0.966	83%	0.834	S	S	*	*			trans	-134.3	135	152.8	-84	-151.2	-64.4	0	0	106.4
147	G	32.3	Very low	32.3	Very low	64 Å²	64	147.6 Å²	147.6	66%	0.66	84%	0.835	S	S	*	*			trans	162.4	129.8	-179	0	0	0	0	0	110.3
148	N	34.3	Very low	32.5	Very low	157 Å²	157	144 Å²	144	84%	0.84	84%	0.838	S	S	*	*			trans	63.6	92.6	178.4	-51.3	-8.6	0	0	0	113.2
149	V	31.4	Very low	32.8	Very low	126 Å²	126	143.1 Å²	143.1	76%	0.764	84%	0.838	S	S	*	*				65.1	104.5	51.5	-170.1	0	0	0	0	113.2
150	H	34.5	Very low	33.1	Very low	188 Å²	188	142.5 Å²	142.5	87%	0.87	84%	0.842	S	S	*	*				-165.3	160.3	126	-106.6	69.5	0	0	0	111.5
151	H	33	Very low	33.4	Very low	197 Å²	197	138.3 Å²	138.3	91%	0.912	84%	0.838	S	S	*	*			trans	-85.6	154.2	-174.8	-74.4	-80.7	0	0	0	114.2
152	G	34.5	Very low	33.5	Very low	78 Å²	78	138.1 Å²	138.1	80%	0.804	85%	0.845	S	S	*	*			trans	-163.3	132.2	164.3	0	0	0	0	0	110.3
153	N	33.3	Very low	33.8	Very low	166 Å²	166	135.7 Å²	135.7	89%	0.888	84%	0.84	S	S	*	*			trans	-95.5	146.8	-168.2	-149.6	35.4	0	0	0	112.2
154	P	39.4	Very low	34.2	Very low	102 Å²	102	133 Å²	133	66%	0.662	84%	0.837	S	S	*	*			trans	-98.6	159.1	-178.6	38.1	-33.2	0	0	0	113.3
155	N	37.3	Very low	34.8	Very low	135 Å²	135	127.9 Å²	127.9	72%	0.722	83%	0.825	S	S	*	*			trans	-170.1	156.5	148.7	-122.8	-24.5	0	0	0	115.4
156	Y	37.2	Very low	35.1	Very low	219 Å²	219	129.8 Å²	129.8	86%	0.859	82%	0.823	S	S	*	*			trans	60.5	151.1	173.1	-55.2	-69.8	0	0	0	117.6
157	G	34.4	Very low	35.3	Very low	73 Å²	73	125 Å²	125	75%	0.753	81%	0.81	S	S	*	*			cis	-168.4	163.7	-4.1	0	0	0	0	0	111
158	A	35.3	Very low	35.9	Very low	115 Å²	115	126.6 Å²	126.6	95%	0.95	81%	0.808	S	S	*	*			trans	-90.9	155	-172.6	0	0	0	0	0	114.1
159	G	34.2	Very low	35.9	Very low	80 Å²	80	125.9 Å²	125.9	83%	0.825	80%	0.804	S	S	*	*			trans	-161.3	116.8	175.7	0	0	0	0	0	113.2
160	V	35.8	Very low	36.1	Very low	160 Å²	160	127.6 Å²	127.6	97%	0.97	80%	0.804	S	S	*	*			trans	-90.1	148	-176.5	177	0	0	0	0	111.3
161	G	34.9	Very low	36	Very low	77 Å²	77	124.7 Å²	124.7	79%	0.794	80%	0.795	S	S	*	*			trans	165.6	126.2	162.6	0	0	0	0	0	114
162	G	31.3	Very low	36.1	Very low	89 Å²	89	122.1 Å²	122.1	92%	0.918	79%	0.793	S	S	*	*			trans	-99.7	166.5	-178.8	0	0	0	0	0	114.5
163	G	34.1	Very low	35.9	Very low	73 Å²	73	123.7 Å²	123.7	75%	0.753	79%	0.787	S	S	*	*			trans	179	130.4	174.7	0	0	0	0	0	112
164	V	38.7	Very low	35.9	Very low	142 Å²	142	121.5 Å²	121.5	86%	0.861	78%	0.775	S	S	*	*			trans	-154.9	148.6	-170.7	-176.6	0	0	0	0	108.1
165	P	43.1	Very low	35.3	Very low	103 Å²	103	124.3 Å²	124.3	67%	0.669	78%	0.777	S	S	*	*			cis	-121.8	-174.2	-32.7	39.2	-24.4	0	0	0	111.5
166	H	38.9	Very low	35.1	Very low	185 Å²	185	125.4 Å²	125.4	86%	0.856	78%	0.781	S	S	*	*				-170.5	168	127.1	-111.7	-82.5	0	0	0	111.8
167	S	34.5	Very low	34.7	Very low	97 Å²	97	119.9 Å²	119.9	68%	0.678	77%	0.77	S	S	*	*			trans	-145.2	176	-173.4	62.6	0	0	0	0	109.8
168	P	43.5	Very low	34.4	Very low	97 Å²	97	125.2 Å²	125.2	63%	0.63	77%	0.773	S	S	*	*			cis	-128.3	-142.6	-6.1	29.7	-4.4	0	0	0	111.2
169	D	35.4	Very low	34.3	Very low	141 Å²	141	127.5 Å²	127.5	75%	0.754	77%	0.769	S	S	*	*			trans	71.6	146.6	160.1	-50.4	-25.8	0	0	0	117.5
170	E	35.1	Very low	34.2	Very low	163 Å²	163	127.2 Å²	127.2	76%	0.762	76%	0.759	S	S	*	*			cis	-149.7	-170.1	-11.5	-134.8	-155.5	-162.4	0	0	111.7
171	N	32.1	Very low	33.9	Very low	126 Å²	126	125.4 Å²	125.4	67%	0.674	75%	0.749	S	S	*	*			trans	-28.9	140.5	173.2	-64.9	-67.5	0	0	0	118.5
172	V	35.7	Very low	33.6	Very low	143 Å²	143	129 Å²	129	87%	0.867	75%	0.749	S	S	*	*				-161.8	139.5	117.9	136.3	0	0	0	0	110.8
173	T	29.8	Very low	33.8	Very low	111 Å²	111	132 Å²	132	68%	0.681	74%	0.743	S	S	*	*			trans	-101	144.2	172.2	52.7	0	0	0	0	110.5
174	N	33	Very low	33.7	Very low	121 Å²	121	137.3 Å²	137.3	65%	0.647	75%	0.745	S	S	*	*				177.7	163.9	118.6	-100.9	-74.9	0	0	0	115
175	K	27.8	Very low	33.2	Very low	161 Å²	161	135.3 Å²	135.3	70%	0.7	74%	0.738	S	S	*	*			trans	-20	150.1	156.9	-57.5	147.7	-167.1	161.2	0	115.1
176	I	33.1	Very low	32.8	Very low	157 Å²	157	139 Å²	139	81%	0.805	75%	0.746	S	S	*	*				-155.5	119.2	70.9	-78.7	146.6	0	0	0	108.6
177	T	28.4	Very low	32.3	Very low	103 Å²	103	137.9 Å²	137.9	63%	0.632	75%	0.746	S	S	*	*				57.6	121.3	70.1	49.3	0	0	0	0	119.5
178	K	28.8	Very low	32.1	Very low	186 Å²	186	141.8 Å²	141.8	81%	0.809	75%	0.751	S	S	*	*			trans	74.5	123.9	151.3	-65.2	177	179.1	-174.9	0	120.2
179	N	31.5	Very low	31.3	Very low	162 Å²	162	146.2 Å²	146.2	87%	0.866	76%	0.763	S	S	*	*			trans	156.3	146.6	132.2	-79.2	-13.2	0	0	0	108.8
180	A	33.4	Very low	31	Very low	75 Å²	75	145.7 Å²	145.7	62%	0.62	76%	0.76	S	S	*	*			cis	-155.8	125.6	-11.5	0	0	0	0	0	106.5
181	T	27.9	Very low	30.5	Very low	122 Å²	122	143.8 Å²	143.8	75%	0.748	76%	0.759	S	S	*	*				48.3	140.3	100.4	55	0	0	0	0	118.2
182	N	30.1	Very low	30.5	Very low	151 Å²	151	144.4 Å²	144.4	81%	0.807	76%	0.761	S	S	*	*			trans	77.1	151.2	-174.8	-48.6	-66.4	0	0	0	114.3
183	I	33.9	Very low	30.1	Very low	154 Å²	154	146 Å²	146	79%	0.79	76%	0.758	S	S	*	*			cis	-131.5	136	16.2	-69.7	171.1	0	0	0	113.1
184	K	32.4	Very low	30.3	Very low	183 Å²	183	145.8 Å²	145.8	80%	0.796	76%	0.762	S	S	*	*			trans	13.7	119.2	148.9	-58	178.2	178.8	178.9	0	121.3
185	S	29.5	Very low	30.1	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	77%	0.769	S	S	*	*				27.3	131	128.7	65.2	0	0	0	0	121.7
186	H	33	Very low	30.6	Very low	182 Å²	182	146.7 Å²	146.7	84%	0.843	78%	0.775	S	S	*	*			trans	-147.3	121.3	136.7	-114.1	71	0	0	0	111.4
187	N	28.8	Very low	30.6	Very low	161 Å²	161	144.8 Å²	144.8	86%	0.861	77%	0.771	S	S	*	*			trans	-75.6	134.2	164.7	-105.9	-14.5	0	0	0	109
188	K	31.8	Very low	30.8	Very low	178 Å²	178	146.1 Å²	146.1	77%	0.774	77%	0.774	S	S	*	*			trans	-154.2	98.2	156.6	-119.5	169.6	-172.4	176.7	0	112.1
189	Q	26.3	Very low	31.1	Very low	191 Å²	191	144.5 Å²	144.5	89%	0.893	77%	0.769	S	S	*	*			trans	-62.3	131	164.4	-166	173.2	21.2	0	0	108.4
190	L	28.4	Very low	31.1	Very low	130 Å²	130	144.9 Å²	144.9	68%	0.681	77%	0.766	S	S	*	*			trans	-142.6	88.7	-173.5	-129.7	160.6	0	0	0	111.2	I192	L190-I192 HydrophobicContact CD2-CD1 4.21Å; L190-I192 HydrophobicContact CD2-CG1 3.72Å
191	V	24.9	Very low	31.1	Very low	123 Å²	123	146.7 Å²	146.7	75%	0.745	77%	0.769	S	S	*	*			trans	-68.8	134.2	162.1	176.2	0	0	0	0	107.9
192	I	32.3	Very low	31.3	Very low	138 Å²	138	147.9 Å²	147.9	71%	0.708	77%	0.771	S	S	*	*			trans	-119.5	101.7	173.3	-59.5	-179.7	0	0	0	108.9	L190	L190-I192 HydrophobicContact CD2-CD1 4.21Å; L190-I192 HydrophobicContact CD2-CG1 3.72Å
193	H	27.3	Very low	31.4	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.815	76%	0.764	S	S	*	*			trans	-80	144.8	154.1	-83.1	-66.4	0	0	0	109.3
194	S	32.7	Very low	31.4	Very low	108 Å²	108	143.8 Å²	143.8	76%	0.755	76%	0.762	S	S	*	*			trans	-143.1	133.2	157.3	47.1	0	0	0	0	109.6
195	H	29	Very low	31.5	Very low	173 Å²	173	139.7 Å²	139.7	80%	0.801	76%	0.757	S	S	*	*			trans	-76.6	166.3	-178.2	-76.1	-85.6	0	0	0	112
196	P	38.9	Very low	31.8	Very low	127 Å²	127	139.5 Å²	139.5	83%	0.825	76%	0.755	S	S	*	*				-115.2	167.8	105.7	34.1	-35.9	0	0	0	114
197	T	32.4	Very low	32	Very low	117 Å²	117	134.9 Å²	134.9	72%	0.718	74%	0.743	S	S	*	*			trans	-90.6	162.5	-160.2	-12.3	0	0	0	0	114.7
198	N	34.1	Very low	32.4	Very low	131 Å²	131	133.8 Å²	133.8	70%	0.701	74%	0.737	S	S	*	*			trans	89.6	122.6	146.4	-73.7	-16.4	0	0	0	122.3
199	Q	34	Very low	32.7	Very low	152 Å²	152	132.1 Å²	132.1	71%	0.71	74%	0.737	S	S	*	*			trans	79.4	111.2	139.3	-67.4	172.7	11.4	0	0	120.7
200	Q	32.9	Very low	33.1	Very low	171 Å²	171	126.4 Å²	126.4	80%	0.799	73%	0.729	S	S	*	*			trans	66.1	137.5	130.5	-68.9	177.2	7.7	0	0	118.6
201	T	32.5	Very low	33.4	Very low	112 Å²	112	128.4 Å²	128.4	69%	0.687	74%	0.735	S	S	*	*			cis	-156.3	148.3	5.2	13.1	0	0	0	0	111.4
202	L	32	Very low	33.8	Very low	148 Å²	148	129.5 Å²	129.5	78%	0.775	74%	0.736	S	S	*	*			trans	36.9	117.6	142.1	-78.9	141.8	0	0	0	122.1
203	S	32.4	Very low	33.7	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	74%	0.735	S	S	*	*				64.7	151.5	124.8	74.5	0	0	0	0	120.7
204	T	33.9	Very low	34.1	Very low	122 Å²	122	125 Å²	125	75%	0.748	74%	0.736	S	S	*	*			cis	-161.5	166.2	10.4	-12	0	0	0	0	112.6
205	S	34.5	Very low	34	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	74%	0.737	S	S	*	*			trans	3.7	154.2	142.8	59.4	0	0	0	0	121.8
206	S	36.6	Very low	34.2	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	73%	0.732	S	S	*	*			cis	-176.4	175.8	-1.9	47.1	0	0	0	0	112.8
207	S	37	Very low	33.9	Very low	85 Å²	85	124.7 Å²	124.7	59%	0.594	73%	0.732	S	S	*	*			trans	67.6	114.2	137.7	59.8	0	0	0	0	121.3
208	N	37.6	Very low	33.8	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	73%	0.734	S	S	*	*				92.7	152	97.8	-74.1	41.1	0	0	0	112.2
209	D	37.1	Very low	33.7	Very low	143 Å²	143	126 Å²	126	77%	0.765	74%	0.739	S	S	*	*			cis	-158.4	148.7	-7.8	-109.3	-26.4	0	0	0	111.6
210	G	34.1	Very low	33.5	Very low	71 Å²	71	123 Å²	123	73%	0.732	74%	0.735	S	S	*	*			trans	57.7	-175.4	156	0	0	0	0	0	120.2
211	H	35.8	Very low	33.6	Very low	173 Å²	173	123.4 Å²	123.4	80%	0.801	74%	0.737	S	S	*	*			cis	-164.9	164.2	-47.7	-146.6	-90.1	0	0	0	108.1
212	L	32.8	Very low	33.4	Very low	146 Å²	146	123 Å²	123	76%	0.764	74%	0.738	S	S	*	*			trans	65.4	110.2	169.8	-55.2	161.9	0	0	0	115.9
213	S	31.2	Very low	33.6	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	74%	0.744	S	S	*	*				82.7	111.5	55.4	76.8	0	0	0	0	116.3
214	S	34.1	Very low	33.5	Very low	119 Å²	119	126.6 Å²	126.6	83%	0.832	75%	0.749	S	S	*	*				179.2	152.4	123.6	50.9	0	0	0	0	115.1
215	C	30.8	Very low	33.6	Very low	116 Å²	116	126.2 Å²	126.2	78%	0.784	75%	0.752	S	S	*	*			trans	40.7	112.1	147.3	-73.8	0	0	0	0	124.5
216	S	33.3	Very low	33.7	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	75%	0.752	S	S	*	*				78.2	114.6	114.9	73	0	0	0	0	123.3
217	K	32	Very low	33.7	Very low	187 Å²	187	130.6 Å²	130.6	81%	0.813	76%	0.761	S	S	*	*				68.9	118.9	125.7	-71.3	-172.4	176.3	-179.9	0	121.3
218	T	32	Very low	33.5	Very low	126 Å²	126	131.9 Å²	131.9	77%	0.773	77%	0.766	S	S	*	*			trans	75.6	100.1	131.3	57.1	0	0	0	0	121.7
219	N	30.6	Very low	33.2	Very low	151 Å²	151	133 Å²	133	81%	0.807	77%	0.77	S	S	*	*				103.3	149.7	111.3	-144.8	20.1	0	0	0	120.6
220	S	31.4	Very low	32.9	Very low	88 Å²	88	131.6 Å²	131.6	62%	0.615	77%	0.767	S	S	*	*			trans	73.3	117.4	158.1	22.4	0	0	0	0	122.5
221	Q	33.2	Very low	32.9	Very low	180 Å²	180	134.3 Å²	134.3	84%	0.841	77%	0.769	S	S	*	*			trans	77.2	95.1	130.8	-67.1	176.5	-9	0	0	121.7
222	S	29.6	Very low	32.4	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	77%	0.769	S	S	*	*				39.2	129.5	120.5	61.8	0	0	0	0	122.2
223	I	34.8	Very low	32.5	Very low	173 Å²	173	131.4 Å²	131.4	89%	0.887	77%	0.772	S	S	*	*			trans	-153.1	160	130.9	-104	151.6	0	0	0	109.4
224	N	31.2	Very low	32.4	Very low	148 Å²	148	131.1 Å²	131.1	79%	0.791	77%	0.77	S	S	*	*			trans	-92.5	179.1	-166.5	-77.5	-34.1	0	0	0	115.1
225	S	36	Very low	32.3	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	77%	0.765	S	S	*	*			trans	84.2	144.4	157.1	78.7	0	0	0	0	117.3
226	S	35.9	Very low	32.5	Very low	99 Å²	99	134.2 Å²	134.2	69%	0.692	77%	0.77	S	S	*	*			cis	-164.1	-179.8	-11.9	-107.8	0	0	0	0	111.1
227	H	37.3	Very low	32.4	Very low	186 Å²	186	134.4 Å²	134.4	86%	0.861	77%	0.767	S	S	*	*			trans	94.1	130.7	177.9	-53.4	-64.8	0	0	0	115.8
228	T	32.2	Very low	32.4	Very low	112 Å²	112	131.8 Å²	131.8	69%	0.687	76%	0.762	S	S	*	*			cis	158.1	130.3	-29.3	-84.7	0	0	0	0	106.1
229	I	32.5	Very low	32.5	Very low	160 Å²	160	133.6 Å²	133.6	82%	0.821	77%	0.765	S	S	*	*			trans	149.6	87.9	167.4	-82.1	154	0	0	0	104
230	T	30.4	Very low	32.8	Very low	115 Å²	115	133.6 Å²	133.6	71%	0.706	76%	0.763	S	S	*	*				52.2	126.8	74.6	-12.8	0	0	0	0	111.7
231	T	33.1	Very low	32.9	Very low	127 Å²	127	137.1 Å²	137.1	78%	0.779	78%	0.775	S	S	*	*			cis	-144.4	157.2	27.7	47.6	0	0	0	0	113.6
232	T	26.4	Very low	32.8	Very low	130 Å²	130	131.8 Å²	131.8	80%	0.798	77%	0.768	S	S	*	*			trans	-85.3	172.1	158.9	54.2	0	0	0	0	111.1
233	P	35.2	Very low	33	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	77%	0.774	S	S	*	*				-146.8	177	98.6	39.8	-24.2	0	0	0	115.4
234	S	29.1	Very low	33	Very low	93 Å²	93	130.7 Å²	130.7	65%	0.65	77%	0.765	S	S	*	*			trans	-105.4	174.3	177.7	54.7	0	0	0	0	113
235	N	31.4	Very low	33.1	Very low	134 Å²	134	130.4 Å²	130.4	72%	0.717	76%	0.763	S	S	*	*			trans	69.8	124.3	164.2	-57.2	-18.1	0	0	0	118.4
236	N	34.7	Very low	33	Very low	166 Å²	166	132 Å²	132	89%	0.888	76%	0.763	S	S	*	*				-167.4	153.7	100.9	-97.9	-26.9	0	0	0	113.4
237	T	31.2	Very low	32.9	Very low	103 Å²	103	131.7 Å²	131.7	63%	0.632	77%	0.766	S	S	*	*			trans	-118.9	146	171.5	49.2	0	0	0	0	110.5
238	N	32.9	Very low	32.7	Very low	132 Å²	132	128.1 Å²	128.1	71%	0.706	76%	0.763	S	S	*	*			trans	68	114.1	167.4	-49.5	-17.7	0	0	0	116.8
239	I	34.4	Very low	32.8	Very low	165 Å²	165	129.3 Å²	129.3	85%	0.846	77%	0.765	S	S	*	*			trans	178.1	139.2	151.4	-100.1	152.9	0	0	0	106.1
240	I	36.5	Very low	33	Very low	151 Å²	151	127.6 Å²	127.6	77%	0.774	76%	0.764	S	S	*	*			cis	-153.8	170.7	-27	-121.3	169.9	0	0	0	106.3
241	N	32.6	Very low	33.6	Very low	161 Å²	161	126.5 Å²	126.5	86%	0.861	76%	0.757	S	S	*	*			trans	-71.1	147.6	178.3	-58.5	-50.6	0	0	0	114.2
242	G	30.8	Very low	34.5	Very low	68 Å²	68	124.6 Å²	124.6	70%	0.701	75%	0.745	S	S	*	*			trans	110.4	162.1	131.4	0	0	0	0	0	119.3
243	V	34.2	Very low	35.7	Very low	137 Å²	137	122.9 Å²	122.9	83%	0.83	74%	0.735	S	S	*	*			trans	64	102.6	168.9	-168.5	0	0	0	0	114.6
244	V	34.1	Very low	37.3	Very low	115 Å²	115	122.4 Å²	122.4	70%	0.697	73%	0.725	S	S	*	*			cis	77.1	122.6	43.4	-173.7	0	0	0	0	113.9
245	N	34.5	Very low	39.4	Very low	142 Å²	142	123.7 Å²	123.7	76%	0.759	72%	0.721	S	S	*	*			trans	89.9	141.7	169	-65.6	-18.4	0	0	0	121
246	N	34.1	Very low	41.4	Very low	149 Å²	149	120.7 Å²	120.7	80%	0.797	71%	0.708	S	S	*	*			trans	77.4	76.5	152.5	-62.3	-2.8	0	0	0	121.3
247	A	32.8	Very low	43.4	Very low	91 Å²	91	116.9 Å²	116.9	75%	0.752	69%	0.687	S	S	*	*				69.7	150	108.2	0	0	0	0	0	122.5
248	S	34	Very low	45.9	Very low	112 Å²	112	115.4 Å²	115.4	78%	0.783	68%	0.677	S	S	*	*			trans	55.7	89.6	162	52.6	0	0	0	0	118.6
249	N	33.5	Very low	48.1	Very low	137 Å²	137	115 Å²	115	73%	0.733	67%	0.671	S	S	*	*			trans	-156.7	124.2	131.9	-112.7	-27.7	0	0	0	111.9	T251	N249-T251 PolarHBondContact O-N 2.83Å
250	P	37	Very low	50.3	Low	123 Å²	123	111.4 Å²	111.4	80%	0.799	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	75.4	-177.4	35.4	-34.7	0	0	0	112.3
251	T	43.2	Very low	52.6	Low	92 Å²	92	110.1 Å²	110.1	56%	0.564	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.5	-23.4	178.8	16	0	0	0	0	114.9	N249 T253	N249-T251 PolarHBondContact O-N 2.83Å; T251-T253 VanDerWaalsContact C-N 3.29Å; T251-T253 PolarHBondContact O-N 2.8Å
252	T	51.6	Low	55.2	Low	87 Å²	87	108.7 Å²	108.7	53%	0.534	63%	0.632	S	S	.	*	H	α-helix	trans	-69.7	-17.3	-173.2	46.3	0	0	0	0	115.1	T256	T252-T256 WeakPolarHBondContact O-CB 3.29Å; T252-T256 PolarHBondContact O-N 2.87Å; T252-T256 PolarHBondContact O-OG1 3.41Å
253	T	52.8	Low	57.8	Low	94 Å²	94	110.5 Å²	110.5	58%	0.577	62%	0.623	S	S	*	*	H	α-helix	trans	-65.2	-41.5	178.9	43.1	0	0	0	0	112.4	T251 T256 I257	T251-T253 VanDerWaalsContact C-N 3.29Å; T251-T253 PolarHBondContact O-N 2.8Å; T253-T256 PolarHBondContact O-N 2.85Å; T253-I257 WeakPolarHBondContact O-CD1 3.36Å; T253-I257 VanDerWaalsContact O-CG1 3.26Å; T253-I257 WeakPolarHBondContact O-CG1 3.19Å; T253-I257 PolarHBondContact O-N 3.06Å
254	N	68.2	Low	60.3	Low	118 Å²	118	107.3 Å²	107.3	63%	0.631	60%	0.604	S	S	*	*	H	α-helix	trans	-67.8	-42.8	177.3	-80.2	-14.2	0	0	0	111.9	T256 I257 V258	N254-T256 VanDerWaalsContact C-N 3.33Å; N254-T256 PolarHBondContact O-N 3.35Å; N254-I257 PolarHBondContact O-N 2.82Å; N254-V258 WeakPolarHBondContact O-CG2 3.21Å; N254-V258 PolarHBondContact O-N 2.82Å
255	E	72.7	Confident	62.9	Low	121 Å²	121	104.6 Å²	104.6	57%	0.565	59%	0.594	S	S	*	*	H	α-helix	trans	-60.7	-42.7	176	-62.8	-179	144	0	0	111.6	I257 V258 Q259	E255-I257 VanDerWaalsContact C-N 3.34Å; E255-I257 PolarHBondContact O-N 3.12Å; E255-V258 PolarHBondContact O-N 3.38Å; E255-Q259 WeakPolarHBondContact O-CG 3.42Å; E255-Q259 PolarHBondContact O-N 2.84Å
256	T	72.9	Confident	65.4	Low	71 Å²	71	103.5 Å²	103.5	44%	0.436	58%	0.584	S	S	.	*	H	α-helix	trans	-63.5	-39.8	176.7	-52.6	0	0	0	0	111.5	T252 T253 N254 L260	T252-T256 WeakPolarHBondContact O-CB 3.29Å; T252-T256 PolarHBondContact O-N 2.87Å; T252-T256 PolarHBondContact O-OG1 3.41Å; T253-T256 PolarHBondContact O-N 2.85Å; N254-T256 VanDerWaalsContact C-N 3.33Å; N254-T256 PolarHBondContact O-N 3.35Å; T256-L260 HydrophobicContact CG2-CD1 4.27Å; T256-L260 WeakPolarHBondContact O-CB 3.38Å; T256-L260 VanDerWaalsContact O-CG 3.29Å; T256-L260 WeakPolarHBondContact O-CG 3.5Å; T256-L260 PolarHBondContact O-N 3.27Å
257	I	78.3	Confident	67.8	Low	86 Å²	86	101 Å²	101	44%	0.441	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-42.7	176.1	-71.9	165	0	0	0	111.1	T253 N254 E255 L260 Q261	T253-I257 WeakPolarHBondContact O-CD1 3.36Å; T253-I257 VanDerWaalsContact O-CG1 3.26Å; T253-I257 WeakPolarHBondContact O-CG1 3.19Å; T253-I257 PolarHBondContact O-N 3.06Å; N254-I257 PolarHBondContact O-N 2.82Å; E255-I257 VanDerWaalsContact C-N 3.34Å; E255-I257 PolarHBondContact O-N 3.12Å; I257-L260 PolarHBondContact O-N 2.82Å; I257-Q261 HydrophobicContact CG2-CG 4.48Å; I257-Q261 VanDerWaalsContact O-CG 3.29Å; I257-Q261 WeakPolarHBondContact O-CG 3.12Å; I257-Q261 PolarHBondContact O-N 2.82Å
258	V	83.2	Confident	70.5	Confident	72 Å²	72	103.2 Å²	103.2	44%	0.436	56%	0.563	S	S	.	*	H	α-helix	trans	-62.3	-48.3	176.7	171.6	0	0	0	0	110.9	N254 E255 L260 Q261 E262	N254-V258 WeakPolarHBondContact O-CG2 3.21Å; N254-V258 PolarHBondContact O-N 2.82Å; E255-V258 PolarHBondContact O-N 3.38Å; V258-L260 VanDerWaalsContact C-N 3.3Å; V258-L260 PolarHBondContact O-N 2.9Å; V258-Q261 WeakPolarHBondContact O-CB 3.41Å; V258-Q261 PolarHBondContact O-N 3.29Å; V258-E262 HydrophobicContact CG1-CG 4.49Å; V258-E262 WeakPolarHBondContact O-CG 3.3Å; V258-E262 PolarHBondContact O-N 2.82Å
259	Q	78.8	Confident	73.1	Confident	124 Å²	124	100.7 Å²	100.7	58%	0.579	55%	0.549	S	S	*	.	H	α-helix	trans	-59.2	-39.5	177.2	-70.8	173.5	14.4	0	0	112.5	E255 M263	E255-Q259 WeakPolarHBondContact O-CG 3.42Å; E255-Q259 PolarHBondContact O-N 2.84Å; Q259-M263 WeakPolarHBondContact O-CB 3.32Å; Q259-M263 PolarHBondContact O-N 3.32Å
260	L	80.9	Confident	75.6	Confident	89 Å²	89	98.1 Å²	98.1	47%	0.466	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-37.4	174.5	-73	171.9	0	0	0	112.3	T256 I257 V258 M263 V264	T256-L260 HydrophobicContact CG2-CD1 4.27Å; T256-L260 WeakPolarHBondContact O-CB 3.38Å; T256-L260 VanDerWaalsContact O-CG 3.29Å; T256-L260 WeakPolarHBondContact O-CG 3.5Å; T256-L260 PolarHBondContact O-N 3.27Å; I257-L260 PolarHBondContact O-N 2.82Å; V258-L260 VanDerWaalsContact C-N 3.3Å; V258-L260 PolarHBondContact O-N 2.9Å; L260-M263 HydrophobicContact CD2-CE 3.94Å; L260-V264 WeakPolarHBondContact O-CB 3.41Å; L260-V264 VanDerWaalsContact O-CG2 3.28Å; L260-V264 WeakPolarHBondContact O-CG2 3.43Å; L260-V264 PolarHBondContact O-N 3.47Å
261	Q	85.7	Confident	78	Confident	124 Å²	124	95.9 Å²	95.9	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-43.4	175.5	-74	174.1	3.3	0	0	111.9	I257 V258 V264 A265	I257-Q261 HydrophobicContact CG2-CG 4.48Å; I257-Q261 VanDerWaalsContact O-CG 3.29Å; I257-Q261 WeakPolarHBondContact O-CG 3.12Å; I257-Q261 PolarHBondContact O-N 2.82Å; V258-Q261 WeakPolarHBondContact O-CB 3.41Å; V258-Q261 PolarHBondContact O-N 3.29Å; Q261-V264 PolarHBondContact O-N 3.24Å; Q261-A265 WeakPolarHBondContact O-CB 3.42Å; Q261-A265 PolarHBondContact O-N 2.83Å
262	E	86.7	Confident	80.2	Confident	130 Å²	130	96.1 Å²	96.1	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-61.4	-45.7	173.9	-70.6	-176.8	152.4	0	0	111.7	V258 V264 A265 H266	V258-E262 HydrophobicContact CG1-CG 4.49Å; V258-E262 WeakPolarHBondContact O-CG 3.3Å; V258-E262 PolarHBondContact O-N 2.82Å; E262-V264 VanDerWaalsContact C-N 3.34Å; E262-V264 PolarHBondContact O-N 3.13Å; E262-A265 WeakPolarHBondContact O-CB 3.49Å; E262-A265 PolarHBondContact O-N 2.9Å; E262-A265 VanDerWaalsContact O-N 3.17Å; E262-H266 PolarHBondContact O-N 2.95Å
263	M	84.4	Confident	82	Confident	106 Å²	106	94.5 Å²	94.5	52%	0.522	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-37.9	177.9	-170.4	171.3	69.3	0	0	112.1	Q259 L260 H266 L267	Q259-M263 WeakPolarHBondContact O-CB 3.32Å; Q259-M263 PolarHBondContact O-N 3.32Å; L260-M263 HydrophobicContact CD2-CE 3.94Å; M263-H266 PolarHBondContact O-N 2.71Å; M263-L267 HydrophobicContact CG-CD1 4.41Å; M263-L267 WeakPolarHBondContact O-CB 3.5Å; M263-L267 VanDerWaalsContact O-CG 3.3Å; M263-L267 WeakPolarHBondContact O-CG 3.19Å; M263-L267 PolarHBondContact O-N 2.73Å
264	V	87	Confident	83.6	Confident	70 Å²	70	96.9 Å²	96.9	42%	0.424	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-37.7	172.9	167.2	0	0	0	0	111.8	L260 Q261 E262 L267 K268	L260-V264 WeakPolarHBondContact O-CB 3.41Å; L260-V264 VanDerWaalsContact O-CG2 3.28Å; L260-V264 WeakPolarHBondContact O-CG2 3.43Å; L260-V264 PolarHBondContact O-N 3.47Å; Q261-V264 PolarHBondContact O-N 3.24Å; E262-V264 VanDerWaalsContact C-N 3.34Å; E262-V264 PolarHBondContact O-N 3.13Å; V264-L267 PolarHBondContact O-N 3.49Å; V264-K268 HydrophobicContact CG1-CD 4.29Å; V264-K268 WeakPolarHBondContact O-CG 3.26Å; V264-K268 PolarHBondContact O-N 2.95Å
265	A	88.2	Confident	84.6	Confident	58 Å²	58	94.8 Å²	94.8	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-64.6	-43.8	174.5	0	0	0	0	0	111.6	Q261 E262 K268 A269	Q261-A265 WeakPolarHBondContact O-CB 3.42Å; Q261-A265 PolarHBondContact O-N 2.83Å; E262-A265 WeakPolarHBondContact O-CB 3.49Å; E262-A265 PolarHBondContact O-N 2.9Å; E262-A265 VanDerWaalsContact O-N 3.17Å; A265-K268 PolarHBondContact O-N 2.59Å; A265-A269 PolarHBondContact O-N 3.44Å
266	H	88.3	Confident	85.4	Confident	120 Å²	120	95 Å²	95	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-62.4	-43.3	175.3	-174.8	71.6	0	0	0	112.3	E262 M263 K268 A269 L270	E262-H266 PolarHBondContact O-N 2.95Å; M263-H266 PolarHBondContact O-N 2.71Å; H266-K268 PolarHBondContact O-N 3.07Å; H266-A269 PolarHBondContact O-N 2.68Å; H266-L270 PolarHBondContact O-N 2.94Å
267	L	84.9	Confident	86.2	Confident	96 Å²	96	97.7 Å²	97.7	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175	-74.4	169.6	0	0	0	112.4	M263 V264 L270 V271	M263-L267 HydrophobicContact CG-CD1 4.41Å; M263-L267 WeakPolarHBondContact O-CB 3.5Å; M263-L267 VanDerWaalsContact O-CG 3.3Å; M263-L267 WeakPolarHBondContact O-CG 3.19Å; M263-L267 PolarHBondContact O-N 2.73Å; V264-L267 PolarHBondContact O-N 3.49Å; L267-L270 PolarHBondContact O-N 3.23Å; L267-V271 WeakPolarHBondContact O-CG2 3.27Å; L267-V271 PolarHBondContact O-N 2.96Å
268	K	88.7	Confident	86.6	Confident	138 Å²	138	97.7 Å²	97.7	60%	0.6	51%	0.506	S	S	*	.	H	α-helix	trans	-61.9	-41.6	173.3	-75.8	173.7	178.8	179.3	0	112	V264 A265 H266 V271 N272	V264-K268 HydrophobicContact CG1-CD 4.29Å; V264-K268 WeakPolarHBondContact O-CG 3.26Å; V264-K268 PolarHBondContact O-N 2.95Å; A265-K268 PolarHBondContact O-N 2.59Å; H266-K268 PolarHBondContact O-N 3.07Å; K268-V271 PolarHBondContact O-N 3.22Å; K268-N272 PolarHBondContact O-N 3.32Å
269	A	88.9	Confident	86.9	Confident	59 Å²	59	99.8 Å²	99.8	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-42.5	175.2	0	0	0	0	0	112.2	A265 H266 V271 N272 A273	A265-A269 PolarHBondContact O-N 3.44Å; H266-A269 PolarHBondContact O-N 2.68Å; A269-V271 PolarHBondContact O-N 3.19Å; A269-N272 PolarHBondContact O-N 3.44Å; A269-A273 WeakPolarHBondContact O-CB 3.44Å; A269-A273 PolarHBondContact O-N 3.49Å
270	L	85.3	Confident	87.4	Confident	82 Å²	82	97.7 Å²	97.7	43%	0.429	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-33.5	175.7	-75.6	173.5	0	0	0	113.7	H266 L267 K274	H266-L270 PolarHBondContact O-N 2.94Å; L267-L270 PolarHBondContact O-N 3.23Å; L270-K274 WeakPolarHBondContact O-CG 3.32Å; L270-K274 PolarHBondContact O-N 2.98Å
271	V	87.5	Confident	87.6	Confident	76 Å²	76	97.9 Å²	97.9	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-68.8	-52.6	172.9	170.3	0	0	0	0	110.1	L267 K268 A269 A273 K274 D275	L267-V271 WeakPolarHBondContact O-CG2 3.27Å; L267-V271 PolarHBondContact O-N 2.96Å; K268-V271 PolarHBondContact O-N 3.22Å; A269-V271 PolarHBondContact O-N 3.19Å; V271-A273 VanDerWaalsContact C-N 3.27Å; V271-A273 PolarHBondContact O-N 3.26Å; V271-K274 WeakPolarHBondContact O-CA 3.28Å; V271-K274 WeakPolarHBondContact O-CB 3.32Å; V271-K274 PolarHBondContact O-N 3.36Å; V271-D275 WeakPolarHBondContact CG1-OD2 3.32Å; V271-D275 PolarHBondContact O-N 2.93Å
272	N	88.9	Confident	87.7	Confident	97 Å²	97	96.8 Å²	96.8	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-56.1	-40.6	178.8	-71.8	-1.3	0	0	0	112.5	K268 A269 D275 Q276	K268-N272 PolarHBondContact O-N 3.32Å; A269-N272 PolarHBondContact O-N 3.44Å; N272-D275 PolarHBondContact O-N 2.97Å; N272-Q276 WeakPolarHBondContact O-CB 3.16Å; N272-Q276 WeakPolarHBondContact O-CG 3.19Å; N272-Q276 PolarHBondContact O-N 3.44Å
273	A	89.3	Confident	87.7	Confident	53 Å²	53	97.6 Å²	97.6	44%	0.438	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-35.2	176.2	0	0	0	0	0	112.9	A269 V271 R277	A269-A273 WeakPolarHBondContact O-CB 3.44Å; A269-A273 PolarHBondContact O-N 3.49Å; V271-A273 VanDerWaalsContact C-N 3.27Å; V271-A273 PolarHBondContact O-N 3.26Å; A273-R277 WeakPolarHBondContact O-CB 3.24Å; A273-R277 PolarHBondContact O-N 2.89Å; A273-R277 VanDerWaalsContact O-N 3.11Å
274	K	86.6	Confident	87.9	Confident	145 Å²	145	95.5 Å²	95.5	63%	0.63	49%	0.485	S	S	*	.	H	α-helix	trans	-70.7	-39.9	173.5	-77	177	178.2	179.3	0	112	L270 V271 R277 I278	L270-K274 WeakPolarHBondContact O-CG 3.32Å; L270-K274 PolarHBondContact O-N 2.98Å; V271-K274 WeakPolarHBondContact O-CA 3.28Å; V271-K274 WeakPolarHBondContact O-CB 3.32Å; V271-K274 PolarHBondContact O-N 3.36Å; K274-R277 CarbonylContact O-C 3.58Å; K274-R277 PolarHBondContact O-N 3.43Å; K274-I278 WeakPolarHBondContact O-CG1 3.29Å; K274-I278 PolarHBondContact O-N 3.37Å
275	D	89.6	Confident	87.8	Confident	74 Å²	74	95.7 Å²	95.7	40%	0.396	48%	0.48	S	S	.	.	H	α-helix	trans	-68.1	-40	178.8	-66.1	-24.2	0	0	0	111.5	V271 N272 R277 I278 Q279	V271-D275 WeakPolarHBondContact CG1-OD2 3.32Å; V271-D275 PolarHBondContact O-N 2.93Å; N272-D275 PolarHBondContact O-N 2.97Å; D275-R277 VanDerWaalsContact C-N 3.33Å; D275-R277 PolarHBondContact O-N 3.5Å; D275-I278 PolarHBondContact O-N 3.48Å; D275-Q279 WeakPolarHBondContact O-CG 3.2Å; D275-Q279 PolarHBondContact O-N 2.96Å
276	Q	89.2	Confident	87.6	Confident	126 Å²	126	96.3 Å²	96.3	59%	0.589	48%	0.476	S	S	*	.	H	α-helix	trans	-57.9	-44.5	168.5	-74.9	175.7	-5	0	0	111.7	N272 I278 Q279 E280	N272-Q276 WeakPolarHBondContact O-CB 3.16Å; N272-Q276 WeakPolarHBondContact O-CG 3.19Å; N272-Q276 PolarHBondContact O-N 3.44Å; Q276-I278 VanDerWaalsContact C-N 3.33Å; Q276-I278 PolarHBondContact O-N 2.87Å; Q276-Q279 PolarHBondContact O-N 3.3Å; Q276-E280 PolarHBondContact O-N 3.17Å
277	R	89.6	Confident	87.5	Confident	126 Å²	126	96.7 Å²	96.7	48%	0.475	48%	0.476	S	S	.	.	H	α-helix	trans	-67.1	-31.1	177.7	-172.5	54.8	177.4	161.9	3.6	113	A273 K274 D275 E280 L281	A273-R277 WeakPolarHBondContact O-CB 3.24Å; A273-R277 PolarHBondContact O-N 2.89Å; A273-R277 VanDerWaalsContact O-N 3.11Å; K274-R277 CarbonylContact O-C 3.58Å; K274-R277 PolarHBondContact O-N 3.43Å; D275-R277 VanDerWaalsContact C-N 3.33Å; D275-R277 PolarHBondContact O-N 3.5Å; R277-E280 WeakPolarHBondContact CD-OE2 3.48Å; R277-E280 IonicContact CZ-OE2 2.7Å; R277-E280 IonicContact NE-OE2 3.77Å; R277-E280 IonicContact NH1-OE2 2.85Å; R277-E280 PolarHBondContact NH1-OE2 2.9Å; R277-L281 HydrophobicContact CG-CD1 4.36Å; R277-L281 VanDerWaalsContact O-CG 3.28Å; R277-L281 WeakPolarHBondContact O-CG 3.45Å; R277-L281 PolarHBondContact O-N 3.06Å; R277-L281 VanDerWaalsContact O-N 3.07Å
278	I	87.8	Confident	87.4	Confident	87 Å²	87	98 Å²	98	45%	0.446	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-47.6	170.6	-70.6	163.5	0	0	0	109.8	K274 D275 Q276 E280 L281 E282	K274-I278 WeakPolarHBondContact O-CG1 3.29Å; K274-I278 PolarHBondContact O-N 3.37Å; D275-I278 PolarHBondContact O-N 3.48Å; Q276-I278 VanDerWaalsContact C-N 3.33Å; Q276-I278 PolarHBondContact O-N 2.87Å; I278-E280 VanDerWaalsContact C-N 3.28Å; I278-E280 PolarHBondContact O-N 2.97Å; I278-L281 PolarHBondContact O-N 2.94Å; I278-L281 VanDerWaalsContact O-N 3.13Å; I278-E282 HydrophobicContact CG2-CG 4.38Å; I278-E282 WeakPolarHBondContact O-CG 3.24Å; I278-E282 PolarHBondContact O-N 3.33Å
279	Q	88.3	Confident	87	Confident	116 Å²	116	98.8 Å²	98.8	54%	0.542	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-28.4	177.5	-67.6	173.3	11.6	0	0	113.7	D275 Q276 R283	D275-Q279 WeakPolarHBondContact O-CG 3.2Å; D275-Q279 PolarHBondContact O-N 2.96Å; Q276-Q279 PolarHBondContact O-N 3.3Å; Q279-R283 WeakPolarHBondContact O-CG 3.47Å; Q279-R283 PolarHBondContact O-N 2.97Å; Q279-R283 PolarHBondContact O-NE 3.47Å
280	E	89	Confident	86.6	Confident	79 Å²	79	99.6 Å²	99.6	37%	0.369	48%	0.484	S	S	.	.	H	α-helix	trans	-66.5	-53.5	167.3	-73.2	178.9	162.1	0	0	111.9	Q276 R277 I278 E282 R283 D284	Q276-E280 PolarHBondContact O-N 3.17Å; R277-E280 WeakPolarHBondContact CD-OE2 3.48Å; R277-E280 IonicContact CZ-OE2 2.7Å; R277-E280 IonicContact NE-OE2 3.77Å; R277-E280 IonicContact NH1-OE2 2.85Å; R277-E280 PolarHBondContact NH1-OE2 2.9Å; I278-E280 VanDerWaalsContact C-N 3.28Å; I278-E280 PolarHBondContact O-N 2.97Å; E280-E282 PolarHBondContact O-N 3.37Å; E280-R283 WeakPolarHBondContact O-CB 3.29Å; E280-R283 PolarHBondContact O-N 3.3Å; E280-R283 VanDerWaalsContact O-N 3.09Å; E280-D284 PolarHBondContact O-N 3Å
281	L	86.4	Confident	86.5	Confident	93 Å²	93	99 Å²	99	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-62.2	-31.7	-178.8	-69.8	169.6	0	0	0	112.3	R277 I278 K285	R277-L281 HydrophobicContact CG-CD1 4.36Å; R277-L281 VanDerWaalsContact O-CG 3.28Å; R277-L281 WeakPolarHBondContact O-CG 3.45Å; R277-L281 PolarHBondContact O-N 3.06Å; R277-L281 VanDerWaalsContact O-N 3.07Å; I278-L281 PolarHBondContact O-N 2.94Å; I278-L281 VanDerWaalsContact O-N 3.13Å; L281-K285 WeakPolarHBondContact O-CB 3.42Å; L281-K285 PolarHBondContact O-N 2.74Å
282	E	86.5	Confident	85.9	Confident	101 Å²	101	100.2 Å²	100.2	47%	0.472	49%	0.487	S	S	.	.	H	α-helix	trans	-70.9	-39.1	173.8	-72.5	-166.1	123.5	0	0	113.1	I278 E280 K285 D286	I278-E282 HydrophobicContact CG2-CG 4.38Å; I278-E282 WeakPolarHBondContact O-CG 3.24Å; I278-E282 PolarHBondContact O-N 3.33Å; E280-E282 PolarHBondContact O-N 3.37Å; E282-K285 WeakPolarHBondContact O-CB 3.33Å; E282-K285 PolarHBondContact O-N 3.18Å; E282-K285 PolarHBondContact O-NZ 3.03Å; E282-D286 PolarHBondContact O-N 2.71Å; E282-D286 VanDerWaalsContact O-N 3.1Å
283	R	87.9	Confident	85.2	Confident	147 Å²	147	101.8 Å²	101.8	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-42.5	171.8	-77.5	176.1	-72.6	160.5	-3.7	111.3	Q279 E280 D286 K287	Q279-R283 WeakPolarHBondContact O-CG 3.47Å; Q279-R283 PolarHBondContact O-N 2.97Å; Q279-R283 PolarHBondContact O-NE 3.47Å; E280-R283 WeakPolarHBondContact O-CB 3.29Å; E280-R283 PolarHBondContact O-N 3.3Å; E280-R283 VanDerWaalsContact O-N 3.09Å; R283-D286 PolarHBondContact O-N 3.46Å; R283-K287 WeakPolarHBondContact O-CG 3.38Å; R283-K287 PolarHBondContact O-N 3.02Å
284	D	87.4	Confident	84.5	Confident	62 Å²	62	105.2 Å²	105.2	33%	0.332	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-36.3	178.5	-71.2	-19	0	0	0	112.4	E280 D286 K287 L288	E280-D284 PolarHBondContact O-N 3Å; D284-D286 VanDerWaalsContact C-N 3.32Å; D284-D286 PolarHBondContact O-N 3.19Å; D284-K287 PolarHBondContact O-N 2.96Å; D284-K287 WeakPolarHBondContact OD1-CD 3.28Å; D284-K287 WeakPolarHBondContact OD1-CE 3.42Å; D284-K287 IonicContact OD1-NZ 2.73Å; D284-K287 PolarHBondContact OD1-NZ 2.96Å; D284-L288 WeakPolarHBondContact O-CB 3.41Å; D284-L288 VanDerWaalsContact O-CG 3.28Å; D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 3.44Å
285	K	86.1	Confident	83.9	Confident	74 Å²	74	104.3 Å²	104.3	32%	0.322	50%	0.496	S	S	.	.	H	α-helix	trans	-56.8	-42.6	169.2	175.4	-144.4	78	-127.9	0	111.9	L281 E282 R289	L281-K285 WeakPolarHBondContact O-CB 3.42Å; L281-K285 PolarHBondContact O-N 2.74Å; E282-K285 WeakPolarHBondContact O-CB 3.33Å; E282-K285 PolarHBondContact O-N 3.18Å; E282-K285 PolarHBondContact O-NZ 3.03Å; K285-R289 WeakPolarHBondContact O-CG 3.48Å; K285-R289 PolarHBondContact O-N 2.79Å
286	D	84	Confident	82.7	Confident	71 Å²	71	105.7 Å²	105.7	38%	0.38	50%	0.503	S	S	.	.	H	α-helix	trans	-80.4	-29.3	179.5	-68.8	-40.6	0	0	0	113.2	E282 R283 D284 R289 S290	E282-D286 PolarHBondContact O-N 2.71Å; E282-D286 VanDerWaalsContact O-N 3.1Å; R283-D286 PolarHBondContact O-N 3.46Å; D284-D286 VanDerWaalsContact C-N 3.32Å; D284-D286 PolarHBondContact O-N 3.19Å; D286-R289 PolarHBondContact O-N 2.87Å; D286-R289 WeakPolarHBondContact OD1-CD 3.47Å; D286-R289 IonicContact OD1-CZ 2.88Å; D286-R289 IonicContact OD1-NE 2.71Å; D286-R289 IonicContact OD1-NH1 3.98Å; D286-R289 PolarHBondContact OD1-NH1 3.26Å; D286-S290 PolarHBondContact O-N 3.11Å
287	K	85.9	Confident	81.4	Confident	129 Å²	129	103.1 Å²	103.1	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-58.3	-48.1	163.4	-70.5	173.5	-164.4	161.8	0	111.4	R283 D284 R289 S290 V291	R283-K287 WeakPolarHBondContact O-CG 3.38Å; R283-K287 PolarHBondContact O-N 3.02Å; D284-K287 PolarHBondContact O-N 2.96Å; D284-K287 WeakPolarHBondContact OD1-CD 3.28Å; D284-K287 WeakPolarHBondContact OD1-CE 3.42Å; D284-K287 IonicContact OD1-NZ 2.73Å; D284-K287 PolarHBondContact OD1-NZ 2.96Å; K287-R289 VanDerWaalsContact C-N 3.31Å; K287-R289 PolarHBondContact O-N 3.45Å; K287-S290 WeakPolarHBondContact O-CB 3.29Å; K287-S290 PolarHBondContact O-N 3.09Å; K287-S290 VanDerWaalsContact O-N 3.1Å; K287-V291 WeakPolarHBondContact O-CG2 3.48Å; K287-V291 PolarHBondContact O-N 3.3Å
288	L	83	Confident	79.6	Confident	123 Å²	123	101.2 Å²	101.2	64%	0.644	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-35.1	179.7	-73.6	169.2	0	0	0	112.1	D284 L292	D284-L288 WeakPolarHBondContact O-CB 3.41Å; D284-L288 VanDerWaalsContact O-CG 3.28Å; D284-L288 WeakPolarHBondContact O-CG 3.49Å; D284-L288 PolarHBondContact O-N 3.44Å; L288-L292 VanDerWaalsContact O-CB 3.26Å; L288-L292 WeakPolarHBondContact O-CB 3.36Å; L288-L292 PolarHBondContact O-N 3.32Å
289	R	80.2	Confident	77.5	Confident	155 Å²	155	101.2 Å²	101.2	59%	0.585	51%	0.509	S	S	*	.	H	α-helix	trans	-63.2	-43.2	169.1	-78.4	162.9	151.3	-169.9	-9.4	112.3	K285 D286 K287 L292 H293	K285-R289 WeakPolarHBondContact O-CG 3.48Å; K285-R289 PolarHBondContact O-N 2.79Å; D286-R289 PolarHBondContact O-N 2.87Å; D286-R289 WeakPolarHBondContact OD1-CD 3.47Å; D286-R289 IonicContact OD1-CZ 2.88Å; D286-R289 IonicContact OD1-NE 2.71Å; D286-R289 IonicContact OD1-NH1 3.98Å; D286-R289 PolarHBondContact OD1-NH1 3.26Å; K287-R289 VanDerWaalsContact C-N 3.31Å; K287-R289 PolarHBondContact O-N 3.45Å; R289-L292 PolarHBondContact O-N 2.73Å; R289-H293 WeakPolarHBondContact O-CB 3.05Å; R289-H293 PolarHBondContact O-N 3.48Å
290	S	80.5	Confident	75.4	Confident	76 Å²	76	105.4 Å²	105.4	53%	0.531	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-48.2	176.5	-173.6	0	0	0	0	111.5	D286 K287 L292 H293 Q294	D286-S290 PolarHBondContact O-N 3.11Å; K287-S290 WeakPolarHBondContact O-CB 3.29Å; K287-S290 PolarHBondContact O-N 3.09Å; K287-S290 VanDerWaalsContact O-N 3.1Å; S290-L292 PolarHBondContact O-N 3Å; S290-H293 PolarHBondContact O-N 2.92Å; S290-Q294 WeakPolarHBondContact O-CB 3.46Å; S290-Q294 PolarHBondContact O-N 2.93Å
291	V	82.8	Confident	72.8	Confident	70 Å²	70	109 Å²	109	42%	0.424	54%	0.542	S	S	.	.	H	α-helix	trans	-61.6	-42.8	175.8	174.2	0	0	0	0	111.7	K287 Q294 Q295	K287-V291 WeakPolarHBondContact O-CG2 3.48Å; K287-V291 PolarHBondContact O-N 3.3Å; V291-Q294 PolarHBondContact O-N 2.91Å; V291-Q295 WeakPolarHBondContact O-CB 3.43Å; V291-Q295 WeakPolarHBondContact O-CG 3.26Å; V291-Q295 PolarHBondContact O-N 3.11Å
292	L	75	Confident	70.4	Confident	101 Å²	101	112 Å²	112	53%	0.529	56%	0.559	S	S	.	*	H	α-helix	trans	-64.7	-39.2	176.8	-178.9	63.6	0	0	0	111.9	L288 R289 S290 Q295 L296	L288-L292 VanDerWaalsContact O-CB 3.26Å; L288-L292 WeakPolarHBondContact O-CB 3.36Å; L288-L292 PolarHBondContact O-N 3.32Å; R289-L292 PolarHBondContact O-N 2.73Å; S290-L292 PolarHBondContact O-N 3Å; L292-Q295 PolarHBondContact O-N 2.86Å; L292-L296 HydrophobicContact CD1-CD1 4.47Å; L292-L296 HydrophobicContact CG-CD1 4.19Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CD1 3.45Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.3Å; L292-L296 PolarHBondContact O-N 2.87Å
293	H	73.9	Confident	67.9	Low	129 Å²	129	111.8 Å²	111.8	60%	0.597	57%	0.568	S	S	*	*	H	α-helix	trans	-68	-41.6	175.7	-168.3	45.8	0	0	0	111.3	R289 S290 Q295 L296 T297	R289-H293 WeakPolarHBondContact O-CB 3.05Å; R289-H293 PolarHBondContact O-N 3.48Å; S290-H293 PolarHBondContact O-N 2.92Å; H293-Q295 VanDerWaalsContact C-N 3.35Å; H293-Q295 PolarHBondContact O-N 2.82Å; H293-L296 CarbonylContact O-C 3.53Å; H293-L296 PolarHBondContact O-N 3.35Å; H293-L296 VanDerWaalsContact O-N 3.13Å; H293-T297 PolarHBondContact O-N 3.45Å; H293-T297 PolarHBondContact O-OG1 3.02Å
294	Q	74	Confident	65.4	Low	126 Å²	126	111 Å²	111	59%	0.589	58%	0.58	S	S	*	*	H	α-helix	trans	-63.5	-37.3	175.5	-168.8	175.7	19.1	0	0	112.2	S290 V291 T297 S298	S290-Q294 WeakPolarHBondContact O-CB 3.46Å; S290-Q294 PolarHBondContact O-N 2.93Å; V291-Q294 PolarHBondContact O-N 2.91Å; Q294-T297 PolarHBondContact O-N 3.38Å; Q294-T297 PolarHBondContact O-OG1 2.89Å; Q294-S298 WeakPolarHBondContact O-CB 3.43Å; Q294-S298 PolarHBondContact O-N 3.1Å; Q294-S298 PolarHBondContact O-OG 3.2Å
295	Q	74.6	Confident	62.8	Low	125 Å²	125	115.6 Å²	115.6	58%	0.584	60%	0.604	S	S	*	*	H	α-helix	trans	-71.5	-28.5	172.8	-75.1	-176.6	-21	0	0	113.2	V291 L292 H293	V291-Q295 WeakPolarHBondContact O-CB 3.43Å; V291-Q295 WeakPolarHBondContact O-CG 3.26Å; V291-Q295 PolarHBondContact O-N 3.11Å; L292-Q295 PolarHBondContact O-N 2.86Å; H293-Q295 VanDerWaalsContact C-N 3.35Å; H293-Q295 PolarHBondContact O-N 2.82Å
296	L	64.7	Low	60.4	Low	104 Å²	104	116.7 Å²	116.7	55%	0.545	62%	0.621	S	S	.	*	H	α-helix	trans	-76.7	-26.2	174.4	-77.7	165.9	0	0	0	112.9	L292 H293	L292-L296 HydrophobicContact CD1-CD1 4.47Å; L292-L296 HydrophobicContact CG-CD1 4.19Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CD1 3.45Å; L292-L296 VanDerWaalsContact O-CG 3.29Å; L292-L296 WeakPolarHBondContact O-CG 3.3Å; L292-L296 PolarHBondContact O-N 2.87Å; H293-L296 CarbonylContact O-C 3.53Å; H293-L296 PolarHBondContact O-N 3.35Å; H293-L296 VanDerWaalsContact O-N 3.13Å
297	T	61.8	Low	58	Low	71 Å²	71	118.8 Å²	118.8	44%	0.436	64%	0.641	S	S	.	*	H	α-helix	trans	-89.6	-38	172.8	55.3	0	0	0	0	112.3	H293 Q294 S299 W300	H293-T297 PolarHBondContact O-N 3.45Å; H293-T297 PolarHBondContact O-OG1 3.02Å; Q294-T297 PolarHBondContact O-N 3.38Å; Q294-T297 PolarHBondContact O-OG1 2.89Å; T297-S299 PolarHBondContact O-N 3.03Å; T297-W300 PolarHBondContact O-N 3.42Å; T297-W300 VanDerWaalsContact O-N 3.12Å
298	S	51.9	Low	55.7	Low	87 Å²	87	118 Å²	118	61%	0.608	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	6	-179.9	81.8	0	0	0	0	114.9	Q294	Q294-S298 WeakPolarHBondContact O-CB 3.43Å; Q294-S298 PolarHBondContact O-N 3.1Å; Q294-S298 PolarHBondContact O-OG 3.2Å
299	S	44.3	Very low	53.4	Low	87 Å²	87	118.4 Å²	118.4	61%	0.608	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	12.8	169.9	86.3	0	0	0	0	113.2	T297	T297-S299 PolarHBondContact O-N 3.03Å
300	W	44.6	Very low	51.1	Low	203 Å²	203	120.3 Å²	120.3	77%	0.769	67%	0.672	S	S	*	*	S	Bend	trans	-124	-5.4	-173.4	-74.3	75.4	0	0	0	115.1	T297	T297-W300 PolarHBondContact O-N 3.42Å; T297-W300 VanDerWaalsContact O-N 3.12Å
301	D	33.8	Very low	48.7	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	68%	0.684	S	S	*	*			trans	-121.9	87.4	179.3	-77.2	-54.6	0	0	0	112
302	D	34.6	Very low	46.1	Very low	157 Å²	157	125.2 Å²	125.2	84%	0.84	71%	0.707	S	S	*	*			trans	-154.7	157.1	145.8	-154.8	-8.7	0	0	0	110.5
303	S	34.3	Very low	44.1	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	72%	0.722	S	S	*	*	S	Bend	trans	68.9	84.4	177.5	64.1	0	0	0	0	119
304	T	36	Very low	42	Very low	132 Å²	132	129.9 Å²	129.9	81%	0.81	73%	0.732	S	S	*	*			trans	85	123.3	131.8	56.9	0	0	0	0	123.3
305	L	33.2	Very low	40	Very low	158 Å²	158	131.1 Å²	131.1	83%	0.827	74%	0.741	S	S	*	*			trans	88.7	84.6	141.8	-67.9	164	0	0	0	122
306	S	34.7	Very low	38	Very low	96 Å²	96	132 Å²	132	67%	0.671	75%	0.745	S	S	*	*				82.5	107.2	122.5	61.1	0	0	0	0	123.2
307	S	34.6	Very low	36.4	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	75%	0.753	S	S	*	*			trans	86.4	147.9	136.2	89.4	0	0	0	0	117.6
308	P	37.2	Very low	34.9	Very low	113 Å²	113	138.9 Å²	138.9	73%	0.734	77%	0.774	S	S	*	*				-139.6	158.4	-113.2	36.9	-16.9	0	0	0	118.5
309	V	33.9	Very low	33.9	Very low	130 Å²	130	142 Å²	142	79%	0.788	78%	0.783	S	S	*	*			trans	57.7	111.5	141.6	174.9	0	0	0	0	118.6
310	E	32.6	Very low	33.4	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	79%	0.792	S	S	*	*				-166.1	169.7	102.5	-132	159.9	-146	0	0	111.7
311	G	30.6	Very low	32.7	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	79%	0.785	S	S	*	*			trans	120.1	16.2	161.4	0	0	0	0	0	120.8
312	L	28.4	Very low	32.7	Very low	173 Å²	173	138.8 Å²	138.8	91%	0.906	79%	0.787	S	S	*	*			trans	-136.8	96.8	173.1	-121.6	166.5	0	0	0	112.8
313	K	32	Very low	32.5	Very low	194 Å²	194	136.7 Å²	136.7	84%	0.843	78%	0.776	S	S	*	*			trans	-136.6	131.1	169.5	-95.9	-176.9	176.5	173.8	0	111.5
314	V	29.7	Very low	32.5	Very low	133 Å²	133	139.8 Å²	139.8	81%	0.806	78%	0.779	S	S	*	*			trans	-70.5	134.3	162.6	176.4	0	0	0	0	108.3
315	I	32.4	Very low	32.4	Very low	152 Å²	152	139.1 Å²	139.1	78%	0.779	78%	0.776	S	S	*	*			trans	-131	126	164.5	-64.1	178.1	0	0	0	107.8
316	H	31.9	Very low	32.3	Very low	144 Å²	144	138.4 Å²	138.4	67%	0.667	77%	0.773	S	S	*	*			trans	-90.8	152	167.4	-128.9	-112.9	0	0	0	108.1
317	E	30.7	Very low	32.4	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	77%	0.771	S	S	*	*			trans	36.7	114	155.5	-67.1	163.2	136.4	0	0	119
318	D	32.4	Very low	32.3	Very low	166 Å²	166	139.7 Å²	139.7	89%	0.888	77%	0.766	S	S	*	*				-168.1	162.1	100.7	-108.2	-32.3	0	0	0	113.7
319	L	28.9	Very low	32.3	Very low	152 Å²	152	141.2 Å²	141.2	80%	0.796	77%	0.768	S	S	*	*			trans	-103.8	154.6	174.7	-128.7	83.8	0	0	0	109.8
320	P	34.5	Very low	32.3	Very low	123 Å²	123	141.4 Å²	141.4	80%	0.799	77%	0.765	S	S	*	*				-149	169.6	83.9	37.7	-19.1	0	0	0	116.8
321	S	30.2	Very low	32.7	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	75%	0.752	S	S	*	*			trans	-73.2	158.6	174.9	54.1	0	0	0	0	115.1
322	I	32.9	Very low	33	Very low	167 Å²	167	140.3 Å²	140.3	86%	0.856	75%	0.746	S	S	*	*				-160.6	155.2	120.5	-100.2	151.8	0	0	0	111.6
323	N	32.1	Very low	33.5	Very low	113 Å²	113	138.1 Å²	138.1	60%	0.604	74%	0.735	S	S	*	*			trans	-70.7	161	-168.2	-78.1	20.1	0	0	0	117.8
324	E	32.4	Very low	33.9	Very low	159 Å²	159	134 Å²	134	74%	0.743	72%	0.722	S	S	*	*			trans	59.2	148.7	133.4	-66.3	162.6	155.7	0	0	119.3
325	T	34.3	Very low	34.4	Very low	119 Å²	119	133.9 Å²	133.9	73%	0.73	71%	0.711	S	S	*	*			cis	-162.6	136.2	6.3	9.3	0	0	0	0	111.6
326	N	32.5	Very low	34.6	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	71%	0.711	S	S	*	*				72.8	163	119.2	-156.9	21.1	0	0	0	123
327	V	35.2	Very low	34.9	Very low	106 Å²	106	135.2 Å²	135.2	64%	0.642	71%	0.709	S	S	*	*			trans	86.4	89.3	161.7	-165.1	0	0	0	0	120.1
328	N	33.8	Very low	35.4	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	71%	0.707	S	S	*	*				55.3	152.6	124.9	-60.8	-3.5	0	0	0	125.4
329	N	36.7	Very low	35.8	Very low	146 Å²	146	133.1 Å²	133.1	78%	0.781	70%	0.703	S	S	*	*			trans	78.2	150.4	150.6	-67.3	-15	0	0	0	119.5
330	N	35	Very low	36.3	Very low	133 Å²	133	133.5 Å²	133.5	71%	0.711	70%	0.701	S	S	*	*			cis	-170.1	-179.1	-32.5	-155	-2.5	0	0	0	108.8
331	I	39.4	Very low	36.6	Very low	128 Å²	128	130.9 Å²	130.9	66%	0.656	69%	0.686	S	S	*	*			trans	78.4	102.1	149.9	-70.3	160.2	0	0	0	119.1
332	N	37.8	Very low	37.1	Very low	121 Å²	121	135.1 Å²	135.1	65%	0.647	70%	0.695	S	S	*	*				80	145.7	121.5	-75.7	44.1	0	0	0	126.6
333	D	39.5	Very low	37.2	Very low	127 Å²	127	132.3 Å²	132.3	68%	0.679	69%	0.69	S	S	*	*			trans	63.5	147.8	138.8	-57.4	-20.5	0	0	0	120.4
334	D	40.5	Very low	38	Very low	108 Å²	108	132.1 Å²	132.1	58%	0.578	70%	0.695	S	S	*	*			cis	-155.7	157.1	-3.7	-136.2	-5.5	0	0	0	116.7
335	K	39.5	Very low	38.3	Very low	130 Å²	130	129.5 Å²	129.5	57%	0.565	70%	0.695	S	S	*	*			trans	26.8	144.9	142.1	-77.3	168.7	-157.6	81.2	0	125
336	R	37.2	Very low	38.5	Very low	205 Å²	205	128.8 Å²	128.8	77%	0.774	69%	0.694	S	S	*	*			trans	78.6	155.2	133.8	-78.7	172	-171.8	165.5	1.2	120.7
337	N	37.8	Very low	38.8	Very low	120 Å²	120	126.8 Å²	126.8	64%	0.642	69%	0.692	S	S	*	*			cis	-171.1	167.1	-24.9	-121.2	37.9	0	0	0	112.4
338	D	40.4	Very low	38.9	Very low	124 Å²	124	126.9 Å²	126.9	66%	0.663	70%	0.697	S	S	*	*			trans	69.5	157.2	145.2	-55.6	-24.7	0	0	0	124.6
339	D	41.3	Very low	39	Very low	151 Å²	151	126 Å²	126	81%	0.807	70%	0.701	S	S	*	*			trans	64.4	148.2	165.6	-56.4	-20.8	0	0	0	119.5
340	E	39.2	Very low	38.9	Very low	159 Å²	159	125.4 Å²	125.4	74%	0.743	70%	0.703	S	S	*	*			cis	-169	161.3	-9.3	-100.4	-94.3	112.2	0	0	106.4
341	S	40	Very low	39.1	Very low	69 Å²	69	125 Å²	125	48%	0.483	71%	0.707	S	S	.	*			cis	-176.5	-171.5	-20.4	60.6	0	0	0	0	113.1
342	H	41.3	Very low	38.9	Very low	177 Å²	177	123.9 Å²	123.9	82%	0.819	72%	0.717	S	S	*	*			trans	68.9	152.9	164.6	-68.7	-57.6	0	0	0	123
343	S	36.4	Very low	38.8	Very low	108 Å²	108	121 Å²	121	76%	0.755	72%	0.717	S	S	*	*			trans	-160.8	-171.5	-174.5	64.2	0	0	0	0	108.2
344	P	47	Very low	38.6	Very low	110 Å²	110	121 Å²	121	71%	0.714	73%	0.726	S	S	*	*			cis	-134.7	-167.4	-10.6	40.6	-21.8	0	0	0	114.3
345	S	39.4	Very low	38.5	Very low	104 Å²	104	121.1 Å²	121.1	73%	0.727	73%	0.733	S	S	*	*			trans	127.9	135.3	133.6	73.2	0	0	0	0	121.7
346	S	39.7	Very low	38.3	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	75%	0.747	S	S	*	*			trans	67.3	119	148.7	43.7	0	0	0	0	125.2
347	S	38.6	Very low	38.3	Very low	102 Å²	102	117.9 Å²	117.9	71%	0.713	75%	0.749	S	S	*	*			trans	65.9	90.7	134.1	62.5	0	0	0	0	123.3
348	S	36.3	Very low	38.2	Very low	107 Å²	107	117.9 Å²	117.9	75%	0.748	75%	0.754	S	S	*	*				42	110	119.7	62.4	0	0	0	0	121.9
349	S	36.7	Very low	37.7	Very low	114 Å²	114	119.5 Å²	119.5	80%	0.797	76%	0.763	S	S	*	*				164.7	146.7	102.8	51.2	0	0	0	0	113.5
350	T	33.3	Very low	37.7	Very low	133 Å²	133	118 Å²	118	82%	0.816	76%	0.758	S	S	*	*			trans	-5.3	146.1	167.7	49.3	0	0	0	0	120.6
351	P	39.5	Very low	37.6	Very low	124 Å²	124	116.9 Å²	116.9	81%	0.805	76%	0.762	S	S	*	*			cis	-145.5	-175.6	38.5	42.2	-22.2	0	0	0	118.2
352	A	36.3	Very low	37.3	Very low	105 Å²	105	119.7 Å²	119.7	87%	0.868	78%	0.777	S	S	*	*			trans	-4	138.4	165.1	0	0	0	0	0	122.8
353	G	35.1	Very low	36.8	Very low	62 Å²	62	114.7 Å²	114.7	64%	0.639	76%	0.76	S	S	*	*			trans	163.2	119.4	149.4	0	0	0	0	0	117.5
354	S	35.8	Very low	36.6	Very low	125 Å²	125	113.6 Å²	113.6	87%	0.874	75%	0.75	S	S	*	*			trans	60.8	170.6	162.7	39.5	0	0	0	0	117.9
355	P	37.3	Very low	36.1	Very low	112 Å²	112	113.7 Å²	113.7	73%	0.727	75%	0.751	S	S	*	*			cis	-115.5	172.3	-3.1	26.4	-5	0	0	0	114.7
356	P	34.9	Very low	35.8	Very low	130 Å²	130	112.6 Å²	112.6	84%	0.844	75%	0.749	S	S	*	*			trans	-76.9	153.4	175.7	32.7	-36	0	0	0	112.9
357	V	37.8	Very low	35.4	Very low	136 Å²	136	109.3 Å²	109.3	82%	0.824	73%	0.728	S	S	*	*			trans	-122.6	142.7	173.2	180	0	0	0	0	109.7
358	T	36	Very low	35	Very low	120 Å²	120	106.9 Å²	106.9	74%	0.736	71%	0.713	S	S	*	*			trans	-56.9	147.4	-169.9	47.9	0	0	0	0	115.4
359	D	30.9	Very low	35.3	Very low	159 Å²	159	105.9 Å²	105.9	85%	0.85	70%	0.7	S	S	*	*			trans	-57.4	140.6	171.6	-164.5	5.3	0	0	0	111.9
360	V	39.5	Very low	35.5	Very low	119 Å²	119	104.5 Å²	104.5	72%	0.721	68%	0.683	S	S	*	*			trans	-110.7	100.2	-174.8	179.5	0	0	0	0	108.8	T362	V360-T362 PolarHBondContact O-N 2.84Å
361	T	37.2	Very low	36.2	Very low	135 Å²	135	103 Å²	103	83%	0.828	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.4	120.4	177.6	27	0	0	0	0	111.3
362	T	33.7	Very low	37	Very low	129 Å²	129	106.3 Å²	106.3	79%	0.791	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-67.3	135.8	179.2	44.7	0	0	0	0	110.6	V360	V360-T362 PolarHBondContact O-N 2.84Å
363	P	31.5	Very low	38.1	Very low	71 Å²	71	104.1 Å²	104.1	46%	0.461	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-65.9	147.8	177.4	27.3	-34.1	0	0	0	110.4	A367	P363-A367 HydrophobicContact CB-CB 4.28Å
364	P	32.2	Very low	39.8	Very low	85 Å²	85	102.7 Å²	102.7	55%	0.552	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.8	149.7	-176.3	23.5	-34	0	0	0	111.4	A366 A367 A368	P364-A366 PolarHBondContact O-N 3.14Å; P364-A367 HydrophobicContact CG-CB 4.26Å; P364-A367 PolarHBondContact O-N 2.82Å; P364-A368 PolarHBondContact O-N 2.89Å
365	P	36.8	Very low	40.8	Very low	112 Å²	112	102.7 Å²	102.7	73%	0.727	60%	0.601	S	S	*	*	H	α-helix	trans	-55.6	-26.7	-167.5	-29.8	35.8	0	0	0	115.9	L369	P365-L369 PolarHBondContact O-N 3.28Å
366	A	31.8	Very low	41.5	Very low	82 Å²	82	98.5 Å²	98.5	68%	0.678	58%	0.578	S	S	*	*	H	α-helix	trans	-69.9	-35.9	174.8	0	0	0	0	0	113.3	P364	P364-A366 PolarHBondContact O-N 3.14Å
367	A	31.6	Very low	42.6	Very low	34 Å²	34	94.1 Å²	94.1	28%	0.281	55%	0.549	S	S	.	.	H	α-helix	trans	-76.3	-37.8	177.6	0	0	0	0	0	111.6	P363 P364 L369 L370	P363-A367 HydrophobicContact CB-CB 4.28Å; P364-A367 HydrophobicContact CG-CB 4.26Å; P364-A367 PolarHBondContact O-N 2.82Å; A367-L369 PolarHBondContact O-N 2.88Å; A367-L370 WeakPolarHBondContact O-CB 3.24Å; A367-L370 PolarHBondContact O-N 2.81Å
368	A	31.7	Very low	43.4	Very low	50 Å²	50	88.2 Å²	88.2	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-58.5	-29.4	173	0	0	0	0	0	112.8	P364 L370	P364-A368 PolarHBondContact O-N 2.89Å; A368-L370 VanDerWaalsContact C-N 3.32Å; A368-L370 PolarHBondContact O-N 3.28Å
369	L	41.5	Very low	44.2	Very low	87 Å²	87	82.6 Å²	82.6	46%	0.455	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-20	178.3	-145.8	122.7	0	0	0	113.6	P365 A367	P365-L369 PolarHBondContact O-N 3.28Å; A367-L369 PolarHBondContact O-N 2.88Å
370	L	42.2	Very low	45.4	Very low	84 Å²	84	77.1 Å²	77.1	44%	0.44	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.7	177.4	-63.3	171.9	0	0	0	113	A367 A368 A917	A367-L370 WeakPolarHBondContact O-CB 3.24Å; A367-L370 PolarHBondContact O-N 2.81Å; A368-L370 VanDerWaalsContact C-N 3.32Å; A368-L370 PolarHBondContact O-N 3.28Å; L370-A917 HydrophobicContact CD2-CB 3.98Å
371	L	47.4	Very low	46	Very low	102 Å²	102	72.2 Å²	72.2	53%	0.534	42%	0.42	S	S	.	.	S	Bend	trans	-95.3	2.3	-168.1	-75.6	162.4	0	0	0	114.9	W809 R813	L371-W809 WeakPolarHBondContact O-CH2 3.42Å; L371-R813 HydrophobicContact CD2-CG 4.15Å
372	R	55.4	Low	46.6	Very low	194 Å²	194	67.3 Å²	67.3	73%	0.732	39%	0.388	S	S	*	.	S	Bend	trans	-101.8	126.2	-173.4	-169.3	176.4	-177.5	170.8	2.6	112	R374	R372-R374 PolarHBondContact O-N 3.09Å
373	K	59	Low	47.1	Very low	59 Å²	59	69 Å²	69	26%	0.257	38%	0.384	S	S	.	.			trans	-53.6	132.6	169.7	-65.6	-168.8	-175.8	-172.3	0	110.3	E807 W809 E850 D1014	K373-E807 WeakPolarHBondContact CE-OE2 3.4Å; K373-E807 IonicContact NZ-OE1 3.31Å; K373-E807 PolarHBondContact NZ-OE1 3.3Å; K373-E807 IonicContact NZ-OE2 2.74Å; K373-E807 PolarHBondContact NZ-OE2 2.89Å; K373-W809 HydrophobicContact CB-CZ2 4.37Å; K373-W809 HydrophobicContact CD-CE3 4.09Å; K373-W809 HydrophobicContact CD-CH2 4.45Å; K373-W809 HydrophobicContact CD-CZ3 4Å; K373-W809 VanDerWaalsContact CE-CE3 3.43Å; K373-W809 HydrophobicContact CG-CD2 3.9Å; K373-W809 HydrophobicContact CG-CE3 3.69Å; K373-W809 HydrophobicContact CG-CH2 3.46Å; K373-W809 VanDerWaalsContact CG-CH2 3.46Å; K373-W809 HydrophobicContact CG-CZ2 3.68Å; K373-W809 HydrophobicContact CG-CZ3 3.46Å; K373-W809 VanDerWaalsContact CG-CZ3 3.46Å; K373-E850 HydrophobicContact CB-CG 4.35Å; K373-D1014 VanDerWaalsContact CE-OD2 3.26Å; K373-D1014 WeakPolarHBondContact CE-OD2 3.33Å; K373-D1014 IonicContact NZ-OD2 3.57Å; K373-D1014 PolarHBondContact NZ-OD2 2.68Å
374	R	72.4	Confident	47.6	Very low	31 Å²	31	71.3 Å²	71.3	12%	0.117	40%	0.401	C	S	.	.			trans	-93.6	111.3	-171.9	-53.5	-166.3	-161.5	104.2	10.6	111.4	R372 K848 E850 T883 E912	R372-R374 PolarHBondContact O-N 3.09Å; R374-K848 PolarHBondContact O-NZ 3.04Å; R374-E850 WeakPolarHBondContact CB-OE1 3.45Å; R374-E850 PolarHBondContact N-OE1 2.76Å; R374-T883 HydrophobicContact CB-CG2 3.59Å; R374-E912 IonicContact CZ-OE1 3.75Å; R374-E912 VanDerWaalsContact CZ-OE1 3.26Å; R374-E912 IonicContact CZ-OE2 3.6Å; R374-E912 IonicContact NH1-OE1 2.82Å; R374-E912 PolarHBondContact NH1-OE1 3.17Å; R374-E912 IonicContact NH1-OE2 2.81Å; R374-E912 PolarHBondContact NH1-OE2 3.08Å; R374-E912 IonicContact NH2-OE1 2.73Å; R374-E912 PolarHBondContact NH2-OE1 2.69Å; R374-E912 IonicContact NH2-OE2 3.71Å
375	L	56.3	Low	48.4	Very low	126 Å²	126	71.5 Å²	71.5	66%	0.66	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-77	130.8	170.2	-60.9	177.9	0	0	0	109.3
376	G	51	Low	49.3	Very low	23 Å²	23	71.6 Å²	71.6	24%	0.237	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-79.3	155.8	175.6	0	0	0	0	0	112.4	T883	G376-T883 WeakPolarHBondContact CA-OG1 3.13Å
377	V	59.8	Low	51.1	Low	39 Å²	39	76.3 Å²	76.3	24%	0.236	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	150.6	173.6	-67.9	0	0	0	0	110	F880 C881 G882	V377-F880 HydrophobicContact CG2-CE1 3.8Å; V377-C881 CarbonylContact O-C 3.52Å; V377-C881 WeakPolarHBondContact O-CA 3.41Å; V377-G882 VanDerWaalsContact CG2-O 3.29Å; V377-G882 WeakPolarHBondContact CG2-O 3.45Å; V377-G882 PolarHBondContact N-O 3.31Å; V377-G882 PolarHBondContact O-N 3.31Å
378	S	53.5	Low	53.6	Low	12 Å²	12	75.8 Å²	75.8	8%	0.084	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	123.6	174.4	-165.7	0	0	0	0	110.2	N481 H767 F867 C881	S378-N481 PolarHBondContact O-ND2 2.85Å; S378-H767 PolarHBondContact OG-CE1 2.98Å; S378-F867 VanDerWaalsContact CB-CE1 3.47Å; S378-C881 WeakPolarHBondContact OG-CB 3.22Å
379	G	53.9	Low	56.3	Low	1 Å²	1	77.9 Å²	77.9	1%	0.01	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-69.7	159.7	166.6	0	0	0	0	0	111	S381 H767 F880	G379-S381 PolarHBondContact O-N 3.46Å; G379-H767 PolarHBondContact O-CE1 2.9Å; G379-F880 PolarHBondContact N-O 3.24Å
380	E	56.1	Low	58.6	Low	45 Å²	45	79 Å²	79	21%	0.21	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-53.9	137.2	174.7	-65.7	159	122.4	0	0	110.4	M382 R501 R763	E380-M382 PolarHBondContact O-N 2.97Å; E380-R501 IonicContact OE2-NH1 3.67Å; E380-R501 PolarHBondContact OE2-NH1 2.85Å; E380-R763 WeakPolarHBondContact OE1-CD 3.35Å; E380-R763 IonicContact OE1-CZ 2.75Å; E380-R763 IonicContact OE1-NE 3.54Å; E380-R763 IonicContact OE1-NH1 2.78Å; E380-R763 PolarHBondContact OE1-NH1 2.95Å
381	S	50.2	Low	61	Low	16 Å²	16	78.1 Å²	78.1	11%	0.112	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70	128.2	168.6	-163.8	0	0	0	0	108.3	G379 K383 E766 K869	G379-S381 PolarHBondContact O-N 3.46Å; S381-K383 PolarHBondContact O-N 3.48Å; S381-E766 WeakPolarHBondContact CB-OE1 3.33Å; S381-E766 PolarHBondContact OG-OE1 2.96Å; S381-K869 PolarHBondContact OG-NZ 3.33Å
382	M	50.9	Low	63	Low	31 Å²	31	80.1 Å²	80.1	15%	0.153	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-72.3	123.2	178	-78.6	-159.5	76.7	0	0	110.4	E380 C384 Q505 A506 M509	E380-M382 PolarHBondContact O-N 2.97Å; M382-C384 PolarHBondContact O-N 2.83Å; M382-Q505 HydrophobicContact CG-CB 4.15Å; M382-Q505 VanDerWaalsContact SD-C 3.53Å; M382-Q505 HydrophobicContact SD-CB 3.46Å; M382-Q505 WeakPolarHBondContact SD-CB 3.15Å; M382-A506 HydrophobicContact CE-CB 3.55Å; M382-A506 HydrophobicContact SD-CB 4.47Å; M382-A506 PolarHBondContact SD-N 3.45Å; M382-M509 HydrophobicContact CE-CE 4.43Å; M382-M509 HydrophobicContact SD-CE 4.22Å
383	K	44.2	Very low	64.7	Low	164 Å²	164	71.6 Å²	71.6	71%	0.713	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-56.1	135.3	158.5	-68.1	-174	177.4	-176.1	0	108.8	S381 A385	S381-K383 PolarHBondContact O-N 3.48Å; K383-A385 PolarHBondContact O-N 3.15Å
384	C	42.1	Very low	66.4	Low	121 Å²	121	72.9 Å²	72.9	82%	0.818	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	133.7	177.7	-164.1	0	0	0	0	110	M382	M382-C384 PolarHBondContact O-N 2.83Å
385	A	49.4	Very low	67.2	Low	89 Å²	89	75.1 Å²	75.1	74%	0.736	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	64.3	179	0	0	0	0	0	115.7	K383	K383-A385 PolarHBondContact O-N 3.15Å
386	Q	55.2	Low	68.9	Low	113 Å²	113	73.3 Å²	73.3	53%	0.528	41%	0.406	S	S	.	.			trans	-75.7	121.6	152.7	-151.5	173.4	-1.6	0	0	108.2
387	E	69.7	Low	70.9	Confident	182 Å²	182	72.6 Å²	72.6	85%	0.85	40%	0.397	S	S	*	.			trans	-69.1	137.2	-175.3	-169.7	164.3	-149.3	0	0	111.4	V389	E387-V389 PolarHBondContact O-N 3.47Å
388	L	83.5	Confident	72.5	Confident	22 Å²	22	74.8 Å²	74.8	12%	0.115	40%	0.401	C	S	.	.			trans	-80.4	113	-177.7	-71.3	177.2	0	0	0	110.2	Y390 A506 I507 K510	L388-Y390 HydrophobicContact CB-CE2 3.83Å; L388-Y390 WeakPolarHBondContact O-CD2 3.38Å; L388-Y390 WeakPolarHBondContact O-CE2 3.34Å; L388-Y390 PolarHBondContact O-N 3.49Å; L388-A506 HydrophobicContact CD2-CB 3.73Å; L388-I507 HydrophobicContact CD1-CG1 3.92Å; L388-I507 HydrophobicContact CD2-CD1 4.48Å; L388-I507 HydrophobicContact CD2-CG1 3.82Å; L388-K510 HydrophobicContact CD1-CD 3.75Å
389	V	88.6	Confident	74.4	Confident	94 Å²	94	81 Å²	81	57%	0.57	42%	0.423	S	S	*	.			trans	-76.9	118.9	170.6	-170.5	0	0	0	0	109	E387 H391 C425	E387-V389 PolarHBondContact O-N 3.47Å; V389-H391 WeakPolarHBondContact CG1-NE2 3.45Å; V389-C425 WeakPolarHBondContact O-CA 3.41Å; V389-C425 WeakPolarHBondContact O-CB 3.23Å
390	Y	90.8	Very high	76.2	Confident	111 Å²	111	83 Å²	83	44%	0.435	43%	0.432	S	S	.	.			trans	-97.6	138.1	176	-63.4	-82	0	0	0	109.8	L388 E421 C425 K510	L388-Y390 HydrophobicContact CB-CE2 3.83Å; L388-Y390 WeakPolarHBondContact O-CD2 3.38Å; L388-Y390 WeakPolarHBondContact O-CE2 3.34Å; L388-Y390 PolarHBondContact O-N 3.49Å; Y390-E421 PolarHBondContact OH-OE2 2.71Å; Y390-C425 VanDerWaalsContact CD1-SG 3.58Å; Y390-C425 VanDerWaalsContact CE1-SG 3.58Å; Y390-K510 PolarHBondContact OH-NZ 2.91Å
391	H	92	Very high	78	Confident	66 Å²	66	80.9 Å²	80.9	31%	0.306	42%	0.422	S	S	.	.			trans	-122.5	129.5	-177.5	-62.8	-84.9	0	0	0	110.9	V389 K393 S424 M426	V389-H391 WeakPolarHBondContact CG1-NE2 3.45Å; H391-K393 PolarHBondContact O-NZ 2.87Å; H391-S424 PolarHBondContact N-O 2.95Å; H391-M426 WeakPolarHBondContact CB-O 3.37Å
392	D	89.5	Confident	80.1	Confident	144 Å²	144	83.7 Å²	83.7	77%	0.77	43%	0.43	S	S	*	.			trans	-69.8	147.5	178.9	-93.4	-48.7	0	0	0	113.7	R398	D392-R398 IonicContact OD1-NH2 2.68Å; D392-R398 PolarHBondContact OD1-NH2 3.03Å; D392-R398 VanDerWaalsContact OD1-NH2 3.14Å
393	K	91.7	Very high	82	Confident	15 Å²	15	87.7 Å²	87.7	7%	0.065	45%	0.448	C	S	.	.			trans	-156.4	143.9	-170.9	-60.3	-176.1	-169.9	69.4	0	110.1	H391 R398 I401 V423 S424 M426 W497	H391-K393 PolarHBondContact O-NZ 2.87Å; K393-R398 HydrophobicContact CB-CG 3.61Å; K393-R398 HydrophobicContact CD-CG 4.36Å; K393-R398 WeakPolarHBondContact O-CD 2.97Å; K393-R398 PolarHBondContact O-NE 3.43Å; K393-R398 PolarHBondContact O-NH1 3.4Å; K393-I401 HydrophobicContact CD-CD1 3.61Å; K393-V423 WeakPolarHBondContact CE-O 3.29Å; K393-V423 PolarHBondContact NZ-O 2.86Å; K393-S424 PolarHBondContact NZ-O 3.13Å; K393-M426 WeakPolarHBondContact CE-O 3.23Å; K393-M426 PolarHBondContact NZ-O 3.49Å; K393-W497 HydrophobicContact CB-CH2 4.5Å; K393-W497 HydrophobicContact CD-CD2 4.44Å; K393-W497 HydrophobicContact CD-CE3 4.04Å; K393-W497 HydrophobicContact CD-CH2 3.92Å; K393-W497 HydrophobicContact CD-CZ2 4.28Å; K393-W497 HydrophobicContact CD-CZ3 3.76Å; K393-W497 VanDerWaalsContact CE-CE3 3.4Å; K393-W497 HydrophobicContact CG-CH2 3.66Å; K393-W497 HydrophobicContact CG-CZ2 4.3Å; K393-W497 HydrophobicContact CG-CZ3 3.79Å
394	D	92.7	Very high	84.3	Confident	85 Å²	85	80 Å²	80	46%	0.455	42%	0.415	S	S	.	.			trans	-70.7	175.6	172.6	70.9	89.8	0	0	0	112.6	N396 S397 R398	D394-N396 VanDerWaalsContact OD1-CA 3.24Å; D394-N396 WeakPolarHBondContact OD1-CA 3.5Å; D394-N396 WeakPolarHBondContact OD1-CB 3.26Å; D394-N396 PolarHBondContact OD1-N 3.48Å; D394-S397 PolarHBondContact OD1-N 3.45Å; D394-S397 WeakPolarHBondContact OD2-CB 3.35Å; D394-S397 PolarHBondContact OD2-OG 2.83Å; D394-R398 VanDerWaalsContact O-CB 3.29Å; D394-R398 WeakPolarHBondContact O-CB 3.44Å; D394-R398 VanDerWaalsContact O-CG 3.24Å; D394-R398 WeakPolarHBondContact O-CG 3.46Å; D394-R398 PolarHBondContact O-N 3.22Å; D394-R398 VanDerWaalsContact O-N 3.07Å
395	A	91.2	Very high	86.7	Confident	78 Å²	78	74.2 Å²	74.2	65%	0.645	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.3	-176.6	0	0	0	0	0	114.8	R399	A395-R399 WeakPolarHBondContact O-CB 3.43Å; A395-R399 PolarHBondContact O-N 3.35Å
396	N	92	Very high	88.5	Confident	89 Å²	89	76.7 Å²	76.7	48%	0.476	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-53.4	171.9	-170.6	77.1	0	0	0	110.7	D394 R398 R399 Q400	D394-N396 VanDerWaalsContact OD1-CA 3.24Å; D394-N396 WeakPolarHBondContact OD1-CA 3.5Å; D394-N396 WeakPolarHBondContact OD1-CB 3.26Å; D394-N396 PolarHBondContact OD1-N 3.48Å; N396-R398 VanDerWaalsContact C-N 3.31Å; N396-R398 PolarHBondContact O-N 2.9Å; N396-R399 CarbonylContact O-C 3.53Å; N396-R399 VanDerWaalsContact O-CA 3.32Å; N396-R399 WeakPolarHBondContact O-CA 3.44Å; N396-R399 VanDerWaalsContact O-CB 3.27Å; N396-R399 WeakPolarHBondContact O-CB 3.47Å; N396-R399 PolarHBondContact O-N 3.23Å; N396-Q400 PolarHBondContact O-N 3.1Å
397	S	93	Very high	90	Very high	7 Å²	7	74.4 Å²	74.4	5%	0.049	36%	0.363	C	S	.	.	H	α-helix	trans	-55.6	-46.6	176.5	-61.2	0	0	0	0	111.4	D394 R399 Q400 I401	D394-S397 PolarHBondContact OD1-N 3.45Å; D394-S397 WeakPolarHBondContact OD2-CB 3.35Å; D394-S397 PolarHBondContact OD2-OG 2.83Å; S397-R399 PolarHBondContact O-N 2.89Å; S397-R399 VanDerWaalsContact O-N 3.1Å; S397-Q400 PolarHBondContact O-N 3.38Å; S397-I401 WeakPolarHBondContact O-CD1 3.17Å; S397-I401 VanDerWaalsContact O-CG1 3.23Å; S397-I401 WeakPolarHBondContact O-CG1 3.37Å; S397-I401 PolarHBondContact O-N 2.95Å
398	R	93.3	Very high	90.6	Very high	86 Å²	86	66.4 Å²	66.4	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-60.5	-20.5	174	-73.7	174.4	166.5	148.9	-2.1	113.5	D392 K393 D394 N396 R402 V423	D392-R398 IonicContact OD1-NH2 2.68Å; D392-R398 PolarHBondContact OD1-NH2 3.03Å; D392-R398 VanDerWaalsContact OD1-NH2 3.14Å; K393-R398 HydrophobicContact CB-CG 3.61Å; K393-R398 HydrophobicContact CD-CG 4.36Å; K393-R398 WeakPolarHBondContact O-CD 2.97Å; K393-R398 PolarHBondContact O-NE 3.43Å; K393-R398 PolarHBondContact O-NH1 3.4Å; D394-R398 VanDerWaalsContact O-CB 3.29Å; D394-R398 WeakPolarHBondContact O-CB 3.44Å; D394-R398 VanDerWaalsContact O-CG 3.24Å; D394-R398 WeakPolarHBondContact O-CG 3.46Å; D394-R398 PolarHBondContact O-N 3.22Å; D394-R398 VanDerWaalsContact O-N 3.07Å; N396-R398 VanDerWaalsContact C-N 3.31Å; N396-R398 PolarHBondContact O-N 2.9Å; R398-R402 WeakPolarHBondContact O-CB 3.49Å; R398-R402 PolarHBondContact O-NH1 2.89Å; R398-R402 PolarHBondContact O-NH2 2.91Å; R398-V423 HydrophobicContact CB-CG1 4.22Å; R398-V423 HydrophobicContact CG-CG1 4.12Å
399	R	92.8	Very high	90	Very high	142 Å²	142	70.7 Å²	70.7	54%	0.536	35%	0.349	S	S	.	.	H	α-helix	trans	-87.5	-50.8	174.2	-174.5	-171.3	-53.1	-154.9	4	111.2	A395 N396 S397 I401 R402 E403	A395-R399 WeakPolarHBondContact O-CB 3.43Å; A395-R399 PolarHBondContact O-N 3.35Å; N396-R399 CarbonylContact O-C 3.53Å; N396-R399 VanDerWaalsContact O-CA 3.32Å; N396-R399 WeakPolarHBondContact O-CA 3.44Å; N396-R399 VanDerWaalsContact O-CB 3.27Å; N396-R399 WeakPolarHBondContact O-CB 3.47Å; N396-R399 PolarHBondContact O-N 3.23Å; S397-R399 PolarHBondContact O-N 2.89Å; S397-R399 VanDerWaalsContact O-N 3.1Å; R399-I401 PolarHBondContact O-N 3.43Å; R399-R402 WeakPolarHBondContact O-CA 3.35Å; R399-R402 WeakPolarHBondContact O-CB 3.39Å; R399-R402 PolarHBondContact O-N 3.1Å; R399-E403 WeakPolarHBondContact CD-OE1 3.46Å; R399-E403 HydrophobicContact CG-CG 4.42Å; R399-E403 WeakPolarHBondContact CG-OE1 3.44Å; R399-E403 PolarHBondContact O-N 3.04Å
400	Q	92.2	Very high	89.1	Confident	43 Å²	43	67.7 Å²	67.7	20%	0.201	33%	0.33	C	S	.	.	H	α-helix	trans	-57.4	-46.4	-178.4	-177.6	152.9	-41	0	0	111.8	N396 S397 R402 E403 A404 G450 E451	N396-Q400 PolarHBondContact O-N 3.1Å; S397-Q400 PolarHBondContact O-N 3.38Å; Q400-R402 PolarHBondContact O-N 3.49Å; Q400-E403 PolarHBondContact O-N 3.27Å; Q400-A404 WeakPolarHBondContact O-CB 3.34Å; Q400-A404 PolarHBondContact O-N 2.87Å; Q400-G450 PolarHBondContact NE2-O 2.93Å; Q400-E451 PolarHBondContact NE2-O 2.74Å
401	I	93.5	Very high	88.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.9	-48.7	172.4	-59	163	0	0	0	111	K393 S397 R399 E403 A404 L405 V423 M426 W497	K393-I401 HydrophobicContact CD-CD1 3.61Å; S397-I401 WeakPolarHBondContact O-CD1 3.17Å; S397-I401 VanDerWaalsContact O-CG1 3.23Å; S397-I401 WeakPolarHBondContact O-CG1 3.37Å; S397-I401 PolarHBondContact O-N 2.95Å; R399-I401 PolarHBondContact O-N 3.43Å; I401-E403 VanDerWaalsContact C-N 3.3Å; I401-E403 PolarHBondContact O-N 2.85Å; I401-A404 PolarHBondContact O-N 2.97Å; I401-L405 HydrophobicContact CG2-CD1 3.71Å; I401-L405 HydrophobicContact CG2-CG 4.19Å; I401-L405 WeakPolarHBondContact O-CB 3.15Å; I401-L405 VanDerWaalsContact O-CG 3.26Å; I401-L405 WeakPolarHBondContact O-CG 3.47Å; I401-L405 PolarHBondContact O-N 2.61Å; I401-V423 HydrophobicContact CB-CG2 4.29Å; I401-V423 HydrophobicContact CD1-CG1 4.45Å; I401-V423 HydrophobicContact CG2-CB 4.47Å; I401-V423 HydrophobicContact CG2-CG2 3.77Å; I401-M426 HydrophobicContact CG2-CG 4.47Å; I401-M426 HydrophobicContact CG2-SD 3.37Å; I401-M426 WeakPolarHBondContact CG2-SD 3.39Å; I401-W497 HydrophobicContact CD1-CB 4.22Å; I401-W497 HydrophobicContact CD1-CD2 3.67Å; I401-W497 HydrophobicContact CD1-CE3 4.32Å; I401-W497 HydrophobicContact CD1-CG 3.56Å; I401-W497 HydrophobicContact CG1-CB 4.22Å; I401-W497 VanDerWaalsContact CG1-CD1 3.42Å; I401-W497 HydrophobicContact CG1-CD2 4.31Å; I401-W497 HydrophobicContact CG1-CG 3.71Å
402	R	93.2	Very high	88	Confident	75 Å²	75	64.3 Å²	64.3	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-35.6	-176.3	-167.7	-175.5	-62	99.5	6.4	112.3	R398 R399 Q400 R406 L419 V423	R398-R402 WeakPolarHBondContact O-CB 3.49Å; R398-R402 PolarHBondContact O-NH1 2.89Å; R398-R402 PolarHBondContact O-NH2 2.91Å; R399-R402 WeakPolarHBondContact O-CA 3.35Å; R399-R402 WeakPolarHBondContact O-CB 3.39Å; R399-R402 PolarHBondContact O-N 3.1Å; Q400-R402 PolarHBondContact O-N 3.49Å; R402-R406 WeakPolarHBondContact O-CB 3.36Å; R402-R406 WeakPolarHBondContact O-CD 3.45Å; R402-R406 WeakPolarHBondContact O-CG 3.49Å; R402-R406 PolarHBondContact O-N 3.32Å; R402-L419 HydrophobicContact CG-CD1 4.49Å; R402-L419 HydrophobicContact CG-CD2 3.7Å; R402-L419 HydrophobicContact CG-CG 4.04Å; R402-V423 HydrophobicContact CB-CG2 4.23Å
403	E	92.4	Very high	87.3	Confident	115 Å²	115	62.3 Å²	62.3	54%	0.537	31%	0.306	S	S	.	.	H	α-helix	trans	-75.4	-42.1	177	-71.9	174.5	-165.1	0	0	111.3	R399 Q400 I401 L405 R406 S407	R399-E403 WeakPolarHBondContact CD-OE1 3.46Å; R399-E403 HydrophobicContact CG-CG 4.42Å; R399-E403 WeakPolarHBondContact CG-OE1 3.44Å; R399-E403 PolarHBondContact O-N 3.04Å; Q400-E403 PolarHBondContact O-N 3.27Å; I401-E403 VanDerWaalsContact C-N 3.3Å; I401-E403 PolarHBondContact O-N 2.85Å; E403-L405 PolarHBondContact O-N 3.13Å; E403-R406 PolarHBondContact O-N 3.07Å; E403-S407 WeakPolarHBondContact O-CB 3.41Å; E403-S407 PolarHBondContact O-N 2.76Å
404	A	92.4	Very high	86.9	Confident	2 Å²	2	63 Å²	63	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-49	173.6	0	0	0	0	0	112.2	Q400 I401 R406 S407 N408 V449 G470 C472	Q400-A404 WeakPolarHBondContact O-CB 3.34Å; Q400-A404 PolarHBondContact O-N 2.87Å; I401-A404 PolarHBondContact O-N 2.97Å; A404-R406 PolarHBondContact O-N 2.93Å; A404-S407 PolarHBondContact O-N 2.75Å; A404-S407 PolarHBondContact O-OG 3.37Å; A404-N408 PolarHBondContact O-N 3.22Å; A404-V449 HydrophobicContact CB-CB 4.45Å; A404-V449 HydrophobicContact CB-CG1 3.49Å; A404-V449 VanDerWaalsContact CB-CG1 3.49Å; A404-V449 HydrophobicContact CB-CG2 4.07Å; A404-G470 WeakPolarHBondContact CB-O 3.22Å; A404-C472 HydrophobicContact CB-CB 4.21Å
405	L	90.9	Very high	86.3	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-37.6	178.7	-64.8	173.4	0	0	0	112.6	I401 E403 S407 N408 I411 K412 L419 V422 V423 L447 V449	I401-L405 HydrophobicContact CG2-CD1 3.71Å; I401-L405 HydrophobicContact CG2-CG 4.19Å; I401-L405 WeakPolarHBondContact O-CB 3.15Å; I401-L405 VanDerWaalsContact O-CG 3.26Å; I401-L405 WeakPolarHBondContact O-CG 3.47Å; I401-L405 PolarHBondContact O-N 2.61Å; E403-L405 PolarHBondContact O-N 3.13Å; L405-S407 VanDerWaalsContact C-N 3.32Å; L405-N408 PolarHBondContact O-N 2.89Å; L405-I411 HydrophobicContact CB-CG2 4.26Å; L405-I411 HydrophobicContact CD2-CD1 4.18Å; L405-I411 HydrophobicContact CD2-CG2 4.14Å; L405-K412 PolarHBondContact O-N 3.5Å; L405-L419 HydrophobicContact CB-CD1 3.84Å; L405-L419 HydrophobicContact CD1-CD1 3.7Å; L405-L419 HydrophobicContact CG-CD1 4.45Å; L405-V422 HydrophobicContact CD1-CG1 3.63Å; L405-V423 HydrophobicContact CD1-CG2 4.2Å; L405-L447 HydrophobicContact CD2-CD2 3.96Å; L405-V449 HydrophobicContact CD2-CG2 4.22Å
406	R	88.5	Confident	85.9	Confident	140 Å²	140	60.9 Å²	60.9	53%	0.528	30%	0.299	S	S	.	.	H	α-helix	trans	-70.9	-25.1	174	-77.1	173.4	173.2	174	-2.7	113.6	R402 E403 A404 K412 L419	R402-R406 WeakPolarHBondContact O-CB 3.36Å; R402-R406 WeakPolarHBondContact O-CD 3.45Å; R402-R406 WeakPolarHBondContact O-CG 3.49Å; R402-R406 PolarHBondContact O-N 3.32Å; E403-R406 PolarHBondContact O-N 3.07Å; A404-R406 PolarHBondContact O-N 2.93Å; R406-K412 VanDerWaalsContact O-CB 3.3Å; R406-K412 WeakPolarHBondContact O-CB 3.42Å; R406-L419 HydrophobicContact CG-CD2 3.85Å; R406-L419 VanDerWaalsContact NE-CD2 3.26Å
407	S	85.5	Confident	85.7	Confident	65 Å²	65	60.4 Å²	60.4	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-79	-19.5	174.9	80.8	0	0	0	0	113.2	E403 A404 L405	E403-S407 WeakPolarHBondContact O-CB 3.41Å; E403-S407 PolarHBondContact O-N 2.76Å; A404-S407 PolarHBondContact O-N 2.75Å; A404-S407 PolarHBondContact O-OG 3.37Å; L405-S407 VanDerWaalsContact C-N 3.32Å
408	N	83.6	Confident	85.4	Confident	14 Å²	14	61.3 Å²	61.3	8%	0.075	30%	0.302	C	S	.	.	S	Bend	trans	-78.4	125.7	-177.6	-175.9	-78.8	0	0	0	111.5	A404 L405 L410 I411 K412 C472 E475	A404-N408 PolarHBondContact O-N 3.22Å; L405-N408 PolarHBondContact O-N 2.89Å; N408-L410 PolarHBondContact O-N 2.96Å; N408-L410 VanDerWaalsContact O-N 3.07Å; N408-L410 WeakPolarHBondContact OD1-CA 3.28Å; N408-L410 WeakPolarHBondContact OD1-CB 3.42Å; N408-L410 PolarHBondContact OD1-N 2.78Å; N408-I411 HydrophobicContact CB-CB 4.4Å; N408-I411 PolarHBondContact O-N 2.9Å; N408-I411 PolarHBondContact OD1-N 2.93Å; N408-I411 VanDerWaalsContact OD1-N 3.15Å; N408-K412 VanDerWaalsContact O-CB 3.23Å; N408-K412 WeakPolarHBondContact O-CB 3.47Å; N408-K412 WeakPolarHBondContact O-CG 3.17Å; N408-K412 PolarHBondContact O-N 3.17Å; N408-C472 HydrophobicContact CB-CB 4.2Å; N408-E475 PolarHBondContact ND2-OE1 3.43Å
409	D	71.2	Confident	85.3	Confident	112 Å²	112	57.6 Å²	57.6	60%	0.599	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.2	-175	-89.8	-42.7	0	0	0	115	K412	D409-K412 VanDerWaalsContact O-CE 3.27Å; D409-K412 WeakPolarHBondContact O-CE 3.28Å; D409-K412 IonicContact OD1-NZ 3.79Å; D409-K412 PolarHBondContact OD1-NZ 3.19Å
410	L	69.2	Low	85.3	Confident	31 Å²	31	55.6 Å²	55.6	16%	0.162	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-35.5	-177.4	-58.1	167.3	0	0	0	112	N408 E475 L476 L479 Y480 I926 M930	N408-L410 PolarHBondContact O-N 2.96Å; N408-L410 VanDerWaalsContact O-N 3.07Å; N408-L410 WeakPolarHBondContact OD1-CA 3.28Å; N408-L410 WeakPolarHBondContact OD1-CB 3.42Å; N408-L410 PolarHBondContact OD1-N 2.78Å; L410-E475 HydrophobicContact CB-CG 4.38Å; L410-E475 HydrophobicContact CD1-CG 3.5Å; L410-E475 HydrophobicContact CG-CG 4.47Å; L410-L476 HydrophobicContact CD1-CD2 3.6Å; L410-L476 HydrophobicContact CD1-CG 4.32Å; L410-L479 HydrophobicContact CB-CD1 3.65Å; L410-L479 HydrophobicContact CD1-CD1 4.39Å; L410-Y480 HydrophobicContact CD1-CE2 4.46Å; L410-Y480 HydrophobicContact CD2-CE2 4.34Å; L410-I926 HydrophobicContact CD2-CD1 3.99Å; L410-M930 HydrophobicContact CD2-CE 3.27Å; L410-M930 HydrophobicContact CG-CE 4.5Å
411	I	79.6	Confident	85.2	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.036	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-18.1	-174.1	-57.1	-179.1	0	0	0	113.1	L405 N408 N413 L414 L447 E475 L479	L405-I411 HydrophobicContact CB-CG2 4.26Å; L405-I411 HydrophobicContact CD2-CD1 4.18Å; L405-I411 HydrophobicContact CD2-CG2 4.14Å; N408-I411 HydrophobicContact CB-CB 4.4Å; N408-I411 PolarHBondContact O-N 2.9Å; N408-I411 PolarHBondContact OD1-N 2.93Å; N408-I411 VanDerWaalsContact OD1-N 3.15Å; I411-N413 PolarHBondContact O-N 3.25Å; I411-L414 HydrophobicContact CG2-CD1 3.62Å; I411-L414 HydrophobicContact CG2-CG 3.86Å; I411-L414 WeakPolarHBondContact O-CG 3.43Å; I411-L414 PolarHBondContact O-N 2.83Å; I411-L447 HydrophobicContact CD1-CD1 4.08Å; I411-L447 HydrophobicContact CD1-CD2 3.61Å; I411-E475 HydrophobicContact CD1-CB 3.87Å; I411-E475 HydrophobicContact CG1-CB 4.45Å; I411-L479 HydrophobicContact CG1-CD1 4.35Å
412	K	80.2	Confident	85.2	Confident	99 Å²	99	54.6 Å²	54.6	43%	0.43	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-13.7	-179.5	66.2	-175.5	177.1	-169.4	0	117	L405 R406 N408 D409	L405-K412 PolarHBondContact O-N 3.5Å; R406-K412 VanDerWaalsContact O-CB 3.3Å; R406-K412 WeakPolarHBondContact O-CB 3.42Å; N408-K412 VanDerWaalsContact O-CB 3.23Å; N408-K412 WeakPolarHBondContact O-CB 3.47Å; N408-K412 WeakPolarHBondContact O-CG 3.17Å; N408-K412 PolarHBondContact O-N 3.17Å; D409-K412 VanDerWaalsContact O-CE 3.27Å; D409-K412 WeakPolarHBondContact O-CE 3.28Å; D409-K412 IonicContact OD1-NZ 3.79Å; D409-K412 PolarHBondContact OD1-NZ 3.19Å
413	N	75.2	Confident	85.2	Confident	102 Å²	102	51.1 Å²	51.1	55%	0.545	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-4	179.7	-61.5	-34.3	0	0	0	113.8	I411	I411-N413 PolarHBondContact O-N 3.25Å
414	L	82.7	Confident	85.3	Confident	30 Å²	30	46.8 Å²	46.8	16%	0.157	25%	0.25	C	S	.	.			trans	-58.9	136.4	172.9	-67.6	-170.9	0	0	0	110.9	I411 Q418 L419 V422 F504 M508	I411-L414 HydrophobicContact CG2-CD1 3.62Å; I411-L414 HydrophobicContact CG2-CG 3.86Å; I411-L414 WeakPolarHBondContact O-CG 3.43Å; I411-L414 PolarHBondContact O-N 2.83Å; L414-Q418 HydrophobicContact CB-CB 4.07Å; L414-Q418 HydrophobicContact CD2-CB 4.2Å; L414-Q418 HydrophobicContact CG-CB 4.49Å; L414-L419 HydrophobicContact CB-CB 4.27Å; L414-V422 HydrophobicContact CD1-CG2 4.05Å; L414-F504 HydrophobicContact CD1-CE2 4.35Å; L414-F504 HydrophobicContact CD2-CE2 4.47Å; L414-M508 HydrophobicContact CD1-CE 4.02Å; L414-M508 HydrophobicContact CD2-CE 3.6Å; L414-M508 HydrophobicContact CD2-SD 3.5Å; L414-M508 WeakPolarHBondContact CD2-SD 3.34Å; L414-M508 HydrophobicContact CG-CE 4.47Å
415	D	79.4	Confident	85.4	Confident	41 Å²	41	46.9 Å²	46.9	22%	0.219	25%	0.251	C	S	.	.			trans	-72.5	174	173.6	76	39.1	0	0	0	112.5	V417 Q418 L419 R515	D415-V417 VanDerWaalsContact C-N 3.25Å; D415-V417 PolarHBondContact O-N 2.88Å; D415-V417 PolarHBondContact OD1-N 2.78Å; D415-Q418 PolarHBondContact O-N 3.16Å; D415-Q418 PolarHBondContact OD1-N 3.29Å; D415-L419 WeakPolarHBondContact O-CB 3.39Å; D415-L419 PolarHBondContact O-N 2.87Å; D415-R515 IonicContact OD2-CZ 3.21Å; D415-R515 IonicContact OD2-NH1 2.77Å; D415-R515 PolarHBondContact OD2-NH1 2.92Å
416	A	84.2	Confident	85.5	Confident	77 Å²	77	46.9 Å²	46.9	64%	0.636	25%	0.251	S	S	*	.	H	α-helix	trans	-65	-26.4	-174.1	0	0	0	0	0	113.8	Q420	A416-Q420 WeakPolarHBondContact O-CB 3.46Å; A416-Q420 PolarHBondContact O-N 2.86Å
417	V	86	Confident	85.8	Confident	79 Å²	79	42.7 Å²	42.7	48%	0.479	24%	0.237	S	C	.	.	H	α-helix	trans	-82.6	-50.4	178.6	-176	0	0	0	0	109.2	D415 L419 Q420 E421 T511	D415-V417 VanDerWaalsContact C-N 3.25Å; D415-V417 PolarHBondContact O-N 2.88Å; D415-V417 PolarHBondContact OD1-N 2.78Å; V417-L419 VanDerWaalsContact C-N 3.28Å; V417-L419 PolarHBondContact O-N 3.03Å; V417-Q420 WeakPolarHBondContact O-CA 3.22Å; V417-Q420 WeakPolarHBondContact O-CB 3.11Å; V417-Q420 PolarHBondContact O-N 3.42Å; V417-E421 PolarHBondContact O-N 3.21Å; V417-T511 HydrophobicContact CG1-CG2 3.98Å
418	Q	88.4	Confident	86.3	Confident	27 Å²	27	44.1 Å²	44.1	13%	0.126	24%	0.237	C	C	.	.	H	α-helix	trans	-51.4	-46.9	173.8	-74.1	175.3	-21.2	0	0	112.3	L414 D415 Q420 V422 M508 T511	L414-Q418 HydrophobicContact CB-CB 4.07Å; L414-Q418 HydrophobicContact CD2-CB 4.2Å; L414-Q418 HydrophobicContact CG-CB 4.49Å; D415-Q418 PolarHBondContact O-N 3.16Å; D415-Q418 PolarHBondContact OD1-N 3.29Å; Q418-Q420 VanDerWaalsContact C-N 3.34Å; Q418-Q420 PolarHBondContact O-N 2.92Å; Q418-V422 WeakPolarHBondContact O-CB 3.42Å; Q418-V422 VanDerWaalsContact O-CG2 3.3Å; Q418-V422 WeakPolarHBondContact O-CG2 3.3Å; Q418-V422 PolarHBondContact O-N 3.29Å; Q418-M508 HydrophobicContact CB-CE 4.11Å; Q418-M508 HydrophobicContact CB-SD 4.22Å; Q418-M508 HydrophobicContact CG-CE 4.33Å; Q418-M508 HydrophobicContact CG-SD 3.89Å; Q418-T511 HydrophobicContact CG-CG2 4.36Å; Q418-T511 VanDerWaalsContact CG-OG1 3.27Å; Q418-T511 WeakPolarHBondContact CG-OG1 3.19Å
419	L	90.5	Very high	86.8	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-69.9	-28.6	178.6	-176	61.4	0	0	0	112.8	R402 L405 R406 L414 D415 V417 V423	R402-L419 HydrophobicContact CG-CD1 4.49Å; R402-L419 HydrophobicContact CG-CD2 3.7Å; R402-L419 HydrophobicContact CG-CG 4.04Å; L405-L419 HydrophobicContact CB-CD1 3.84Å; L405-L419 HydrophobicContact CD1-CD1 3.7Å; L405-L419 HydrophobicContact CG-CD1 4.45Å; R406-L419 HydrophobicContact CG-CD2 3.85Å; R406-L419 VanDerWaalsContact NE-CD2 3.26Å; L414-L419 HydrophobicContact CB-CB 4.27Å; D415-L419 WeakPolarHBondContact O-CB 3.39Å; D415-L419 PolarHBondContact O-N 2.87Å; V417-L419 VanDerWaalsContact C-N 3.28Å; V417-L419 PolarHBondContact O-N 3.03Å; L419-V423 HydrophobicContact CD1-CG2 4.42Å; L419-V423 WeakPolarHBondContact O-CB 3.26Å; L419-V423 WeakPolarHBondContact O-CG2 3.3Å; L419-V423 PolarHBondContact O-N 2.99Å; L419-V423 VanDerWaalsContact O-N 3.16Å
420	Q	91.7	Very high	88	Confident	100 Å²	100	46.5 Å²	46.5	47%	0.467	25%	0.25	S	S	.	.	H	α-helix	trans	-72.2	-47	174.4	-174.7	-175.5	-71.7	0	0	111.3	A416 V417 Q418 V423 S424	A416-Q420 WeakPolarHBondContact O-CB 3.46Å; A416-Q420 PolarHBondContact O-N 2.86Å; V417-Q420 WeakPolarHBondContact O-CA 3.22Å; V417-Q420 WeakPolarHBondContact O-CB 3.11Å; V417-Q420 PolarHBondContact O-N 3.42Å; Q418-Q420 VanDerWaalsContact C-N 3.34Å; Q418-Q420 PolarHBondContact O-N 2.92Å; Q420-V423 PolarHBondContact O-N 2.93Å; Q420-S424 WeakPolarHBondContact O-CB 3.29Å; Q420-S424 PolarHBondContact O-N 3.28Å; Q420-S424 PolarHBondContact O-OG 2.87Å
421	E	91.8	Very high	89.2	Confident	21 Å²	21	45.4 Å²	45.4	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-46.9	176.8	-68	-64.6	86.7	0	0	110.4	Y390 V417 V423 S424 C425 I507 K510 T511	Y390-E421 PolarHBondContact OH-OE2 2.71Å; V417-E421 PolarHBondContact O-N 3.21Å; E421-V423 PolarHBondContact O-N 2.92Å; E421-S424 WeakPolarHBondContact O-CA 3.34Å; E421-S424 WeakPolarHBondContact O-CB 3.4Å; E421-S424 PolarHBondContact O-N 3Å; E421-C425 PolarHBondContact O-N 3.4Å; E421-C425 PolarHBondContact O-SG 3.42Å; E421-I507 HydrophobicContact CB-CB 4.43Å; E421-I507 HydrophobicContact CB-CD1 4.21Å; E421-I507 HydrophobicContact CB-CG1 4.08Å; E421-I507 HydrophobicContact CB-CG2 3.47Å; E421-I507 VanDerWaalsContact CB-CG2 3.47Å; E421-I507 HydrophobicContact CG-CG2 4.26Å; E421-K510 IonicContact OE2-NZ 2.74Å; E421-K510 PolarHBondContact OE2-NZ 2.7Å; E421-T511 HydrophobicContact CG-CG2 4.17Å
422	V	92.1	Very high	90	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-56.9	-49.6	176.7	163.9	0	0	0	0	111.9	L405 L414 Q418 S424 C425 M426 L499 F504 I507 M508	L405-V422 HydrophobicContact CD1-CG1 3.63Å; L414-V422 HydrophobicContact CD1-CG2 4.05Å; Q418-V422 WeakPolarHBondContact O-CB 3.42Å; Q418-V422 VanDerWaalsContact O-CG2 3.3Å; Q418-V422 WeakPolarHBondContact O-CG2 3.3Å; Q418-V422 PolarHBondContact O-N 3.29Å; V422-S424 PolarHBondContact O-N 3.12Å; V422-C425 PolarHBondContact O-N 2.77Å; V422-M426 WeakPolarHBondContact O-CG 3.49Å; V422-M426 PolarHBondContact O-N 3.02Å; V422-L499 HydrophobicContact CG1-CD2 3.83Å; V422-L499 HydrophobicContact CG2-CD2 4.34Å; V422-F504 HydrophobicContact CG2-CD2 4.14Å; V422-F504 HydrophobicContact CG2-CE2 4.5Å; V422-I507 HydrophobicContact CB-CD1 4.49Å; V422-I507 HydrophobicContact CG2-CD1 3.87Å; V422-I507 HydrophobicContact CG2-CG2 4.23Å; V422-M508 HydrophobicContact CG2-CE 3.71Å
423	V	94	Very high	90.7	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-32.7	176.9	168.9	0	0	0	0	111.7	K393 R398 I401 R402 L405 L419 Q420 E421	K393-V423 WeakPolarHBondContact CE-O 3.29Å; K393-V423 PolarHBondContact NZ-O 2.86Å; R398-V423 HydrophobicContact CB-CG1 4.22Å; R398-V423 HydrophobicContact CG-CG1 4.12Å; I401-V423 HydrophobicContact CB-CG2 4.29Å; I401-V423 HydrophobicContact CD1-CG1 4.45Å; I401-V423 HydrophobicContact CG2-CB 4.47Å; I401-V423 HydrophobicContact CG2-CG2 3.77Å; R402-V423 HydrophobicContact CB-CG2 4.23Å; L405-V423 HydrophobicContact CD1-CG2 4.2Å; L419-V423 HydrophobicContact CD1-CG2 4.42Å; L419-V423 WeakPolarHBondContact O-CB 3.26Å; L419-V423 WeakPolarHBondContact O-CG2 3.3Å; L419-V423 PolarHBondContact O-N 2.99Å; L419-V423 VanDerWaalsContact O-N 3.16Å; Q420-V423 PolarHBondContact O-N 2.93Å; E421-V423 PolarHBondContact O-N 2.92Å
424	S	93.6	Very high	91.6	Very high	23 Å²	23	45.3 Å²	45.3	16%	0.161	26%	0.259	C	S	.	.	H	α-helix	trans	-75.4	-35.9	-179.8	-53.5	0	0	0	0	112.3	H391 K393 Q420 E421 V422	H391-S424 PolarHBondContact N-O 2.95Å; K393-S424 PolarHBondContact NZ-O 3.13Å; Q420-S424 WeakPolarHBondContact O-CB 3.29Å; Q420-S424 PolarHBondContact O-N 3.28Å; Q420-S424 PolarHBondContact O-OG 2.87Å; E421-S424 WeakPolarHBondContact O-CA 3.34Å; E421-S424 WeakPolarHBondContact O-CB 3.4Å; E421-S424 PolarHBondContact O-N 3Å; V422-S424 PolarHBondContact O-N 3.12Å
425	C	94.3	Very high	92.2	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-89.7	-5.6	-178.2	-53.7	0	0	0	0	115.7	V389 Y390 E421 V422 L499 C503 I507	V389-C425 WeakPolarHBondContact O-CA 3.41Å; V389-C425 WeakPolarHBondContact O-CB 3.23Å; Y390-C425 VanDerWaalsContact CD1-SG 3.58Å; Y390-C425 VanDerWaalsContact CE1-SG 3.58Å; E421-C425 PolarHBondContact O-N 3.4Å; E421-C425 PolarHBondContact O-SG 3.42Å; V422-C425 PolarHBondContact O-N 2.77Å; C425-L499 HydrophobicContact CB-CD1 4.27Å; C425-C503 WeakPolarHBondContact CB-SG 3.48Å; C425-I507 HydrophobicContact CB-CD1 4.12Å
426	M	94.7	Very high	92.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.277	C	S	.	.			trans	-66.1	139	171.1	-53	-160.7	73.3	0	0	110.9	H391 K393 I401 V422 V449 W497 V498 L499	H391-M426 WeakPolarHBondContact CB-O 3.37Å; K393-M426 WeakPolarHBondContact CE-O 3.23Å; K393-M426 PolarHBondContact NZ-O 3.49Å; I401-M426 HydrophobicContact CG2-CG 4.47Å; I401-M426 HydrophobicContact CG2-SD 3.37Å; I401-M426 WeakPolarHBondContact CG2-SD 3.39Å; V422-M426 WeakPolarHBondContact O-CG 3.49Å; V422-M426 PolarHBondContact O-N 3.02Å; M426-V449 HydrophobicContact CE-CG2 4.2Å; M426-V449 HydrophobicContact SD-CG2 4.42Å; M426-W497 HydrophobicContact CB-CB 4.1Å; M426-W497 HydrophobicContact CB-CE3 4.46Å; M426-W497 HydrophobicContact CE-CB 3.83Å; M426-W497 WeakPolarHBondContact CE-O 3.4Å; M426-W497 HydrophobicContact SD-CB 4.02Å; M426-V498 CarbonylContact C-O 3.59Å; M426-V498 WeakPolarHBondContact CA-O 3.44Å; M426-V498 WeakPolarHBondContact CB-O 3.47Å; M426-L499 HydrophobicContact CE-CB 3.81Å; M426-L499 HydrophobicContact CG-CB 4.12Å; M426-L499 HydrophobicContact CG-CD1 4.18Å
427	H	94.4	Very high	93.3	Very high	52 Å²	52	46.7 Å²	46.7	24%	0.241	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	157	172.9	62.2	-108	0	0	0	112	W497 V498 E500	H427-W497 CarbonylContact O-C 3.59Å; H427-W497 WeakPolarHBondContact O-CA 3.43Å; H427-V498 PolarHBondContact N-O 3.11Å; H427-V498 PolarHBondContact O-N 2.82Å; H427-E500 IonicContact CE1-OE1 3.62Å
428	E	95.5	Very high	93.7	Very high	95 Å²	95	43.2 Å²	43.2	44%	0.444	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	140.7	176.9	-170.9	167.7	-150.7	0	0	111.3	R495 W497	E428-R495 WeakPolarHBondContact OE1-CD 3.3Å; E428-R495 IonicContact OE1-CZ 3.79Å; E428-R495 IonicContact OE1-NE 3.49Å; E428-R495 PolarHBondContact OE1-NE 2.95Å; E428-W497 HydrophobicContact CB-CE3 4.09Å; E428-W497 HydrophobicContact CB-CH2 3.96Å; E428-W497 HydrophobicContact CB-CZ3 3.65Å; E428-W497 HydrophobicContact CG-CH2 4.5Å
429	Q	94.7	Very high	93.8	Very high	81 Å²	81	47.8 Å²	47.8	38%	0.379	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	125.3	169.7	-178.2	-178.4	5.6	0	0	110.1	V431 V496 V498	Q429-V431 HydrophobicContact CG-CG2 4.38Å; Q429-V496 HydrophobicContact CB-CG2 4.04Å; Q429-V496 PolarHBondContact N-O 2.88Å; Q429-V496 WeakPolarHBondContact O-CG2 3.24Å; Q429-V496 PolarHBondContact O-N 2.95Å; Q429-V498 HydrophobicContact CB-CG2 3.6Å
430	T	95.7	Very high	93.8	Very high	95 Å²	95	50.9 Å²	50.9	58%	0.583	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	138.3	167.5	-51.9	0	0	0	0	110.2
431	V	94.6	Very high	93.4	Very high	8 Å²	8	47.9 Å²	47.9	5%	0.048	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119	178.5	-178.6	0	0	0	0	108.7	Q429 C435 I437 A490 A494 V496	Q429-V431 HydrophobicContact CG-CG2 4.38Å; V431-C435 HydrophobicContact CG1-CB 3.79Å; V431-I437 HydrophobicContact CB-CD1 4.44Å; V431-I437 HydrophobicContact CB-CG1 4.43Å; V431-I437 HydrophobicContact CG1-CD1 4.22Å; V431-I437 HydrophobicContact CG1-CG1 3.81Å; V431-I437 HydrophobicContact CG2-CD1 4.13Å; V431-I437 HydrophobicContact CG2-CG1 4.08Å; V431-A490 HydrophobicContact CG1-CB 3.76Å; V431-A494 PolarHBondContact N-O 2.76Å; V431-A494 PolarHBondContact O-N 3.37Å; V431-V496 HydrophobicContact CG2-CG2 4.14Å
432	P	96.1	Very high	93.1	Very high	70 Å²	70	50.3 Å²	50.3	46%	0.455	27%	0.271	S	S	.	.			trans	-66.1	156.3	177.2	-21.9	33.3	0	0	0	113.6	N434 C435 D493	P432-N434 PolarHBondContact O-N 2.73Å; P432-C435 VanDerWaalsContact O-CB 3.32Å; P432-C435 WeakPolarHBondContact O-CB 3.44Å; P432-C435 PolarHBondContact O-N 2.9Å; P432-C435 VanDerWaalsContact O-N 3.13Å; P432-D493 VanDerWaalsContact CA-OD1 3.29Å; P432-D493 WeakPolarHBondContact CA-OD1 3.34Å
433	A	95.5	Very high	92.4	Very high	38 Å²	38	55.9 Å²	55.9	31%	0.314	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	139.2	172.8	0	0	0	0	0	111.8	C435 T492 D493	A433-C435 PolarHBondContact O-N 3.13Å; A433-T492 WeakPolarHBondContact CA-O 3.49Å; A433-D493 PolarHBondContact N-OD1 3.05Å
434	N	93.4	Very high	91.3	Very high	99 Å²	99	55.9 Å²	55.9	53%	0.529	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-0.8	-175.9	-66.7	-85.5	0	0	0	117.5	P432 K489 A490	P432-N434 PolarHBondContact O-N 2.73Å; N434-K489 VanDerWaalsContact CA-CE 3.46Å; N434-K489 VanDerWaalsContact O-CE 3.3Å; N434-K489 WeakPolarHBondContact O-CE 3.35Å; N434-K489 WeakPolarHBondContact OD1-CE 3.22Å; N434-K489 PolarHBondContact OD1-NZ 2.96Å; N434-A490 WeakPolarHBondContact CA-O 3.5Å; N434-A490 PolarHBondContact N-O 2.93Å
435	C	95.5	Very high	90.6	Very high	54 Å²	54	55.9 Å²	55.9	37%	0.365	31%	0.305	S	S	.	.			trans	-72.7	148	171.8	-69.3	0	0	0	0	112.6	V431 P432 A433 K489 A490	V431-C435 HydrophobicContact CG1-CB 3.79Å; P432-C435 VanDerWaalsContact O-CB 3.32Å; P432-C435 WeakPolarHBondContact O-CB 3.44Å; P432-C435 PolarHBondContact O-N 2.9Å; P432-C435 VanDerWaalsContact O-N 3.13Å; A433-C435 PolarHBondContact O-N 3.13Å; C435-K489 CarbonylContact O-C 3.42Å; C435-K489 WeakPolarHBondContact O-CA 3.42Å; C435-K489 WeakPolarHBondContact O-CG 3.44Å; C435-A490 PolarHBondContact O-N 2.89Å
436	Y	93.3	Very high	90.4	Very high	101 Å²	101	58.9 Å²	58.9	40%	0.396	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129	171.7	-76.8	-103.5	0	0	0	110.1	R439 K489	Y436-R439 HydrophobicContact CD1-CG 4.08Å; Y436-R439 VanDerWaalsContact CD2-NH1 3.26Å; Y436-R439 HydrophobicContact CG-CG 4.28Å; Y436-R439 VanDerWaalsContact CG-NH1 3.32Å; Y436-K489 HydrophobicContact CD1-CB 4.14Å; Y436-K489 HydrophobicContact CD2-CG 4.24Å; Y436-K489 HydrophobicContact CE1-CB 4.2Å; Y436-K489 HydrophobicContact CE2-CD 4.02Å; Y436-K489 HydrophobicContact CE2-CG 4.24Å; Y436-K489 HydrophobicContact CG-CB 4.38Å; Y436-K489 HydrophobicContact CG-CG 4.43Å
437	I	93.9	Very high	90.2	Very high	21 Å²	21	59 Å²	59	11%	0.108	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-33.5	171.7	-52.1	179.1	0	0	0	109.7	V431 Y448 F455 F473 V488 V496	V431-I437 HydrophobicContact CB-CD1 4.44Å; V431-I437 HydrophobicContact CB-CG1 4.43Å; V431-I437 HydrophobicContact CG1-CD1 4.22Å; V431-I437 HydrophobicContact CG1-CG1 3.81Å; V431-I437 HydrophobicContact CG2-CD1 4.13Å; V431-I437 HydrophobicContact CG2-CG1 4.08Å; I437-Y448 HydrophobicContact CG2-CD1 3.89Å; I437-Y448 HydrophobicContact CG2-CD2 3.92Å; I437-Y448 HydrophobicContact CG2-CE1 3.67Å; I437-Y448 HydrophobicContact CG2-CE2 3.69Å; I437-Y448 HydrophobicContact CG2-CG 4.02Å; I437-F455 HydrophobicContact CD1-CD1 3.57Å; I437-F455 HydrophobicContact CD1-CE1 3.6Å; I437-F473 HydrophobicContact CD1-CE2 4.41Å; I437-F473 HydrophobicContact CD1-CZ 4.05Å; I437-F473 HydrophobicContact CG2-CE2 4.09Å; I437-V488 PolarHBondContact N-O 2.91Å; I437-V496 HydrophobicContact CD1-CG1 4.14Å
438	I	93.6	Very high	90.2	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.036	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.9	178.4	-63.6	-178.7	0	0	0	107.9	Y448 F473 R484 A486 S487 V488	I438-Y448 HydrophobicContact CD1-CD2 4.03Å; I438-Y448 HydrophobicContact CD1-CE2 3.97Å; I438-Y448 HydrophobicContact CG1-CD2 4.32Å; I438-Y448 HydrophobicContact CG1-CE2 3.85Å; I438-F473 HydrophobicContact CD1-CD2 4.01Å; I438-F473 HydrophobicContact CD1-CE2 4.4Å; I438-R484 HydrophobicContact CG2-CB 3.69Å; I438-R484 HydrophobicContact CG2-CG 3.62Å; I438-A486 VanDerWaalsContact CG2-O 3.23Å; I438-A486 WeakPolarHBondContact CG2-O 3.45Å; I438-S487 CarbonylContact O-C 3.54Å; I438-S487 VanDerWaalsContact O-CA 3.29Å; I438-S487 WeakPolarHBondContact O-CA 3.4Å; I438-V488 HydrophobicContact CB-CB 4.02Å; I438-V488 HydrophobicContact CB-CG2 4.16Å; I438-V488 HydrophobicContact CD1-CB 4.48Å; I438-V488 HydrophobicContact CD1-CG2 4.08Å; I438-V488 HydrophobicContact CG1-CB 4.41Å; I438-V488 HydrophobicContact CG1-CG2 4.47Å; I438-V488 PolarHBondContact N-O 2.79Å; I438-V488 VanDerWaalsContact N-O 3.11Å; I438-V488 PolarHBondContact O-N 2.91Å
439	R	92.1	Very high	90.2	Very high	123 Å²	123	52.7 Å²	52.7	46%	0.464	29%	0.288	S	S	.	.			trans	-110.9	150	162.1	-45.5	177.8	173.1	-77.9	-0.6	109.6	Y436 D442 R484	Y436-R439 HydrophobicContact CD1-CG 4.08Å; Y436-R439 VanDerWaalsContact CD2-NH1 3.26Å; Y436-R439 HydrophobicContact CG-CG 4.28Å; Y436-R439 VanDerWaalsContact CG-NH1 3.32Å; R439-D442 VanDerWaalsContact CB-OD2 3.23Å; R439-D442 WeakPolarHBondContact CB-OD2 3.23Å; R439-D442 PolarHBondContact N-OD2 2.93Å; R439-R484 WeakPolarHBondContact O-CB 3.25Å
440	E	90.3	Very high	90.2	Very high	72 Å²	72	48.8 Å²	48.8	34%	0.336	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	135.2	173.8	-173.9	174.8	-176.3	0	0	110.5	K459 G460 R484 S487	E440-K459 WeakPolarHBondContact OE1-CE 3.29Å; E440-K459 WeakPolarHBondContact OE1-CG 3.36Å; E440-K459 VanDerWaalsContact OE2-CA 3.3Å; E440-K459 WeakPolarHBondContact OE2-CA 3.41Å; E440-K459 WeakPolarHBondContact OE2-CG 3.09Å; E440-G460 PolarHBondContact OE2-N 2.9Å; E440-R484 WeakPolarHBondContact CA-O 3.05Å; E440-S487 PolarHBondContact N-OG 2.89Å
441	G	83.4	Confident	90.1	Very high	38 Å²	38	44.9 Å²	44.9	39%	0.392	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	-17.1	-177.9	0	0	0	0	0	115.7	K483 R484	G441-K483 WeakPolarHBondContact O-CD 3.41Å; G441-K483 PolarHBondContact O-NZ 3.1Å; G441-R484 PolarHBondContact N-O 2.96Å
442	D	85.6	Confident	90.1	Very high	71 Å²	71	49 Å²	49	38%	0.38	26%	0.264	S	S	.	.	S	Bend	trans	-61.6	154.4	172.5	-68.4	-9.6	0	0	0	111.5	R439 K483 R484	R439-D442 VanDerWaalsContact CB-OD2 3.23Å; R439-D442 WeakPolarHBondContact CB-OD2 3.23Å; R439-D442 PolarHBondContact N-OD2 2.93Å; D442-K483 CarbonylContact O-C 3.54Å; D442-K483 WeakPolarHBondContact O-CA 3.47Å; D442-R484 HydrophobicContact CB-CB 4.39Å; D442-R484 HydrophobicContact CB-CG 3.94Å; D442-R484 WeakPolarHBondContact O-CG 3.34Å; D442-R484 PolarHBondContact O-N 2.93Å
443	D	75.9	Confident	89.9	Confident	119 Å²	119	46.7 Å²	46.7	64%	0.636	25%	0.253	S	S	*	.	B	Isolated β-bridge	trans	-83.6	118	171.5	-61.8	-61	0	0	0	110.4	K483	D443-K483 VanDerWaalsContact OD1-CE 3.26Å; D443-K483 WeakPolarHBondContact OD1-CE 3.17Å; D443-K483 WeakPolarHBondContact OD1-CG 3.36Å; D443-K483 IonicContact OD1-NZ 3.14Å; D443-K483 PolarHBondContact OD1-NZ 2.84Å; D443-K483 IonicContact OD2-NZ 2.61Å; D443-K483 PolarHBondContact OD2-NZ 3.43Å
444	G	71	Confident	90	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.01	26%	0.258	C	S	.	.			trans	-98.8	96.2	-165.1	0	0	0	0	0	115.4	A477 R501	G444-A477 CarbonylContact O-C 3.51Å; G444-A477 VanDerWaalsContact O-C 3.27Å; G444-A477 WeakPolarHBondContact O-CB 3.41Å; G444-A477 VanDerWaalsContact O-O 3.14Å; G444-R501 PolarHBondContact O-NH2 3.19Å; G444-R501 VanDerWaalsContact O-NH2 3.11Å
445	G	80	Confident	90.1	Very high	24 Å²	24	44.4 Å²	44.4	25%	0.247	23%	0.233	C	C	.	.			trans	-83.3	-6.2	175.4	0	0	0	0	0	116.6	R501	G445-R501 WeakPolarHBondContact O-CB 3.37Å; G445-R501 PolarHBondContact O-N 2.98Å
446	H	89.3	Confident	90.1	Very high	68 Å²	68	43.8 Å²	43.8	32%	0.315	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142	-164.6	-56.1	102.6	0	0	0	114.5	Y448 R484 V498 L499	H446-Y448 HydrophobicContact CB-CE1 4.32Å; H446-Y448 HydrophobicContact CB-CE2 3.94Å; H446-Y448 WeakPolarHBondContact CB-OH 3.45Å; H446-R484 VanDerWaalsContact O-CZ 3.28Å; H446-R484 PolarHBondContact O-NH1 2.91Å; H446-R484 PolarHBondContact O-NH2 3.25Å; H446-V498 HydrophobicContact CB-CG1 4.15Å; H446-L499 WeakPolarHBondContact CA-O 3.13Å
447	L	91.8	Very high	90.1	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.7	166.4	164.1	69.7	0	0	0	109.6	L405 I411 E475 L478 V498 L499	L405-L447 HydrophobicContact CD2-CD2 3.96Å; I411-L447 HydrophobicContact CD1-CD1 4.08Å; I411-L447 HydrophobicContact CD1-CD2 3.61Å; L447-E475 HydrophobicContact CD1-CB 3.79Å; L447-L478 HydrophobicContact CB-CB 4.35Å; L447-L478 HydrophobicContact CB-CD1 3.83Å; L447-L478 HydrophobicContact CB-CD2 3.9Å; L447-L478 HydrophobicContact CB-CG 4.25Å; L447-L478 HydrophobicContact CD2-CD2 4.06Å; L447-V498 CarbonylContact O-C 3.55Å; L447-V498 WeakPolarHBondContact O-CA 3.26Å; L447-L499 HydrophobicContact CB-CB 4.29Å; L447-L499 HydrophobicContact CD2-CB 4.38Å; L447-L499 HydrophobicContact CD2-CD2 4.06Å; L447-L499 PolarHBondContact N-O 3.46Å; L447-L499 PolarHBondContact O-N 2.73Å
448	Y	94.4	Very high	90.1	Very high	15 Å²	15	38.8 Å²	38.8	6%	0.059	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.7	178.3	-55.5	-82.3	0	0	0	112.4	I437 I438 H446 C472 F473 V496 W497 V498	I437-Y448 HydrophobicContact CG2-CD1 3.89Å; I437-Y448 HydrophobicContact CG2-CD2 3.92Å; I437-Y448 HydrophobicContact CG2-CE1 3.67Å; I437-Y448 HydrophobicContact CG2-CE2 3.69Å; I437-Y448 HydrophobicContact CG2-CG 4.02Å; I438-Y448 HydrophobicContact CD1-CD2 4.03Å; I438-Y448 HydrophobicContact CD1-CE2 3.97Å; I438-Y448 HydrophobicContact CG1-CD2 4.32Å; I438-Y448 HydrophobicContact CG1-CE2 3.85Å; H446-Y448 HydrophobicContact CB-CE1 4.32Å; H446-Y448 HydrophobicContact CB-CE2 3.94Å; H446-Y448 WeakPolarHBondContact CB-OH 3.45Å; Y448-C472 CarbonylContact O-C 3.49Å; Y448-C472 WeakPolarHBondContact O-CA 3.35Å; Y448-F473 HydrophobicContact CD2-CD2 4Å; Y448-F473 AromaticContact CD2-CE2 3.73Å; Y448-F473 HydrophobicContact CD2-CE2 3.73Å; Y448-F473 HydrophobicContact CG-CD2 4.34Å; Y448-F473 AromaticContact CG-CE2 3.81Å; Y448-F473 HydrophobicContact CG-CE2 3.81Å; Y448-F473 HydrophobicContact CG-CZ 4.2Å; Y448-F473 PolarHBondContact N-O 2.91Å; Y448-F473 PolarHBondContact O-N 2.93Å; Y448-V496 HydrophobicContact CD1-CB 4.42Å; Y448-V496 HydrophobicContact CD1-CG2 3.89Å; Y448-V496 HydrophobicContact CE1-CG2 4.49Å; Y448-W497 CarbonylContact C-O 3.55Å; Y448-W497 VanDerWaalsContact CA-O 3.25Å; Y448-W497 WeakPolarHBondContact CA-O 3.4Å; Y448-V498 HydrophobicContact CD1-CB 4.39Å; Y448-V498 HydrophobicContact CD1-CG1 4.18Å; Y448-V498 HydrophobicContact CD1-CG2 3.94Å; Y448-V498 HydrophobicContact CE1-CB 4.37Å; Y448-V498 HydrophobicContact CE1-CG1 3.79Å; Y448-V498 HydrophobicContact CE1-CG2 3.9Å
449	V	94.9	Very high	90	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.3	160.9	175.5	0	0	0	0	108.7	A404 L405 M426 E451 R471 C472 V496 W497	A404-V449 HydrophobicContact CB-CB 4.45Å; A404-V449 HydrophobicContact CB-CG1 3.49Å; A404-V449 VanDerWaalsContact CB-CG1 3.49Å; A404-V449 HydrophobicContact CB-CG2 4.07Å; L405-V449 HydrophobicContact CD2-CG2 4.22Å; M426-V449 HydrophobicContact CE-CG2 4.2Å; M426-V449 HydrophobicContact SD-CG2 4.42Å; V449-E451 PolarHBondContact O-N 3.07Å; V449-R471 CarbonylContact C-O 3.59Å; V449-R471 WeakPolarHBondContact CA-O 3.08Å; V449-C472 HydrophobicContact CG2-CB 4.1Å; V449-V496 CarbonylContact O-C 3.53Å; V449-V496 VanDerWaalsContact O-CA 3.29Å; V449-V496 WeakPolarHBondContact O-CA 3.45Å; V449-W497 HydrophobicContact CB-CB 4.37Å; V449-W497 PolarHBondContact N-O 3.15Å; V449-W497 PolarHBondContact O-N 3.32Å
450	G	94	Very high	89.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	118.8	174.2	0	0	0	0	0	112.1	Q400 G470 R471	Q400-G450 PolarHBondContact NE2-O 2.93Å; G450-G470 PolarHBondContact O-N 3.3Å; G450-R471 PolarHBondContact N-O 3.29Å
451	E	94.1	Very high	89.6	Confident	13 Å²	13	40 Å²	40	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-46.3	168.8	-166.4	62.2	-155.7	0	0	110.2	Q400 V449 A469 R495 W497	Q400-E451 PolarHBondContact NE2-O 2.74Å; V449-E451 PolarHBondContact O-N 3.07Å; E451-A469 VanDerWaalsContact O-CB 3.26Å; E451-A469 WeakPolarHBondContact O-CB 3.18Å; E451-R495 HydrophobicContact CB-CB 4.33Å; E451-R495 PolarHBondContact N-O 2.84Å; E451-W497 VanDerWaalsContact OE2-CD1 3.28Å; E451-W497 PolarHBondContact OE2-NE1 3.01Å
452	E	93.8	Very high	89.9	Confident	93 Å²	93	45.7 Å²	45.7	44%	0.435	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.1	178.7	-75	177.8	-158.8	0	0	111.6	F455 A494 R495	E452-F455 WeakPolarHBondContact O-CZ 3.48Å; E452-A494 VanDerWaalsContact O-CA 3.28Å; E452-A494 WeakPolarHBondContact O-CA 3.14Å; E452-A494 VanDerWaalsContact O-CB 3.32Å; E452-A494 WeakPolarHBondContact O-CB 3.4Å; E452-R495 HydrophobicContact CB-CB 4.39Å; E452-R495 VanDerWaalsContact CD-CZ 3.43Å; E452-R495 PolarHBondContact N-O 3.12Å; E452-R495 VanDerWaalsContact N-O 3.12Å; E452-R495 PolarHBondContact O-N 2.92Å; E452-R495 IonicContact OE1-CZ 3.15Å; E452-R495 IonicContact OE1-NH1 2.76Å; E452-R495 PolarHBondContact OE1-NH1 3.22Å; E452-R495 IonicContact OE1-NH2 3.95Å; E452-R495 PolarHBondContact OE1-NH2 2.85Å; E452-R495 IonicContact OE2-CZ 3.55Å; E452-R495 IonicContact OE2-NH1 2.78Å; E452-R495 PolarHBondContact OE2-NH1 2.78Å; E452-R495 IonicContact OE2-NH2 2.68Å
453	G	93.3	Very high	90.1	Very high	22 Å²	22	49 Å²	49	23%	0.227	28%	0.276	C	S	.	.	S	Bend	trans	96.7	176.9	175.1	0	0	0	0	0	115.5	F455 A469 T492	G453-F455 WeakPolarHBondContact O-CE2 3.21Å; G453-A469 PolarHBondContact O-N 3.5Å; G453-T492 WeakPolarHBondContact CA-OG1 3.17Å
454	E	95.6	Very high	90.8	Very high	89 Å²	89	47.7 Å²	47.7	42%	0.416	27%	0.269	S	S	.	.			trans	-111.2	142.5	175.6	-70.9	-162.2	152.5	0	0	112.3	I466 M467 V491 T492	E454-I466 HydrophobicContact CB-CG2 3.99Å; E454-I466 HydrophobicContact CG-CG2 4.26Å; E454-M467 CarbonylContact C-O 3.53Å; E454-M467 WeakPolarHBondContact CA-O 3.25Å; E454-V491 HydrophobicContact CB-CB 4.03Å; E454-V491 HydrophobicContact CB-CG2 4.46Å; E454-V491 PolarHBondContact O-N 3.23Å; E454-T492 HydrophobicContact CB-CG2 4.46Å; E454-T492 PolarHBondContact N-OG1 3.14Å
455	F	95.8	Very high	91.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	113.9	-173.4	-49.4	-83.1	0	0	0	110.9	I437 E452 G453 I466 M467 F473 V488 K489 A494 V496	I437-F455 HydrophobicContact CD1-CD1 3.57Å; I437-F455 HydrophobicContact CD1-CE1 3.6Å; E452-F455 WeakPolarHBondContact O-CZ 3.48Å; G453-F455 WeakPolarHBondContact O-CE2 3.21Å; F455-I466 CarbonylContact O-C 3.57Å; F455-I466 VanDerWaalsContact O-CA 3.32Å; F455-I466 WeakPolarHBondContact O-CA 3.27Å; F455-M467 HydrophobicContact CB-CB 4.42Å; F455-M467 HydrophobicContact CB-CE 4.13Å; F455-M467 PolarHBondContact N-O 2.97Å; F455-M467 PolarHBondContact O-N 3.47Å; F455-F473 HydrophobicContact CD1-CE1 4.35Å; F455-F473 HydrophobicContact CD1-CZ 4.08Å; F455-F473 HydrophobicContact CD2-CE1 4.37Å; F455-F473 HydrophobicContact CE1-CZ 4.29Å; F455-F473 HydrophobicContact CG-CE1 4.27Å; F455-F473 HydrophobicContact CG-CZ 4.39Å; F455-V488 HydrophobicContact CB-CG1 3.95Å; F455-K489 CarbonylContact C-O 3.58Å; F455-K489 WeakPolarHBondContact CA-O 3.21Å; F455-A494 HydrophobicContact CE1-CB 3.62Å; F455-A494 HydrophobicContact CZ-CB 3.84Å; F455-V496 HydrophobicContact CE1-CG1 3.58Å; F455-V496 HydrophobicContact CZ-CG1 3.69Å
456	E	95.6	Very high	92.4	Very high	41 Å²	41	54.9 Å²	54.9	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.5	174.2	-173.8	178.8	89.3	0	0	110.8	R463 I466 V488 K489 V491	E456-R463 HydrophobicContact CG-CG 3.88Å; E456-R463 WeakPolarHBondContact OE2-CD 3.31Å; E456-R463 IonicContact OE2-CZ 2.8Å; E456-R463 IonicContact OE2-NE 3.42Å; E456-R463 PolarHBondContact OE2-NE 2.91Å; E456-R463 IonicContact OE2-NH1 2.76Å; E456-R463 PolarHBondContact OE2-NH1 3.28Å; E456-I466 HydrophobicContact CB-CG1 4.1Å; E456-I466 HydrophobicContact CG-CG1 4.34Å; E456-V488 WeakPolarHBondContact O-CA 3.41Å; E456-K489 PolarHBondContact N-O 3.19Å; E456-K489 PolarHBondContact O-N 2.82Å; E456-V491 HydrophobicContact CB-CG2 3.71Å
457	V	94.4	Very high	92.5	Very high	6 Å²	6	52.7 Å²	52.7	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129	174.9	-172.5	0	0	0	0	109.2	L464 Y465 M467 A486 S487 V488	V457-L464 HydrophobicContact CG1-CD1 4.36Å; V457-L464 PolarHBondContact O-N 2.85Å; V457-Y465 HydrophobicContact CB-CD1 4.47Å; V457-Y465 HydrophobicContact CB-CD2 4.37Å; V457-Y465 HydrophobicContact CB-CE1 4.2Å; V457-Y465 HydrophobicContact CB-CE2 4.12Å; V457-Y465 HydrophobicContact CG1-CE1 4.19Å; V457-Y465 HydrophobicContact CG2-CD2 4.1Å; V457-Y465 HydrophobicContact CG2-CE2 3.64Å; V457-Y465 PolarHBondContact N-O 2.88Å; V457-Y465 PolarHBondContact O-N 2.79Å; V457-M467 HydrophobicContact CG2-CE 3.69Å; V457-M467 HydrophobicContact CG2-CG 4.31Å; V457-M467 HydrophobicContact CG2-SD 4.28Å; V457-A486 HydrophobicContact CG1-CB 4.14Å; V457-S487 WeakPolarHBondContact CA-O 3.5Å; V457-V488 HydrophobicContact CG2-CG2 4.36Å
458	S	93.6	Very high	92.5	Very high	11 Å²	11	54.3 Å²	54.3	8%	0.077	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	148.7	179	51.9	0	0	0	0	112.4	K462 A486 S487	S458-K462 CarbonylContact C-O 3.58Å; S458-K462 VanDerWaalsContact CA-O 3.24Å; S458-K462 WeakPolarHBondContact CA-O 3.22Å; S458-K462 WeakPolarHBondContact CB-O 3.4Å; S458-A486 CarbonylContact O-C 3.51Å; S458-A486 WeakPolarHBondContact O-CA 3.49Å; S458-A486 WeakPolarHBondContact O-CB 3.43Å; S458-S487 PolarHBondContact N-O 3.27Å; S458-S487 PolarHBondContact O-N 2.9Å
459	K	90.5	Very high	92.3	Very high	81 Å²	81	55.9 Å²	55.9	35%	0.352	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	133.8	174	-166	-176.6	-177.7	172.6	0	110.4	E440 G461 K462 L464 T485 A486 E924	E440-K459 WeakPolarHBondContact OE1-CE 3.29Å; E440-K459 WeakPolarHBondContact OE1-CG 3.36Å; E440-K459 VanDerWaalsContact OE2-CA 3.3Å; E440-K459 WeakPolarHBondContact OE2-CA 3.41Å; E440-K459 WeakPolarHBondContact OE2-CG 3.09Å; K459-G461 PolarHBondContact O-N 3.29Å; K459-K462 PolarHBondContact N-O 3.49Å; K459-K462 WeakPolarHBondContact O-CB 3.43Å; K459-K462 PolarHBondContact O-N 3.15Å; K459-L464 HydrophobicContact CB-CD1 3.97Å; K459-L464 HydrophobicContact CB-CG 4.42Å; K459-T485 WeakPolarHBondContact CD-O 3.3Å; K459-T485 WeakPolarHBondContact CE-O 3.38Å; K459-T485 WeakPolarHBondContact CG-O 3.49Å; K459-A486 HydrophobicContact CB-CB 4.38Å; K459-E924 IonicContact NZ-OE1 2.72Å
460	G	88.7	Confident	92	Very high	69 Å²	69	57 Å²	57	71%	0.711	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	37	-176.9	0	0	0	0	0	112.8	E440 K462	E440-G460 PolarHBondContact OE2-N 2.9Å; G460-K462 PolarHBondContact O-N 3.05Å; G460-K462 VanDerWaalsContact O-N 3.09Å
461	G	85.2	Confident	91.8	Very high	78 Å²	78	63.6 Å²	63.6	80%	0.804	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-14.5	-172	0	0	0	0	0	115.4	K459	K459-G461 PolarHBondContact O-N 3.29Å
462	K	89.6	Confident	91.7	Very high	157 Å²	157	63.7 Å²	63.7	68%	0.683	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	119.2	178.6	-174.3	174.6	-178.7	175.3	0	110.9	S458 K459 G460 L464	S458-K462 CarbonylContact C-O 3.58Å; S458-K462 VanDerWaalsContact CA-O 3.24Å; S458-K462 WeakPolarHBondContact CA-O 3.22Å; S458-K462 WeakPolarHBondContact CB-O 3.4Å; K459-K462 PolarHBondContact N-O 3.49Å; K459-K462 WeakPolarHBondContact O-CB 3.43Å; K459-K462 PolarHBondContact O-N 3.15Å; G460-K462 PolarHBondContact O-N 3.05Å; G460-K462 VanDerWaalsContact O-N 3.09Å; K462-L464 PolarHBondContact O-N 2.92Å
463	R	91.1	Very high	91.6	Very high	140 Å²	140	59.8 Å²	59.8	53%	0.528	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	131.4	167	178.5	-178.7	171.3	155.8	-19.1	110.4	E456	E456-R463 HydrophobicContact CG-CG 3.88Å; E456-R463 WeakPolarHBondContact OE2-CD 3.31Å; E456-R463 IonicContact OE2-CZ 2.8Å; E456-R463 IonicContact OE2-NE 3.42Å; E456-R463 PolarHBondContact OE2-NE 2.91Å; E456-R463 IonicContact OE2-NH1 2.76Å; E456-R463 PolarHBondContact OE2-NH1 3.28Å
464	L	90.2	Very high	91.2	Very high	92 Å²	92	59.3 Å²	59.3	48%	0.482	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-52.8	178.4	-55.9	-176.8	0	0	0	111.1	V457 K459 K462	V457-L464 HydrophobicContact CG1-CD1 4.36Å; V457-L464 PolarHBondContact O-N 2.85Å; K459-L464 HydrophobicContact CB-CD1 3.97Å; K459-L464 HydrophobicContact CB-CG 4.42Å; K462-L464 PolarHBondContact O-N 2.92Å
465	Y	92.5	Very high	90.6	Very high	125 Å²	125	56.6 Å²	56.6	49%	0.49	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	172.6	-179.9	53	-84.7	0	0	0	111.1	V457 M467	V457-Y465 HydrophobicContact CB-CD1 4.47Å; V457-Y465 HydrophobicContact CB-CD2 4.37Å; V457-Y465 HydrophobicContact CB-CE1 4.2Å; V457-Y465 HydrophobicContact CB-CE2 4.12Å; V457-Y465 HydrophobicContact CG1-CE1 4.19Å; V457-Y465 HydrophobicContact CG2-CD2 4.1Å; V457-Y465 HydrophobicContact CG2-CE2 3.64Å; V457-Y465 PolarHBondContact N-O 2.88Å; V457-Y465 PolarHBondContact O-N 2.79Å; Y465-M467 HydrophobicContact CD2-CG 3.79Å; Y465-M467 HydrophobicContact CE2-CG 3.49Å; Y465-M467 VanDerWaalsContact CE2-CG 3.49Å; Y465-M467 HydrophobicContact CE2-SD 3.87Å
466	I	92.5	Very high	89.6	Confident	52 Å²	52	58.4 Å²	58.4	27%	0.267	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.1	162.8	-76.5	177.9	0	0	0	108.7	E454 F455 E456 V491	E454-I466 HydrophobicContact CB-CG2 3.99Å; E454-I466 HydrophobicContact CG-CG2 4.26Å; F455-I466 CarbonylContact O-C 3.57Å; F455-I466 VanDerWaalsContact O-CA 3.32Å; F455-I466 WeakPolarHBondContact O-CA 3.27Å; E456-I466 HydrophobicContact CB-CG1 4.1Å; E456-I466 HydrophobicContact CG-CG1 4.34Å; I466-V491 HydrophobicContact CD1-CG2 4.03Å; I466-V491 HydrophobicContact CG1-CG2 4.42Å
467	M	91.9	Very high	88.5	Confident	22 Å²	22	56.6 Å²	56.6	11%	0.108	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.4	166.1	-58.6	-178	-63.6	0	0	109.5	E454 F455 V457 Y465 R471 F473 V488	E454-M467 CarbonylContact C-O 3.53Å; E454-M467 WeakPolarHBondContact CA-O 3.25Å; F455-M467 HydrophobicContact CB-CB 4.42Å; F455-M467 HydrophobicContact CB-CE 4.13Å; F455-M467 PolarHBondContact N-O 2.97Å; F455-M467 PolarHBondContact O-N 3.47Å; V457-M467 HydrophobicContact CG2-CE 3.69Å; V457-M467 HydrophobicContact CG2-CG 4.31Å; V457-M467 HydrophobicContact CG2-SD 4.28Å; Y465-M467 HydrophobicContact CD2-CG 3.79Å; Y465-M467 HydrophobicContact CE2-CG 3.49Å; Y465-M467 VanDerWaalsContact CE2-CG 3.49Å; Y465-M467 HydrophobicContact CE2-SD 3.87Å; M467-R471 HydrophobicContact CB-CB 4.27Å; M467-R471 HydrophobicContact CB-CG 4.21Å; M467-R471 HydrophobicContact SD-CB 4.1Å; M467-F473 HydrophobicContact CE-CB 3.91Å; M467-F473 HydrophobicContact CE-CD1 3.57Å; M467-F473 HydrophobicContact CE-CE1 4.19Å; M467-F473 HydrophobicContact CE-CG 3.78Å; M467-V488 HydrophobicContact CE-CG1 4.44Å
468	G	90.6	Very high	87.4	Confident	34 Å²	34	56.4 Å²	56.4	35%	0.351	32%	0.318	S	S	.	.			trans	-87	-172	160.7	0	0	0	0	0	112.1	R471	G468-R471 WeakPolarHBondContact O-CG 3.17Å
469	A	90.4	Very high	86.2	Confident	48 Å²	48	57.1 Å²	57.1	40%	0.397	32%	0.32	S	S	.	.	S	Bend	trans	-53.7	165.1	170.5	0	0	0	0	0	114.5	E451 G453 R471	E451-A469 VanDerWaalsContact O-CB 3.26Å; E451-A469 WeakPolarHBondContact O-CB 3.18Å; G453-A469 PolarHBondContact O-N 3.5Å; A469-R471 VanDerWaalsContact C-N 3.25Å; A469-R471 PolarHBondContact O-N 2.98Å
470	G	89.1	Confident	85.1	Confident	24 Å²	24	53.8 Å²	53.8	25%	0.247	31%	0.306	C	S	.	.	S	Bend	trans	73.9	11.8	-177.6	0	0	0	0	0	114.2	A404 G450	A404-G470 WeakPolarHBondContact CB-O 3.22Å; G450-G470 PolarHBondContact O-N 3.3Å
471	R	90.1	Very high	83.9	Confident	139 Å²	139	52.8 Å²	52.8	53%	0.525	28%	0.284	S	S	.	.			trans	-108.9	138	-179.1	-63.1	-56.8	-174.4	171	0.3	112.4	V449 G450 M467 G468 A469	V449-R471 CarbonylContact C-O 3.59Å; V449-R471 WeakPolarHBondContact CA-O 3.08Å; G450-R471 PolarHBondContact N-O 3.29Å; M467-R471 HydrophobicContact CB-CB 4.27Å; M467-R471 HydrophobicContact CB-CG 4.21Å; M467-R471 HydrophobicContact SD-CB 4.1Å; G468-R471 WeakPolarHBondContact O-CG 3.17Å; A469-R471 VanDerWaalsContact C-N 3.25Å; A469-R471 PolarHBondContact O-N 2.98Å
472	C	91	Very high	83	Confident	14 Å²	14	50.8 Å²	50.8	10%	0.095	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.6	179.8	172.1	0	0	0	0	109.2	A404 N408 Y448 V449	A404-C472 HydrophobicContact CB-CB 4.21Å; N408-C472 HydrophobicContact CB-CB 4.2Å; Y448-C472 CarbonylContact O-C 3.49Å; Y448-C472 WeakPolarHBondContact O-CA 3.35Å; V449-C472 HydrophobicContact CG2-CB 4.1Å
473	F	91	Very high	82.5	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.048	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	153.1	-177.1	62.2	-92.6	0	0	0	113.8	I437 I438 Y448 F455 M467 V488 V496	I437-F473 HydrophobicContact CD1-CE2 4.41Å; I437-F473 HydrophobicContact CD1-CZ 4.05Å; I437-F473 HydrophobicContact CG2-CE2 4.09Å; I438-F473 HydrophobicContact CD1-CD2 4.01Å; I438-F473 HydrophobicContact CD1-CE2 4.4Å; Y448-F473 HydrophobicContact CD2-CD2 4Å; Y448-F473 AromaticContact CD2-CE2 3.73Å; Y448-F473 HydrophobicContact CD2-CE2 3.73Å; Y448-F473 HydrophobicContact CG-CD2 4.34Å; Y448-F473 AromaticContact CG-CE2 3.81Å; Y448-F473 HydrophobicContact CG-CE2 3.81Å; Y448-F473 HydrophobicContact CG-CZ 4.2Å; Y448-F473 PolarHBondContact N-O 2.91Å; Y448-F473 PolarHBondContact O-N 2.93Å; F455-F473 HydrophobicContact CD1-CE1 4.35Å; F455-F473 HydrophobicContact CD1-CZ 4.08Å; F455-F473 HydrophobicContact CD2-CE1 4.37Å; F455-F473 HydrophobicContact CE1-CZ 4.29Å; F455-F473 HydrophobicContact CG-CE1 4.27Å; F455-F473 HydrophobicContact CG-CZ 4.39Å; M467-F473 HydrophobicContact CE-CB 3.91Å; M467-F473 HydrophobicContact CE-CD1 3.57Å; M467-F473 HydrophobicContact CE-CE1 4.19Å; M467-F473 HydrophobicContact CE-CG 3.78Å; F473-V488 HydrophobicContact CD2-CB 4.4Å; F473-V488 HydrophobicContact CD2-CG1 4.09Å; F473-V488 HydrophobicContact CD2-CG2 4.12Å; F473-V488 HydrophobicContact CE2-CB 4.27Å; F473-V488 HydrophobicContact CE2-CG1 3.77Å; F473-V488 HydrophobicContact CE2-CG2 4.48Å; F473-V488 HydrophobicContact CZ-CG1 4.2Å; F473-V496 HydrophobicContact CZ-CG1 4.36Å
474	G	86	Confident	82.3	Confident	12 Å²	12	42.6 Å²	42.6	12%	0.124	23%	0.225	C	C	.	.			trans	92	0.5	-179.5	0	0	0	0	0	114.2	L476 A477 R484	G474-L476 VanDerWaalsContact C-N 3.27Å; G474-L476 PolarHBondContact O-N 3.37Å; G474-A477 PolarHBondContact O-N 3.19Å; G474-R484 PolarHBondContact O-NH1 3Å
475	E	83.8	Confident	82	Confident	33 Å²	33	40.9 Å²	40.9	15%	0.154	22%	0.219	C	C	.	.	H	α-helix	trans	-55.9	-33.2	179.2	73.6	-78.8	-141.2	0	0	114.1	N408 L410 I411 L447 A477 L478 L479	N408-E475 PolarHBondContact ND2-OE1 3.43Å; L410-E475 HydrophobicContact CB-CG 4.38Å; L410-E475 HydrophobicContact CD1-CG 3.5Å; L410-E475 HydrophobicContact CG-CG 4.47Å; I411-E475 HydrophobicContact CD1-CB 3.87Å; I411-E475 HydrophobicContact CG1-CB 4.45Å; L447-E475 HydrophobicContact CD1-CB 3.79Å; E475-A477 VanDerWaalsContact C-N 3.28Å; E475-A477 PolarHBondContact O-N 2.84Å; E475-L478 WeakPolarHBondContact O-CB 3.49Å; E475-L478 PolarHBondContact O-N 3.3Å; E475-L478 VanDerWaalsContact O-N 3.15Å; E475-L479 HydrophobicContact CB-CD1 4.45Å; E475-L479 WeakPolarHBondContact O-CB 3.39Å; E475-L479 WeakPolarHBondContact O-CG 3.23Å; E475-L479 PolarHBondContact O-N 2.85Å
476	L	74.2	Confident	81.8	Confident	38 Å²	38	35.8 Å²	35.8	20%	0.199	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-39.5	-177.4	-70.6	172.3	0	0	0	112.4	L410 G474 Y480 C482 I926	L410-L476 HydrophobicContact CD1-CD2 3.6Å; L410-L476 HydrophobicContact CD1-CG 4.32Å; G474-L476 VanDerWaalsContact C-N 3.27Å; G474-L476 PolarHBondContact O-N 3.37Å; L476-Y480 HydrophobicContact CD2-CD2 4.11Å; L476-Y480 HydrophobicContact CD2-CE2 4.09Å; L476-Y480 WeakPolarHBondContact O-CB 3.29Å; L476-Y480 PolarHBondContact O-N 3.42Å; L476-C482 VanDerWaalsContact C-SG 3.5Å; L476-C482 PolarHBondContact O-SG 2.77Å; L476-I926 HydrophobicContact CD2-CB 4.34Å; L476-I926 HydrophobicContact CD2-CD1 3.66Å; L476-I926 HydrophobicContact CD2-CG1 3.79Å
477	A	71.3	Confident	81.9	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-81.8	-26.5	179.8	0	0	0	0	0	112.3	G444 G474 E475 C482 R501	G444-A477 CarbonylContact O-C 3.51Å; G444-A477 VanDerWaalsContact O-C 3.27Å; G444-A477 WeakPolarHBondContact O-CB 3.41Å; G444-A477 VanDerWaalsContact O-O 3.14Å; G474-A477 PolarHBondContact O-N 3.19Å; E475-A477 VanDerWaalsContact C-N 3.28Å; E475-A477 PolarHBondContact O-N 2.84Å; A477-C482 WeakPolarHBondContact CB-O 3.35Å; A477-R501 PolarHBondContact O-NE 3.41Å; A477-R501 PolarHBondContact O-NH2 3.4Å
478	L	72.7	Confident	82.1	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-48.9	169.9	-165.4	94.1	0	0	0	110.8	L447 E475 R501 F504	L447-L478 HydrophobicContact CB-CB 4.35Å; L447-L478 HydrophobicContact CB-CD1 3.83Å; L447-L478 HydrophobicContact CB-CD2 3.9Å; L447-L478 HydrophobicContact CB-CG 4.25Å; L447-L478 HydrophobicContact CD2-CD2 4.06Å; E475-L478 WeakPolarHBondContact O-CB 3.49Å; E475-L478 PolarHBondContact O-N 3.3Å; E475-L478 VanDerWaalsContact O-N 3.15Å; L478-R501 VanDerWaalsContact CD1-CA 3.47Å; L478-R501 HydrophobicContact CD1-CB 3.99Å; L478-F504 HydrophobicContact CD1-CB 4.39Å; L478-F504 HydrophobicContact CD2-CB 3.87Å; L478-F504 HydrophobicContact CD2-CD1 3.86Å; L478-F504 HydrophobicContact CD2-CD2 3.72Å; L478-F504 HydrophobicContact CD2-CE1 4.34Å; L478-F504 HydrophobicContact CD2-CE2 4.19Å; L478-F504 HydrophobicContact CD2-CG 3.54Å; L478-F504 HydrophobicContact CD2-CZ 4.49Å; L478-F504 HydrophobicContact CG-CB 4.3Å; L478-F504 HydrophobicContact CG-CD1 4.42Å; L478-F504 HydrophobicContact CG-CG 4.32Å
479	L	68	Low	82.3	Confident	25 Å²	25	33.9 Å²	33.9	13%	0.131	19%	0.185	C	C	.	.	H	α-helix	trans	-81.2	-40.3	-171.5	-66.3	171.3	0	0	0	113.9	L410 I411 E475 F504	L410-L479 HydrophobicContact CB-CD1 3.65Å; L410-L479 HydrophobicContact CD1-CD1 4.39Å; I411-L479 HydrophobicContact CG1-CD1 4.35Å; E475-L479 HydrophobicContact CB-CD1 4.45Å; E475-L479 WeakPolarHBondContact O-CB 3.39Å; E475-L479 WeakPolarHBondContact O-CG 3.23Å; E475-L479 PolarHBondContact O-N 2.85Å; L479-F504 HydrophobicContact CD2-CE1 3.56Å; L479-F504 HydrophobicContact CD2-CZ 3.6Å
480	Y	66.4	Low	82.6	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.047	17%	0.166	C	C	.	.	H	α-helix	trans	-115.3	8.8	-164.7	-55.5	-56.4	0	0	0	115.2	L410 L476 C482 F880 I892 I926 Y929	L410-Y480 HydrophobicContact CD1-CE2 4.46Å; L410-Y480 HydrophobicContact CD2-CE2 4.34Å; L476-Y480 HydrophobicContact CD2-CD2 4.11Å; L476-Y480 HydrophobicContact CD2-CE2 4.09Å; L476-Y480 WeakPolarHBondContact O-CB 3.29Å; L476-Y480 PolarHBondContact O-N 3.42Å; Y480-C482 PolarHBondContact O-N 2.58Å; Y480-C482 VanDerWaalsContact O-N 3.14Å; Y480-F880 HydrophobicContact CD1-CD2 4.49Å; Y480-F880 HydrophobicContact CD1-CE1 4.1Å; Y480-F880 AromaticContact CD1-CE2 3.86Å; Y480-F880 HydrophobicContact CD1-CE2 3.86Å; Y480-F880 AromaticContact CD1-CZ 3.65Å; Y480-F880 HydrophobicContact CD1-CZ 3.65Å; Y480-F880 HydrophobicContact CE1-CE2 4.27Å; Y480-F880 HydrophobicContact CE1-CZ 4.42Å; Y480-I892 HydrophobicContact CE1-CG2 4.18Å; Y480-I926 HydrophobicContact CD2-CD1 4.21Å; Y480-I926 HydrophobicContact CE2-CD1 3.53Å; Y480-Y929 AromaticContact CD1-CD2 3.7Å; Y480-Y929 HydrophobicContact CD1-CD2 3.7Å; Y480-Y929 AromaticContact CD1-CE2 3.49Å; Y480-Y929 HydrophobicContact CD1-CE2 3.49Å; Y480-Y929 VanDerWaalsContact CD1-CE2 3.49Å; Y480-Y929 HydrophobicContact CD2-CD2 4.31Å; Y480-Y929 HydrophobicContact CD2-CE2 4.3Å; Y480-Y929 AromaticContact CE1-CD2 3.7Å; Y480-Y929 HydrophobicContact CE1-CD2 3.7Å; Y480-Y929 AromaticContact CE1-CE2 4Å; Y480-Y929 HydrophobicContact CE1-CE2 4Å; Y480-Y929 HydrophobicContact CE1-CG 4.46Å; Y480-Y929 HydrophobicContact CE2-CD2 4.3Å; Y480-Y929 HydrophobicContact CG-CD2 4.02Å; Y480-Y929 AromaticContact CG-CE2 3.66Å; Y480-Y929 HydrophobicContact CG-CE2 3.66Å
481	N	65.1	Low	82.9	Confident	47 Å²	47	33 Å²	33	25%	0.251	17%	0.169	S	C	.	.			trans	38.9	46	-168	-164.9	24.5	0	0	0	114	S378 R501	S378-N481 PolarHBondContact O-ND2 2.85Å; N481-R501 PolarHBondContact OD1-NH1 3.33Å; N481-R501 PolarHBondContact OD1-NH2 2.94Å
482	C	66.1	Low	83.2	Confident	37 Å²	37	29.1 Å²	29.1	25%	0.25	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-94.8	153.3	173.7	65.7	0	0	0	0	111.3	L476 A477 Y480	L476-C482 VanDerWaalsContact C-SG 3.5Å; L476-C482 PolarHBondContact O-SG 2.77Å; A477-C482 WeakPolarHBondContact CB-O 3.35Å; Y480-C482 PolarHBondContact O-N 2.58Å; Y480-C482 VanDerWaalsContact O-N 3.14Å
483	K	78.3	Confident	83.4	Confident	108 Å²	108	33.8 Å²	33.8	47%	0.47	19%	0.185	S	C	.	.	B	Isolated β-bridge	trans	-60.5	149	164.9	-80.6	176.5	170.8	-65.4	0	110.4	G441 D442 D443 T485	G441-K483 WeakPolarHBondContact O-CD 3.41Å; G441-K483 PolarHBondContact O-NZ 3.1Å; D442-K483 CarbonylContact O-C 3.54Å; D442-K483 WeakPolarHBondContact O-CA 3.47Å; D443-K483 VanDerWaalsContact OD1-CE 3.26Å; D443-K483 WeakPolarHBondContact OD1-CE 3.17Å; D443-K483 WeakPolarHBondContact OD1-CG 3.36Å; D443-K483 IonicContact OD1-NZ 3.14Å; D443-K483 PolarHBondContact OD1-NZ 2.84Å; D443-K483 IonicContact OD2-NZ 2.61Å; D443-K483 PolarHBondContact OD2-NZ 3.43Å; K483-T485 PolarHBondContact O-N 3.35Å
484	R	86.2	Confident	83.6	Confident	17 Å²	17	33.4 Å²	33.4	6%	0.064	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-57.3	119.1	-179.5	-66	-65.5	-156.2	-167.1	3.1	110.2	I438 R439 E440 G441 D442 H446 G474 A486	I438-R484 HydrophobicContact CG2-CB 3.69Å; I438-R484 HydrophobicContact CG2-CG 3.62Å; R439-R484 WeakPolarHBondContact O-CB 3.25Å; E440-R484 WeakPolarHBondContact CA-O 3.05Å; G441-R484 PolarHBondContact N-O 2.96Å; D442-R484 HydrophobicContact CB-CB 4.39Å; D442-R484 HydrophobicContact CB-CG 3.94Å; D442-R484 WeakPolarHBondContact O-CG 3.34Å; D442-R484 PolarHBondContact O-N 2.93Å; H446-R484 VanDerWaalsContact O-CZ 3.28Å; H446-R484 PolarHBondContact O-NH1 2.91Å; H446-R484 PolarHBondContact O-NH2 3.25Å; G474-R484 PolarHBondContact O-NH1 3Å; R484-A486 VanDerWaalsContact C-N 3.34Å; R484-A486 PolarHBondContact O-N 3.26Å
485	T	84	Confident	84	Confident	56 Å²	56	36.3 Å²	36.3	34%	0.344	19%	0.192	S	C	.	.	S	Bend	trans	-85.8	-3.1	-170	56.8	0	0	0	0	114.8	K459 K483	K459-T485 WeakPolarHBondContact CD-O 3.3Å; K459-T485 WeakPolarHBondContact CE-O 3.38Å; K459-T485 WeakPolarHBondContact CG-O 3.49Å; K483-T485 PolarHBondContact O-N 3.35Å
486	A	89.9	Confident	84.6	Confident	18 Å²	18	34.8 Å²	34.8	15%	0.149	19%	0.185	C	C	.	.	S	Bend	trans	-163.3	157.8	179.5	0	0	0	0	0	108	I438 V457 S458 K459 R484	I438-A486 VanDerWaalsContact CG2-O 3.23Å; I438-A486 WeakPolarHBondContact CG2-O 3.45Å; V457-A486 HydrophobicContact CG1-CB 4.14Å; S458-A486 CarbonylContact O-C 3.51Å; S458-A486 WeakPolarHBondContact O-CA 3.49Å; S458-A486 WeakPolarHBondContact O-CB 3.43Å; K459-A486 HydrophobicContact CB-CB 4.38Å; R484-A486 VanDerWaalsContact C-N 3.34Å; R484-A486 PolarHBondContact O-N 3.26Å
487	S	93.9	Very high	85.7	Confident	16 Å²	16	33.5 Å²	33.5	11%	0.112	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	147.9	169.3	-56.1	0	0	0	0	110.8	I438 E440 V457 S458	I438-S487 CarbonylContact O-C 3.54Å; I438-S487 VanDerWaalsContact O-CA 3.29Å; I438-S487 WeakPolarHBondContact O-CA 3.4Å; E440-S487 PolarHBondContact N-OG 2.89Å; V457-S487 WeakPolarHBondContact CA-O 3.5Å; S458-S487 PolarHBondContact N-O 3.27Å; S458-S487 PolarHBondContact O-N 2.9Å
488	V	95.4	Very high	86.8	Confident	9 Å²	9	33.5 Å²	33.5	6%	0.055	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.9	170.8	-173.3	0	0	0	0	109.1	I437 I438 F455 E456 V457 M467 F473	I437-V488 PolarHBondContact N-O 2.91Å; I438-V488 HydrophobicContact CB-CB 4.02Å; I438-V488 HydrophobicContact CB-CG2 4.16Å; I438-V488 HydrophobicContact CD1-CB 4.48Å; I438-V488 HydrophobicContact CD1-CG2 4.08Å; I438-V488 HydrophobicContact CG1-CB 4.41Å; I438-V488 HydrophobicContact CG1-CG2 4.47Å; I438-V488 PolarHBondContact N-O 2.79Å; I438-V488 VanDerWaalsContact N-O 3.11Å; I438-V488 PolarHBondContact O-N 2.91Å; F455-V488 HydrophobicContact CB-CG1 3.95Å; E456-V488 WeakPolarHBondContact O-CA 3.41Å; V457-V488 HydrophobicContact CG2-CG2 4.36Å; M467-V488 HydrophobicContact CE-CG1 4.44Å; F473-V488 HydrophobicContact CD2-CB 4.4Å; F473-V488 HydrophobicContact CD2-CG1 4.09Å; F473-V488 HydrophobicContact CD2-CG2 4.12Å; F473-V488 HydrophobicContact CE2-CB 4.27Å; F473-V488 HydrophobicContact CE2-CG1 3.77Å; F473-V488 HydrophobicContact CE2-CG2 4.48Å; F473-V488 HydrophobicContact CZ-CG1 4.2Å
489	K	95.5	Very high	87.7	Confident	43 Å²	43	33.4 Å²	33.4	19%	0.187	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.1	-175.3	-178.6	-168.9	164.2	-167.8	0	110.1	N434 C435 Y436 F455 E456	N434-K489 VanDerWaalsContact CA-CE 3.46Å; N434-K489 VanDerWaalsContact O-CE 3.3Å; N434-K489 WeakPolarHBondContact O-CE 3.35Å; N434-K489 WeakPolarHBondContact OD1-CE 3.22Å; N434-K489 PolarHBondContact OD1-NZ 2.96Å; C435-K489 CarbonylContact O-C 3.42Å; C435-K489 WeakPolarHBondContact O-CA 3.42Å; C435-K489 WeakPolarHBondContact O-CG 3.44Å; Y436-K489 HydrophobicContact CD1-CB 4.14Å; Y436-K489 HydrophobicContact CD2-CG 4.24Å; Y436-K489 HydrophobicContact CE1-CB 4.2Å; Y436-K489 HydrophobicContact CE2-CD 4.02Å; Y436-K489 HydrophobicContact CE2-CG 4.24Å; Y436-K489 HydrophobicContact CG-CB 4.38Å; Y436-K489 HydrophobicContact CG-CG 4.43Å; F455-K489 CarbonylContact C-O 3.58Å; F455-K489 WeakPolarHBondContact CA-O 3.21Å; E456-K489 PolarHBondContact N-O 3.19Å; E456-K489 PolarHBondContact O-N 2.82Å
490	A	96.4	Very high	88.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	129.7	172	0	0	0	0	0	109.9	V431 N434 C435 A494	V431-A490 HydrophobicContact CG1-CB 3.76Å; N434-A490 WeakPolarHBondContact CA-O 3.5Å; N434-A490 PolarHBondContact N-O 2.93Å; C435-A490 PolarHBondContact O-N 2.89Å; A490-A494 HydrophobicContact CB-CB 4.34Å
491	V	95.3	Very high	89.5	Confident	52 Å²	52	36.5 Å²	36.5	32%	0.315	19%	0.19	S	C	.	.	S	Bend	trans	-91.2	-48.7	179.5	-179.8	0	0	0	0	109.6	E454 E456 I466	E454-V491 HydrophobicContact CB-CB 4.03Å; E454-V491 HydrophobicContact CB-CG2 4.46Å; E454-V491 PolarHBondContact O-N 3.23Å; E456-V491 HydrophobicContact CB-CG2 3.71Å; I466-V491 HydrophobicContact CD1-CG2 4.03Å; I466-V491 HydrophobicContact CG1-CG2 4.42Å
492	T	95.9	Very high	90.2	Very high	59 Å²	59	35.4 Å²	35.4	36%	0.362	19%	0.187	S	C	.	.	S	Bend	trans	-95.4	175.2	167	62.2	0	0	0	0	110	A433 G453 E454	A433-T492 WeakPolarHBondContact CA-O 3.49Å; G453-T492 WeakPolarHBondContact CA-OG1 3.17Å; E454-T492 HydrophobicContact CB-CG2 4.46Å; E454-T492 PolarHBondContact N-OG1 3.14Å
493	D	95.8	Very high	91.2	Very high	111 Å²	111	34.8 Å²	34.8	59%	0.594	18%	0.183	S	C	*	.			trans	-58.4	143.8	155.1	-60.2	-54.2	0	0	0	109	P432 A433	P432-D493 VanDerWaalsContact CA-OD1 3.29Å; P432-D493 WeakPolarHBondContact CA-OD1 3.34Å; A433-D493 PolarHBondContact N-OD1 3.05Å
494	A	95.3	Very high	91.6	Very high	4 Å²	4	30 Å²	30	3%	0.033	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	152	-169.6	0	0	0	0	0	111.8	V431 E452 F455 A490	V431-A494 PolarHBondContact N-O 2.76Å; V431-A494 PolarHBondContact O-N 3.37Å; E452-A494 VanDerWaalsContact O-CA 3.28Å; E452-A494 WeakPolarHBondContact O-CA 3.14Å; E452-A494 VanDerWaalsContact O-CB 3.32Å; E452-A494 WeakPolarHBondContact O-CB 3.4Å; F455-A494 HydrophobicContact CE1-CB 3.62Å; F455-A494 HydrophobicContact CZ-CB 3.84Å; A490-A494 HydrophobicContact CB-CB 4.34Å
495	R	95.6	Very high	91.2	Very high	73 Å²	73	29.9 Å²	29.9	28%	0.275	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.8	167.6	-54.9	-152.8	-49.5	-84.3	-13.4	109.1	E428 E451 E452	E428-R495 WeakPolarHBondContact OE1-CD 3.3Å; E428-R495 IonicContact OE1-CZ 3.79Å; E428-R495 IonicContact OE1-NE 3.49Å; E428-R495 PolarHBondContact OE1-NE 2.95Å; E451-R495 HydrophobicContact CB-CB 4.33Å; E451-R495 PolarHBondContact N-O 2.84Å; E452-R495 HydrophobicContact CB-CB 4.39Å; E452-R495 VanDerWaalsContact CD-CZ 3.43Å; E452-R495 PolarHBondContact N-O 3.12Å; E452-R495 VanDerWaalsContact N-O 3.12Å; E452-R495 PolarHBondContact O-N 2.92Å; E452-R495 IonicContact OE1-CZ 3.15Å; E452-R495 IonicContact OE1-NH1 2.76Å; E452-R495 PolarHBondContact OE1-NH1 3.22Å; E452-R495 IonicContact OE1-NH2 3.95Å; E452-R495 PolarHBondContact OE1-NH2 2.85Å; E452-R495 IonicContact OE2-CZ 3.55Å; E452-R495 IonicContact OE2-NH1 2.78Å; E452-R495 PolarHBondContact OE2-NH1 2.78Å; E452-R495 IonicContact OE2-NH2 2.68Å
496	V	96	Very high	91.1	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.9	179.4	-59.3	0	0	0	0	111.1	Q429 V431 I437 Y448 V449 F455 F473 V498	Q429-V496 HydrophobicContact CB-CG2 4.04Å; Q429-V496 PolarHBondContact N-O 2.88Å; Q429-V496 WeakPolarHBondContact O-CG2 3.24Å; Q429-V496 PolarHBondContact O-N 2.95Å; V431-V496 HydrophobicContact CG2-CG2 4.14Å; I437-V496 HydrophobicContact CD1-CG1 4.14Å; Y448-V496 HydrophobicContact CD1-CB 4.42Å; Y448-V496 HydrophobicContact CD1-CG2 3.89Å; Y448-V496 HydrophobicContact CE1-CG2 4.49Å; V449-V496 CarbonylContact O-C 3.53Å; V449-V496 VanDerWaalsContact O-CA 3.29Å; V449-V496 WeakPolarHBondContact O-CA 3.45Å; F455-V496 HydrophobicContact CE1-CG1 3.58Å; F455-V496 HydrophobicContact CZ-CG1 3.69Å; F473-V496 HydrophobicContact CZ-CG1 4.36Å; V496-V498 HydrophobicContact CG2-CG2 4.11Å
497	W	96.1	Very high	91	Very high	11 Å²	11	26.8 Å²	26.8	4%	0.042	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.7	163.8	-64.4	102.8	0	0	0	109.2	K393 I401 M426 H427 E428 Y448 V449 E451	K393-W497 HydrophobicContact CB-CH2 4.5Å; K393-W497 HydrophobicContact CD-CD2 4.44Å; K393-W497 HydrophobicContact CD-CE3 4.04Å; K393-W497 HydrophobicContact CD-CH2 3.92Å; K393-W497 HydrophobicContact CD-CZ2 4.28Å; K393-W497 HydrophobicContact CD-CZ3 3.76Å; K393-W497 VanDerWaalsContact CE-CE3 3.4Å; K393-W497 HydrophobicContact CG-CH2 3.66Å; K393-W497 HydrophobicContact CG-CZ2 4.3Å; K393-W497 HydrophobicContact CG-CZ3 3.79Å; I401-W497 HydrophobicContact CD1-CB 4.22Å; I401-W497 HydrophobicContact CD1-CD2 3.67Å; I401-W497 HydrophobicContact CD1-CE3 4.32Å; I401-W497 HydrophobicContact CD1-CG 3.56Å; I401-W497 HydrophobicContact CG1-CB 4.22Å; I401-W497 VanDerWaalsContact CG1-CD1 3.42Å; I401-W497 HydrophobicContact CG1-CD2 4.31Å; I401-W497 HydrophobicContact CG1-CG 3.71Å; M426-W497 HydrophobicContact CB-CB 4.1Å; M426-W497 HydrophobicContact CB-CE3 4.46Å; M426-W497 HydrophobicContact CE-CB 3.83Å; M426-W497 WeakPolarHBondContact CE-O 3.4Å; M426-W497 HydrophobicContact SD-CB 4.02Å; H427-W497 CarbonylContact O-C 3.59Å; H427-W497 WeakPolarHBondContact O-CA 3.43Å; E428-W497 HydrophobicContact CB-CE3 4.09Å; E428-W497 HydrophobicContact CB-CH2 3.96Å; E428-W497 HydrophobicContact CB-CZ3 3.65Å; E428-W497 HydrophobicContact CG-CH2 4.5Å; Y448-W497 CarbonylContact C-O 3.55Å; Y448-W497 VanDerWaalsContact CA-O 3.25Å; Y448-W497 WeakPolarHBondContact CA-O 3.4Å; V449-W497 HydrophobicContact CB-CB 4.37Å; V449-W497 PolarHBondContact N-O 3.15Å; V449-W497 PolarHBondContact O-N 3.32Å; E451-W497 VanDerWaalsContact OE2-CD1 3.28Å; E451-W497 PolarHBondContact OE2-NE1 3.01Å
498	V	94.6	Very high	90.4	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.5	-176.7	-167.5	0	0	0	0	110	M426 H427 Q429 H446 L447 Y448 V496	M426-V498 CarbonylContact C-O 3.59Å; M426-V498 WeakPolarHBondContact CA-O 3.44Å; M426-V498 WeakPolarHBondContact CB-O 3.47Å; H427-V498 PolarHBondContact N-O 3.11Å; H427-V498 PolarHBondContact O-N 2.82Å; Q429-V498 HydrophobicContact CB-CG2 3.6Å; H446-V498 HydrophobicContact CB-CG1 4.15Å; L447-V498 CarbonylContact O-C 3.55Å; L447-V498 WeakPolarHBondContact O-CA 3.26Å; Y448-V498 HydrophobicContact CD1-CB 4.39Å; Y448-V498 HydrophobicContact CD1-CG1 4.18Å; Y448-V498 HydrophobicContact CD1-CG2 3.94Å; Y448-V498 HydrophobicContact CE1-CB 4.37Å; Y448-V498 HydrophobicContact CE1-CG1 3.79Å; Y448-V498 HydrophobicContact CE1-CG2 3.9Å; V496-V498 HydrophobicContact CG2-CG2 4.11Å
499	L	92.8	Very high	89.5	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.9	168.9	-173.3	77.5	0	0	0	110.1	V422 C425 M426 H446 L447 C503 F504	V422-L499 HydrophobicContact CG1-CD2 3.83Å; V422-L499 HydrophobicContact CG2-CD2 4.34Å; C425-L499 HydrophobicContact CB-CD1 4.27Å; M426-L499 HydrophobicContact CE-CB 3.81Å; M426-L499 HydrophobicContact CG-CB 4.12Å; M426-L499 HydrophobicContact CG-CD1 4.18Å; H446-L499 WeakPolarHBondContact CA-O 3.13Å; L447-L499 HydrophobicContact CB-CB 4.29Å; L447-L499 HydrophobicContact CD2-CB 4.38Å; L447-L499 HydrophobicContact CD2-CD2 4.06Å; L447-L499 PolarHBondContact N-O 3.46Å; L447-L499 PolarHBondContact O-N 2.73Å; L499-C503 HydrophobicContact CD1-CB 4.34Å; L499-F504 HydrophobicContact CD2-CB 3.82Å; L499-F504 HydrophobicContact CD2-CD2 3.78Å; L499-F504 HydrophobicContact CD2-CG 4.27Å; L499-F504 HydrophobicContact CG-CB 4.41Å
500	E	89	Confident	88.9	Confident	86 Å²	86	29.2 Å²	29.2	40%	0.402	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	147.4	176.2	-59.9	-175	-165.2	0	0	112	H427 A502 C503 F504	H427-E500 IonicContact CE1-OE1 3.62Å; E500-A502 PolarHBondContact O-N 3.25Å; E500-C503 HydrophobicContact CB-CB 4.22Å; E500-C503 WeakPolarHBondContact O-CB 3.28Å; E500-C503 PolarHBondContact O-N 3.39Å; E500-F504 PolarHBondContact O-N 3.29Å
501	R	82.4	Confident	88.3	Confident	16 Å²	16	29.5 Å²	29.5	6%	0.06	15%	0.154	C	C	.	.	H	α-helix	trans	-56.9	-46.7	177	-174.9	-167.5	-64.2	156.7	-6.5	112.2	E380 G444 G445 A477 L478 N481 C503 F504 Q505	E380-R501 IonicContact OE2-NH1 3.67Å; E380-R501 PolarHBondContact OE2-NH1 2.85Å; G444-R501 PolarHBondContact O-NH2 3.19Å; G444-R501 VanDerWaalsContact O-NH2 3.11Å; G445-R501 WeakPolarHBondContact O-CB 3.37Å; G445-R501 PolarHBondContact O-N 2.98Å; A477-R501 PolarHBondContact O-NE 3.41Å; A477-R501 PolarHBondContact O-NH2 3.4Å; L478-R501 VanDerWaalsContact CD1-CA 3.47Å; L478-R501 HydrophobicContact CD1-CB 3.99Å; N481-R501 PolarHBondContact OD1-NH1 3.33Å; N481-R501 PolarHBondContact OD1-NH2 2.94Å; R501-C503 VanDerWaalsContact C-N 3.3Å; R501-C503 PolarHBondContact O-N 3.04Å; R501-F504 PolarHBondContact O-N 2.68Å; R501-Q505 HydrophobicContact CG-CG 4.2Å; R501-Q505 WeakPolarHBondContact O-CB 3.45Å; R501-Q505 WeakPolarHBondContact O-CG 3.35Å; R501-Q505 PolarHBondContact O-N 2.94Å
502	A	79.9	Confident	87.4	Confident	24 Å²	24	27.6 Å²	27.6	20%	0.198	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-40.8	-178.9	0	0	0	0	0	111.3	E500 Q505 A506	E500-A502 PolarHBondContact O-N 3.25Å; A502-Q505 PolarHBondContact O-N 2.97Å; A502-A506 VanDerWaalsContact O-CB 3.22Å; A502-A506 WeakPolarHBondContact O-CB 3.42Å; A502-A506 PolarHBondContact O-N 3.45Å
503	C	87.6	Confident	86.6	Confident	24 Å²	24	28.2 Å²	28.2	16%	0.162	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-47.6	172.7	-177.3	0	0	0	0	112.2	C425 L499 E500 R501 Q505 A506 I507	C425-C503 WeakPolarHBondContact CB-SG 3.48Å; L499-C503 HydrophobicContact CD1-CB 4.34Å; E500-C503 HydrophobicContact CB-CB 4.22Å; E500-C503 WeakPolarHBondContact O-CB 3.28Å; E500-C503 PolarHBondContact O-N 3.39Å; R501-C503 VanDerWaalsContact C-N 3.3Å; R501-C503 PolarHBondContact O-N 3.04Å; C503-Q505 PolarHBondContact O-N 2.85Å; C503-A506 WeakPolarHBondContact O-CB 3.2Å; C503-A506 PolarHBondContact O-N 3.48Å; C503-I507 VanDerWaalsContact O-CG1 3.28Å; C503-I507 WeakPolarHBondContact O-CG1 3.37Å; C503-I507 PolarHBondContact O-N 3.33Å
504	F	86.6	Confident	86	Confident	8 Å²	8	27.1 Å²	27.1	4%	0.035	14%	0.136	C	C	.	.	H	α-helix	trans	-58.4	-47.6	176	179.2	-95.5	0	0	0	112.2	L414 V422 L478 L479 L499 E500 R501 I507 M508	L414-F504 HydrophobicContact CD1-CE2 4.35Å; L414-F504 HydrophobicContact CD2-CE2 4.47Å; V422-F504 HydrophobicContact CG2-CD2 4.14Å; V422-F504 HydrophobicContact CG2-CE2 4.5Å; L478-F504 HydrophobicContact CD1-CB 4.39Å; L478-F504 HydrophobicContact CD2-CB 3.87Å; L478-F504 HydrophobicContact CD2-CD1 3.86Å; L478-F504 HydrophobicContact CD2-CD2 3.72Å; L478-F504 HydrophobicContact CD2-CE1 4.34Å; L478-F504 HydrophobicContact CD2-CE2 4.19Å; L478-F504 HydrophobicContact CD2-CG 3.54Å; L478-F504 HydrophobicContact CD2-CZ 4.49Å; L478-F504 HydrophobicContact CG-CB 4.3Å; L478-F504 HydrophobicContact CG-CD1 4.42Å; L478-F504 HydrophobicContact CG-CG 4.32Å; L479-F504 HydrophobicContact CD2-CE1 3.56Å; L479-F504 HydrophobicContact CD2-CZ 3.6Å; L499-F504 HydrophobicContact CD2-CB 3.82Å; L499-F504 HydrophobicContact CD2-CD2 3.78Å; L499-F504 HydrophobicContact CD2-CG 4.27Å; L499-F504 HydrophobicContact CG-CB 4.41Å; E500-F504 PolarHBondContact O-N 3.29Å; R501-F504 PolarHBondContact O-N 2.68Å; F504-I507 PolarHBondContact O-N 3.28Å; F504-M508 HydrophobicContact CD1-CG 4.31Å; F504-M508 HydrophobicContact CD2-CE 4.01Å; F504-M508 HydrophobicContact CE1-CG 3.95Å; F504-M508 HydrophobicContact CE2-CE 3.72Å; F504-M508 HydrophobicContact CZ-CE 4.12Å; F504-M508 HydrophobicContact CZ-CG 4.06Å; F504-M508 HydrophobicContact CZ-SD 4.43Å; F504-M508 WeakPolarHBondContact O-CG 3.48Å; F504-M508 PolarHBondContact O-N 3Å
505	Q	77.3	Confident	85.3	Confident	13 Å²	13	32.2 Å²	32.2	6%	0.061	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-40.8	177.8	-69.2	174.3	-40.7	0	0	111.7	M382 R501 A502 C503 I507 M508 M509	M382-Q505 HydrophobicContact CG-CB 4.15Å; M382-Q505 VanDerWaalsContact SD-C 3.53Å; M382-Q505 HydrophobicContact SD-CB 3.46Å; M382-Q505 WeakPolarHBondContact SD-CB 3.15Å; R501-Q505 HydrophobicContact CG-CG 4.2Å; R501-Q505 WeakPolarHBondContact O-CB 3.45Å; R501-Q505 WeakPolarHBondContact O-CG 3.35Å; R501-Q505 PolarHBondContact O-N 2.94Å; A502-Q505 PolarHBondContact O-N 2.97Å; C503-Q505 PolarHBondContact O-N 2.85Å; Q505-I507 VanDerWaalsContact C-N 3.34Å; Q505-I507 PolarHBondContact O-N 2.93Å; Q505-M508 PolarHBondContact O-N 3.22Å; Q505-M509 WeakPolarHBondContact O-CB 3.29Å; Q505-M509 PolarHBondContact O-N 3.44Å
506	A	82.8	Confident	84.3	Confident	9 Å²	9	29.9 Å²	29.9	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-58.1	-45.3	174.7	0	0	0	0	0	111.6	M382 L388 A502 C503 M509 K510	M382-A506 HydrophobicContact CE-CB 3.55Å; M382-A506 HydrophobicContact SD-CB 4.47Å; M382-A506 PolarHBondContact SD-N 3.45Å; L388-A506 HydrophobicContact CD2-CB 3.73Å; A502-A506 VanDerWaalsContact O-CB 3.22Å; A502-A506 WeakPolarHBondContact O-CB 3.42Å; A502-A506 PolarHBondContact O-N 3.45Å; C503-A506 WeakPolarHBondContact O-CB 3.2Å; C503-A506 PolarHBondContact O-N 3.48Å; A506-M509 PolarHBondContact O-N 3.3Å; A506-K510 WeakPolarHBondContact O-CB 3.21Å; A506-K510 PolarHBondContact O-N 3.08Å
507	I	86.5	Confident	83.6	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-46.8	177.2	-65.6	161.9	0	0	0	111	L388 E421 V422 C425 C503 F504 Q505 M509 K510 T511	L388-I507 HydrophobicContact CD1-CG1 3.92Å; L388-I507 HydrophobicContact CD2-CD1 4.48Å; L388-I507 HydrophobicContact CD2-CG1 3.82Å; E421-I507 HydrophobicContact CB-CB 4.43Å; E421-I507 HydrophobicContact CB-CD1 4.21Å; E421-I507 HydrophobicContact CB-CG1 4.08Å; E421-I507 HydrophobicContact CB-CG2 3.47Å; E421-I507 VanDerWaalsContact CB-CG2 3.47Å; E421-I507 HydrophobicContact CG-CG2 4.26Å; V422-I507 HydrophobicContact CB-CD1 4.49Å; V422-I507 HydrophobicContact CG2-CD1 3.87Å; V422-I507 HydrophobicContact CG2-CG2 4.23Å; C425-I507 HydrophobicContact CB-CD1 4.12Å; C503-I507 VanDerWaalsContact O-CG1 3.28Å; C503-I507 WeakPolarHBondContact O-CG1 3.37Å; C503-I507 PolarHBondContact O-N 3.33Å; F504-I507 PolarHBondContact O-N 3.28Å; Q505-I507 VanDerWaalsContact C-N 3.34Å; Q505-I507 PolarHBondContact O-N 2.93Å; I507-M509 VanDerWaalsContact C-N 3.33Å; I507-M509 PolarHBondContact O-N 3.45Å; I507-K510 PolarHBondContact O-N 2.77Å; I507-T511 HydrophobicContact CG2-CG2 4.2Å; I507-T511 WeakPolarHBondContact O-CB 3.34Å; I507-T511 WeakPolarHBondContact O-CG2 3.24Å; I507-T511 PolarHBondContact O-N 2.65Å; I507-T511 PolarHBondContact O-OG1 3.19Å
508	M	81.8	Confident	83.1	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-36.7	-179.5	-62.1	-48.9	127.3	0	0	112.3	L414 Q418 V422 F504 Q505 G512 W878 N894	L414-M508 HydrophobicContact CD1-CE 4.02Å; L414-M508 HydrophobicContact CD2-CE 3.6Å; L414-M508 HydrophobicContact CD2-SD 3.5Å; L414-M508 WeakPolarHBondContact CD2-SD 3.34Å; L414-M508 HydrophobicContact CG-CE 4.47Å; Q418-M508 HydrophobicContact CB-CE 4.11Å; Q418-M508 HydrophobicContact CB-SD 4.22Å; Q418-M508 HydrophobicContact CG-CE 4.33Å; Q418-M508 HydrophobicContact CG-SD 3.89Å; V422-M508 HydrophobicContact CG2-CE 3.71Å; F504-M508 HydrophobicContact CD1-CG 4.31Å; F504-M508 HydrophobicContact CD2-CE 4.01Å; F504-M508 HydrophobicContact CE1-CG 3.95Å; F504-M508 HydrophobicContact CE2-CE 3.72Å; F504-M508 HydrophobicContact CZ-CE 4.12Å; F504-M508 HydrophobicContact CZ-CG 4.06Å; F504-M508 HydrophobicContact CZ-SD 4.43Å; F504-M508 WeakPolarHBondContact O-CG 3.48Å; F504-M508 PolarHBondContact O-N 3Å; Q505-M508 PolarHBondContact O-N 3.22Å; M508-G512 WeakPolarHBondContact O-CA 3.12Å; M508-G512 PolarHBondContact O-N 2.97Å; M508-W878 PolarHBondContact O-NE1 2.96Å; M508-N894 WeakPolarHBondContact CB-ND2 3.43Å; M508-N894 WeakPolarHBondContact CG-ND2 3.38Å
509	M	76.7	Confident	82.5	Confident	48 Å²	48	42.5 Å²	42.5	24%	0.236	20%	0.204	C	C	.	.	H	α-helix	trans	-69	-50.3	174	-178.9	175.6	70.5	0	0	111.9	M382 Q505 A506 I507 G512 L513 W878	M382-M509 HydrophobicContact CE-CE 4.43Å; M382-M509 HydrophobicContact SD-CE 4.22Å; Q505-M509 WeakPolarHBondContact O-CB 3.29Å; Q505-M509 PolarHBondContact O-N 3.44Å; A506-M509 PolarHBondContact O-N 3.3Å; I507-M509 VanDerWaalsContact C-N 3.33Å; I507-M509 PolarHBondContact O-N 3.45Å; M509-G512 PolarHBondContact O-N 2.92Å; M509-L513 HydrophobicContact CG-CD1 3.82Å; M509-L513 HydrophobicContact CG-CG 4.48Å; M509-L513 WeakPolarHBondContact O-CB 3.35Å; M509-L513 VanDerWaalsContact O-CG 3.29Å; M509-L513 WeakPolarHBondContact O-CG 3.42Å; M509-L513 PolarHBondContact O-N 2.72Å; M509-W878 HydrophobicContact CB-CB 4.48Å; M509-W878 HydrophobicContact CB-CD2 4.16Å; M509-W878 HydrophobicContact CB-CE3 4.2Å; M509-W878 HydrophobicContact CB-CG 4.27Å; M509-W878 HydrophobicContact CG-CD2 4.18Å; M509-W878 HydrophobicContact CG-CE3 3.71Å; M509-W878 HydrophobicContact CG-CZ3 4.13Å
510	K	83.2	Confident	82.1	Confident	68 Å²	68	43.6 Å²	43.6	30%	0.296	21%	0.209	S	C	.	.	H	α-helix	trans	-56.1	-60.3	179	174.9	-171.1	168.5	-165.9	0	110.8	L388 Y390 E421 A506 I507 G512 L513 E514	L388-K510 HydrophobicContact CD1-CD 3.75Å; Y390-K510 PolarHBondContact OH-NZ 2.91Å; E421-K510 IonicContact OE2-NZ 2.74Å; E421-K510 PolarHBondContact OE2-NZ 2.7Å; A506-K510 WeakPolarHBondContact O-CB 3.21Å; A506-K510 PolarHBondContact O-N 3.08Å; I507-K510 PolarHBondContact O-N 2.77Å; K510-G512 VanDerWaalsContact C-N 3.27Å; K510-G512 PolarHBondContact O-N 2.83Å; K510-L513 PolarHBondContact O-N 3.29Å; K510-L513 VanDerWaalsContact O-N 3.17Å; K510-E514 WeakPolarHBondContact CE-OE1 3.4Å; K510-E514 HydrophobicContact CG-CG 4.49Å; K510-E514 WeakPolarHBondContact CG-OE1 3.27Å; K510-E514 WeakPolarHBondContact O-CB 3.5Å; K510-E514 VanDerWaalsContact O-CG 3.29Å; K510-E514 WeakPolarHBondContact O-CG 3.26Å; K510-E514 PolarHBondContact O-N 3.18Å
511	T	83.6	Confident	82	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-32.2	-178.9	58.3	0	0	0	0	112.5	V417 Q418 E421 I507 E514 R515	V417-T511 HydrophobicContact CG1-CG2 3.98Å; Q418-T511 HydrophobicContact CG-CG2 4.36Å; Q418-T511 VanDerWaalsContact CG-OG1 3.27Å; Q418-T511 WeakPolarHBondContact CG-OG1 3.19Å; E421-T511 HydrophobicContact CG-CG2 4.17Å; I507-T511 HydrophobicContact CG2-CG2 4.2Å; I507-T511 WeakPolarHBondContact O-CB 3.34Å; I507-T511 WeakPolarHBondContact O-CG2 3.24Å; I507-T511 PolarHBondContact O-N 2.65Å; I507-T511 PolarHBondContact O-OG1 3.19Å; T511-E514 WeakPolarHBondContact CA-OE2 3.48Å; T511-R515 WeakPolarHBondContact O-CB 3.17Å; T511-R515 PolarHBondContact O-N 2.94Å
512	G	76	Confident	82.3	Confident	11 Å²	11	42.4 Å²	42.4	11%	0.113	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-45.9	173	0	0	0	0	0	112.9	M508 M509 K510 I516	M508-G512 WeakPolarHBondContact O-CA 3.12Å; M508-G512 PolarHBondContact O-N 2.97Å; M509-G512 PolarHBondContact O-N 2.92Å; K510-G512 VanDerWaalsContact C-N 3.27Å; K510-G512 PolarHBondContact O-N 2.83Å; G512-I516 WeakPolarHBondContact O-CB 3.17Å; G512-I516 WeakPolarHBondContact O-CD1 3.28Å; G512-I516 WeakPolarHBondContact O-CG1 3.46Å; G512-I516 PolarHBondContact O-N 3.26Å
513	L	78.5	Confident	82.7	Confident	73 Å²	73	41.3 Å²	41.3	38%	0.382	20%	0.204	S	C	.	.	H	α-helix	trans	-67.4	-46.2	176.8	-73.5	168.3	0	0	0	112	M509 K510 R515 I516 E517 W878	M509-L513 HydrophobicContact CG-CD1 3.82Å; M509-L513 HydrophobicContact CG-CG 4.48Å; M509-L513 WeakPolarHBondContact O-CB 3.35Å; M509-L513 VanDerWaalsContact O-CG 3.29Å; M509-L513 WeakPolarHBondContact O-CG 3.42Å; M509-L513 PolarHBondContact O-N 2.72Å; K510-L513 PolarHBondContact O-N 3.29Å; K510-L513 VanDerWaalsContact O-N 3.17Å; L513-R515 PolarHBondContact O-N 2.75Å; L513-I516 PolarHBondContact O-N 3.41Å; L513-I516 VanDerWaalsContact O-N 3.16Å; L513-E517 PolarHBondContact O-N 3.4Å; L513-W878 HydrophobicContact CD1-CZ3 4.46Å; L513-W878 HydrophobicContact CD2-CH2 3.63Å; L513-W878 HydrophobicContact CD2-CZ3 3.93Å; L513-W878 HydrophobicContact CG-CH2 3.7Å; L513-W878 HydrophobicContact CG-CZ2 4.49Å; L513-W878 HydrophobicContact CG-CZ3 3.97Å
514	E	83.2	Confident	82.7	Confident	88 Å²	88	45.3 Å²	45.3	41%	0.411	22%	0.216	S	C	.	.	H	α-helix	trans	-54.3	-52.4	174.9	-72.5	166	164.7	0	0	110.4	K510 T511 I516 E517 E518	K510-E514 WeakPolarHBondContact CE-OE1 3.4Å; K510-E514 HydrophobicContact CG-CG 4.49Å; K510-E514 WeakPolarHBondContact CG-OE1 3.27Å; K510-E514 WeakPolarHBondContact O-CB 3.5Å; K510-E514 VanDerWaalsContact O-CG 3.29Å; K510-E514 WeakPolarHBondContact O-CG 3.26Å; K510-E514 PolarHBondContact O-N 3.18Å; T511-E514 WeakPolarHBondContact CA-OE2 3.48Å; E514-I516 VanDerWaalsContact C-N 3.31Å; E514-I516 PolarHBondContact O-N 2.67Å; E514-E517 PolarHBondContact O-N 3.25Å; E514-E517 VanDerWaalsContact O-N 3.16Å; E514-E518 WeakPolarHBondContact O-CB 3.47Å; E514-E518 WeakPolarHBondContact O-CG 3.36Å; E514-E518 PolarHBondContact O-N 2.85Å
515	R	80.7	Confident	82.8	Confident	111 Å²	111	48.5 Å²	48.5	42%	0.419	24%	0.239	S	C	.	.	H	α-helix	trans	-61.7	-33	177.5	178.7	173.7	167.2	167.2	-4.7	113.6	D415 T511 L513 R519	D415-R515 IonicContact OD2-CZ 3.21Å; D415-R515 IonicContact OD2-NH1 2.77Å; D415-R515 PolarHBondContact OD2-NH1 2.92Å; T511-R515 WeakPolarHBondContact O-CB 3.17Å; T511-R515 PolarHBondContact O-N 2.94Å; L513-R515 PolarHBondContact O-N 2.75Å; R515-R519 WeakPolarHBondContact O-CB 3.34Å; R515-R519 VanDerWaalsContact O-CG 3.23Å; R515-R519 WeakPolarHBondContact O-CG 3.46Å; R515-R519 PolarHBondContact O-N 2.81Å
516	I	74.6	Confident	83.4	Confident	24 Å²	24	47.9 Å²	47.9	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-70.8	-42.9	174.6	-75.7	165.4	0	0	0	110.7	G512 L513 E514 R519 K520 L538 K876 W878	G512-I516 WeakPolarHBondContact O-CB 3.17Å; G512-I516 WeakPolarHBondContact O-CD1 3.28Å; G512-I516 WeakPolarHBondContact O-CG1 3.46Å; G512-I516 PolarHBondContact O-N 3.26Å; L513-I516 PolarHBondContact O-N 3.41Å; L513-I516 VanDerWaalsContact O-N 3.16Å; E514-I516 VanDerWaalsContact C-N 3.31Å; E514-I516 PolarHBondContact O-N 2.67Å; I516-R519 PolarHBondContact O-N 2.89Å; I516-K520 HydrophobicContact CG2-CD 3.99Å; I516-K520 VanDerWaalsContact CG2-CE 3.42Å; I516-K520 VanDerWaalsContact O-CG 3.32Å; I516-K520 WeakPolarHBondContact O-CG 3.46Å; I516-K520 PolarHBondContact O-N 2.95Å; I516-L538 HydrophobicContact CG2-CD1 3.97Å; I516-K876 HydrophobicContact CD1-CD 4.13Å; I516-W878 HydrophobicContact CD1-CH2 4.28Å; I516-W878 HydrophobicContact CD1-CZ2 4.22Å
517	E	82.7	Confident	83.4	Confident	86 Å²	86	51.4 Å²	51.4	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-77.1	-34.3	-178.6	-154.3	59.6	-135.7	0	0	112.7	L513 E514 R519 K520 A521 R524	L513-E517 PolarHBondContact O-N 3.4Å; E514-E517 PolarHBondContact O-N 3.25Å; E514-E517 VanDerWaalsContact O-N 3.16Å; E517-R519 VanDerWaalsContact C-N 3.33Å; E517-R519 PolarHBondContact O-N 3.22Å; E517-K520 VanDerWaalsContact CD-CD 3.48Å; E517-K520 PolarHBondContact O-N 2.97Å; E517-K520 WeakPolarHBondContact OE2-CD 3.16Å; E517-K520 WeakPolarHBondContact OE2-CE 3.4Å; E517-K520 IonicContact OE2-NZ 3.76Å; E517-K520 PolarHBondContact OE2-NZ 2.87Å; E517-A521 VanDerWaalsContact O-CB 3.24Å; E517-A521 WeakPolarHBondContact O-CB 3.22Å; E517-A521 PolarHBondContact O-N 2.94Å; E517-R524 IonicContact OE1-NH1 2.62Å
518	E	84	Confident	83.3	Confident	142 Å²	142	51.8 Å²	51.8	66%	0.664	26%	0.261	S	S	*	.	H	α-helix	trans	-57	-45.2	166.5	-75.5	-172.8	157.3	0	0	111.5	E514 A521 F522	E514-E518 WeakPolarHBondContact O-CB 3.47Å; E514-E518 WeakPolarHBondContact O-CG 3.36Å; E514-E518 PolarHBondContact O-N 2.85Å; E518-A521 PolarHBondContact O-N 3.16Å; E518-F522 WeakPolarHBondContact O-CB 3.41Å; E518-F522 PolarHBondContact O-N 3.27Å
519	R	82.2	Confident	83.6	Confident	50 Å²	50	51.7 Å²	51.7	19%	0.189	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-46.2	175	-79.2	176.9	171.8	-135.2	-10.2	111.9	R515 I516 E517 F522 L523 A541 L544	R515-R519 WeakPolarHBondContact O-CB 3.34Å; R515-R519 VanDerWaalsContact O-CG 3.23Å; R515-R519 WeakPolarHBondContact O-CG 3.46Å; R515-R519 PolarHBondContact O-N 2.81Å; I516-R519 PolarHBondContact O-N 2.89Å; E517-R519 VanDerWaalsContact C-N 3.33Å; E517-R519 PolarHBondContact O-N 3.22Å; R519-F522 PolarHBondContact O-N 2.89Å; R519-L523 WeakPolarHBondContact O-CB 3.37Å; R519-L523 VanDerWaalsContact O-CG 3.24Å; R519-L523 WeakPolarHBondContact O-CG 3.42Å; R519-L523 PolarHBondContact O-N 3.33Å; R519-A541 HydrophobicContact CB-CB 4.11Å; R519-A541 PolarHBondContact NH1-O 3.32Å; R519-L544 PolarHBondContact NH1-O 3.37Å; R519-L544 VanDerWaalsContact NH1-O 3.13Å
520	K	84.1	Confident	84	Confident	24 Å²	24	54.5 Å²	54.5	10%	0.104	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-42.7	176.4	-73.2	161.1	177.4	173.5	0	112	I516 E517 L523 R524 I537	I516-K520 HydrophobicContact CG2-CD 3.99Å; I516-K520 VanDerWaalsContact CG2-CE 3.42Å; I516-K520 VanDerWaalsContact O-CG 3.32Å; I516-K520 WeakPolarHBondContact O-CG 3.46Å; I516-K520 PolarHBondContact O-N 2.95Å; E517-K520 VanDerWaalsContact CD-CD 3.48Å; E517-K520 PolarHBondContact O-N 2.97Å; E517-K520 WeakPolarHBondContact OE2-CD 3.16Å; E517-K520 WeakPolarHBondContact OE2-CE 3.4Å; E517-K520 IonicContact OE2-NZ 3.76Å; E517-K520 PolarHBondContact OE2-NZ 2.87Å; K520-L523 PolarHBondContact O-N 3.29Å; K520-R524 WeakPolarHBondContact O-CB 3.46Å; K520-R524 WeakPolarHBondContact O-CG 3.45Å; K520-R524 PolarHBondContact O-N 3.27Å; K520-I537 HydrophobicContact CB-CG2 4.24Å; K520-I537 HydrophobicContact CG-CG2 4.01Å
521	A	87.5	Confident	84.1	Confident	56 Å²	56	57.1 Å²	57.1	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-65.6	-44.2	177.9	0	0	0	0	0	111.4	E517 E518 R524 S525	E517-A521 VanDerWaalsContact O-CB 3.24Å; E517-A521 WeakPolarHBondContact O-CB 3.22Å; E517-A521 PolarHBondContact O-N 2.94Å; E518-A521 PolarHBondContact O-N 3.16Å; A521-R524 PolarHBondContact O-N 2.68Å; A521-S525 PolarHBondContact O-N 3.08Å
522	F	88.2	Confident	84.1	Confident	21 Å²	21	58.1 Å²	58.1	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-48.5	173	175.2	-106.1	0	0	0	111.6	E518 R519 R524 S525 V526 I568 Q569 K597 L627	E518-F522 WeakPolarHBondContact O-CB 3.41Å; E518-F522 PolarHBondContact O-N 3.27Å; R519-F522 PolarHBondContact O-N 2.89Å; F522-R524 PolarHBondContact O-N 2.9Å; F522-S525 WeakPolarHBondContact O-CA 3.43Å; F522-S525 WeakPolarHBondContact O-CB 3.28Å; F522-S525 PolarHBondContact O-N 3.16Å; F522-S525 PolarHBondContact O-OG 3.03Å; F522-V526 HydrophobicContact CE1-CG2 4.21Å; F522-V526 HydrophobicContact CZ-CG2 4.1Å; F522-V526 PolarHBondContact O-N 2.89Å; F522-I568 WeakPolarHBondContact CZ-O 3.29Å; F522-Q569 HydrophobicContact CZ-CB 4.28Å; F522-K597 HydrophobicContact CE2-CG 4.23Å; F522-L627 HydrophobicContact CD1-CD1 3.91Å; F522-L627 HydrophobicContact CE1-CD1 3.82Å
523	L	88.5	Confident	84.5	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-38.5	179.2	-67.1	170.8	0	0	0	112.3	R519 K520 S525 V526 L529 I537 I540 A541 L544 L567	R519-L523 WeakPolarHBondContact O-CB 3.37Å; R519-L523 VanDerWaalsContact O-CG 3.24Å; R519-L523 WeakPolarHBondContact O-CG 3.42Å; R519-L523 PolarHBondContact O-N 3.33Å; K520-L523 PolarHBondContact O-N 3.29Å; L523-S525 VanDerWaalsContact C-N 3.26Å; L523-S525 PolarHBondContact O-N 3.12Å; L523-V526 WeakPolarHBondContact O-CB 3.49Å; L523-V526 PolarHBondContact O-N 2.93Å; L523-V526 VanDerWaalsContact O-N 3.17Å; L523-L529 HydrophobicContact CB-CD1 4.42Å; L523-L529 HydrophobicContact CD2-CD1 3.66Å; L523-L529 WeakPolarHBondContact O-CB 3.4Å; L523-I537 HydrophobicContact CB-CD1 4.1Å; L523-I537 HydrophobicContact CB-CG2 4.28Å; L523-I537 HydrophobicContact CD1-CG2 4.28Å; L523-I540 HydrophobicContact CD1-CB 4.35Å; L523-I540 HydrophobicContact CD1-CG2 3.9Å; L523-I540 HydrophobicContact CD2-CG2 4.08Å; L523-A541 HydrophobicContact CD1-CB 3.77Å; L523-L544 HydrophobicContact CD1-CD1 4.21Å; L523-L544 HydrophobicContact CD2-CD1 3.59Å; L523-L544 HydrophobicContact CG-CD1 4.44Å; L523-L567 HydrophobicContact CD2-CD1 3.98Å
524	R	89	Confident	84.7	Confident	109 Å²	109	61.2 Å²	61.2	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-26.7	172	-76.6	174.3	171.8	146.1	-7.2	113.4	E517 K520 A521 F522 V526 K530	E517-R524 IonicContact OE1-NH1 2.62Å; K520-R524 WeakPolarHBondContact O-CB 3.46Å; K520-R524 WeakPolarHBondContact O-CG 3.45Å; K520-R524 PolarHBondContact O-N 3.27Å; A521-R524 PolarHBondContact O-N 2.68Å; F522-R524 PolarHBondContact O-N 2.9Å; R524-V526 VanDerWaalsContact C-N 3.3Å; R524-K530 WeakPolarHBondContact O-CB 3.32Å
525	S	88.8	Confident	84.2	Confident	74 Å²	74	60.6 Å²	60.6	52%	0.517	32%	0.317	S	S	.	.	H	α-helix	trans	-75.1	-17.4	173.9	79.2	0	0	0	0	113.7	A521 F522 L523 P527	A521-S525 PolarHBondContact O-N 3.08Å; F522-S525 WeakPolarHBondContact O-CA 3.43Å; F522-S525 WeakPolarHBondContact O-CB 3.28Å; F522-S525 PolarHBondContact O-N 3.16Å; F522-S525 PolarHBondContact O-OG 3.03Å; L523-S525 VanDerWaalsContact C-N 3.26Å; L523-S525 PolarHBondContact O-N 3.12Å; S525-P527 WeakPolarHBondContact O-CD 3.43Å
526	V	87.8	Confident	84.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-76	118.7	173.7	175.2	0	0	0	0	108.7	F522 L523 R524 L528 L529 K530 L567	F522-V526 HydrophobicContact CE1-CG2 4.21Å; F522-V526 HydrophobicContact CZ-CG2 4.1Å; F522-V526 PolarHBondContact O-N 2.89Å; L523-V526 WeakPolarHBondContact O-CB 3.49Å; L523-V526 PolarHBondContact O-N 2.93Å; L523-V526 VanDerWaalsContact O-N 3.17Å; R524-V526 VanDerWaalsContact C-N 3.3Å; V526-L528 HydrophobicContact CG1-CB 4.09Å; V526-L528 PolarHBondContact O-N 3.37Å; V526-L529 HydrophobicContact CB-CB 4.4Å; V526-L529 HydrophobicContact CB-CD1 4.24Å; V526-L529 HydrophobicContact CB-CG 4.29Å; V526-L529 HydrophobicContact CG1-CD1 4.15Å; V526-L529 HydrophobicContact CG1-CG 3.98Å; V526-L529 PolarHBondContact O-N 2.85Å; V526-K530 PolarHBondContact O-N 2.79Å; V526-K530 VanDerWaalsContact O-N 3.13Å; V526-L567 HydrophobicContact CG1-CD2 3.76Å; V526-L567 HydrophobicContact CG2-CD2 4.06Å
527	P	84.5	Confident	84.8	Confident	84 Å²	84	56.7 Å²	56.7	55%	0.545	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29	-173.7	-27.9	36.1	0	0	0	114.9	S525 L529 K530	S525-P527 WeakPolarHBondContact O-CD 3.43Å; P527-L529 VanDerWaalsContact C-N 3.31Å; P527-L529 PolarHBondContact O-N 2.89Å; P527-K530 WeakPolarHBondContact O-CD 3.42Å
528	L	84.1	Confident	84.6	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.042	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.2	176.2	174.1	65.6	0	0	0	113.7	V526 F565 Y600 I638 I641 E643 L644	V526-L528 HydrophobicContact CG1-CB 4.09Å; V526-L528 PolarHBondContact O-N 3.37Å; L528-F565 HydrophobicContact CD2-CZ 4.05Å; L528-Y600 HydrophobicContact CB-CD1 4.3Å; L528-Y600 HydrophobicContact CB-CE1 3.73Å; L528-Y600 HydrophobicContact CD2-CD1 4.06Å; L528-Y600 HydrophobicContact CD2-CD2 4.34Å; L528-Y600 HydrophobicContact CD2-CE1 3.82Å; L528-Y600 HydrophobicContact CD2-CE2 4.08Å; L528-Y600 HydrophobicContact CD2-CG 4.31Å; L528-Y600 HydrophobicContact CG-CE1 4.29Å; L528-I638 HydrophobicContact CD2-CG2 4.13Å; L528-I641 HydrophobicContact CD1-CB 4.39Å; L528-I641 HydrophobicContact CD1-CD1 4.32Å; L528-I641 HydrophobicContact CD1-CG2 3.63Å; L528-E643 HydrophobicContact CD1-CB 3.96Å; L528-L644 HydrophobicContact CD1-CD2 4.09Å; L528-L644 HydrophobicContact CD1-CG 3.84Å; L528-L644 HydrophobicContact CD2-CD2 3.7Å; L528-L644 HydrophobicContact CD2-CG 4.13Å
529	L	86.9	Confident	84.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-13.7	-169	-52.6	178.8	0	0	0	113	L523 V526 P527 D531 L532 I537 I540 L567 I638 I641	L523-L529 HydrophobicContact CB-CD1 4.42Å; L523-L529 HydrophobicContact CD2-CD1 3.66Å; L523-L529 WeakPolarHBondContact O-CB 3.4Å; V526-L529 HydrophobicContact CB-CB 4.4Å; V526-L529 HydrophobicContact CB-CD1 4.24Å; V526-L529 HydrophobicContact CB-CG 4.29Å; V526-L529 HydrophobicContact CG1-CD1 4.15Å; V526-L529 HydrophobicContact CG1-CG 3.98Å; V526-L529 PolarHBondContact O-N 2.85Å; P527-L529 VanDerWaalsContact C-N 3.31Å; P527-L529 PolarHBondContact O-N 2.89Å; L529-D531 PolarHBondContact O-N 2.82Å; L529-L532 HydrophobicContact CB-CD1 4.17Å; L529-L532 HydrophobicContact CD2-CD1 3.66Å; L529-L532 WeakPolarHBondContact O-CB 3.41Å; L529-L532 WeakPolarHBondContact O-CG 3.41Å; L529-L532 PolarHBondContact O-N 2.91Å; L529-I537 HydrophobicContact CB-CD1 4.11Å; L529-I537 WeakPolarHBondContact O-CD1 3.4Å; L529-I540 HydrophobicContact CD2-CD1 4.45Å; L529-L567 HydrophobicContact CD1-CD1 4.11Å; L529-L567 HydrophobicContact CD1-CD2 4.36Å; L529-I638 HydrophobicContact CD2-CD1 3.99Å; L529-I638 HydrophobicContact CD2-CG1 4.35Å; L529-I638 HydrophobicContact CD2-CG2 3.95Å; L529-I641 HydrophobicContact CD2-CD1 4.3Å
530	K	86	Confident	84.5	Confident	107 Å²	107	46.1 Å²	46.1	47%	0.465	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-39	-175.9	76.7	-168.7	-175.6	-166.3	0	114.6	R524 V526 P527	R524-K530 WeakPolarHBondContact O-CB 3.32Å; V526-K530 PolarHBondContact O-N 2.79Å; V526-K530 VanDerWaalsContact O-N 3.13Å; P527-K530 WeakPolarHBondContact O-CD 3.42Å
531	D	84.4	Confident	84.5	Confident	123 Å²	123	45 Å²	45	66%	0.658	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	3.5	-174.1	-61.7	-39.2	0	0	0	113.5	L529	L529-D531 PolarHBondContact O-N 2.82Å
532	L	85.3	Confident	83.9	Confident	29 Å²	29	44.4 Å²	44.4	15%	0.152	24%	0.236	C	C	.	.	S	Bend	trans	-75.1	143.8	177.8	-60.2	-175.5	0	0	0	111.7	L529 R536 I537 I540 I641	L529-L532 HydrophobicContact CB-CD1 4.17Å; L529-L532 HydrophobicContact CD2-CD1 3.66Å; L529-L532 WeakPolarHBondContact O-CB 3.41Å; L529-L532 WeakPolarHBondContact O-CG 3.41Å; L529-L532 PolarHBondContact O-N 2.91Å; L532-R536 HydrophobicContact CB-CB 4.46Å; L532-I537 HydrophobicContact CB-CD1 3.98Å; L532-I537 HydrophobicContact CB-CG1 4.01Å; L532-I537 HydrophobicContact CD1-CD1 4.48Å; L532-I540 HydrophobicContact CD1-CD1 3.65Å; L532-I641 HydrophobicContact CD1-CD1 3.93Å; L532-I641 HydrophobicContact CD2-CD1 3.78Å; L532-I641 HydrophobicContact CD2-CG1 4.16Å; L532-I641 HydrophobicContact CG-CD1 4.28Å
533	S	84.3	Confident	83.6	Confident	67 Å²	67	43.9 Å²	43.9	47%	0.469	24%	0.236	S	C	.	.			trans	-60	148.9	-179.7	69	0	0	0	0	112	N535 R536 I537	S533-N535 PolarHBondContact O-N 3.36Å; S533-N535 VanDerWaalsContact O-N 3.11Å; S533-R536 WeakPolarHBondContact O-CA 3.46Å; S533-R536 WeakPolarHBondContact O-CB 3.38Å; S533-R536 PolarHBondContact O-N 3.29Å; S533-I537 PolarHBondContact O-N 2.83Å
534	P	80.9	Confident	83.4	Confident	81 Å²	81	44.1 Å²	44.1	53%	0.526	24%	0.237	S	C	.	.	H	α-helix	trans	-53.6	-37.5	-176.1	-28.6	35.5	0	0	0	113.9	I537 L538	P534-I537 PolarHBondContact O-N 2.87Å; P534-L538 PolarHBondContact O-N 3.21Å
535	N	73.5	Confident	83	Confident	76 Å²	76	43.1 Å²	43.1	41%	0.406	24%	0.237	S	C	.	.	H	α-helix	trans	-66.2	-38.6	176.6	-61.6	-12.4	0	0	0	112	S533 L538 R539 I873	S533-N535 PolarHBondContact O-N 3.36Å; S533-N535 VanDerWaalsContact O-N 3.11Å; N535-L538 PolarHBondContact O-N 3.42Å; N535-R539 WeakPolarHBondContact O-CG 3.32Å; N535-R539 PolarHBondContact O-N 2.72Å; N535-I873 WeakPolarHBondContact ND2-CG2 3.33Å
536	R	80.4	Confident	82.9	Confident	51 Å²	51	42.2 Å²	42.2	19%	0.192	23%	0.234	C	C	.	.	H	α-helix	trans	-70.3	-40.3	176.9	-161.4	173.7	-165.5	-172.1	7	110.8	L532 S533 R539 I540 E636 L637 D640	L532-R536 HydrophobicContact CB-CB 4.46Å; S533-R536 WeakPolarHBondContact O-CA 3.46Å; S533-R536 WeakPolarHBondContact O-CB 3.38Å; S533-R536 PolarHBondContact O-N 3.29Å; R536-R539 PolarHBondContact O-N 3.06Å; R536-I540 HydrophobicContact CG-CD1 4.43Å; R536-I540 WeakPolarHBondContact O-CD1 3.32Å; R536-I540 VanDerWaalsContact O-CG1 3.28Å; R536-I540 WeakPolarHBondContact O-CG1 3.34Å; R536-I540 PolarHBondContact O-N 3.26Å; R536-E636 PolarHBondContact NH2-O 2.96Å; R536-E636 VanDerWaalsContact NH2-O 3.16Å; R536-L637 PolarHBondContact NE-O 3.45Å; R536-L637 VanDerWaalsContact NH2-C 3.27Å; R536-L637 PolarHBondContact NH2-O 2.89Å; R536-L637 VanDerWaalsContact NH2-O 3.16Å; R536-D640 IonicContact CZ-OD1 2.77Å; R536-D640 VanDerWaalsContact CZ-OD1 3.26Å; R536-D640 IonicContact CZ-OD2 3.7Å; R536-D640 IonicContact NH1-OD1 3.26Å; R536-D640 PolarHBondContact NH1-OD1 3.16Å; R536-D640 IonicContact NH1-OD2 3.19Å; R536-D640 VanDerWaalsContact NH2-CG 3.32Å; R536-D640 IonicContact NH2-OD1 2.7Å; R536-D640 PolarHBondContact NH2-OD1 3.42Å; R536-D640 IonicContact NH2-OD2 2.7Å; R536-D640 PolarHBondContact NH2-OD2 2.97Å
537	I	86.8	Confident	83	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-45.2	172	-70.5	-68.7	0	0	0	111.7	K520 L523 L529 L532 S533 P534 I540 A541	K520-I537 HydrophobicContact CB-CG2 4.24Å; K520-I537 HydrophobicContact CG-CG2 4.01Å; L523-I537 HydrophobicContact CB-CD1 4.1Å; L523-I537 HydrophobicContact CB-CG2 4.28Å; L523-I537 HydrophobicContact CD1-CG2 4.28Å; L529-I537 HydrophobicContact CB-CD1 4.11Å; L529-I537 WeakPolarHBondContact O-CD1 3.4Å; L532-I537 HydrophobicContact CB-CD1 3.98Å; L532-I537 HydrophobicContact CB-CG1 4.01Å; L532-I537 HydrophobicContact CD1-CD1 4.48Å; S533-I537 PolarHBondContact O-N 2.83Å; P534-I537 PolarHBondContact O-N 2.87Å; I537-I540 PolarHBondContact O-N 2.9Å; I537-A541 WeakPolarHBondContact O-CB 3.3Å; I537-A541 PolarHBondContact O-N 2.92Å
538	L	79.3	Confident	83.3	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.058	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-46.5	177.2	-173	82.2	0	0	0	111.7	I516 P534 N535 I540 A541 D542 G874	I516-L538 HydrophobicContact CG2-CD1 3.97Å; P534-L538 PolarHBondContact O-N 3.21Å; N535-L538 PolarHBondContact O-N 3.42Å; L538-I540 PolarHBondContact O-N 3.44Å; L538-A541 CarbonylContact O-C 3.56Å; L538-A541 WeakPolarHBondContact O-CA 3.46Å; L538-A541 WeakPolarHBondContact O-CB 3.34Å; L538-A541 PolarHBondContact O-N 3.05Å; L538-D542 PolarHBondContact O-N 3.04Å; L538-G874 VanDerWaalsContact CD2-CA 3.49Å; L538-G874 WeakPolarHBondContact CD2-O 3.14Å
539	R	78.9	Confident	83.6	Confident	45 Å²	45	46.6 Å²	46.6	17%	0.17	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-32.3	177.8	-73.2	-162.5	65.1	-135.6	-15.3	112.7	N535 R536 A543 E636 L637 V969 G970	N535-R539 WeakPolarHBondContact O-CG 3.32Å; N535-R539 PolarHBondContact O-N 2.72Å; R536-R539 PolarHBondContact O-N 3.06Å; R539-A543 VanDerWaalsContact O-CB 3.27Å; R539-A543 WeakPolarHBondContact O-CB 3.41Å; R539-A543 PolarHBondContact O-N 3.43Å; R539-E636 IonicContact CZ-OE1 2.68Å; R539-E636 IonicContact NH1-OE1 3.45Å; R539-E636 PolarHBondContact NH1-OE1 3.34Å; R539-E636 IonicContact NH2-OE1 2.85Å; R539-E636 PolarHBondContact NH2-OE1 3.49Å; R539-L637 HydrophobicContact CB-CD1 4.39Å; R539-L637 HydrophobicContact CB-CD2 3.88Å; R539-V969 PolarHBondContact NE-O 2.99Å; R539-V969 PolarHBondContact NH1-O 2.65Å; R539-V969 PolarHBondContact NH2-O 3.1Å; R539-G970 PolarHBondContact NH1-O 3.16Å
540	I	84.5	Confident	83.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-48.9	169.2	-66.4	162.7	0	0	0	110.2	L523 L529 L532 R536 I537 L538 D542 A543 L544 L637 I638	L523-I540 HydrophobicContact CD1-CB 4.35Å; L523-I540 HydrophobicContact CD1-CG2 3.9Å; L523-I540 HydrophobicContact CD2-CG2 4.08Å; L529-I540 HydrophobicContact CD2-CD1 4.45Å; L532-I540 HydrophobicContact CD1-CD1 3.65Å; R536-I540 HydrophobicContact CG-CD1 4.43Å; R536-I540 WeakPolarHBondContact O-CD1 3.32Å; R536-I540 VanDerWaalsContact O-CG1 3.28Å; R536-I540 WeakPolarHBondContact O-CG1 3.34Å; R536-I540 PolarHBondContact O-N 3.26Å; I537-I540 PolarHBondContact O-N 2.9Å; L538-I540 PolarHBondContact O-N 3.44Å; I540-D542 PolarHBondContact O-N 2.77Å; I540-A543 PolarHBondContact O-N 3.03Å; I540-L544 HydrophobicContact CG2-CD1 3.59Å; I540-L544 HydrophobicContact CG2-CG 4Å; I540-L544 VanDerWaalsContact O-CG 3.22Å; I540-L544 WeakPolarHBondContact O-CG 3.24Å; I540-L544 PolarHBondContact O-N 3.31Å; I540-L637 HydrophobicContact CD1-CB 4.36Å; I540-L637 HydrophobicContact CG1-CB 3.75Å; I540-L637 HydrophobicContact CG1-CD1 4Å; I540-L637 HydrophobicContact CG1-CG 4.41Å; I540-I638 HydrophobicContact CD1-CD1 4.12Å; I540-I638 HydrophobicContact CD1-CG1 3.86Å; I540-I638 HydrophobicContact CG1-CD1 4.36Å; I540-I638 HydrophobicContact CG1-CG1 4.21Å; I540-I638 HydrophobicContact CG2-CD1 4.4Å
541	A	83.9	Confident	84.2	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-30.1	179.8	0	0	0	0	0	114.1	R519 L523 I537 L538	R519-A541 HydrophobicContact CB-CB 4.11Å; R519-A541 PolarHBondContact NH1-O 3.32Å; L523-A541 HydrophobicContact CD1-CB 3.77Å; I537-A541 WeakPolarHBondContact O-CB 3.3Å; I537-A541 PolarHBondContact O-N 2.92Å; L538-A541 CarbonylContact O-C 3.56Å; L538-A541 WeakPolarHBondContact O-CA 3.46Å; L538-A541 WeakPolarHBondContact O-CB 3.34Å; L538-A541 PolarHBondContact O-N 3.05Å
542	D	76.4	Confident	84.5	Confident	42 Å²	42	42.8 Å²	42.8	23%	0.225	25%	0.251	C	S	.	.	H	α-helix	trans	-85.7	-27.9	175.2	-78.4	-22.2	0	0	0	114	L538 I540 K876	L538-D542 PolarHBondContact O-N 3.04Å; I540-D542 PolarHBondContact O-N 2.77Å; D542-K876 IonicContact OD1-NZ 3.64Å; D542-K876 PolarHBondContact OD1-NZ 3.35Å; D542-K876 VanDerWaalsContact OD2-CE 3.27Å; D542-K876 WeakPolarHBondContact OD2-CE 3.33Å; D542-K876 IonicContact OD2-NZ 2.72Å; D542-K876 PolarHBondContact OD2-NZ 3.33Å
543	A	80.7	Confident	84.9	Confident	10 Å²	10	44.7 Å²	44.7	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-84.7	-9.2	177.1	0	0	0	0	0	113.5	R539 I540 L629 D633 L637	R539-A543 VanDerWaalsContact O-CB 3.27Å; R539-A543 WeakPolarHBondContact O-CB 3.41Å; R539-A543 PolarHBondContact O-N 3.43Å; I540-A543 PolarHBondContact O-N 3.03Å; A543-L629 HydrophobicContact CB-CD1 3.51Å; A543-D633 HydrophobicContact CB-CB 4.34Å; A543-L637 HydrophobicContact CB-CD1 4.06Å
544	L	84.5	Confident	85.3	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	25%	0.251	C	S	.	.			trans	-87.6	115.6	-178.5	-76.3	174.5	0	0	0	113.5	R519 L523 I540 L567 L627 C628 L629	R519-L544 PolarHBondContact NH1-O 3.37Å; R519-L544 VanDerWaalsContact NH1-O 3.13Å; L523-L544 HydrophobicContact CD1-CD1 4.21Å; L523-L544 HydrophobicContact CD2-CD1 3.59Å; L523-L544 HydrophobicContact CG-CD1 4.44Å; I540-L544 HydrophobicContact CG2-CD1 3.59Å; I540-L544 HydrophobicContact CG2-CG 4Å; I540-L544 VanDerWaalsContact O-CG 3.22Å; I540-L544 WeakPolarHBondContact O-CG 3.24Å; I540-L544 PolarHBondContact O-N 3.31Å; L544-L567 HydrophobicContact CD1-CD1 3.99Å; L544-L567 HydrophobicContact CD2-CD1 4.23Å; L544-L627 HydrophobicContact CB-CB 4.22Å; L544-L627 HydrophobicContact CD1-CB 4.09Å; L544-L627 HydrophobicContact CD1-CD1 3.92Å; L544-L627 HydrophobicContact CD2-CB 3.96Å; L544-L627 HydrophobicContact CG-CB 4.32Å; L544-C628 WeakPolarHBondContact CA-O 3.43Å; L544-C628 WeakPolarHBondContact CD2-O 3.49Å; L544-L629 HydrophobicContact CD2-CB 3.7Å; L544-L629 HydrophobicContact CD2-CD1 4.17Å; L544-L629 HydrophobicContact CD2-CG 4.42Å
545	E	82.2	Confident	85.9	Confident	88 Å²	88	40.3 Å²	40.3	41%	0.411	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132	170	-67.1	-171.2	163.7	0	0	111	L627 C628 Y630	E545-L627 CarbonylContact O-C 3.48Å; E545-L627 WeakPolarHBondContact O-CA 3.25Å; E545-C628 PolarHBondContact N-O 3.29Å; E545-C628 VanDerWaalsContact N-O 3.1Å; E545-C628 PolarHBondContact O-N 3Å; E545-Y630 HydrophobicContact CG-CE2 4.37Å; E545-Y630 WeakPolarHBondContact OE2-CE2 3.43Å; E545-Y630 PolarHBondContact OE2-OH 2.87Å
546	A	85	Confident	86.9	Confident	56 Å²	56	37 Å²	37	46%	0.463	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	131.1	173.1	0	0	0	0	0	110.9	L627	A546-L627 HydrophobicContact CB-CD2 3.81Å
547	Q	89.7	Confident	87.4	Confident	40 Å²	40	40.3 Å²	40.3	19%	0.187	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.3	177.2	-59.8	-178.2	5.7	0	0	110.2	H549 E625 V626 C628	Q547-H549 PolarHBondContact OE1-NE2 2.72Å; Q547-E625 WeakPolarHBondContact O-CA 3.39Å; Q547-V626 HydrophobicContact CB-CG2 4.07Å; Q547-V626 PolarHBondContact N-O 3.47Å; Q547-V626 PolarHBondContact O-N 3.16Å; Q547-C628 HydrophobicContact CG-CB 4.28Å
548	Y	90.7	Very high	87.6	Confident	111 Å²	111	43.4 Å²	43.4	44%	0.435	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.1	172.9	176.9	-92.2	0	0	0	110.1	G622	Y548-G622 VanDerWaalsContact CE2-O 3.29Å; Y548-G622 WeakPolarHBondContact CE2-O 3.23Å; Y548-G622 PolarHBondContact OH-O 3.32Å
549	H	91.8	Very high	87.8	Confident	33 Å²	33	44.5 Å²	44.5	15%	0.153	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.9	176.8	-65	-98.8	0	0	0	109.3	Q547 D553 I555 A618 G623 V624	Q547-H549 PolarHBondContact OE1-NE2 2.72Å; H549-D553 HydrophobicContact CB-CB 4.15Å; H549-I555 HydrophobicContact CB-CD1 4.29Å; H549-I555 HydrophobicContact CB-CG1 4.16Å; H549-A618 HydrophobicContact CB-CB 4.12Å; H549-G623 CarbonylContact O-C 3.59Å; H549-G623 VanDerWaalsContact O-CA 3.25Å; H549-G623 WeakPolarHBondContact O-CA 3.47Å; H549-V624 HydrophobicContact CB-CG1 3.88Å; H549-V624 PolarHBondContact N-O 2.83Å; H549-V624 PolarHBondContact O-N 3.33Å
550	S	92.6	Very high	88.2	Confident	42 Å²	42	46.8 Å²	46.8	29%	0.294	27%	0.266	S	S	.	.			trans	-75.1	160.9	-177.8	-55.2	0	0	0	0	111.8	G552 D553 A618	S550-G552 PolarHBondContact O-N 3.46Å; S550-G552 VanDerWaalsContact O-N 3.13Å; S550-D553 WeakPolarHBondContact CA-OD2 3.32Å; S550-D553 VanDerWaalsContact CB-OD2 3.22Å; S550-D553 WeakPolarHBondContact CB-OD2 3.41Å; S550-D553 PolarHBondContact N-OD2 2.89Å; S550-D553 VanDerWaalsContact O-CB 3.31Å; S550-D553 WeakPolarHBondContact O-CB 3.18Å; S550-D553 PolarHBondContact O-N 2.83Å; S550-D553 PolarHBondContact OG-OD2 3.02Å; S550-A618 WeakPolarHBondContact O-CB 3.36Å
551	A	92.1	Very high	88.3	Confident	58 Å²	58	52.7 Å²	52.7	48%	0.479	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	118.7	176.2	0	0	0	0	0	112.2	G620	A551-G620 WeakPolarHBondContact CB-O 3.45Å
552	G	91.1	Very high	88.2	Confident	50 Å²	50	52.9 Å²	52.9	52%	0.515	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	-9.9	-177.8	0	0	0	0	0	115.7	S550 A618	S550-G552 PolarHBondContact O-N 3.46Å; S550-G552 VanDerWaalsContact O-N 3.13Å; G552-A618 PolarHBondContact N-O 2.91Å
553	D	93.6	Very high	88.6	Confident	68 Å²	68	53.4 Å²	53.4	36%	0.364	30%	0.301	S	S	.	.			trans	-63.2	140.1	178.2	-71.7	-10.2	0	0	0	111.2	H549 S550 Y617 A618	H549-D553 HydrophobicContact CB-CB 4.15Å; S550-D553 WeakPolarHBondContact CA-OD2 3.32Å; S550-D553 VanDerWaalsContact CB-OD2 3.22Å; S550-D553 WeakPolarHBondContact CB-OD2 3.41Å; S550-D553 PolarHBondContact N-OD2 2.89Å; S550-D553 VanDerWaalsContact O-CB 3.31Å; S550-D553 WeakPolarHBondContact O-CB 3.18Å; S550-D553 PolarHBondContact O-N 2.83Å; S550-D553 PolarHBondContact OG-OD2 3.02Å; D553-Y617 CarbonylContact O-C 3.53Å; D553-Y617 VanDerWaalsContact O-CA 3.28Å; D553-Y617 WeakPolarHBondContact O-CA 3.15Å; D553-A618 PolarHBondContact O-N 3.46Å
554	C	93.3	Very high	89	Confident	37 Å²	37	53.2 Å²	53.2	25%	0.25	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	107.9	-179.9	-173.5	0	0	0	0	109.6	I556 Y617	C554-I556 PolarHBondContact SG-O 2.82Å; C554-I556 VanDerWaalsContact SG-O 3.33Å; C554-Y617 HydrophobicContact CB-CD1 3.8Å; C554-Y617 HydrophobicContact CB-CE1 3.63Å
555	I	93.7	Very high	89.4	Confident	20 Å²	20	52.9 Å²	52.9	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-33.4	-172.8	-47.9	175.3	0	0	0	110.9	H549 F566 V573 F601 V616 A618 V624	H549-I555 HydrophobicContact CB-CD1 4.29Å; H549-I555 HydrophobicContact CB-CG1 4.16Å; I555-F566 HydrophobicContact CG2-CE1 4.34Å; I555-F566 HydrophobicContact CG2-CE2 4.45Å; I555-F566 HydrophobicContact CG2-CZ 4.27Å; I555-V573 HydrophobicContact CD1-CG1 3.64Å; I555-F601 HydrophobicContact CD1-CZ 4.19Å; I555-F601 HydrophobicContact CG2-CE2 4.03Å; I555-F601 HydrophobicContact CG2-CZ 4.08Å; I555-V616 PolarHBondContact N-O 3.44Å; I555-A618 HydrophobicContact CD1-CB 4.31Å; I555-V624 HydrophobicContact CD1-CG1 3.76Å
556	I	93.1	Very high	89.9	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.6	174.6	-69.1	-175.4	0	0	0	107.6	C554 F566 F601 R612 A614 N615 V616	C554-I556 PolarHBondContact SG-O 2.82Å; C554-I556 VanDerWaalsContact SG-O 3.33Å; I556-F566 HydrophobicContact CD1-CD2 4Å; I556-F566 HydrophobicContact CD1-CE2 3.92Å; I556-F566 HydrophobicContact CG1-CD2 4.4Å; I556-F566 HydrophobicContact CG1-CE2 3.94Å; I556-F601 HydrophobicContact CD1-CD2 3.62Å; I556-F601 HydrophobicContact CD1-CE2 3.87Å; I556-F601 HydrophobicContact CG1-CD2 4.44Å; I556-F601 HydrophobicContact CG1-CE2 4.24Å; I556-R612 HydrophobicContact CG2-CB 3.8Å; I556-R612 HydrophobicContact CG2-CG 3.64Å; I556-A614 WeakPolarHBondContact CG2-O 3.35Å; I556-N615 CarbonylContact O-C 3.59Å; I556-N615 VanDerWaalsContact O-CA 3.28Å; I556-N615 WeakPolarHBondContact O-CA 3.4Å; I556-V616 HydrophobicContact CB-CB 4.06Å; I556-V616 HydrophobicContact CB-CG2 4.01Å; I556-V616 HydrophobicContact CD1-CG2 4.33Å; I556-V616 PolarHBondContact N-O 2.82Å; I556-V616 PolarHBondContact O-N 3.29Å
557	R	91.8	Very high	90.3	Very high	121 Å²	121	46.5 Å²	46.5	46%	0.457	26%	0.258	S	S	.	.			trans	-111.6	143	168.3	-144.3	173.8	-69.8	-88.1	-0.3	111.3	E560 R612 N615	R557-E560 HydrophobicContact CB-CG 3.92Å; R557-E560 WeakPolarHBondContact CB-OE1 3.38Å; R557-E560 WeakPolarHBondContact CB-OE2 3.46Å; R557-E560 PolarHBondContact N-OE2 2.84Å; R557-E560 WeakPolarHBondContact O-CB 3.41Å; R557-E560 PolarHBondContact O-N 2.87Å; R557-R612 WeakPolarHBondContact O-CB 3.47Å; R557-N615 WeakPolarHBondContact CA-OD1 3.49Å; R557-N615 WeakPolarHBondContact CG-OD1 3.09Å
558	Q	90.2	Very high	90.4	Very high	65 Å²	65	44.6 Å²	44.6	30%	0.304	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	140.5	178.3	-175.1	175.8	-43.8	0	0	110.7	E560 S578 N615	Q558-E560 VanDerWaalsContact C-N 3.25Å; Q558-E560 PolarHBondContact O-N 2.85Å; Q558-S578 PolarHBondContact NE2-O 2.78Å; Q558-N615 WeakPolarHBondContact CB-OD1 3.23Å; Q558-N615 PolarHBondContact N-OD1 3.37Å
559	G	85	Confident	90.4	Very high	34 Å²	34	41.5 Å²	41.5	35%	0.351	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-18.3	-179.6	0	0	0	0	0	115.6	R611 R612	G559-R611 PolarHBondContact O-NH1 3.45Å; G559-R612 PolarHBondContact N-O 3.37Å
560	E	87.3	Confident	90.4	Very high	94 Å²	94	42 Å²	42	44%	0.439	25%	0.246	S	C	.	.	S	Bend	trans	-61.1	158.9	174.8	-70.2	179.2	164.3	0	0	112.2	R557 Q558 R611 R612	R557-E560 HydrophobicContact CB-CG 3.92Å; R557-E560 WeakPolarHBondContact CB-OE1 3.38Å; R557-E560 WeakPolarHBondContact CB-OE2 3.46Å; R557-E560 PolarHBondContact N-OE2 2.84Å; R557-E560 WeakPolarHBondContact O-CB 3.41Å; R557-E560 PolarHBondContact O-N 2.87Å; Q558-E560 VanDerWaalsContact C-N 3.25Å; Q558-E560 PolarHBondContact O-N 2.85Å; E560-R611 CarbonylContact O-C 3.57Å; E560-R611 VanDerWaalsContact O-CA 3.3Å; E560-R611 WeakPolarHBondContact O-CA 3.46Å; E560-R612 HydrophobicContact CB-CG 4.08Å; E560-R612 WeakPolarHBondContact O-CG 3Å; E560-R612 PolarHBondContact O-N 3.48Å
561	L	84.9	Confident	90.4	Very high	123 Å²	123	41.8 Å²	41.8	64%	0.644	25%	0.251	S	S	*	.	B	Isolated β-bridge	trans	-76.9	137.7	173.6	-67.9	173.8	0	0	0	110.9	G610 R611	L561-G610 CarbonylContact C-O 3.6Å; L561-G610 WeakPolarHBondContact CA-O 3.29Å; L561-R611 HydrophobicContact CD2-CG 4.16Å
562	A	82.2	Confident	90.5	Very high	7 Å²	7	43.8 Å²	43.8	6%	0.058	25%	0.248	C	C	.	.			trans	-95.9	113.4	-173.4	0	0	0	0	0	112.7	A605 L606 G610 R612 R631	A562-A605 HydrophobicContact CB-CB 3.32Å; A562-L606 HydrophobicContact CB-CD2 3.9Å; A562-L606 VanDerWaalsContact O-CD2 3.27Å; A562-L606 WeakPolarHBondContact O-CD2 3.4Å; A562-G610 PolarHBondContact N-O 2.84Å; A562-R612 HydrophobicContact CB-CG 4.44Å; A562-R631 PolarHBondContact O-NH1 3.44Å; A562-R631 VanDerWaalsContact O-NH1 3.14Å
563	D	85.3	Confident	90.8	Very high	52 Å²	52	41.4 Å²	41.4	28%	0.278	22%	0.224	S	C	.	.			trans	-118.2	-8.7	-179.7	66.6	-11.9	0	0	0	114	R134 R612 Y630 R631	R134-D563 IonicContact CZ-OD2 3.95Å; R134-D563 IonicContact NH2-OD2 3.78Å; R134-D563 PolarHBondContact NH2-OD2 3.49Å; D563-R612 IonicContact OD1-NH2 2.68Å; D563-Y630 CarbonylContact O-C 3.55Å; D563-Y630 WeakPolarHBondContact O-CA 3.37Å; D563-R631 WeakPolarHBondContact O-CB 3.18Å; D563-R631 PolarHBondContact O-N 2.64Å
564	S	89	Confident	90.9	Very high	6 Å²	6	42.4 Å²	42.4	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.2	-167.3	-48.6	0	0	0	0	113.2	R612 Y630	S564-R612 VanDerWaalsContact O-CZ 3.29Å; S564-R612 PolarHBondContact O-NH1 2.81Å; S564-R612 PolarHBondContact O-NH2 2.98Å; S564-Y630 WeakPolarHBondContact OG-CD1 3.48Å
565	F	91.9	Very high	90.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	147.2	171.3	168.3	-103.9	0	0	0	109.5	L528 L567 Y600 E603 L606 C628 L629 F634 I638	L528-F565 HydrophobicContact CD2-CZ 4.05Å; F565-L567 HydrophobicContact CE1-CD1 4.01Å; F565-L567 HydrophobicContact CE1-CD2 4.11Å; F565-L567 HydrophobicContact CE1-CG 3.7Å; F565-L567 HydrophobicContact CZ-CD2 4.2Å; F565-L567 HydrophobicContact CZ-CG 4.23Å; F565-Y600 AromaticContact CE2-CD2 3.69Å; F565-Y600 HydrophobicContact CE2-CD2 3.69Å; F565-Y600 HydrophobicContact CE2-CG 4.07Å; F565-Y600 HydrophobicContact CZ-CD2 4.06Å; F565-Y600 HydrophobicContact CZ-CG 4.01Å; F565-E603 HydrophobicContact CD2-CB 3.94Å; F565-E603 HydrophobicContact CE2-CB 3.99Å; F565-L606 HydrophobicContact CB-CD1 3.66Å; F565-C628 CarbonylContact O-C 3.45Å; F565-C628 WeakPolarHBondContact O-CA 3.48Å; F565-L629 HydrophobicContact CB-CB 4.43Å; F565-L629 HydrophobicContact CD1-CB 4.14Å; F565-L629 PolarHBondContact N-O 3.37Å; F565-L629 PolarHBondContact O-N 2.9Å; F565-F634 HydrophobicContact CB-CB 4.39Å; F565-F634 HydrophobicContact CB-CD2 3.52Å; F565-F634 HydrophobicContact CB-CE2 4.03Å; F565-F634 HydrophobicContact CB-CG 4.1Å; F565-F634 AromaticContact CD1-CD2 3.84Å; F565-F634 HydrophobicContact CD1-CD2 3.84Å; F565-F634 HydrophobicContact CD1-CE2 4.21Å; F565-F634 AromaticContact CD2-CD2 3.84Å; F565-F634 HydrophobicContact CD2-CD2 3.84Å; F565-F634 AromaticContact CD2-CE2 3.49Å; F565-F634 HydrophobicContact CD2-CE2 3.49Å; F565-F634 VanDerWaalsContact CD2-CE2 3.49Å; F565-F634 HydrophobicContact CD2-CZ 4.43Å; F565-F634 HydrophobicContact CE1-CD2 4.46Å; F565-F634 HydrophobicContact CE2-CD2 4.46Å; F565-F634 AromaticContact CE2-CE2 3.88Å; F565-F634 HydrophobicContact CE2-CE2 3.88Å; F565-F634 AromaticContact CG-CD2 3.47Å; F565-F634 HydrophobicContact CG-CD2 3.47Å; F565-F634 VanDerWaalsContact CG-CD2 3.47Å; F565-F634 AromaticContact CG-CE2 3.67Å; F565-F634 HydrophobicContact CG-CE2 3.67Å; F565-F634 HydrophobicContact CG-CG 4.5Å; F565-F634 HydrophobicContact CZ-CE2 4.39Å; F565-I638 HydrophobicContact CD1-CD1 4.45Å; F565-I638 HydrophobicContact CE1-CD1 4.04Å
566	F	93.7	Very high	90.9	Very high	9 Å²	9	40.1 Å²	40.1	4%	0.039	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.9	-174.9	-58.4	-84.5	0	0	0	112.8	I555 I556 Y600 F601 V626 L627 C628	I555-F566 HydrophobicContact CG2-CE1 4.34Å; I555-F566 HydrophobicContact CG2-CE2 4.45Å; I555-F566 HydrophobicContact CG2-CZ 4.27Å; I556-F566 HydrophobicContact CD1-CD2 4Å; I556-F566 HydrophobicContact CD1-CE2 3.92Å; I556-F566 HydrophobicContact CG1-CD2 4.4Å; I556-F566 HydrophobicContact CG1-CE2 3.94Å; F566-Y600 WeakPolarHBondContact O-CA 3.46Å; F566-Y600 WeakPolarHBondContact O-CB 3.34Å; F566-F601 HydrophobicContact CB-CD1 4.34Å; F566-F601 HydrophobicContact CB-CD2 3.97Å; F566-F601 HydrophobicContact CB-CE1 3.95Å; F566-F601 HydrophobicContact CB-CE2 3.56Å; F566-F601 HydrophobicContact CB-CG 4.35Å; F566-F601 HydrophobicContact CB-CZ 3.55Å; F566-F601 AromaticContact CD2-CD2 3.87Å; F566-F601 HydrophobicContact CD2-CD2 3.87Å; F566-F601 AromaticContact CD2-CE2 3.44Å; F566-F601 HydrophobicContact CD2-CE2 3.44Å; F566-F601 VanDerWaalsContact CD2-CE2 3.44Å; F566-F601 HydrophobicContact CD2-CZ 4.21Å; F566-F601 HydrophobicContact CE2-CE2 4.29Å; F566-F601 HydrophobicContact CG-CD2 4.3Å; F566-F601 AromaticContact CG-CE2 3.66Å; F566-F601 HydrophobicContact CG-CE2 3.66Å; F566-F601 AromaticContact CG-CZ 3.96Å; F566-F601 HydrophobicContact CG-CZ 3.96Å; F566-F601 PolarHBondContact N-O 2.72Å; F566-F601 PolarHBondContact O-N 3.23Å; F566-V626 HydrophobicContact CB-CB 4.4Å; F566-V626 HydrophobicContact CD1-CB 4.27Å; F566-V626 HydrophobicContact CD1-CG2 3.71Å; F566-V626 HydrophobicContact CE1-CG2 4.32Å; F566-L627 WeakPolarHBondContact CA-O 3.16Å; F566-C628 HydrophobicContact CD1-CB 3.94Å; F566-C628 HydrophobicContact CE1-CB 3.83Å
567	L	92.7	Very high	90.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.2	170.8	-71	155.5	0	0	0	109.1	L523 V526 L529 L544 F565 Q569 V626 L627	L523-L567 HydrophobicContact CD2-CD1 3.98Å; V526-L567 HydrophobicContact CG1-CD2 3.76Å; V526-L567 HydrophobicContact CG2-CD2 4.06Å; L529-L567 HydrophobicContact CD1-CD1 4.11Å; L529-L567 HydrophobicContact CD1-CD2 4.36Å; L544-L567 HydrophobicContact CD1-CD1 3.99Å; L544-L567 HydrophobicContact CD2-CD1 4.23Å; F565-L567 HydrophobicContact CE1-CD1 4.01Å; F565-L567 HydrophobicContact CE1-CD2 4.11Å; F565-L567 HydrophobicContact CE1-CG 3.7Å; F565-L567 HydrophobicContact CZ-CD2 4.2Å; F565-L567 HydrophobicContact CZ-CG 4.23Å; L567-Q569 PolarHBondContact O-N 3.48Å; L567-V626 CarbonylContact O-C 3.36Å; L567-V626 VanDerWaalsContact O-CA 3.23Å; L567-V626 WeakPolarHBondContact O-CA 3.24Å; L567-L627 HydrophobicContact CB-CB 4.3Å; L567-L627 PolarHBondContact N-O 2.8Å; L567-L627 PolarHBondContact O-N 3.45Å
568	I	93	Very high	90.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	112.2	-177.9	-58.3	165.5	0	0	0	109.9	F522 V573 L595 T596 K597 G598 E599 F601 V624 V626	F522-I568 WeakPolarHBondContact CZ-O 3.29Å; I568-V573 HydrophobicContact CD1-CG2 3.81Å; I568-L595 HydrophobicContact CD1-CB 3.55Å; I568-T596 WeakPolarHBondContact CB-O 3Å; I568-T596 WeakPolarHBondContact CD1-O 3.46Å; I568-K597 WeakPolarHBondContact O-CA 3.21Å; I568-G598 PolarHBondContact O-N 3.23Å; I568-E599 HydrophobicContact CD1-CB 4.47Å; I568-E599 PolarHBondContact N-O 3.38Å; I568-F601 HydrophobicContact CD1-CD1 4.1Å; I568-F601 HydrophobicContact CD1-CE1 4Å; I568-F601 HydrophobicContact CG1-CD1 4.17Å; I568-F601 HydrophobicContact CG1-CE1 3.77Å; I568-V624 HydrophobicContact CG2-CG2 4.03Å; I568-V626 HydrophobicContact CG1-CG1 4.32Å
569	Q	90.3	Very high	90	Very high	47 Å²	47	36 Å²	36	22%	0.22	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-40	179.3	-176	175.1	-65.3	0	0	112	F522 L567 K597 E625 L627	F522-Q569 HydrophobicContact CZ-CB 4.28Å; L567-Q569 PolarHBondContact O-N 3.48Å; Q569-K597 WeakPolarHBondContact O-CD 3.3Å; Q569-K597 WeakPolarHBondContact O-CE 3.41Å; Q569-K597 VanDerWaalsContact O-CG 3.32Å; Q569-K597 WeakPolarHBondContact O-CG 3.37Å; Q569-E625 HydrophobicContact CB-CG 4.37Å; Q569-E625 PolarHBondContact N-O 2.91Å; Q569-E625 PolarHBondContact NE2-OE1 3.42Å; Q569-E625 PolarHBondContact NE2-OE2 3.16Å; Q569-L627 HydrophobicContact CB-CG 4.39Å
570	S	91.3	Very high	89.3	Confident	44 Å²	44	39.5 Å²	39.5	31%	0.308	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.2	173.8	71.7	0	0	0	0	111.6	V624 E625	S570-V624 WeakPolarHBondContact O-CA 3.43Å; S570-V624 WeakPolarHBondContact O-CG2 3.32Å; S570-E625 PolarHBondContact N-O 2.91Å; S570-E625 PolarHBondContact O-N 3.02Å; S570-E625 VanDerWaalsContact OG-CB 3.24Å; S570-E625 WeakPolarHBondContact OG-CB 3.38Å; S570-E625 PolarHBondContact OG-OE2 3.2Å
571	G	92.6	Very high	88.2	Confident	37 Å²	37	39.6 Å²	39.6	38%	0.381	22%	0.22	S	C	.	.	S	Bend	trans	85.7	-158.8	-175.9	0	0	0	0	0	114.1
572	K	95.4	Very high	86.5	Confident	100 Å²	100	42 Å²	42	44%	0.435	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	157.1	178.5	-63.8	-166.8	176.6	-170.8	0	111.5	L595 T596 V619	K572-L595 WeakPolarHBondContact CA-O 3.45Å; K572-T596 HydrophobicContact CD-CG2 4.09Å; K572-T596 HydrophobicContact CG-CG2 4.09Å; K572-V619 HydrophobicContact CB-CB 4.3Å; K572-V619 PolarHBondContact O-N 3.33Å
573	V	96.1	Very high	85.4	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.4	166.9	-56.2	0	0	0	0	111.2	I555 I568 Q594 L595 F601 V616 Y617 V624	I555-V573 HydrophobicContact CD1-CG1 3.64Å; I568-V573 HydrophobicContact CD1-CG2 3.81Å; V573-Q594 CarbonylContact O-C 3.46Å; V573-Q594 VanDerWaalsContact O-CA 3.24Å; V573-Q594 WeakPolarHBondContact O-CA 3.28Å; V573-L595 HydrophobicContact CG2-CB 3.74Å; V573-L595 HydrophobicContact CG2-CD1 4.31Å; V573-L595 HydrophobicContact CG2-CG 4.36Å; V573-L595 PolarHBondContact N-O 3.2Å; V573-L595 PolarHBondContact O-N 3.5Å; V573-F601 HydrophobicContact CG1-CE1 4.13Å; V573-F601 HydrophobicContact CG1-CZ 4.4Å; V573-F601 HydrophobicContact CG2-CD1 4.15Å; V573-F601 HydrophobicContact CG2-CE1 3.96Å; V573-V616 HydrophobicContact CB-CG1 3.72Å; V573-V616 HydrophobicContact CG1-CG1 4.14Å; V573-V616 HydrophobicContact CG2-CG1 3.75Å; V573-Y617 CarbonylContact C-O 3.52Å; V573-Y617 WeakPolarHBondContact CA-O 3.22Å; V573-Y617 VanDerWaalsContact CB-O 3.29Å; V573-Y617 WeakPolarHBondContact CB-O 3.4Å; V573-V624 HydrophobicContact CG1-CB 4.45Å; V573-V624 HydrophobicContact CG1-CG1 4.11Å; V573-V624 HydrophobicContact CG1-CG2 3.96Å
574	R	95.2	Very high	83.9	Confident	89 Å²	89	46 Å²	46	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.8	164.2	63.1	176.1	-174.7	164.3	6.3	110.3	E591 Q594 V616 Y617 V619	R574-E591 HydrophobicContact CB-CG 4.27Å; R574-E591 WeakPolarHBondContact CD-OE2 3.37Å; R574-E591 IonicContact NH1-OE2 3.75Å; R574-Q594 HydrophobicContact CB-CG 4.17Å; R574-V616 WeakPolarHBondContact O-CA 3.37Å; R574-Y617 HydrophobicContact CG-CD2 4.42Å; R574-Y617 PolarHBondContact N-O 3.08Å; R574-Y617 PolarHBondContact O-N 3.22Å; R574-V619 HydrophobicContact CB-CG2 3.8Å; R574-V619 HydrophobicContact CG-CG2 3.64Å
575	V	94.5	Very high	82.5	Confident	6 Å²	6	54.1 Å²	54.1	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.3	177.5	-173.5	0	0	0	0	108.5	I592 R593 L595 A614 N615 V616	V575-I592 PolarHBondContact O-N 3.07Å; V575-R593 HydrophobicContact CB-CG 3.83Å; V575-R593 HydrophobicContact CG1-CG 4.47Å; V575-R593 HydrophobicContact CG2-CG 4.05Å; V575-R593 PolarHBondContact N-O 3.22Å; V575-L595 HydrophobicContact CG2-CD1 3.84Å; V575-L595 HydrophobicContact CG2-CG 4.15Å; V575-A614 HydrophobicContact CG1-CB 3.79Å; V575-N615 WeakPolarHBondContact CA-O 3.39Å; V575-V616 HydrophobicContact CG1-CG2 4.47Å; V575-V616 HydrophobicContact CG2-CG2 4.29Å
576	T	93.2	Very high	81	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	152	-175.6	47.2	0	0	0	0	110.7	E589 T590 E591 A614 N615 Y617	T576-E589 VanDerWaalsContact CB-OE1 3.24Å; T576-E589 WeakPolarHBondContact CB-OE1 3.46Å; T576-E589 HydrophobicContact CG2-CG 3.98Å; T576-E589 PolarHBondContact OG1-OE1 2.92Å; T576-T590 CarbonylContact C-O 3.08Å; T576-T590 WeakPolarHBondContact CA-O 3.46Å; T576-T590 WeakPolarHBondContact CB-O 3.41Å; T576-E591 HydrophobicContact CG2-CB 3.85Å; T576-E591 HydrophobicContact CG2-CG 4.11Å; T576-A614 CarbonylContact O-C 3.58Å; T576-A614 WeakPolarHBondContact O-CA 3.32Å; T576-A614 WeakPolarHBondContact O-CB 3.48Å; T576-N615 PolarHBondContact N-O 2.73Å; T576-N615 VanDerWaalsContact N-O 3.08Å; T576-N615 PolarHBondContact O-N 2.74Å; T576-N615 WeakPolarHBondContact OG1-CB 3.47Å; T576-Y617 WeakPolarHBondContact OG1-CE2 3.2Å
577	I	90.3	Very high	79.9	Confident	32 Å²	32	64.7 Å²	64.7	16%	0.164	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.1	167.8	-74.5	178.7	0	0	0	109.4	E589 T590 I592 A614	I577-E589 WeakPolarHBondContact O-CA 3.46Å; I577-T590 PolarHBondContact N-O 3.39Å; I577-T590 PolarHBondContact O-N 2.86Å; I577-T590 PolarHBondContact O-OG1 2.81Å; I577-I592 HydrophobicContact CB-CD1 3.87Å; I577-I592 HydrophobicContact CD1-CD1 3.49Å; I577-I592 VanDerWaalsContact CD1-CD1 3.49Å; I577-I592 HydrophobicContact CG1-CD1 3.49Å; I577-I592 VanDerWaalsContact CG1-CD1 3.49Å; I577-A614 HydrophobicContact CD1-CB 4.38Å; I577-A614 HydrophobicContact CG1-CB 3.73Å
578	S	86.8	Confident	79.2	Confident	29 Å²	29	70.3 Å²	70.3	20%	0.203	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.6	167.8	-52.6	0	0	0	0	109.1	Q558 N615	Q558-S578 PolarHBondContact NE2-O 2.78Å; S578-N615 PolarHBondContact OG-ND2 3.14Å; S578-N615 VanDerWaalsContact OG-ND2 3.08Å
579	S	78.9	Confident	78.9	Confident	43 Å²	43	73.9 Å²	73.9	30%	0.301	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	139.1	176.8	-68.9	0	0	0	0	110.5	T587 K588	S579-T587 CarbonylContact O-C 3.51Å; S579-T587 VanDerWaalsContact O-CA 3.3Å; S579-T587 WeakPolarHBondContact O-CA 3.34Å; S579-K588 PolarHBondContact N-O 3.06Å; S579-K588 PolarHBondContact O-N 3.48Å
580	P	71.2	Confident	78.8	Confident	108 Å²	108	74.3 Å²	74.3	70%	0.701	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	141.2	174.7	29.3	-34.4	0	0	0	110.6
581	Q	62.7	Low	78.7	Confident	97 Å²	97	76.5 Å²	76.5	45%	0.453	43%	0.431	S	S	.	.			trans	-87.3	158.7	168	-61.9	-149.2	-82.8	0	0	111.5	G583 E586 K588	Q581-G583 PolarHBondContact O-N 2.97Å; Q581-E586 PolarHBondContact N-O 3.4Å; Q581-K588 HydrophobicContact CG-CB 3.77Å
582	N	51.1	Low	78.5	Confident	172 Å²	172	77.4 Å²	77.4	92%	0.92	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	106.2	-175.5	-70.6	-11	0	0	0	112.1
583	G	57.5	Low	78.3	Confident	93 Å²	93	75.6 Å²	75.6	96%	0.959	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	4.8	169	0	0	0	0	0	116.7	Q581	Q581-G583 PolarHBondContact O-N 2.97Å
584	S	55	Low	78.2	Confident	50 Å²	50	80.1 Å²	80.1	35%	0.35	44%	0.438	S	S	.	.	S	Bend	trans	-118.9	157.7	175	72.6	0	0	0	0	112.2	E586	S584-E586 PolarHBondContact O-N 2.86Å; S584-E586 PolarHBondContact OG-N 3.06Å
585	N	59.1	Low	78.1	Confident	178 Å²	178	76.5 Å²	76.5	95%	0.952	43%	0.425	S	S	*	.	S	Bend	trans	-75.6	8.3	171.1	-80.6	-16.7	0	0	0	112.9
586	E	61	Low	78	Confident	141 Å²	141	78.6 Å²	78.6	66%	0.659	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-89.9	116.5	-179.6	-63.1	-173.8	137.2	0	0	110.5	Q581 S584	Q581-E586 PolarHBondContact N-O 3.4Å; S584-E586 PolarHBondContact O-N 2.86Å; S584-E586 PolarHBondContact OG-N 3.06Å
587	T	69.2	Low	77.9	Confident	89 Å²	89	84.8 Å²	84.8	55%	0.546	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	118.7	170.7	54.9	0	0	0	0	109.9	S579	S579-T587 CarbonylContact O-C 3.51Å; S579-T587 VanDerWaalsContact O-CA 3.3Å; S579-T587 WeakPolarHBondContact O-CA 3.34Å
588	K	79.7	Confident	77.9	Confident	119 Å²	119	83.8 Å²	83.8	52%	0.517	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.2	167.9	-177.4	173.1	178.6	178.5	0	108.9	S579 Q581 T590	S579-K588 PolarHBondContact N-O 3.06Å; S579-K588 PolarHBondContact O-N 3.48Å; Q581-K588 HydrophobicContact CG-CB 3.77Å; K588-T590 HydrophobicContact CD-CG2 4.5Å; K588-T590 HydrophobicContact CG-CG2 4.3Å
589	E	85.9	Confident	78.1	Confident	74 Å²	74	85.8 Å²	85.8	35%	0.346	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.8	170.4	-175.5	165.1	-138.3	0	0	110.5	T576 I577 N615 Y617	T576-E589 VanDerWaalsContact CB-OE1 3.24Å; T576-E589 WeakPolarHBondContact CB-OE1 3.46Å; T576-E589 HydrophobicContact CG2-CG 3.98Å; T576-E589 PolarHBondContact OG1-OE1 2.92Å; I577-E589 WeakPolarHBondContact O-CA 3.46Å; E589-N615 PolarHBondContact OE1-ND2 3.27Å; E589-Y617 WeakPolarHBondContact OE1-CE2 3.48Å
590	T	87.8	Confident	78.7	Confident	56 Å²	56	85.1 Å²	85.1	34%	0.344	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.5	179	51.9	0	0	0	0	111	T576 I577 K588	T576-T590 CarbonylContact C-O 3.08Å; T576-T590 WeakPolarHBondContact CA-O 3.46Å; T576-T590 WeakPolarHBondContact CB-O 3.41Å; I577-T590 PolarHBondContact N-O 3.39Å; I577-T590 PolarHBondContact O-N 2.86Å; I577-T590 PolarHBondContact O-OG1 2.81Å; K588-T590 HydrophobicContact CD-CG2 4.5Å; K588-T590 HydrophobicContact CG-CG2 4.3Å
591	E	90	Very high	79.7	Confident	90 Å²	90	80.4 Å²	80.4	42%	0.421	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.7	174.2	-166.8	166.9	143.4	0	0	110.2	R574 T576 Q594	R574-E591 HydrophobicContact CB-CG 4.27Å; R574-E591 WeakPolarHBondContact CD-OE2 3.37Å; R574-E591 IonicContact NH1-OE2 3.75Å; T576-E591 HydrophobicContact CG2-CB 3.85Å; T576-E591 HydrophobicContact CG2-CG 4.11Å; E591-Q594 WeakPolarHBondContact OE1-CG 3.43Å; E591-Q594 PolarHBondContact OE1-NE2 3.01Å
592	I	88.2	Confident	80.9	Confident	57 Å²	57	76.2 Å²	76.2	29%	0.292	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-44.4	-173	-59.3	176.8	0	0	0	110.9	V575 I577	V575-I592 PolarHBondContact O-N 3.07Å; I577-I592 HydrophobicContact CB-CD1 3.87Å; I577-I592 HydrophobicContact CD1-CD1 3.49Å; I577-I592 VanDerWaalsContact CD1-CD1 3.49Å; I577-I592 HydrophobicContact CG1-CD1 3.49Å; I577-I592 VanDerWaalsContact CG1-CD1 3.49Å
593	R	90.9	Very high	82.7	Confident	62 Å²	62	68.6 Å²	68.6	23%	0.234	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	153.6	-175.9	53.1	-175	161	-93.7	-8	111	V575 D651	V575-R593 HydrophobicContact CB-CG 3.83Å; V575-R593 HydrophobicContact CG1-CG 4.47Å; V575-R593 HydrophobicContact CG2-CG 4.05Å; V575-R593 PolarHBondContact N-O 3.22Å; R593-D651 IonicContact CZ-OD1 3.26Å; R593-D651 VanDerWaalsContact CZ-OD1 3.23Å; R593-D651 IonicContact CZ-OD2 3.9Å; R593-D651 IonicContact NH1-OD1 3.98Å; R593-D651 PolarHBondContact NH1-OD1 3.02Å; R593-D651 VanDerWaalsContact NH2-CG 3.33Å; R593-D651 IonicContact NH2-OD1 3.51Å; R593-D651 PolarHBondContact NH2-OD1 2.86Å; R593-D651 IonicContact NH2-OD2 2.77Å; R593-D651 PolarHBondContact NH2-OD2 3.1Å
594	Q	93.1	Very high	83.9	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.444	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	147	164.9	-63.7	-176.7	6.8	0	0	108.8	V573 R574 E591	V573-Q594 CarbonylContact O-C 3.46Å; V573-Q594 VanDerWaalsContact O-CA 3.24Å; V573-Q594 WeakPolarHBondContact O-CA 3.28Å; R574-Q594 HydrophobicContact CB-CG 4.17Å; E591-Q594 WeakPolarHBondContact OE1-CG 3.43Å; E591-Q594 PolarHBondContact OE1-NE2 3.01Å
595	L	93	Very high	85.1	Confident	13 Å²	13	64.6 Å²	64.6	7%	0.068	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.2	178.4	-54.3	171.7	0	0	0	109.7	I568 K572 V573 V575 E599 F601	I568-L595 HydrophobicContact CD1-CB 3.55Å; K572-L595 WeakPolarHBondContact CA-O 3.45Å; V573-L595 HydrophobicContact CG2-CB 3.74Å; V573-L595 HydrophobicContact CG2-CD1 4.31Å; V573-L595 HydrophobicContact CG2-CG 4.36Å; V573-L595 PolarHBondContact N-O 3.2Å; V573-L595 PolarHBondContact O-N 3.5Å; V575-L595 HydrophobicContact CG2-CD1 3.84Å; V575-L595 HydrophobicContact CG2-CG 4.15Å; L595-E599 HydrophobicContact CB-CB 4.2Å; L595-E599 HydrophobicContact CD2-CB 4.45Å; L595-E599 VanDerWaalsContact CD2-OE1 3.25Å; L595-E599 WeakPolarHBondContact CD2-OE1 3.32Å; L595-F601 HydrophobicContact CD1-CB 3.89Å; L595-F601 HydrophobicContact CD1-CD1 4.12Å; L595-F601 HydrophobicContact CD1-CG 4.41Å
596	T	93.9	Very high	86.1	Confident	49 Å²	49	56.1 Å²	56.1	30%	0.301	28%	0.275	S	S	.	.			trans	-136	-178.1	-165.9	71.3	0	0	0	0	111.7	I568 K572 G598 E599	I568-T596 WeakPolarHBondContact CB-O 3Å; I568-T596 WeakPolarHBondContact CD1-O 3.46Å; K572-T596 HydrophobicContact CD-CG2 4.09Å; K572-T596 HydrophobicContact CG-CG2 4.09Å; T596-G598 PolarHBondContact O-N 3.4Å; T596-E599 WeakPolarHBondContact CA-OE2 3.36Å; T596-E599 WeakPolarHBondContact CB-OE2 3.4Å; T596-E599 PolarHBondContact N-OE2 3Å; T596-E599 WeakPolarHBondContact O-CB 3.41Å; T596-E599 PolarHBondContact O-N 3.19Å; T596-E599 PolarHBondContact OG1-OE2 3.04Å
597	K	91.2	Very high	87.1	Confident	133 Å²	133	52.4 Å²	52.4	58%	0.578	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	129.4	-177	178.1	173.8	-175.9	170	0	112.2	F522 I568 Q569 E599	F522-K597 HydrophobicContact CE2-CG 4.23Å; I568-K597 WeakPolarHBondContact O-CA 3.21Å; Q569-K597 WeakPolarHBondContact O-CD 3.3Å; Q569-K597 WeakPolarHBondContact O-CE 3.41Å; Q569-K597 VanDerWaalsContact O-CG 3.32Å; Q569-K597 WeakPolarHBondContact O-CG 3.37Å; K597-E599 VanDerWaalsContact C-N 3.33Å
598	G	88.7	Confident	87.2	Confident	12 Å²	12	50.2 Å²	50.2	12%	0.124	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-11.9	-178.6	0	0	0	0	0	114.2	I568 T596	I568-G598 PolarHBondContact O-N 3.23Å; T596-G598 PolarHBondContact O-N 3.4Å
599	E	92	Very high	86.5	Confident	70 Å²	70	53.9 Å²	53.9	33%	0.327	27%	0.274	S	S	.	.			trans	-87.6	168.2	173.1	-58	179.7	79.3	0	0	111.8	I568 L595 T596 K597	I568-E599 HydrophobicContact CD1-CB 4.47Å; I568-E599 PolarHBondContact N-O 3.38Å; L595-E599 HydrophobicContact CB-CB 4.2Å; L595-E599 HydrophobicContact CD2-CB 4.45Å; L595-E599 VanDerWaalsContact CD2-OE1 3.25Å; L595-E599 WeakPolarHBondContact CD2-OE1 3.32Å; T596-E599 WeakPolarHBondContact CA-OE2 3.36Å; T596-E599 WeakPolarHBondContact CB-OE2 3.4Å; T596-E599 PolarHBondContact N-OE2 3Å; T596-E599 WeakPolarHBondContact O-CB 3.41Å; T596-E599 PolarHBondContact O-N 3.19Å; T596-E599 PolarHBondContact OG1-OE2 3.04Å; K597-E599 VanDerWaalsContact C-N 3.33Å
600	Y	92.5	Very high	86	Confident	30 Å²	30	50.9 Å²	50.9	12%	0.118	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.9	-171.7	60	-93.8	0	0	0	113.3	L528 F565 F566 E603 L644 K647	L528-Y600 HydrophobicContact CB-CD1 4.3Å; L528-Y600 HydrophobicContact CB-CE1 3.73Å; L528-Y600 HydrophobicContact CD2-CD1 4.06Å; L528-Y600 HydrophobicContact CD2-CD2 4.34Å; L528-Y600 HydrophobicContact CD2-CE1 3.82Å; L528-Y600 HydrophobicContact CD2-CE2 4.08Å; L528-Y600 HydrophobicContact CD2-CG 4.31Å; L528-Y600 HydrophobicContact CG-CE1 4.29Å; F565-Y600 AromaticContact CE2-CD2 3.69Å; F565-Y600 HydrophobicContact CE2-CD2 3.69Å; F565-Y600 HydrophobicContact CE2-CG 4.07Å; F565-Y600 HydrophobicContact CZ-CD2 4.06Å; F565-Y600 HydrophobicContact CZ-CG 4.01Å; F566-Y600 WeakPolarHBondContact O-CA 3.46Å; F566-Y600 WeakPolarHBondContact O-CB 3.34Å; Y600-E603 HydrophobicContact CD2-CG 4.46Å; Y600-E603 VanDerWaalsContact CD2-OE1 3.3Å; Y600-E603 WeakPolarHBondContact CD2-OE1 3.39Å; Y600-E603 HydrophobicContact CE2-CG 4.25Å; Y600-E603 VanDerWaalsContact CE2-OE1 3.31Å; Y600-E603 WeakPolarHBondContact CE2-OE1 3.25Å; Y600-L644 HydrophobicContact CD2-CD2 4.46Å; Y600-L644 HydrophobicContact CE2-CD2 3.75Å; Y600-K647 HydrophobicContact CE2-CD 3.85Å; Y600-K647 PolarHBondContact O-NZ 3.31Å
601	F	92.2	Very high	85.8	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.1	180	60.7	-94.8	0	0	0	113.6	I555 I556 F566 I568 V573 L595 V616 V626	I555-F601 HydrophobicContact CD1-CZ 4.19Å; I555-F601 HydrophobicContact CG2-CE2 4.03Å; I555-F601 HydrophobicContact CG2-CZ 4.08Å; I556-F601 HydrophobicContact CD1-CD2 3.62Å; I556-F601 HydrophobicContact CD1-CE2 3.87Å; I556-F601 HydrophobicContact CG1-CD2 4.44Å; I556-F601 HydrophobicContact CG1-CE2 4.24Å; F566-F601 HydrophobicContact CB-CD1 4.34Å; F566-F601 HydrophobicContact CB-CD2 3.97Å; F566-F601 HydrophobicContact CB-CE1 3.95Å; F566-F601 HydrophobicContact CB-CE2 3.56Å; F566-F601 HydrophobicContact CB-CG 4.35Å; F566-F601 HydrophobicContact CB-CZ 3.55Å; F566-F601 AromaticContact CD2-CD2 3.87Å; F566-F601 HydrophobicContact CD2-CD2 3.87Å; F566-F601 AromaticContact CD2-CE2 3.44Å; F566-F601 HydrophobicContact CD2-CE2 3.44Å; F566-F601 VanDerWaalsContact CD2-CE2 3.44Å; F566-F601 HydrophobicContact CD2-CZ 4.21Å; F566-F601 HydrophobicContact CE2-CE2 4.29Å; F566-F601 HydrophobicContact CG-CD2 4.3Å; F566-F601 AromaticContact CG-CE2 3.66Å; F566-F601 HydrophobicContact CG-CE2 3.66Å; F566-F601 AromaticContact CG-CZ 3.96Å; F566-F601 HydrophobicContact CG-CZ 3.96Å; F566-F601 PolarHBondContact N-O 2.72Å; F566-F601 PolarHBondContact O-N 3.23Å; I568-F601 HydrophobicContact CD1-CD1 4.1Å; I568-F601 HydrophobicContact CD1-CE1 4Å; I568-F601 HydrophobicContact CG1-CD1 4.17Å; I568-F601 HydrophobicContact CG1-CE1 3.77Å; V573-F601 HydrophobicContact CG1-CE1 4.13Å; V573-F601 HydrophobicContact CG1-CZ 4.4Å; V573-F601 HydrophobicContact CG2-CD1 4.15Å; V573-F601 HydrophobicContact CG2-CE1 3.96Å; L595-F601 HydrophobicContact CD1-CB 3.89Å; L595-F601 HydrophobicContact CD1-CD1 4.12Å; L595-F601 HydrophobicContact CD1-CG 4.41Å; F601-V616 HydrophobicContact CD2-CB 4.43Å; F601-V616 HydrophobicContact CD2-CG1 4.13Å; F601-V616 HydrophobicContact CD2-CG2 4.03Å; F601-V616 HydrophobicContact CE1-CG1 4.3Å; F601-V616 HydrophobicContact CE2-CB 4.29Å; F601-V616 HydrophobicContact CE2-CG1 3.87Å; F601-V616 HydrophobicContact CE2-CG2 4.38Å; F601-V616 HydrophobicContact CG-CG1 4.46Å; F601-V616 HydrophobicContact CZ-CG1 3.96Å; F601-V626 HydrophobicContact CE1-CG1 4.31Å; F601-V626 HydrophobicContact CZ-CG1 4.22Å
602	G	87.8	Confident	85.8	Confident	10 Å²	10	51.5 Å²	51.5	10%	0.103	26%	0.255	C	S	.	.	S	Bend	trans	96.4	-3.9	174.8	0	0	0	0	0	114.6	R612	G602-R612 PolarHBondContact O-NH1 3.31Å; G602-R612 VanDerWaalsContact O-NH1 3.14Å
603	E	87.5	Confident	85.8	Confident	11 Å²	11	51.4 Å²	51.4	5%	0.051	26%	0.257	C	S	.	.			trans	-60.1	-44.1	176.8	72.8	-66.9	-116.8	0	0	114.1	F565 Y600 A605 L606 L607 F634 L644 K647 Y649	F565-E603 HydrophobicContact CD2-CB 3.94Å; F565-E603 HydrophobicContact CE2-CB 3.99Å; Y600-E603 HydrophobicContact CD2-CG 4.46Å; Y600-E603 VanDerWaalsContact CD2-OE1 3.3Å; Y600-E603 WeakPolarHBondContact CD2-OE1 3.39Å; Y600-E603 HydrophobicContact CE2-CG 4.25Å; Y600-E603 VanDerWaalsContact CE2-OE1 3.31Å; Y600-E603 WeakPolarHBondContact CE2-OE1 3.25Å; E603-A605 PolarHBondContact O-N 3.04Å; E603-A605 VanDerWaalsContact O-N 3.16Å; E603-L606 WeakPolarHBondContact O-CB 3.34Å; E603-L606 PolarHBondContact O-N 2.93Å; E603-L607 PolarHBondContact O-N 3.13Å; E603-L607 VanDerWaalsContact O-N 3.12Å; E603-F634 HydrophobicContact CB-CE2 4.29Å; E603-F634 HydrophobicContact CB-CZ 4Å; E603-L644 HydrophobicContact CB-CD2 3.88Å; E603-L644 HydrophobicContact CG-CD2 3.97Å; E603-K647 IonicContact OE1-NZ 3.33Å; E603-K647 PolarHBondContact OE1-NZ 3.33Å; E603-Y649 VanDerWaalsContact CG-OH 3.31Å; E603-Y649 WeakPolarHBondContact CG-OH 3.22Å
604	K	82.2	Confident	85.8	Confident	55 Å²	55	48.9 Å²	48.9	24%	0.239	25%	0.249	C	C	.	.	H	α-helix	trans	-57.2	-39.5	-170.7	-167.2	167.1	-171.4	160.9	0	112	G608 T613 Y649	K604-G608 PolarHBondContact O-N 2.93Å; K604-T613 HydrophobicContact CD-CG2 4.45Å; K604-Y649 HydrophobicContact CD-CD1 4.21Å; K604-Y649 HydrophobicContact CD-CD2 4.05Å; K604-Y649 HydrophobicContact CD-CE1 4.03Å; K604-Y649 HydrophobicContact CD-CE2 3.86Å; K604-Y649 HydrophobicContact CD-CG 4.24Å; K604-Y649 HydrophobicContact CG-CE2 4.39Å; K604-Y649 VanDerWaalsContact NZ-CD2 3.27Å
605	A	80.7	Confident	85.8	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-79.6	-17.1	178.9	0	0	0	0	0	114.5	A562 E603 G610 R611 R631	A562-A605 HydrophobicContact CB-CB 3.32Å; E603-A605 PolarHBondContact O-N 3.04Å; E603-A605 VanDerWaalsContact O-N 3.16Å; A605-G610 WeakPolarHBondContact O-CA 3.29Å; A605-G610 PolarHBondContact O-N 2.68Å; A605-R611 VanDerWaalsContact CB-C 3.46Å; A605-R611 WeakPolarHBondContact CB-O 3.14Å; A605-R631 PolarHBondContact O-NH1 3.03Å
606	L	81.4	Confident	85.9	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-82.2	-35.2	173.9	-62.6	179.4	0	0	0	111.7	A562 F565 E603 R631 F634	A562-L606 HydrophobicContact CB-CD2 3.9Å; A562-L606 VanDerWaalsContact O-CD2 3.27Å; A562-L606 WeakPolarHBondContact O-CD2 3.4Å; F565-L606 HydrophobicContact CB-CD1 3.66Å; E603-L606 WeakPolarHBondContact O-CB 3.34Å; E603-L606 PolarHBondContact O-N 2.93Å; L606-R631 HydrophobicContact CD2-CB 3.93Å; L606-R631 HydrophobicContact CD2-CG 3.95Å; L606-R631 PolarHBondContact O-NH2 3.43Å; L606-F634 HydrophobicContact CB-CD1 3.68Å; L606-F634 HydrophobicContact CB-CE1 3.48Å; L606-F634 VanDerWaalsContact CB-CE1 3.48Å; L606-F634 HydrophobicContact CB-CZ 4.28Å; L606-F634 HydrophobicContact CD1-CB 4.1Å; L606-F634 HydrophobicContact CD1-CD1 3.46Å; L606-F634 VanDerWaalsContact CD1-CD1 3.46Å; L606-F634 HydrophobicContact CD1-CD2 4.08Å; L606-F634 HydrophobicContact CD1-CE1 3.82Å; L606-F634 HydrophobicContact CD1-CE2 4.38Å; L606-F634 HydrophobicContact CD1-CG 3.6Å; L606-F634 HydrophobicContact CD1-CZ 4.25Å; L606-F634 HydrophobicContact CG-CD1 4.22Å; L606-F634 HydrophobicContact CG-CE1 4.31Å
607	L	80.2	Confident	86	Confident	63 Å²	63	43.4 Å²	43.4	33%	0.33	22%	0.22	S	C	.	.	H	α-helix	trans	-82.7	-34.5	179.6	-60	166.6	0	0	0	112.7	E603 F634 L644	E603-L607 PolarHBondContact O-N 3.13Å; E603-L607 VanDerWaalsContact O-N 3.12Å; L607-F634 HydrophobicContact CD1-CZ 4.43Å; L607-F634 HydrophobicContact CD2-CE1 3.85Å; L607-F634 HydrophobicContact CD2-CZ 4.22Å; L607-F634 HydrophobicContact CG-CE1 4.03Å; L607-F634 HydrophobicContact CG-CZ 4.19Å; L607-L644 HydrophobicContact CD1-CB 3.92Å; L607-L644 HydrophobicContact CD1-CD1 4.45Å
608	G	73.3	Confident	86.3	Confident	43 Å²	43	37.2 Å²	37.2	44%	0.443	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-142.9	179	0	0	0	0	0	114.7	K604 G610	K604-G608 PolarHBondContact O-N 2.93Å; G608-G610 PolarHBondContact O-N 2.99Å
609	E	64.2	Low	86.4	Confident	195 Å²	195	38.7 Å²	38.7	91%	0.911	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	5.7	-168.8	-55.6	-178.3	150.3	0	0	117.2	R611	E609-R611 VanDerWaalsContact C-N 3.27Å; E609-R611 PolarHBondContact O-N 3.19Å
610	G	74.9	Confident	86.1	Confident	12 Å²	12	37 Å²	37	12%	0.124	20%	0.201	C	C	.	.	S	Bend	trans	78.3	-0.1	178.3	0	0	0	0	0	115.3	L561 A562 A605 G608	L561-G610 CarbonylContact C-O 3.6Å; L561-G610 WeakPolarHBondContact CA-O 3.29Å; A562-G610 PolarHBondContact N-O 2.84Å; A605-G610 WeakPolarHBondContact O-CA 3.29Å; A605-G610 PolarHBondContact O-N 2.68Å; G608-G610 PolarHBondContact O-N 2.99Å
611	R	84.3	Confident	85.7	Confident	144 Å²	144	42.1 Å²	42.1	54%	0.543	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-112.6	138.4	179.9	-70.4	-171.7	-178.3	-82.8	0.2	113.7	G559 E560 L561 A605 E609 T613	G559-R611 PolarHBondContact O-NH1 3.45Å; E560-R611 CarbonylContact O-C 3.57Å; E560-R611 VanDerWaalsContact O-CA 3.3Å; E560-R611 WeakPolarHBondContact O-CA 3.46Å; L561-R611 HydrophobicContact CD2-CG 4.16Å; A605-R611 VanDerWaalsContact CB-C 3.46Å; A605-R611 WeakPolarHBondContact CB-O 3.14Å; E609-R611 VanDerWaalsContact C-N 3.27Å; E609-R611 PolarHBondContact O-N 3.19Å; R611-T613 PolarHBondContact O-N 2.9Å
612	R	89.9	Confident	85.2	Confident	15 Å²	15	43.9 Å²	43.9	6%	0.057	26%	0.259	C	S	.	.			trans	-64.8	126.6	177.7	-59.8	-64.2	-166.7	-173.9	5.3	110.6	I556 R557 G559 E560 A562 D563 S564 G602	I556-R612 HydrophobicContact CG2-CB 3.8Å; I556-R612 HydrophobicContact CG2-CG 3.64Å; R557-R612 WeakPolarHBondContact O-CB 3.47Å; G559-R612 PolarHBondContact N-O 3.37Å; E560-R612 HydrophobicContact CB-CG 4.08Å; E560-R612 WeakPolarHBondContact O-CG 3Å; E560-R612 PolarHBondContact O-N 3.48Å; A562-R612 HydrophobicContact CB-CG 4.44Å; D563-R612 IonicContact OD1-NH2 2.68Å; S564-R612 VanDerWaalsContact O-CZ 3.29Å; S564-R612 PolarHBondContact O-NH1 2.81Å; S564-R612 PolarHBondContact O-NH2 2.98Å; G602-R612 PolarHBondContact O-NH1 3.31Å; G602-R612 VanDerWaalsContact O-NH1 3.14Å
613	T	87.4	Confident	85.3	Confident	55 Å²	55	43.7 Å²	43.7	34%	0.337	26%	0.256	S	S	.	.			trans	-89.4	-11.4	-174.1	54.5	0	0	0	0	114.7	K604 R611	K604-T613 HydrophobicContact CD-CG2 4.45Å; R611-T613 PolarHBondContact O-N 2.9Å
614	A	91.2	Very high	85.6	Confident	8 Å²	8	43.2 Å²	43.2	7%	0.066	25%	0.254	C	S	.	.	S	Bend	trans	-153.6	160.7	-174.5	0	0	0	0	0	110	I556 V575 T576 I577	I556-A614 WeakPolarHBondContact CG2-O 3.35Å; V575-A614 HydrophobicContact CG1-CB 3.79Å; T576-A614 CarbonylContact O-C 3.58Å; T576-A614 WeakPolarHBondContact O-CA 3.32Å; T576-A614 WeakPolarHBondContact O-CB 3.48Å; I577-A614 HydrophobicContact CD1-CB 4.38Å; I577-A614 HydrophobicContact CG1-CB 3.73Å
615	N	93.5	Very high	86.1	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.032	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	154.2	165.1	-53.1	-52.8	0	0	0	109.9	I556 R557 Q558 V575 T576 S578 E589 Y617	I556-N615 CarbonylContact O-C 3.59Å; I556-N615 VanDerWaalsContact O-CA 3.28Å; I556-N615 WeakPolarHBondContact O-CA 3.4Å; R557-N615 WeakPolarHBondContact CA-OD1 3.49Å; R557-N615 WeakPolarHBondContact CG-OD1 3.09Å; Q558-N615 WeakPolarHBondContact CB-OD1 3.23Å; Q558-N615 PolarHBondContact N-OD1 3.37Å; V575-N615 WeakPolarHBondContact CA-O 3.39Å; T576-N615 PolarHBondContact N-O 2.73Å; T576-N615 VanDerWaalsContact N-O 3.08Å; T576-N615 PolarHBondContact O-N 2.74Å; T576-N615 WeakPolarHBondContact OG1-CB 3.47Å; S578-N615 PolarHBondContact OG-ND2 3.14Å; S578-N615 VanDerWaalsContact OG-ND2 3.08Å; E589-N615 PolarHBondContact OE1-ND2 3.27Å; N615-Y617 HydrophobicContact CB-CD2 4.29Å; N615-Y617 HydrophobicContact CB-CE2 3.49Å; N615-Y617 VanDerWaalsContact CB-CE2 3.49Å
616	V	95.5	Very high	86.6	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.4	172.3	-174.3	0	0	0	0	109.7	I555 I556 V573 R574 V575 F601	I555-V616 PolarHBondContact N-O 3.44Å; I556-V616 HydrophobicContact CB-CB 4.06Å; I556-V616 HydrophobicContact CB-CG2 4.01Å; I556-V616 HydrophobicContact CD1-CG2 4.33Å; I556-V616 PolarHBondContact N-O 2.82Å; I556-V616 PolarHBondContact O-N 3.29Å; V573-V616 HydrophobicContact CB-CG1 3.72Å; V573-V616 HydrophobicContact CG1-CG1 4.14Å; V573-V616 HydrophobicContact CG2-CG1 3.75Å; R574-V616 WeakPolarHBondContact O-CA 3.37Å; V575-V616 HydrophobicContact CG1-CG2 4.47Å; V575-V616 HydrophobicContact CG2-CG2 4.29Å; F601-V616 HydrophobicContact CD2-CB 4.43Å; F601-V616 HydrophobicContact CD2-CG1 4.13Å; F601-V616 HydrophobicContact CD2-CG2 4.03Å; F601-V616 HydrophobicContact CE1-CG1 4.3Å; F601-V616 HydrophobicContact CE2-CB 4.29Å; F601-V616 HydrophobicContact CE2-CG1 3.87Å; F601-V616 HydrophobicContact CE2-CG2 4.38Å; F601-V616 HydrophobicContact CG-CG1 4.46Å; F601-V616 HydrophobicContact CZ-CG1 3.96Å
617	Y	96.1	Very high	87.1	Confident	30 Å²	30	42.4 Å²	42.4	12%	0.118	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143	-178.8	-59.3	-96.2	0	0	0	112.3	D553 C554 V573 R574 T576 E589 N615	D553-Y617 CarbonylContact O-C 3.53Å; D553-Y617 VanDerWaalsContact O-CA 3.28Å; D553-Y617 WeakPolarHBondContact O-CA 3.15Å; C554-Y617 HydrophobicContact CB-CD1 3.8Å; C554-Y617 HydrophobicContact CB-CE1 3.63Å; V573-Y617 CarbonylContact C-O 3.52Å; V573-Y617 WeakPolarHBondContact CA-O 3.22Å; V573-Y617 VanDerWaalsContact CB-O 3.29Å; V573-Y617 WeakPolarHBondContact CB-O 3.4Å; R574-Y617 HydrophobicContact CG-CD2 4.42Å; R574-Y617 PolarHBondContact N-O 3.08Å; R574-Y617 PolarHBondContact O-N 3.22Å; T576-Y617 WeakPolarHBondContact OG1-CE2 3.2Å; E589-Y617 WeakPolarHBondContact OE1-CE2 3.48Å; N615-Y617 HydrophobicContact CB-CD2 4.29Å; N615-Y617 HydrophobicContact CB-CE2 3.49Å; N615-Y617 VanDerWaalsContact CB-CE2 3.49Å
618	A	95.9	Very high	87.6	Confident	3 Å²	3	39.4 Å²	39.4	3%	0.025	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135.2	172.5	0	0	0	0	0	112.3	H549 S550 G552 D553 I555 V624	H549-A618 HydrophobicContact CB-CB 4.12Å; S550-A618 WeakPolarHBondContact O-CB 3.36Å; G552-A618 PolarHBondContact N-O 2.91Å; D553-A618 PolarHBondContact O-N 3.46Å; I555-A618 HydrophobicContact CD1-CB 4.31Å; A618-V624 HydrophobicContact CB-CB 4.36Å; A618-V624 HydrophobicContact CB-CG1 3.49Å; A618-V624 VanDerWaalsContact CB-CG1 3.49Å
619	V	92.1	Very high	88.4	Confident	44 Å²	44	37.4 Å²	37.4	27%	0.267	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.6	-173	178.4	0	0	0	0	112.2	K572 R574	K572-V619 HydrophobicContact CB-CB 4.3Å; K572-V619 PolarHBondContact O-N 3.33Å; R574-V619 HydrophobicContact CB-CG2 3.8Å; R574-V619 HydrophobicContact CG-CG2 3.64Å
620	G	85.4	Confident	89.4	Confident	34 Å²	34	32 Å²	32	35%	0.351	19%	0.186	S	C	.	.	S	Bend	trans	97.5	153.6	174.3	0	0	0	0	0	113.6	A551 G622 G623	A551-G620 WeakPolarHBondContact CB-O 3.45Å; G620-G622 PolarHBondContact O-N 3.17Å; G620-G622 VanDerWaalsContact O-N 3.12Å; G620-G623 PolarHBondContact O-N 2.88Å
621	P	83.6	Confident	89.8	Confident	138 Å²	138	35.4 Å²	35.4	90%	0.896	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-16.5	-168.2	27.2	-36.1	0	0	0	114.7	G623	P621-G623 VanDerWaalsContact C-N 3.34Å
622	G	82.7	Confident	89.6	Confident	45 Å²	45	33.1 Å²	33.1	46%	0.464	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-9	173.6	0	0	0	0	0	114.5	Y548 G620	Y548-G622 VanDerWaalsContact CE2-O 3.29Å; Y548-G622 WeakPolarHBondContact CE2-O 3.23Å; Y548-G622 PolarHBondContact OH-O 3.32Å; G620-G622 PolarHBondContact O-N 3.17Å; G620-G622 VanDerWaalsContact O-N 3.12Å
623	G	89.4	Confident	89.2	Confident	5 Å²	5	33.1 Å²	33.1	5%	0.052	19%	0.19	C	C	.	.			trans	72.1	-160.3	-168.1	0	0	0	0	0	112.7	H549 G620 P621	H549-G623 CarbonylContact O-C 3.59Å; H549-G623 VanDerWaalsContact O-CA 3.25Å; H549-G623 WeakPolarHBondContact O-CA 3.47Å; G620-G623 PolarHBondContact O-N 2.88Å; P621-G623 VanDerWaalsContact C-N 3.34Å
624	V	93.4	Very high	89.2	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.7	177.3	68.6	0	0	0	0	110.2	H549 I555 I568 S570 V573 A618 V626	H549-V624 HydrophobicContact CB-CG1 3.88Å; H549-V624 PolarHBondContact N-O 2.83Å; H549-V624 PolarHBondContact O-N 3.33Å; I555-V624 HydrophobicContact CD1-CG1 3.76Å; I568-V624 HydrophobicContact CG2-CG2 4.03Å; S570-V624 WeakPolarHBondContact O-CA 3.43Å; S570-V624 WeakPolarHBondContact O-CG2 3.32Å; V573-V624 HydrophobicContact CG1-CB 4.45Å; V573-V624 HydrophobicContact CG1-CG1 4.11Å; V573-V624 HydrophobicContact CG1-CG2 3.96Å; A618-V624 HydrophobicContact CB-CB 4.36Å; A618-V624 HydrophobicContact CB-CG1 3.49Å; A618-V624 VanDerWaalsContact CB-CG1 3.49Å; V624-V626 HydrophobicContact CG2-CG1 4.1Å
625	E	92.4	Very high	88.9	Confident	42 Å²	42	33.7 Å²	33.7	20%	0.196	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.3	173.3	-170.5	-173.4	-159.4	0	0	108.8	Q547 Q569 S570	Q547-E625 WeakPolarHBondContact O-CA 3.39Å; Q569-E625 HydrophobicContact CB-CG 4.37Å; Q569-E625 PolarHBondContact N-O 2.91Å; Q569-E625 PolarHBondContact NE2-OE1 3.42Å; Q569-E625 PolarHBondContact NE2-OE2 3.16Å; S570-E625 PolarHBondContact N-O 2.91Å; S570-E625 PolarHBondContact O-N 3.02Å; S570-E625 VanDerWaalsContact OG-CB 3.24Å; S570-E625 WeakPolarHBondContact OG-CB 3.38Å; S570-E625 PolarHBondContact OG-OE2 3.2Å
626	V	93.1	Very high	88.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141	-179.2	-60.8	0	0	0	0	110.9	Q547 F566 L567 I568 F601 V624	Q547-V626 HydrophobicContact CB-CG2 4.07Å; Q547-V626 PolarHBondContact N-O 3.47Å; Q547-V626 PolarHBondContact O-N 3.16Å; F566-V626 HydrophobicContact CB-CB 4.4Å; F566-V626 HydrophobicContact CD1-CB 4.27Å; F566-V626 HydrophobicContact CD1-CG2 3.71Å; F566-V626 HydrophobicContact CE1-CG2 4.32Å; L567-V626 CarbonylContact O-C 3.36Å; L567-V626 VanDerWaalsContact O-CA 3.23Å; L567-V626 WeakPolarHBondContact O-CA 3.24Å; I568-V626 HydrophobicContact CG1-CG1 4.32Å; F601-V626 HydrophobicContact CE1-CG1 4.31Å; F601-V626 HydrophobicContact CZ-CG1 4.22Å; V624-V626 HydrophobicContact CG2-CG1 4.1Å
627	L	91.3	Very high	87.6	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.5	167.8	-63.8	-178.6	0	0	0	108.6	F522 L544 E545 A546 F566 L567 Q569	F522-L627 HydrophobicContact CD1-CD1 3.91Å; F522-L627 HydrophobicContact CE1-CD1 3.82Å; L544-L627 HydrophobicContact CB-CB 4.22Å; L544-L627 HydrophobicContact CD1-CB 4.09Å; L544-L627 HydrophobicContact CD1-CD1 3.92Å; L544-L627 HydrophobicContact CD2-CB 3.96Å; L544-L627 HydrophobicContact CG-CB 4.32Å; E545-L627 CarbonylContact O-C 3.48Å; E545-L627 WeakPolarHBondContact O-CA 3.25Å; A546-L627 HydrophobicContact CB-CD2 3.81Å; F566-L627 WeakPolarHBondContact CA-O 3.16Å; L567-L627 HydrophobicContact CB-CB 4.3Å; L567-L627 PolarHBondContact N-O 2.8Å; L567-L627 PolarHBondContact O-N 3.45Å; Q569-L627 HydrophobicContact CB-CG 4.39Å
628	C	91.1	Very high	87	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.4	-177.3	178.5	0	0	0	0	111.1	L544 E545 Q547 F565 F566	L544-C628 WeakPolarHBondContact CA-O 3.43Å; L544-C628 WeakPolarHBondContact CD2-O 3.49Å; E545-C628 PolarHBondContact N-O 3.29Å; E545-C628 VanDerWaalsContact N-O 3.1Å; E545-C628 PolarHBondContact O-N 3Å; Q547-C628 HydrophobicContact CG-CB 4.28Å; F565-C628 CarbonylContact O-C 3.45Å; F565-C628 WeakPolarHBondContact O-CA 3.48Å; F566-C628 HydrophobicContact CD1-CB 3.94Å; F566-C628 HydrophobicContact CE1-CB 3.83Å
629	L	88.5	Confident	86.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.7	171.1	-166.2	64.1	0	0	0	110	A543 L544 F565 D633 F634 I638	A543-L629 HydrophobicContact CB-CD1 3.51Å; L544-L629 HydrophobicContact CD2-CB 3.7Å; L544-L629 HydrophobicContact CD2-CD1 4.17Å; L544-L629 HydrophobicContact CD2-CG 4.42Å; F565-L629 HydrophobicContact CB-CB 4.43Å; F565-L629 HydrophobicContact CD1-CB 4.14Å; F565-L629 PolarHBondContact N-O 3.37Å; F565-L629 PolarHBondContact O-N 2.9Å; L629-D633 HydrophobicContact CD1-CB 3.83Å; L629-D633 HydrophobicContact CG-CB 4.24Å; L629-F634 HydrophobicContact CD2-CB 4.08Å; L629-F634 HydrophobicContact CG-CB 4.27Å; L629-I638 HydrophobicContact CD2-CD1 3.41Å; L629-I638 VanDerWaalsContact CD2-CD1 3.41Å; L629-I638 HydrophobicContact CD2-CG1 3.9Å
630	Y	86.7	Confident	85.6	Confident	82 Å²	82	34 Å²	34	32%	0.322	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	158.4	-178.4	-64.5	-66.9	0	0	0	113	E545 D563 S564 K632 D633 F634	E545-Y630 HydrophobicContact CG-CE2 4.37Å; E545-Y630 WeakPolarHBondContact OE2-CE2 3.43Å; E545-Y630 PolarHBondContact OE2-OH 2.87Å; D563-Y630 CarbonylContact O-C 3.55Å; D563-Y630 WeakPolarHBondContact O-CA 3.37Å; S564-Y630 WeakPolarHBondContact OG-CD1 3.48Å; Y630-K632 VanDerWaalsContact C-N 3.3Å; Y630-K632 PolarHBondContact O-N 2.97Å; Y630-K632 VanDerWaalsContact O-N 3.15Å; Y630-D633 PolarHBondContact O-N 3.42Å; Y630-F634 WeakPolarHBondContact O-CB 3.37Å; Y630-F634 PolarHBondContact O-N 3.46Å
631	R	83.4	Confident	85.3	Confident	83 Å²	83	33.2 Å²	33.2	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-52	-41	-169.3	177.5	173	-170.9	103.8	14.4	114	A562 D563 A605 L606 L635	A562-R631 PolarHBondContact O-NH1 3.44Å; A562-R631 VanDerWaalsContact O-NH1 3.14Å; D563-R631 WeakPolarHBondContact O-CB 3.18Å; D563-R631 PolarHBondContact O-N 2.64Å; A605-R631 PolarHBondContact O-NH1 3.03Å; L606-R631 HydrophobicContact CD2-CB 3.93Å; L606-R631 HydrophobicContact CD2-CG 3.95Å; L606-R631 PolarHBondContact O-NH2 3.43Å; R631-L635 HydrophobicContact CG-CD1 3.86Å; R631-L635 HydrophobicContact CG-CG 4.43Å; R631-L635 WeakPolarHBondContact O-CB 3.16Å; R631-L635 WeakPolarHBondContact O-CG 3.28Å; R631-L635 PolarHBondContact O-N 3.39Å
632	K	79.9	Confident	84.9	Confident	97 Å²	97	33.1 Å²	33.1	42%	0.422	17%	0.168	S	C	.	.	H	α-helix	trans	-57	-57.8	176.7	172.7	-167	163.6	-66.4	0	109.5	Y630 L635 E636	Y630-K632 VanDerWaalsContact C-N 3.3Å; Y630-K632 PolarHBondContact O-N 2.97Å; Y630-K632 VanDerWaalsContact O-N 3.15Å; K632-L635 PolarHBondContact O-N 2.67Å; K632-E636 IonicContact NZ-OE2 2.97Å; K632-E636 PolarHBondContact NZ-OE2 2.8Å; K632-E636 WeakPolarHBondContact O-CB 3.27Å; K632-E636 PolarHBondContact O-N 3.4Å
633	D	81.7	Confident	84.5	Confident	14 Å²	14	35 Å²	35	8%	0.075	17%	0.165	C	C	.	.	H	α-helix	trans	-75.8	-29.7	-169.3	-45.4	-72.1	0	0	0	110.7	A543 L629 Y630 E636 L637	A543-D633 HydrophobicContact CB-CB 4.34Å; L629-D633 HydrophobicContact CD1-CB 3.83Å; L629-D633 HydrophobicContact CG-CB 4.24Å; Y630-D633 PolarHBondContact O-N 3.42Å; D633-E636 PolarHBondContact O-N 3.4Å; D633-L637 HydrophobicContact CB-CD1 4.23Å; D633-L637 WeakPolarHBondContact O-CA 3.29Å; D633-L637 WeakPolarHBondContact O-CB 3.48Å; D633-L637 VanDerWaalsContact O-CG 3.24Å; D633-L637 WeakPolarHBondContact O-CG 3.44Å; D633-L637 PolarHBondContact O-N 2.9Å
634	F	86.1	Confident	83.9	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-54.4	165.7	172.4	-94.1	0	0	0	111.9	F565 E603 L606 L607 L629 Y630 E636 L637 I638 G639 L644	F565-F634 HydrophobicContact CB-CB 4.39Å; F565-F634 HydrophobicContact CB-CD2 3.52Å; F565-F634 HydrophobicContact CB-CE2 4.03Å; F565-F634 HydrophobicContact CB-CG 4.1Å; F565-F634 AromaticContact CD1-CD2 3.84Å; F565-F634 HydrophobicContact CD1-CD2 3.84Å; F565-F634 HydrophobicContact CD1-CE2 4.21Å; F565-F634 AromaticContact CD2-CD2 3.84Å; F565-F634 HydrophobicContact CD2-CD2 3.84Å; F565-F634 AromaticContact CD2-CE2 3.49Å; F565-F634 HydrophobicContact CD2-CE2 3.49Å; F565-F634 VanDerWaalsContact CD2-CE2 3.49Å; F565-F634 HydrophobicContact CD2-CZ 4.43Å; F565-F634 HydrophobicContact CE1-CD2 4.46Å; F565-F634 HydrophobicContact CE2-CD2 4.46Å; F565-F634 AromaticContact CE2-CE2 3.88Å; F565-F634 HydrophobicContact CE2-CE2 3.88Å; F565-F634 AromaticContact CG-CD2 3.47Å; F565-F634 HydrophobicContact CG-CD2 3.47Å; F565-F634 VanDerWaalsContact CG-CD2 3.47Å; F565-F634 AromaticContact CG-CE2 3.67Å; F565-F634 HydrophobicContact CG-CE2 3.67Å; F565-F634 HydrophobicContact CG-CG 4.5Å; F565-F634 HydrophobicContact CZ-CE2 4.39Å; E603-F634 HydrophobicContact CB-CE2 4.29Å; E603-F634 HydrophobicContact CB-CZ 4Å; L606-F634 HydrophobicContact CB-CD1 3.68Å; L606-F634 HydrophobicContact CB-CE1 3.48Å; L606-F634 VanDerWaalsContact CB-CE1 3.48Å; L606-F634 HydrophobicContact CB-CZ 4.28Å; L606-F634 HydrophobicContact CD1-CB 4.1Å; L606-F634 HydrophobicContact CD1-CD1 3.46Å; L606-F634 VanDerWaalsContact CD1-CD1 3.46Å; L606-F634 HydrophobicContact CD1-CD2 4.08Å; L606-F634 HydrophobicContact CD1-CE1 3.82Å; L606-F634 HydrophobicContact CD1-CE2 4.38Å; L606-F634 HydrophobicContact CD1-CG 3.6Å; L606-F634 HydrophobicContact CD1-CZ 4.25Å; L606-F634 HydrophobicContact CG-CD1 4.22Å; L606-F634 HydrophobicContact CG-CE1 4.31Å; L607-F634 HydrophobicContact CD1-CZ 4.43Å; L607-F634 HydrophobicContact CD2-CE1 3.85Å; L607-F634 HydrophobicContact CD2-CZ 4.22Å; L607-F634 HydrophobicContact CG-CE1 4.03Å; L607-F634 HydrophobicContact CG-CZ 4.19Å; L629-F634 HydrophobicContact CD2-CB 4.08Å; L629-F634 HydrophobicContact CG-CB 4.27Å; Y630-F634 WeakPolarHBondContact O-CB 3.37Å; Y630-F634 PolarHBondContact O-N 3.46Å; F634-E636 PolarHBondContact O-N 3.4Å; F634-L637 PolarHBondContact O-N 3.46Å; F634-I638 HydrophobicContact CD2-CB 4.22Å; F634-I638 HydrophobicContact CE2-CB 4.42Å; F634-I638 HydrophobicContact CE2-CG2 4.43Å; F634-I638 CarbonylContact O-C 3.47Å; F634-I638 WeakPolarHBondContact O-CA 3.27Å; F634-I638 PolarHBondContact O-N 3.23Å; F634-G639 PolarHBondContact O-N 2.86Å; F634-L644 HydrophobicContact CE2-CD1 3.79Å; F634-L644 HydrophobicContact CZ-CD1 3.61Å
635	L	84.3	Confident	82.7	Confident	75 Å²	75	41.1 Å²	41.1	39%	0.393	19%	0.19	S	C	.	.	H	α-helix	trans	-62.8	-31.5	-179.2	-70.7	170.8	0	0	0	112.3	R631 K632	R631-L635 HydrophobicContact CG-CD1 3.86Å; R631-L635 HydrophobicContact CG-CG 4.43Å; R631-L635 WeakPolarHBondContact O-CB 3.16Å; R631-L635 WeakPolarHBondContact O-CG 3.28Å; R631-L635 PolarHBondContact O-N 3.39Å; K632-L635 PolarHBondContact O-N 2.67Å
636	E	80	Confident	81.5	Confident	25 Å²	25	44.8 Å²	44.8	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-77.7	-48.6	179	-165.9	-167.8	130.8	0	0	112.8	R536 R539 K632 D633 F634 G970 K971	R536-E636 PolarHBondContact NH2-O 2.96Å; R536-E636 VanDerWaalsContact NH2-O 3.16Å; R539-E636 IonicContact CZ-OE1 2.68Å; R539-E636 IonicContact NH1-OE1 3.45Å; R539-E636 PolarHBondContact NH1-OE1 3.34Å; R539-E636 IonicContact NH2-OE1 2.85Å; R539-E636 PolarHBondContact NH2-OE1 3.49Å; K632-E636 IonicContact NZ-OE2 2.97Å; K632-E636 PolarHBondContact NZ-OE2 2.8Å; K632-E636 WeakPolarHBondContact O-CB 3.27Å; K632-E636 PolarHBondContact O-N 3.4Å; D633-E636 PolarHBondContact O-N 3.4Å; F634-E636 PolarHBondContact O-N 3.4Å; E636-G970 WeakPolarHBondContact OE1-CA 3.45Å; E636-K971 HydrophobicContact CG-CB 3.71Å; E636-K971 PolarHBondContact OE1-N 3.42Å
637	L	81.7	Confident	80.4	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-98.3	-19.1	-167.9	-58.6	174	0	0	0	114.7	R536 R539 I540 A543 D633 F634	R536-L637 PolarHBondContact NE-O 3.45Å; R536-L637 VanDerWaalsContact NH2-C 3.27Å; R536-L637 PolarHBondContact NH2-O 2.89Å; R536-L637 VanDerWaalsContact NH2-O 3.16Å; R539-L637 HydrophobicContact CB-CD1 4.39Å; R539-L637 HydrophobicContact CB-CD2 3.88Å; I540-L637 HydrophobicContact CD1-CB 4.36Å; I540-L637 HydrophobicContact CG1-CB 3.75Å; I540-L637 HydrophobicContact CG1-CD1 4Å; I540-L637 HydrophobicContact CG1-CG 4.41Å; A543-L637 HydrophobicContact CB-CD1 4.06Å; D633-L637 HydrophobicContact CB-CD1 4.23Å; D633-L637 WeakPolarHBondContact O-CA 3.29Å; D633-L637 WeakPolarHBondContact O-CB 3.48Å; D633-L637 VanDerWaalsContact O-CG 3.24Å; D633-L637 WeakPolarHBondContact O-CG 3.44Å; D633-L637 PolarHBondContact O-N 2.9Å; F634-L637 PolarHBondContact O-N 3.46Å
638	I	84.6	Confident	78.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.3	-32.7	-173.8	-47.6	-173.3	0	0	0	112.4	L528 L529 I540 F565 L629 F634 D640 I641 L644	L528-I638 HydrophobicContact CD2-CG2 4.13Å; L529-I638 HydrophobicContact CD2-CD1 3.99Å; L529-I638 HydrophobicContact CD2-CG1 4.35Å; L529-I638 HydrophobicContact CD2-CG2 3.95Å; I540-I638 HydrophobicContact CD1-CD1 4.12Å; I540-I638 HydrophobicContact CD1-CG1 3.86Å; I540-I638 HydrophobicContact CG1-CD1 4.36Å; I540-I638 HydrophobicContact CG1-CG1 4.21Å; I540-I638 HydrophobicContact CG2-CD1 4.4Å; F565-I638 HydrophobicContact CD1-CD1 4.45Å; F565-I638 HydrophobicContact CE1-CD1 4.04Å; L629-I638 HydrophobicContact CD2-CD1 3.41Å; L629-I638 VanDerWaalsContact CD2-CD1 3.41Å; L629-I638 HydrophobicContact CD2-CG1 3.9Å; F634-I638 HydrophobicContact CD2-CB 4.22Å; F634-I638 HydrophobicContact CE2-CB 4.42Å; F634-I638 HydrophobicContact CE2-CG2 4.43Å; F634-I638 CarbonylContact O-C 3.47Å; F634-I638 WeakPolarHBondContact O-CA 3.27Å; F634-I638 PolarHBondContact O-N 3.23Å; I638-D640 PolarHBondContact O-N 3.23Å; I638-I641 HydrophobicContact CB-CD1 4.36Å; I638-I641 HydrophobicContact CG2-CD1 3.58Å; I638-I641 WeakPolarHBondContact O-CB 3.27Å; I638-I641 WeakPolarHBondContact O-CD1 3.32Å; I638-I641 WeakPolarHBondContact O-CG1 3.49Å; I638-I641 PolarHBondContact O-N 2.92Å; I638-L644 HydrophobicContact CG2-CD1 3.76Å
639	G	76.8	Confident	77.6	Confident	11 Å²	11	58.1 Å²	58.1	11%	0.113	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.4	-167.9	0	0	0	0	0	117.8	F634	F634-G639 PolarHBondContact O-N 2.86Å
640	D	80.8	Confident	75.9	Confident	57 Å²	57	62.5 Å²	62.5	31%	0.305	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-13.7	171.3	57.6	13.2	0	0	0	114.4	R536 I638 K645 K971	R536-D640 IonicContact CZ-OD1 2.77Å; R536-D640 VanDerWaalsContact CZ-OD1 3.26Å; R536-D640 IonicContact CZ-OD2 3.7Å; R536-D640 IonicContact NH1-OD1 3.26Å; R536-D640 PolarHBondContact NH1-OD1 3.16Å; R536-D640 IonicContact NH1-OD2 3.19Å; R536-D640 VanDerWaalsContact NH2-CG 3.32Å; R536-D640 IonicContact NH2-OD1 2.7Å; R536-D640 PolarHBondContact NH2-OD1 3.42Å; R536-D640 IonicContact NH2-OD2 2.7Å; R536-D640 PolarHBondContact NH2-OD2 2.97Å; I638-D640 PolarHBondContact O-N 3.23Å; D640-K645 PolarHBondContact O-NZ 3.14Å; D640-K971 IonicContact OD2-NZ 3.71Å; D640-K971 PolarHBondContact OD2-NZ 2.63Å
641	I	80.6	Confident	74.4	Confident	16 Å²	16	59.3 Å²	59.3	8%	0.082	29%	0.287	C	S	.	.			trans	-58.5	141.3	179.8	-62.7	171.9	0	0	0	111.2	L528 L529 L532 I638 E643	L528-I641 HydrophobicContact CD1-CB 4.39Å; L528-I641 HydrophobicContact CD1-CD1 4.32Å; L528-I641 HydrophobicContact CD1-CG2 3.63Å; L529-I641 HydrophobicContact CD2-CD1 4.3Å; L532-I641 HydrophobicContact CD1-CD1 3.93Å; L532-I641 HydrophobicContact CD2-CD1 3.78Å; L532-I641 HydrophobicContact CD2-CG1 4.16Å; L532-I641 HydrophobicContact CG-CD1 4.28Å; I638-I641 HydrophobicContact CB-CD1 4.36Å; I638-I641 HydrophobicContact CG2-CD1 3.58Å; I638-I641 WeakPolarHBondContact O-CB 3.27Å; I638-I641 WeakPolarHBondContact O-CD1 3.32Å; I638-I641 WeakPolarHBondContact O-CG1 3.49Å; I638-I641 PolarHBondContact O-N 2.92Å; I641-E643 HydrophobicContact CG2-CB 4.36Å; I641-E643 WeakPolarHBondContact CG2-OE2 3.41Å
642	Q	74.8	Confident	72.7	Confident	137 Å²	137	61.2 Å²	61.2	64%	0.64	30%	0.299	S	S	*	.	S	Bend	trans	-76.7	-37.1	-173.7	-65.6	-171.4	2.1	0	0	112.6	L644 K645 N646	Q642-L644 PolarHBondContact O-N 3.39Å; Q642-K645 PolarHBondContact O-N 3.44Å; Q642-N646 PolarHBondContact O-N 2.82Å
643	E	74.7	Confident	70.9	Confident	85 Å²	85	63.6 Å²	63.6	40%	0.397	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-30.6	177.6	-65.9	93.3	143.9	0	0	112.6	L528 I641 K645 K647	L528-E643 HydrophobicContact CD1-CB 3.96Å; I641-E643 HydrophobicContact CG2-CB 4.36Å; I641-E643 WeakPolarHBondContact CG2-OE2 3.41Å; E643-K645 VanDerWaalsContact C-N 3.31Å; E643-K645 PolarHBondContact O-N 3.42Å; E643-K647 WeakPolarHBondContact O-CB 3.32Å; E643-K647 PolarHBondContact O-N 3.19Å
644	L	76.2	Confident	69.2	Low	4 Å²	4	67.6 Å²	67.6	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-30.5	173.8	-79.7	-175.1	0	0	0	113.8	L528 Y600 E603 L607 F634 I638 Q642	L528-L644 HydrophobicContact CD1-CD2 4.09Å; L528-L644 HydrophobicContact CD1-CG 3.84Å; L528-L644 HydrophobicContact CD2-CD2 3.7Å; L528-L644 HydrophobicContact CD2-CG 4.13Å; Y600-L644 HydrophobicContact CD2-CD2 4.46Å; Y600-L644 HydrophobicContact CE2-CD2 3.75Å; E603-L644 HydrophobicContact CB-CD2 3.88Å; E603-L644 HydrophobicContact CG-CD2 3.97Å; L607-L644 HydrophobicContact CD1-CB 3.92Å; L607-L644 HydrophobicContact CD1-CD1 4.45Å; F634-L644 HydrophobicContact CE2-CD1 3.79Å; F634-L644 HydrophobicContact CZ-CD1 3.61Å; I638-L644 HydrophobicContact CG2-CD1 3.76Å; Q642-L644 PolarHBondContact O-N 3.39Å
645	K	67.5	Low	67.2	Low	130 Å²	130	77.4 Å²	77.4	57%	0.565	37%	0.374	S	S	*	.	H	α-helix	trans	-87.4	-33.5	-178.9	-63.3	171.2	-177.3	163.5	0	111.4	D640 Q642 E643	D640-K645 PolarHBondContact O-NZ 3.14Å; Q642-K645 PolarHBondContact O-N 3.44Å; E643-K645 VanDerWaalsContact C-N 3.31Å; E643-K645 PolarHBondContact O-N 3.42Å
646	N	66.9	Low	65.2	Low	119 Å²	119	80.7 Å²	80.7	64%	0.636	39%	0.391	S	S	*	.	H	α-helix	trans	-98	5.3	-175.5	-59.4	4.3	0	0	0	113	Q642 E648	Q642-N646 PolarHBondContact O-N 2.82Å; N646-E648 PolarHBondContact O-N 3.13Å; N646-E648 VanDerWaalsContact O-N 3.1Å
647	K	70.2	Confident	63.3	Low	60 Å²	60	87.1 Å²	87.1	26%	0.261	43%	0.425	S	S	.	.			trans	-64.8	108.5	174.7	-177.2	171.8	-178.3	-179.9	0	109.3	Y600 E603 E643 Y649	Y600-K647 HydrophobicContact CE2-CD 3.85Å; Y600-K647 PolarHBondContact O-NZ 3.31Å; E603-K647 IonicContact OE1-NZ 3.33Å; E603-K647 PolarHBondContact OE1-NZ 3.33Å; E643-K647 WeakPolarHBondContact O-CB 3.32Å; E643-K647 PolarHBondContact O-N 3.19Å; K647-Y649 HydrophobicContact CB-CE2 4.14Å; K647-Y649 HydrophobicContact CD-CE1 4.13Å; K647-Y649 HydrophobicContact CG-CE1 4.33Å; K647-Y649 HydrophobicContact CG-CE2 4.2Å; K647-Y649 WeakPolarHBondContact O-CD2 3.27Å; K647-Y649 WeakPolarHBondContact O-CE2 3.08Å
648	E	61	Low	61.2	Low	189 Å²	189	89.7 Å²	89.7	88%	0.883	45%	0.453	S	S	*	.			trans	-64.9	139.1	172	-65.4	178.7	164.2	0	0	110.1	N646	N646-E648 PolarHBondContact O-N 3.13Å; N646-E648 VanDerWaalsContact O-N 3.1Å
649	Y	64.1	Low	58.9	Low	33 Å²	33	98.5 Å²	98.5	13%	0.129	49%	0.494	C	S	.	.			trans	-124.7	122.3	175.1	-58	-98	0	0	0	108.5	E603 K604 K647 D651 E652	E603-Y649 VanDerWaalsContact CG-OH 3.31Å; E603-Y649 WeakPolarHBondContact CG-OH 3.22Å; K604-Y649 HydrophobicContact CD-CD1 4.21Å; K604-Y649 HydrophobicContact CD-CD2 4.05Å; K604-Y649 HydrophobicContact CD-CE1 4.03Å; K604-Y649 HydrophobicContact CD-CE2 3.86Å; K604-Y649 HydrophobicContact CD-CG 4.24Å; K604-Y649 HydrophobicContact CG-CE2 4.39Å; K604-Y649 VanDerWaalsContact NZ-CD2 3.27Å; K647-Y649 HydrophobicContact CB-CE2 4.14Å; K647-Y649 HydrophobicContact CD-CE1 4.13Å; K647-Y649 HydrophobicContact CG-CE1 4.33Å; K647-Y649 HydrophobicContact CG-CE2 4.2Å; K647-Y649 WeakPolarHBondContact O-CD2 3.27Å; K647-Y649 WeakPolarHBondContact O-CE2 3.08Å; Y649-D651 PolarHBondContact O-N 3.32Å; Y649-E652 PolarHBondContact O-N 3.34Å
650	T	50.9	Low	56.5	Low	91 Å²	91	103.3 Å²	103.3	56%	0.558	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-6.5	174.3	46.5	0	0	0	0	114.2	E652	T650-E652 PolarHBondContact O-N 2.76Å; T650-E652 VanDerWaalsContact O-N 3.16Å
651	D	55.5	Low	54	Low	16 Å²	16	105.8 Å²	105.8	9%	0.086	55%	0.547	C	S	.	.	H	α-helix	trans	-59.2	-20	175.3	-47.3	-11.7	0	0	0	113.5	R593 Y649	R593-D651 IonicContact CZ-OD1 3.26Å; R593-D651 VanDerWaalsContact CZ-OD1 3.23Å; R593-D651 IonicContact CZ-OD2 3.9Å; R593-D651 IonicContact NH1-OD1 3.98Å; R593-D651 PolarHBondContact NH1-OD1 3.02Å; R593-D651 VanDerWaalsContact NH2-CG 3.33Å; R593-D651 IonicContact NH2-OD1 3.51Å; R593-D651 PolarHBondContact NH2-OD1 2.86Å; R593-D651 IonicContact NH2-OD2 2.77Å; R593-D651 PolarHBondContact NH2-OD2 3.1Å; Y649-D651 PolarHBondContact O-N 3.32Å
652	E	49.1	Very low	51.6	Low	122 Å²	122	115.2 Å²	115.2	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-79.3	-39.6	-171.3	-61.8	-166.3	169.7	0	0	113.6	Y649 T650 T654 R655 L656	Y649-E652 PolarHBondContact O-N 3.34Å; T650-E652 PolarHBondContact O-N 2.76Å; T650-E652 VanDerWaalsContact O-N 3.16Å; E652-T654 PolarHBondContact O-N 2.79Å; E652-R655 PolarHBondContact O-N 3.29Å; E652-R655 VanDerWaalsContact O-N 3.1Å; E652-L656 PolarHBondContact O-N 3.41Å
653	E	41.8	Very low	49.5	Very low	147 Å²	147	112.9 Å²	112.9	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-59.3	-34.7	175.9	-62.1	-174	126.6	0	0	111.8	R655 L656	E653-R655 VanDerWaalsContact C-N 3.31Å; E653-R655 PolarHBondContact O-N 3.35Å; E653-L656 PolarHBondContact O-N 3.47Å
654	T	45.3	Very low	47.3	Very low	98 Å²	98	116.8 Å²	116.8	60%	0.601	61%	0.605	S	S	*	*	H	α-helix	trans	-71	-24.9	-179.5	-55	0	0	0	0	112.6	E652	E652-T654 PolarHBondContact O-N 2.79Å
655	R	45.2	Very low	45.3	Very low	207 Å²	207	124.1 Å²	124.1	78%	0.781	65%	0.645	S	S	*	*	H	α-helix	trans	-80.4	-32.2	175.9	-81.3	-174.4	166.5	-165.6	-4.9	113	E652 E653 L657 G658	E652-R655 PolarHBondContact O-N 3.29Å; E652-R655 VanDerWaalsContact O-N 3.1Å; E653-R655 VanDerWaalsContact C-N 3.31Å; E653-R655 PolarHBondContact O-N 3.35Å; R655-L657 VanDerWaalsContact C-N 3.29Å; R655-L657 PolarHBondContact O-N 3.26Å; R655-G658 PolarHBondContact O-N 2.71Å
656	L	42.5	Very low	43.6	Very low	144 Å²	144	122.9 Å²	122.9	75%	0.754	65%	0.652	S	S	*	*	H	α-helix	trans	-71.4	-23.1	-177	-68.9	169.9	0	0	0	113.3	E652 E653 G658	E652-L656 PolarHBondContact O-N 3.41Å; E653-L656 PolarHBondContact O-N 3.47Å; L656-G658 PolarHBondContact O-N 3.05Å
657	L	39.4	Very low	42.1	Very low	159 Å²	159	122.5 Å²	122.5	83%	0.832	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-1.9	176.3	-67.3	167.8	0	0	0	114.2	R655	R655-L657 VanDerWaalsContact C-N 3.29Å; R655-L657 PolarHBondContact O-N 3.26Å
658	G	36.7	Very low	40.2	Very low	59 Å²	59	127 Å²	127	61%	0.608	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	2.4	-175.5	0	0	0	0	0	116.6	R655 L656	R655-G658 PolarHBondContact O-N 2.71Å; L656-G658 PolarHBondContact O-N 3.05Å
659	H	36.2	Very low	38.8	Very low	185 Å²	185	122.9 Å²	122.9	86%	0.856	68%	0.682	S	S	*	*			trans	-129	96.7	-175.6	-81.4	4.3	0	0	0	113
660	S	28	Very low	37	Very low	111 Å²	111	127 Å²	127	78%	0.776	71%	0.711	S	S	*	*			trans	-83	135.7	165.6	50.9	0	0	0	0	111.6
661	S	28.1	Very low	36.1	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	72%	0.724	S	S	*	*			trans	55.8	100.7	164.8	60.2	0	0	0	0	119
662	F	30.3	Very low	34.7	Very low	213 Å²	213	134.1 Å²	134.1	93%	0.934	75%	0.751	S	S	*	*				-147.1	167.1	107.4	-147.8	-103.7	0	0	0	112.7
663	S	30.1	Very low	34	Very low	88 Å²	88	134.7 Å²	134.7	62%	0.615	76%	0.763	S	S	*	*			trans	-73.9	149.4	-156.5	-169.4	0	0	0	0	117.4
664	Q	29.5	Very low	33.4	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	77%	0.769	S	S	*	*			trans	-28.6	145.4	159.4	-57.2	164.6	-17	0	0	116.8
665	N	33.8	Very low	32.9	Very low	159 Å²	159	139.4 Å²	139.4	85%	0.85	78%	0.781	S	S	*	*				-159.9	166.9	112.9	-107.9	-27.9	0	0	0	113.6
666	S	32.1	Very low	32.1	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	78%	0.779	S	S	*	*			trans	-74.3	169.9	-173.8	64.1	0	0	0	0	113.2
667	S	35.1	Very low	31.7	Very low	110 Å²	110	132.7 Å²	132.7	77%	0.769	79%	0.787	S	S	*	*			cis	-156.6	165.7	39.6	-53.7	0	0	0	0	114.9
668	I	29.5	Very low	31.2	Very low	155 Å²	155	132.6 Å²	132.6	80%	0.795	78%	0.78	S	S	*	*			trans	-86.8	144.4	-177.2	-64.3	166.4	0	0	0	111.8
669	A	30.9	Very low	31	Very low	103 Å²	103	138.2 Å²	138.2	85%	0.851	80%	0.795	S	S	*	*			trans	-144.3	94	159.6	0	0	0	0	0	110.9
670	T	26.8	Very low	30.6	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.724	78%	0.782	S	S	*	*			trans	-89.8	129	174.8	-55.8	0	0	0	0	110.2
671	I	31.5	Very low	30.8	Very low	162 Å²	162	138 Å²	138	83%	0.831	79%	0.791	S	S	*	*			trans	-124.2	120.6	161.6	-64.9	179.3	0	0	0	108.6
672	S	27.5	Very low	30.8	Very low	95 Å²	95	136.9 Å²	136.9	66%	0.664	79%	0.788	S	S	*	*			trans	-127.5	118.4	171.5	140.7	0	0	0	0	107.5
673	T	34.3	Very low	30.7	Very low	134 Å²	134	132 Å²	132	82%	0.822	78%	0.78	S	S	*	*			trans	-123.3	113.9	161.9	40.2	0	0	0	0	109
674	K	28.1	Very low	30.6	Very low	184 Å²	184	132.8 Å²	132.8	80%	0.8	79%	0.786	S	S	*	*			trans	-69.4	155.8	159.1	-57.1	169	-178.1	174.2	0	107.6
675	D	34.9	Very low	30.4	Very low	160 Å²	160	130 Å²	130	86%	0.856	78%	0.78	S	S	*	*			trans	-145.8	155.1	133.1	-139.6	-30.3	0	0	0	111
676	T	29.6	Very low	30.2	Very low	120 Å²	120	132 Å²	132	74%	0.736	78%	0.782	S	S	*	*			trans	-139.6	103.7	-168.9	49.5	0	0	0	0	111.7
677	G	32.8	Very low	30	Very low	91 Å²	91	132 Å²	132	94%	0.938	78%	0.781	S	S	*	*			trans	-96.3	104.7	172.5	0	0	0	0	0	111.9
678	K	28.5	Very low	29.6	Very low	157 Å²	157	134.3 Å²	134.3	68%	0.683	78%	0.78	S	S	*	*			trans	-105.6	135.3	175.8	-168.4	-165.7	-169.9	-135.3	0	110.1	D680	K678-D680 WeakPolarHBondContact CE-OD1 3.45Å; K678-D680 VanDerWaalsContact CE-OD2 3.32Å; K678-D680 WeakPolarHBondContact CE-OD2 3.38Å; K678-D680 IonicContact NZ-OD1 2.78Å; K678-D680 PolarHBondContact NZ-OD1 3.14Å; K678-D680 IonicContact NZ-OD2 2.65Å; K678-D680 PolarHBondContact NZ-OD2 3.35Å
679	L	32.6	Very low	29.6	Very low	176 Å²	176	133.3 Å²	133.3	92%	0.921	78%	0.776	S	S	*	*			trans	-140.8	116.2	163.1	-98.4	168.5	0	0	0	109.6
680	D	29.1	Very low	29.6	Very low	110 Å²	110	137.6 Å²	137.6	59%	0.588	78%	0.779	S	S	*	*			trans	-94.5	147.5	171.4	-43	-88.3	0	0	0	110.2	K678	K678-D680 WeakPolarHBondContact CE-OD1 3.45Å; K678-D680 VanDerWaalsContact CE-OD2 3.32Å; K678-D680 WeakPolarHBondContact CE-OD2 3.38Å; K678-D680 IonicContact NZ-OD1 2.78Å; K678-D680 PolarHBondContact NZ-OD1 3.14Å; K678-D680 IonicContact NZ-OD2 2.65Å; K678-D680 PolarHBondContact NZ-OD2 3.35Å
681	L	31.4	Very low	29.7	Very low	183 Å²	183	139.8 Å²	139.8	96%	0.958	79%	0.785	S	S	*	*			trans	-153.4	159.1	132.2	-151.2	58.5	0	0	0	110.1
682	A	28.9	Very low	29.6	Very low	86 Å²	86	140.4 Å²	140.4	71%	0.711	78%	0.784	S	S	*	*			trans	-138	177	-162.1	0	0	0	0	0	114.1
683	S	28.3	Very low	29.7	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	79%	0.788	S	S	*	*			trans	97.2	136.4	156.6	79.6	0	0	0	0	119.6
684	S	26.8	Very low	29.6	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	79%	0.793	S	S	*	*			trans	63.6	146.6	154.3	-69.4	0	0	0	0	121
685	T	26.7	Very low	29.8	Very low	108 Å²	108	144.9 Å²	144.9	66%	0.663	80%	0.798	S	S	*	*			cis	-172.2	132.3	-28.2	24.8	0	0	0	0	107.5
686	K	28.2	Very low	29.5	Very low	203 Å²	203	140.5 Å²	140.5	88%	0.883	79%	0.79	S	S	*	*			trans	63.8	152.4	165	-57.3	170.3	-177.5	178.7	0	113.6
687	S	28.3	Very low	29.5	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	80%	0.795	S	S	*	*			cis	-151	176.6	-2.1	41	0	0	0	0	109.2
688	Q	27.3	Very low	29.6	Very low	159 Å²	159	146.1 Å²	146.1	74%	0.743	79%	0.792	S	S	*	*			trans	7.1	133.1	138.7	-73.3	-173.3	-104.5	0	0	117.5
689	D	29.4	Very low	29.9	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	80%	0.795	S	S	*	*			cis	-154.5	-161.9	27.9	-86.9	-41.9	0	0	0	113
690	E	30.6	Very low	30.1	Very low	192 Å²	192	144.8 Å²	144.8	90%	0.897	79%	0.788	S	S	*	*			trans	77.6	102.4	163.9	-56.4	-161.9	145.9	0	0	119.3
691	L	29.3	Very low	30.4	Very low	165 Å²	165	143.7 Å²	143.7	86%	0.864	79%	0.787	S	S	*	*			trans	-81.8	129.2	163.5	-65.7	93.2	0	0	0	110.8
692	H	29.1	Very low	30.3	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.806	78%	0.782	S	S	*	*			trans	-162.1	160.4	141.4	-114.3	79.5	0	0	0	113.9
693	T	29.3	Very low	30.6	Very low	120 Å²	120	145 Å²	145	74%	0.736	78%	0.781	S	S	*	*			trans	61.2	82.1	157.4	-47.4	0	0	0	0	118.7
694	K	31.8	Very low	30.7	Very low	217 Å²	217	144 Å²	144	94%	0.943	77%	0.772	S	S	*	*			trans	-133.3	68.1	150.4	-87.4	-167.1	175.3	178.6	0	112.1
695	L	32.9	Very low	31	Very low	170 Å²	170	143.4 Å²	143.4	89%	0.89	77%	0.774	S	S	*	*			trans	-135.6	86.7	167.8	-92.9	169.1	0	0	0	109.4
696	G	28.8	Very low	31.3	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	77%	0.772	S	S	*	*			trans	-156.8	151.5	177.5	0	0	0	0	0	110.8
697	L	29.8	Very low	31.7	Very low	159 Å²	159	137.1 Å²	137.1	83%	0.832	75%	0.752	S	S	*	*			trans	89.8	73.8	-169.8	-59.5	162.9	0	0	0	116
698	I	35.5	Very low	31.9	Very low	171 Å²	171	136.8 Å²	136.8	88%	0.877	75%	0.75	S	S	*	*			trans	-113.7	121.7	138.7	-63.9	-179.8	0	0	0	106.4	Q700	I698-Q700 PolarHBondContact O-N 3.1Å
699	N	33.8	Very low	32.2	Very low	138 Å²	138	136.8 Å²	136.8	74%	0.738	75%	0.754	S	S	*	*			trans	-71.1	117.7	-172.8	-66.5	-32.8	0	0	0	111.3
700	Q	37.7	Very low	32.7	Very low	166 Å²	166	134 Å²	134	78%	0.776	74%	0.737	S	S	*	*			trans	-65.9	132.7	161.5	-69	-174.9	1	0	0	109.3	I698 L702	I698-Q700 PolarHBondContact O-N 3.1Å; Q700-L702 PolarHBondContact O-N 3.41Å
701	P	34.5	Very low	33.3	Very low	88 Å²	88	129.6 Å²	129.6	57%	0.571	73%	0.725	S	S	*	*			trans	-69.6	113.1	161.3	-2.6	18.5	0	0	0	107.7	L703	P701-L703 PolarHBondContact O-N 3.41Å
702	L	29.7	Very low	34	Very low	164 Å²	164	131.9 Å²	131.9	86%	0.859	73%	0.728	S	S	*	*			trans	-61.9	97.7	175.4	-76.4	163.3	0	0	0	110.1	Q700	Q700-L702 PolarHBondContact O-N 3.41Å
703	L	34.3	Very low	35.4	Very low	133 Å²	133	125.5 Å²	125.5	70%	0.696	70%	0.699	S	S	*	*			trans	-66.9	132.8	165.1	-68.7	174.6	0	0	0	108.4	P701 A705	P701-L703 PolarHBondContact O-N 3.41Å; L703-A705 PolarHBondContact O-N 3.24Å
704	P	31	Very low	36.5	Very low	88 Å²	88	127 Å²	127	57%	0.571	70%	0.698	S	S	*	*			trans	-64	130.9	179	26.3	-33.7	0	0	0	110.2	S706	P704-S706 PolarHBondContact O-N 3.41Å
705	A	33.3	Very low	37.7	Very low	92 Å²	92	122.2 Å²	122.2	76%	0.76	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-66.8	3.6	-172.1	0	0	0	0	0	115.6	L703 L707 S708	L703-A705 PolarHBondContact O-N 3.24Å; A705-L707 PolarHBondContact O-N 2.77Å; A705-S708 PolarHBondContact O-OG 2.91Å
706	S	33	Very low	39.8	Very low	91 Å²	91	120.4 Å²	120.4	64%	0.636	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-83	0.9	-173.2	51.8	0	0	0	0	115.6	P704	P704-S706 PolarHBondContact O-N 3.41Å
707	L	36.5	Very low	42.7	Very low	87 Å²	87	117.7 Å²	117.7	46%	0.455	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-91.9	8	174.8	-71	170.9	0	0	0	114.1	A705 L709 V992	A705-L707 PolarHBondContact O-N 2.77Å; L707-L709 PolarHBondContact O-N 2.7Å; L707-V992 WeakPolarHBondContact CD1-O 3.47Å
708	S	32.6	Very low	45.7	Very low	96 Å²	96	114.1 Å²	114.1	67%	0.671	63%	0.632	S	S	*	*			trans	-77.8	28.8	-179.7	51.4	0	0	0	0	114.9	A705 Q710	A705-S708 PolarHBondContact O-OG 2.91Å; S708-Q710 PolarHBondContact O-N 2.92Å; S708-Q710 VanDerWaalsContact O-N 3.12Å
709	L	32.9	Very low	48.4	Very low	160 Å²	160	108.5 Å²	108.5	84%	0.838	60%	0.604	S	S	*	*			trans	-86.4	55.2	170.8	-82.2	158.9	0	0	0	111.5	L707	L707-L709 PolarHBondContact O-N 2.7Å
710	Q	41.3	Very low	51.3	Low	76 Å²	76	109.8 Å²	109.8	36%	0.355	60%	0.602	S	S	.	*	S	Bend	trans	-107.9	142	158.2	-68.1	-176.5	0.1	0	0	107.7	S708 K712	S708-Q710 PolarHBondContact O-N 2.92Å; S708-Q710 VanDerWaalsContact O-N 3.12Å; Q710-K712 PolarHBondContact O-N 2.84Å
711	P	41.2	Very low	53.9	Low	99 Å²	99	103.8 Å²	103.8	64%	0.643	58%	0.576	S	S	*	*			trans	-54	139.9	169.7	-23.3	33.7	0	0	0	110.5	I713	P711-I713 HydrophobicContact CB-CG1 4.45Å; P711-I713 PolarHBondContact O-N 3.24Å
712	K	45.2	Very low	56.8	Low	213 Å²	213	100.7 Å²	100.7	93%	0.926	55%	0.554	S	S	*	*			trans	-71.1	79.4	165.5	-79.4	-172.9	174.8	-177.9	0	108.3	Q710 Q714	Q710-K712 PolarHBondContact O-N 2.84Å; K712-Q714 PolarHBondContact O-N 3.15Å
713	I	57.5	Low	59.9	Low	40 Å²	40	96.1 Å²	96.1	21%	0.205	53%	0.528	C	S	.	.			trans	-53.4	129.4	174.1	-72.5	158.8	0	0	0	108.1	P711 C715 I717 F749 F787	P711-I713 HydrophobicContact CB-CG1 4.45Å; P711-I713 PolarHBondContact O-N 3.24Å; I713-C715 PolarHBondContact O-N 3.01Å; I713-I717 HydrophobicContact CG2-CD1 3.81Å; I713-F749 HydrophobicContact CD1-CE1 4.08Å; I713-F749 HydrophobicContact CG1-CE1 4.5Å; I713-F749 HydrophobicContact CG2-CE1 3.96Å; I713-F749 HydrophobicContact CG2-CZ 4.02Å; I713-F787 HydrophobicContact CD1-CD1 4.05Å; I713-F787 HydrophobicContact CD1-CE1 3.33Å; I713-F787 HydrophobicContact CD1-CE2 4.16Å; I713-F787 HydrophobicContact CD1-CZ 3.4Å; I713-F787 HydrophobicContact CG1-CE1 4.49Å; I713-F787 HydrophobicContact CG2-CD1 4.31Å
714	Q	54.1	Low	62.7	Low	152 Å²	152	94.4 Å²	94.4	71%	0.71	51%	0.513	S	S	*	.			trans	-64.2	122.4	-167.5	-161.4	167	0.4	0	0	109.5	K712 N716	K712-Q714 PolarHBondContact O-N 3.15Å; Q714-N716 PolarHBondContact O-N 2.74Å
715	C	55.8	Low	65.7	Low	115 Å²	115	92.1 Å²	92.1	78%	0.777	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.3	-160.5	-52.2	0	0	0	0	115.7	I713	I713-C715 PolarHBondContact O-N 3.01Å
716	N	77.8	Confident	68.5	Low	132 Å²	132	88.3 Å²	88.3	71%	0.706	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	44.7	-166.9	-60.9	11.2	0	0	0	112.2	Q714 L718	Q714-N716 PolarHBondContact O-N 2.74Å; N716-L718 PolarHBondContact O-N 3.02Å
717	I	90.2	Very high	71.3	Confident	12 Å²	12	84.4 Å²	84.4	6%	0.062	44%	0.435	C	S	.	.			trans	-65	124.1	171.2	-60.5	170.2	0	0	0	108.9	I713 L722 L741 F749 N788 Y790 L799	I713-I717 HydrophobicContact CG2-CD1 3.81Å; I717-L722 HydrophobicContact CG2-CD1 4.34Å; I717-L722 HydrophobicContact CG2-CD2 3.84Å; I717-L722 HydrophobicContact CG2-CG 4.02Å; I717-L741 HydrophobicContact CB-CD2 4.49Å; I717-L741 HydrophobicContact CD1-CD2 4.13Å; I717-L741 HydrophobicContact CG1-CD2 4.01Å; I717-L741 HydrophobicContact CG2-CD2 3.73Å; I717-F749 HydrophobicContact CD1-CE1 4.15Å; I717-F749 HydrophobicContact CD1-CE2 4.23Å; I717-F749 HydrophobicContact CD1-CZ 3.74Å; I717-N788 PolarHBondContact O-ND2 3.2Å; I717-Y790 VanDerWaalsContact O-CE1 3.29Å; I717-Y790 WeakPolarHBondContact O-CE1 3.22Å; I717-Y790 PolarHBondContact O-OH 2.88Å; I717-L799 HydrophobicContact CB-CD2 4.29Å; I717-L799 HydrophobicContact CD1-CD2 3.97Å; I717-L799 HydrophobicContact CG2-CD2 4.05Å
718	L	92.3	Very high	73.9	Confident	84 Å²	84	80.9 Å²	80.9	44%	0.44	42%	0.417	S	S	.	.			trans	-97	150.1	174.5	-50.3	171.4	0	0	0	110.5	N716 K720 D721	N716-L718 PolarHBondContact O-N 3.02Å; L718-K720 HydrophobicContact CB-CG 4.02Å; L718-K720 PolarHBondContact O-N 2.9Å; L718-K720 VanDerWaalsContact O-N 3.12Å; L718-D721 VanDerWaalsContact CB-OD2 3.26Å; L718-D721 WeakPolarHBondContact CB-OD2 3.44Å; L718-D721 PolarHBondContact N-OD2 2.83Å; L718-D721 WeakPolarHBondContact O-CB 3.41Å; L718-D721 PolarHBondContact O-N 2.69Å
719	L	92.7	Very high	76.5	Confident	53 Å²	53	77 Å²	77	28%	0.277	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-56.3	-31.9	-179	-177.7	60	0	0	0	113.6	D721 L722 L751 Y790 Y797	L719-D721 VanDerWaalsContact C-N 3.28Å; L719-D721 PolarHBondContact O-N 3.16Å; L719-L722 HydrophobicContact CD1-CD1 4.36Å; L719-L722 PolarHBondContact O-N 3.12Å; L719-L751 HydrophobicContact CD1-CD2 4.07Å; L719-Y790 HydrophobicContact CB-CD1 3.98Å; L719-Y790 HydrophobicContact CB-CD2 4.06Å; L719-Y790 HydrophobicContact CB-CE1 4.33Å; L719-Y790 HydrophobicContact CB-CE2 4.41Å; L719-Y790 HydrophobicContact CB-CG 3.83Å; L719-Y790 HydrophobicContact CD1-CD2 3.85Å; L719-Y790 HydrophobicContact CD1-CE2 4.3Å; L719-Y790 HydrophobicContact CD1-CG 4.35Å; L719-Y790 HydrophobicContact CD2-CG 4.44Å; L719-Y790 HydrophobicContact CG-CD2 4.41Å; L719-Y790 HydrophobicContact CG-CG 4.43Å; L719-Y797 HydrophobicContact CD1-CD1 4.1Å; L719-Y797 HydrophobicContact CD1-CE1 4.26Å; L719-Y797 HydrophobicContact CD1-CG 4.37Å; L719-Y797 HydrophobicContact CD2-CD2 4.03Å; L719-Y797 HydrophobicContact CD2-CE1 4.41Å; L719-Y797 HydrophobicContact CD2-CE2 3.83Å; L719-Y797 HydrophobicContact CD2-CG 4.44Å
720	K	93.4	Very high	78.8	Confident	164 Å²	164	73.7 Å²	73.7	71%	0.713	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-71.6	-17	176.8	63.1	163.5	-165.3	-178.7	0	114.4	L718 L722	L718-K720 HydrophobicContact CB-CG 4.02Å; L718-K720 PolarHBondContact O-N 2.9Å; L718-K720 VanDerWaalsContact O-N 3.12Å; K720-L722 VanDerWaalsContact C-N 3.29Å
721	D	93.1	Very high	80.3	Confident	41 Å²	41	72.1 Å²	72.1	22%	0.219	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-92.1	4.4	-178.1	-51.7	-36.6	0	0	0	111.3	L718 L719 L741 T742	L718-D721 VanDerWaalsContact CB-OD2 3.26Å; L718-D721 WeakPolarHBondContact CB-OD2 3.44Å; L718-D721 PolarHBondContact N-OD2 2.83Å; L718-D721 WeakPolarHBondContact O-CB 3.41Å; L718-D721 PolarHBondContact O-N 2.69Å; L719-D721 VanDerWaalsContact C-N 3.28Å; L719-D721 PolarHBondContact O-N 3.16Å; D721-L741 WeakPolarHBondContact O-CA 3.46Å; D721-T742 PolarHBondContact O-N 3.01Å; D721-T742 PolarHBondContact O-OG1 3.16Å
722	L	94.9	Very high	81.6	Confident	22 Å²	22	69.7 Å²	69.7	12%	0.115	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.4	-179	-66	173.2	0	0	0	111.3	I717 L719 K720 V739 T740 L741 L751 Y790 L799	I717-L722 HydrophobicContact CG2-CD1 4.34Å; I717-L722 HydrophobicContact CG2-CD2 3.84Å; I717-L722 HydrophobicContact CG2-CG 4.02Å; L719-L722 HydrophobicContact CD1-CD1 4.36Å; L719-L722 PolarHBondContact O-N 3.12Å; K720-L722 VanDerWaalsContact C-N 3.29Å; L722-V739 HydrophobicContact CB-CB 4.34Å; L722-V739 HydrophobicContact CB-CG2 4.43Å; L722-V739 HydrophobicContact CD1-CG2 4.33Å; L722-V739 HydrophobicContact CD2-CB 4.49Å; L722-V739 HydrophobicContact CD2-CG2 3.9Å; L722-V739 HydrophobicContact CG-CG2 4.47Å; L722-T740 CarbonylContact C-O 3.57Å; L722-T740 WeakPolarHBondContact CA-O 3.37Å; L722-L741 HydrophobicContact CD2-CD2 4.08Å; L722-L751 HydrophobicContact CD1-CD1 4.43Å; L722-Y790 HydrophobicContact CD1-CE2 4.06Å; L722-L799 HydrophobicContact CD1-CD1 3.78Å; L722-L799 HydrophobicContact CD1-CD2 4.43Å; L722-L799 HydrophobicContact CD2-CD1 4.23Å
723	E	94.4	Very high	82.9	Confident	68 Å²	68	62.7 Å²	62.7	32%	0.318	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.5	170.4	-174.1	-172.9	131.2	0	0	110.3	I725 V739 T740 T742 R745	E723-I725 HydrophobicContact CG-CD1 4.43Å; E723-V739 CarbonylContact O-C 3.56Å; E723-V739 WeakPolarHBondContact O-CA 3.29Å; E723-V739 WeakPolarHBondContact O-CB 3.44Å; E723-T740 HydrophobicContact CB-CG2 4.14Å; E723-T740 PolarHBondContact N-O 3.19Å; E723-T740 PolarHBondContact O-N 3.35Å; E723-T742 HydrophobicContact CB-CG2 4.19Å; E723-R745 IonicContact OE1-CZ 2.77Å; E723-R745 IonicContact OE1-NH1 2.69Å; E723-R745 PolarHBondContact OE1-NH1 3.41Å; E723-R745 IonicContact OE1-NH2 3.62Å; E723-R745 PolarHBondContact OE1-NH2 3.06Å; E723-R745 IonicContact OE2-CZ 2.69Å; E723-R745 IonicContact OE2-NH1 3.88Å; E723-R745 PolarHBondContact OE2-NH1 2.94Å; E723-R745 IonicContact OE2-NH2 3.99Å
724	R	93.7	Very high	84.1	Confident	97 Å²	97	61.7 Å²	61.7	37%	0.366	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.2	175	175.8	-179	63.7	161.3	-7.5	111.4	D737 V739 M1018 E1020	R724-D737 VanDerWaalsContact CD-OD2 3.26Å; R724-D737 WeakPolarHBondContact CD-OD2 3.48Å; R724-D737 HydrophobicContact CG-CB 4.15Å; R724-V739 HydrophobicContact CB-CG1 4.43Å; R724-M1018 HydrophobicContact CG-CE 3.97Å; R724-E1020 IonicContact CZ-OE1 3.51Å; R724-E1020 IonicContact NH1-OE1 3.23Å; R724-E1020 PolarHBondContact NH1-OE1 3.49Å; R724-E1020 IonicContact NH2-OE1 3.99Å
725	I	93.9	Very high	85.8	Confident	40 Å²	40	55.9 Å²	55.9	21%	0.205	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-52.5	-179.6	-55.4	-54.8	0	0	0	111.8	E723 L738 T740 R745 L1008	E723-I725 HydrophobicContact CG-CD1 4.43Å; I725-L738 HydrophobicContact CB-CB 4.35Å; I725-L738 HydrophobicContact CB-CD2 4.15Å; I725-L738 HydrophobicContact CB-CG 4.13Å; I725-L738 HydrophobicContact CG1-CG 4.49Å; I725-L738 HydrophobicContact CG2-CD2 4.07Å; I725-L738 PolarHBondContact N-O 2.86Å; I725-T740 HydrophobicContact CD1-CG2 3.84Å; I725-T740 HydrophobicContact CG1-CG2 4.17Å; I725-R745 VanDerWaalsContact CD1-NH2 3.32Å; I725-L1008 HydrophobicContact CD1-CD1 4.09Å; I725-L1008 HydrophobicContact CG1-CD1 4.24Å; I725-L1008 HydrophobicContact CG1-CD2 4.3Å
726	C	92.3	Very high	87.6	Confident	13 Å²	13	52.2 Å²	52.2	9%	0.088	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	176.1	-179.3	66.4	0	0	0	0	111.2	D737 L738	C726-D737 CarbonylContact O-C 3.55Å; C726-D737 WeakPolarHBondContact O-CA 3.37Å; C726-L738 PolarHBondContact O-N 2.78Å; C726-L738 VanDerWaalsContact SG-CB 3.57Å
727	V	91.9	Very high	88.4	Confident	9 Å²	9	46.2 Å²	46.2	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.7	170.5	179.6	0	0	0	0	108.3	V730 R735 F1016	V727-V730 HydrophobicContact CG1-CG2 3.96Å; V727-R735 HydrophobicContact CG1-CB 4.37Å; V727-F1016 HydrophobicContact CB-CB 4.01Å; V727-F1016 HydrophobicContact CG1-CB 3.88Å; V727-F1016 HydrophobicContact CG1-CD2 4.31Å; V727-F1016 HydrophobicContact CG1-CG 4.24Å
728	L	90.9	Very high	88.7	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.063	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-28.8	178.3	-66.6	173.9	0	0	0	112.8	V736 L738 A750 H1010 F1013	L728-V736 HydrophobicContact CB-CG1 4.44Å; L728-V736 HydrophobicContact CD1-CG1 4.33Å; L728-V736 PolarHBondContact N-O 3.44Å; L728-L738 HydrophobicContact CD1-CB 3.98Å; L728-L738 HydrophobicContact CD1-CD1 4.34Å; L728-L738 HydrophobicContact CD2-CB 4Å; L728-L738 HydrophobicContact CG-CB 3.82Å; L728-A750 HydrophobicContact CD1-CB 4.2Å; L728-H1010 HydrophobicContact CD2-CB 4Å; L728-F1013 HydrophobicContact CB-CD1 4.3Å; L728-F1013 HydrophobicContact CB-CE1 4.41Å; L728-F1013 HydrophobicContact CD2-CD1 4.31Å; L728-F1013 HydrophobicContact CD2-CD2 3.86Å; L728-F1013 HydrophobicContact CD2-CE1 4.44Å; L728-F1013 HydrophobicContact CD2-CE2 4.01Å; L728-F1013 HydrophobicContact CD2-CG 4.03Å; L728-F1013 HydrophobicContact CD2-CZ 4.29Å; L728-F1013 WeakPolarHBondContact O-CD1 3.38Å
729	G	86.2	Confident	88.9	Confident	14 Å²	14	41.7 Å²	41.7	14%	0.144	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	153.3	-178.4	0	0	0	0	0	112.9	R735 V736	G729-R735 CarbonylContact O-C 3.51Å; G729-R735 WeakPolarHBondContact O-CA 3.48Å; G729-R735 WeakPolarHBondContact O-CB 3.49Å; G729-V736 PolarHBondContact N-O 2.83Å; G729-V736 PolarHBondContact O-N 3.37Å
730	V	82.5	Confident	89	Confident	92 Å²	92	39.2 Å²	39.2	56%	0.558	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	133	178.9	-176.2	0	0	0	0	109.2	V727 R735 F1016	V727-V730 HydrophobicContact CG1-CG2 3.96Å; V730-R735 HydrophobicContact CB-CB 4.48Å; V730-R735 HydrophobicContact CG2-CB 4.13Å; V730-F1016 HydrophobicContact CB-CD1 4.5Å; V730-F1016 HydrophobicContact CG2-CB 4.44Å; V730-F1016 HydrophobicContact CG2-CD1 3.82Å; V730-F1016 HydrophobicContact CG2-CE1 4.32Å; V730-F1016 HydrophobicContact CG2-CG 4.13Å
731	G	72.6	Confident	89	Confident	43 Å²	43	32.2 Å²	32.2	44%	0.443	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	-177.6	-178.9	0	0	0	0	0	112.4	F733 G734	G731-F733 VanDerWaalsContact C-N 3.33Å; G731-F733 PolarHBondContact O-N 3.02Å; G731-G734 CarbonylContact C-O 3.57Å; G731-G734 PolarHBondContact N-O 3.24Å
732	G	67.8	Low	89	Confident	47 Å²	47	33.4 Å²	33.4	49%	0.485	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.5	-173	0	0	0	0	0	114.9	H758	G732-H758 PolarHBondContact O-CE1 2.93Å; G732-H758 PolarHBondContact O-ND1 3.36Å
733	F	72.2	Confident	88.7	Confident	67 Å²	67	39.6 Å²	39.6	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	3.8	-172.8	-51.7	-66.8	0	0	0	114.3	G731 L754 Q755 T762 Q764	G731-F733 VanDerWaalsContact C-N 3.33Å; G731-F733 PolarHBondContact O-N 3.02Å; F733-L754 HydrophobicContact CB-CD2 4.27Å; F733-L754 WeakPolarHBondContact O-CA 3.47Å; F733-Q755 PolarHBondContact O-N 3.31Å; F733-T762 HydrophobicContact CE1-CG2 4.19Å; F733-T762 WeakPolarHBondContact CE1-OG1 3.39Å; F733-Q764 HydrophobicContact CE1-CG 3.85Å; F733-Q764 HydrophobicContact CE2-CG 4.49Å; F733-Q764 HydrophobicContact CZ-CG 3.74Å
734	G	83.5	Confident	88.5	Confident	19 Å²	19	38.6 Å²	38.6	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-151.2	-171.4	0	0	0	0	0	112.7	G731 R753	G731-G734 CarbonylContact C-O 3.57Å; G731-G734 PolarHBondContact N-O 3.24Å; G734-R753 WeakPolarHBondContact CA-O 3.37Å
735	R	90.2	Very high	88.4	Confident	29 Å²	29	39.7 Å²	39.7	11%	0.109	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	172.3	-175.9	71.2	177.8	-162.6	-135.6	-17.9	112.6	V727 G729 V730 D737 R753 E1020	V727-R735 HydrophobicContact CG1-CB 4.37Å; G729-R735 CarbonylContact O-C 3.51Å; G729-R735 WeakPolarHBondContact O-CA 3.48Å; G729-R735 WeakPolarHBondContact O-CB 3.49Å; V730-R735 HydrophobicContact CB-CB 4.48Å; V730-R735 HydrophobicContact CG2-CB 4.13Å; R735-D737 WeakPolarHBondContact CD-OD1 3.41Å; R735-D737 IonicContact CZ-OD1 2.71Å; R735-D737 IonicContact CZ-OD2 2.73Å; R735-D737 IonicContact NE-OD1 3.35Å; R735-D737 PolarHBondContact NE-OD1 2.95Å; R735-D737 IonicContact NE-OD2 2.92Å; R735-D737 PolarHBondContact NE-OD2 3.09Å; R735-D737 IonicContact NH2-OD1 3.24Å; R735-D737 IonicContact NH2-OD2 3.95Å; R735-D737 PolarHBondContact NH2-OD2 2.61Å; R735-R753 PolarHBondContact N-O 2.7Å; R735-R753 PolarHBondContact O-N 2.86Å; R735-E1020 IonicContact CZ-OE1 3.74Å; R735-E1020 IonicContact NH1-OE1 3.8Å; R735-E1020 PolarHBondContact NH1-OE1 3.21Å; R735-E1020 IonicContact NH2-OE1 3.21Å; R735-E1020 PolarHBondContact NH2-OE1 3.35Å
736	V	93.5	Very high	88.2	Confident	39 Å²	39	42.5 Å²	42.5	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.7	174.5	-175.3	0	0	0	0	109	L728 G729 A750 L751 K752	L728-V736 HydrophobicContact CB-CG1 4.44Å; L728-V736 HydrophobicContact CD1-CG1 4.33Å; L728-V736 PolarHBondContact N-O 3.44Å; G729-V736 PolarHBondContact N-O 2.83Å; G729-V736 PolarHBondContact O-N 3.37Å; V736-A750 HydrophobicContact CG1-CB 3.78Å; V736-L751 WeakPolarHBondContact CA-O 2.88Å; V736-K752 HydrophobicContact CG2-CB 4.28Å; V736-K752 HydrophobicContact CG2-CG 4.16Å
737	D	95	Very high	88	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.6	177.5	-71.4	-14.8	0	0	0	110.6	R724 C726 R735 V739 A750 L751	R724-D737 VanDerWaalsContact CD-OD2 3.26Å; R724-D737 WeakPolarHBondContact CD-OD2 3.48Å; R724-D737 HydrophobicContact CG-CB 4.15Å; C726-D737 CarbonylContact O-C 3.55Å; C726-D737 WeakPolarHBondContact O-CA 3.37Å; R735-D737 WeakPolarHBondContact CD-OD1 3.41Å; R735-D737 IonicContact CZ-OD1 2.71Å; R735-D737 IonicContact CZ-OD2 2.73Å; R735-D737 IonicContact NE-OD1 3.35Å; R735-D737 PolarHBondContact NE-OD1 2.95Å; R735-D737 IonicContact NE-OD2 2.92Å; R735-D737 PolarHBondContact NE-OD2 3.09Å; R735-D737 IonicContact NH2-OD1 3.24Å; R735-D737 IonicContact NH2-OD2 3.95Å; R735-D737 PolarHBondContact NH2-OD2 2.61Å; D737-V739 HydrophobicContact CB-CG1 4.12Å; D737-V739 PolarHBondContact O-N 2.73Å; D737-A750 CarbonylContact O-C 3.6Å; D737-A750 WeakPolarHBondContact O-CA 3.41Å; D737-L751 HydrophobicContact CB-CB 4.44Å; D737-L751 PolarHBondContact N-O 2.69Å; D737-L751 PolarHBondContact O-N 2.89Å
738	L	96	Very high	88.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	122.9	163.2	-179.6	61.5	0	0	0	107.8	I725 C726 L728 A748 A802 L804 H1010	I725-L738 HydrophobicContact CB-CB 4.35Å; I725-L738 HydrophobicContact CB-CD2 4.15Å; I725-L738 HydrophobicContact CB-CG 4.13Å; I725-L738 HydrophobicContact CG1-CG 4.49Å; I725-L738 HydrophobicContact CG2-CD2 4.07Å; I725-L738 PolarHBondContact N-O 2.86Å; C726-L738 PolarHBondContact O-N 2.78Å; C726-L738 VanDerWaalsContact SG-CB 3.57Å; L728-L738 HydrophobicContact CD1-CB 3.98Å; L728-L738 HydrophobicContact CD1-CD1 4.34Å; L728-L738 HydrophobicContact CD2-CB 4Å; L728-L738 HydrophobicContact CG-CB 3.82Å; L738-A748 HydrophobicContact CD1-CB 4.27Å; L738-A802 HydrophobicContact CD1-CB 4.33Å; L738-L804 HydrophobicContact CD1-CD2 3.97Å; L738-H1010 HydrophobicContact CD2-CB 4.19Å
739	V	96.4	Very high	88.3	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	156.2	178.4	-54.4	0	0	0	0	111.5	L722 E723 R724 D737 F749 L751 L799	L722-V739 HydrophobicContact CB-CB 4.34Å; L722-V739 HydrophobicContact CB-CG2 4.43Å; L722-V739 HydrophobicContact CD1-CG2 4.33Å; L722-V739 HydrophobicContact CD2-CB 4.49Å; L722-V739 HydrophobicContact CD2-CG2 3.9Å; L722-V739 HydrophobicContact CG-CG2 4.47Å; E723-V739 CarbonylContact O-C 3.56Å; E723-V739 WeakPolarHBondContact O-CA 3.29Å; E723-V739 WeakPolarHBondContact O-CB 3.44Å; R724-V739 HydrophobicContact CB-CG1 4.43Å; D737-V739 HydrophobicContact CB-CG1 4.12Å; D737-V739 PolarHBondContact O-N 2.73Å; V739-F749 HydrophobicContact CG2-CB 3.83Å; V739-F749 PolarHBondContact N-O 2.92Å; V739-F749 PolarHBondContact O-N 3.17Å; V739-L751 HydrophobicContact CG1-CB 3.74Å; V739-L751 HydrophobicContact CG1-CD2 3.96Å; V739-L751 HydrophobicContact CG2-CB 3.98Å; V739-L799 HydrophobicContact CG2-CD1 3.93Å
740	T	95.7	Very high	88.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	162.9	176.9	-164.7	0	0	0	0	110.4	L722 E723 I725 D744 R745 Q747 L1008	L722-T740 CarbonylContact C-O 3.57Å; L722-T740 WeakPolarHBondContact CA-O 3.37Å; E723-T740 HydrophobicContact CB-CG2 4.14Å; E723-T740 PolarHBondContact N-O 3.19Å; E723-T740 PolarHBondContact O-N 3.35Å; I725-T740 HydrophobicContact CD1-CG2 3.84Å; I725-T740 HydrophobicContact CG1-CG2 4.17Å; T740-D744 PolarHBondContact OG1-O 2.84Å; T740-R745 HydrophobicContact CG2-CG 4.45Å; T740-R745 WeakPolarHBondContact OG1-CA 3.43Å; T740-Q747 WeakPolarHBondContact CA-O 3.31Å; T740-Q747 WeakPolarHBondContact CB-O 3.27Å; T740-Q747 PolarHBondContact OG1-O 2.7Å; T740-L1008 HydrophobicContact CG2-CD1 4.33Å; T740-L1008 HydrophobicContact CG2-CD2 4.36Å
741	L	93.6	Very high	89.5	Confident	18 Å²	18	40.3 Å²	40.3	9%	0.094	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.4	175.3	-65.5	168.9	0	0	0	109.4	I717 D721 L722 N743 D744 Q747 F749	I717-L741 HydrophobicContact CB-CD2 4.49Å; I717-L741 HydrophobicContact CD1-CD2 4.13Å; I717-L741 HydrophobicContact CG1-CD2 4.01Å; I717-L741 HydrophobicContact CG2-CD2 3.73Å; D721-L741 WeakPolarHBondContact O-CA 3.46Å; L722-L741 HydrophobicContact CD2-CD2 4.08Å; L741-N743 PolarHBondContact O-N 3.4Å; L741-D744 HydrophobicContact CB-CB 4.18Å; L741-D744 HydrophobicContact CD1-CB 4.4Å; L741-D744 CarbonylContact O-C 3.5Å; L741-D744 PolarHBondContact O-N 3.29Å; L741-Q747 HydrophobicContact CD1-CB 4.17Å; L741-F749 HydrophobicContact CD1-CE2 4.3Å; L741-F749 HydrophobicContact CG-CE2 4.08Å
742	T	91.5	Very high	90.6	Very high	65 Å²	65	39.4 Å²	39.4	40%	0.399	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35	175.7	49.6	0	0	0	0	112.4	D721 E723	D721-T742 PolarHBondContact O-N 3.01Å; D721-T742 PolarHBondContact O-OG1 3.16Å; E723-T742 HydrophobicContact CB-CG2 4.19Å
743	N	89.9	Confident	91.8	Very high	153 Å²	153	39.1 Å²	39.1	82%	0.818	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.5	178.5	-61.4	-38.5	0	0	0	114.2	L741	L741-N743 PolarHBondContact O-N 3.4Å
744	D	90.3	Very high	92.8	Very high	47 Å²	47	36.4 Å²	36.4	25%	0.251	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	92.6	-179.1	-179	6.5	0	0	0	111.9	T740 L741 T746 Q747	T740-D744 PolarHBondContact OG1-O 2.84Å; L741-D744 HydrophobicContact CB-CB 4.18Å; L741-D744 HydrophobicContact CD1-CB 4.4Å; L741-D744 CarbonylContact O-C 3.5Å; L741-D744 PolarHBondContact O-N 3.29Å; D744-T746 PolarHBondContact O-N 3.18Å; D744-T746 VanDerWaalsContact O-N 3.13Å; D744-T746 WeakPolarHBondContact OD1-CA 3.38Å; D744-T746 VanDerWaalsContact OD1-CB 3.26Å; D744-T746 WeakPolarHBondContact OD1-CB 3.47Å; D744-T746 WeakPolarHBondContact OD1-CG2 3.31Å; D744-T746 PolarHBondContact OD1-N 3.17Å; D744-T746 PolarHBondContact OD1-OG1 2.91Å; D744-T746 PolarHBondContact OD2-OG1 3.26Å; D744-Q747 PolarHBondContact O-N 3.3Å; D744-Q747 WeakPolarHBondContact OD2-CG 3.3Å; D744-Q747 PolarHBondContact OD2-NE2 3.01Å
745	R	90.8	Very high	93.3	Very high	120 Å²	120	38.5 Å²	38.5	45%	0.453	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	1.7	177.5	-56.3	-171.1	80.1	99.4	5.3	114.3	E723 I725 T740	E723-R745 IonicContact OE1-CZ 2.77Å; E723-R745 IonicContact OE1-NH1 2.69Å; E723-R745 PolarHBondContact OE1-NH1 3.41Å; E723-R745 IonicContact OE1-NH2 3.62Å; E723-R745 PolarHBondContact OE1-NH2 3.06Å; E723-R745 IonicContact OE2-CZ 2.69Å; E723-R745 IonicContact OE2-NH1 3.88Å; E723-R745 PolarHBondContact OE2-NH1 2.94Å; E723-R745 IonicContact OE2-NH2 3.99Å; I725-R745 VanDerWaalsContact CD1-NH2 3.32Å; T740-R745 HydrophobicContact CG2-CG 4.45Å; T740-R745 WeakPolarHBondContact OG1-CA 3.43Å
746	T	88.9	Confident	93.5	Very high	99 Å²	99	37.4 Å²	37.4	61%	0.607	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	-21.5	174.5	76.6	0	0	0	0	112.8	D744 P1007	D744-T746 PolarHBondContact O-N 3.18Å; D744-T746 VanDerWaalsContact O-N 3.13Å; D744-T746 WeakPolarHBondContact OD1-CA 3.38Å; D744-T746 VanDerWaalsContact OD1-CB 3.26Å; D744-T746 WeakPolarHBondContact OD1-CB 3.47Å; D744-T746 WeakPolarHBondContact OD1-CG2 3.31Å; D744-T746 PolarHBondContact OD1-N 3.17Å; D744-T746 PolarHBondContact OD1-OG1 2.91Å; D744-T746 PolarHBondContact OD2-OG1 3.26Å; T746-P1007 VanDerWaalsContact O-CB 3.3Å; T746-P1007 WeakPolarHBondContact O-CB 3.49Å
747	Q	89.8	Confident	93.4	Very high	48 Å²	48	36.7 Å²	36.7	22%	0.224	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.3	178.2	-70.6	-176.9	77.5	0	0	111.2	T740 L741 D744 F749	T740-Q747 WeakPolarHBondContact CA-O 3.31Å; T740-Q747 WeakPolarHBondContact CB-O 3.27Å; T740-Q747 PolarHBondContact OG1-O 2.7Å; L741-Q747 HydrophobicContact CD1-CB 4.17Å; D744-Q747 PolarHBondContact O-N 3.3Å; D744-Q747 WeakPolarHBondContact OD2-CG 3.3Å; D744-Q747 PolarHBondContact OD2-NE2 3.01Å; Q747-F749 HydrophobicContact CB-CE2 3.82Å; Q747-F749 HydrophobicContact CB-CZ 4.2Å
748	A	93.1	Very high	93	Very high	23 Å²	23	39.1 Å²	39.1	19%	0.19	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	140	-176.5	0	0	0	0	0	111.8	L738 A802 P1007 L1008	L738-A748 HydrophobicContact CD1-CB 4.27Å; A748-A802 HydrophobicContact CB-CB 4.25Å; A748-A802 WeakPolarHBondContact O-CB 3.28Å; A748-P1007 WeakPolarHBondContact CB-O 3.47Å; A748-L1008 HydrophobicContact CB-CD2 3.95Å
749	F	95.8	Very high	92.6	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159	-175.5	-54.3	-92.7	0	0	0	110.7	I713 I717 V739 L741 Q747 F787 L799 L800	I713-F749 HydrophobicContact CD1-CE1 4.08Å; I713-F749 HydrophobicContact CG1-CE1 4.5Å; I713-F749 HydrophobicContact CG2-CE1 3.96Å; I713-F749 HydrophobicContact CG2-CZ 4.02Å; I717-F749 HydrophobicContact CD1-CE1 4.15Å; I717-F749 HydrophobicContact CD1-CE2 4.23Å; I717-F749 HydrophobicContact CD1-CZ 3.74Å; V739-F749 HydrophobicContact CG2-CB 3.83Å; V739-F749 PolarHBondContact N-O 2.92Å; V739-F749 PolarHBondContact O-N 3.17Å; L741-F749 HydrophobicContact CD1-CE2 4.3Å; L741-F749 HydrophobicContact CG-CE2 4.08Å; Q747-F749 HydrophobicContact CB-CE2 3.82Å; Q747-F749 HydrophobicContact CB-CZ 4.2Å; F749-F787 AromaticContact CD1-CD2 3.67Å; F749-F787 HydrophobicContact CD1-CD2 3.67Å; F749-F787 AromaticContact CD1-CE2 3.78Å; F749-F787 HydrophobicContact CD1-CE2 3.78Å; F749-F787 AromaticContact CE1-CD2 3.85Å; F749-F787 HydrophobicContact CE1-CD2 3.85Å; F749-F787 AromaticContact CE1-CE2 3.92Å; F749-F787 HydrophobicContact CE1-CE2 3.92Å; F749-F787 HydrophobicContact CE1-CG 4.43Å; F749-L799 HydrophobicContact CB-CD1 3.48Å; F749-L799 VanDerWaalsContact CB-CD1 3.48Å; F749-L799 HydrophobicContact CB-CG 4.17Å; F749-L799 HydrophobicContact CD1-CD1 4.33Å; F749-L799 HydrophobicContact CD1-CD2 4.34Å; F749-L799 HydrophobicContact CD1-CG 4.17Å; F749-L799 HydrophobicContact CG-CD1 3.94Å; F749-L799 HydrophobicContact CG-CG 4.29Å; F749-L800 WeakPolarHBondContact CA-O 3.39Å
750	A	96.2	Very high	92.2	Very high	9 Å²	9	41.2 Å²	41.2	7%	0.074	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	111.4	175	0	0	0	0	0	109.4	L728 V736 D737 L800	L728-A750 HydrophobicContact CD1-CB 4.2Å; V736-A750 HydrophobicContact CG1-CB 3.78Å; D737-A750 CarbonylContact O-C 3.6Å; D737-A750 WeakPolarHBondContact O-CA 3.41Å; A750-L800 HydrophobicContact CB-CB 4.26Å; A750-L800 PolarHBondContact N-O 3.33Å; A750-L800 WeakPolarHBondContact O-CA 3.24Å; A750-L800 VanDerWaalsContact O-CB 3.3Å; A750-L800 WeakPolarHBondContact O-CB 2.97Å; A750-L800 PolarHBondContact O-N 3.27Å
751	L	96.5	Very high	91.6	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	98.3	-178	-172.2	66.1	0	0	0	109.9	L719 L722 V736 D737 V739 R753 Y790 Y797 M798 L799	L719-L751 HydrophobicContact CD1-CD2 4.07Å; L722-L751 HydrophobicContact CD1-CD1 4.43Å; V736-L751 WeakPolarHBondContact CA-O 2.88Å; D737-L751 HydrophobicContact CB-CB 4.44Å; D737-L751 PolarHBondContact N-O 2.69Å; D737-L751 PolarHBondContact O-N 2.89Å; V739-L751 HydrophobicContact CG1-CB 3.74Å; V739-L751 HydrophobicContact CG1-CD2 3.96Å; V739-L751 HydrophobicContact CG2-CB 3.98Å; L751-R753 PolarHBondContact O-N 3.39Å; L751-Y790 HydrophobicContact CD1-CD2 4.45Å; L751-Y790 HydrophobicContact CD1-CE2 4.44Å; L751-Y797 HydrophobicContact CD1-CD1 4.15Å; L751-Y797 HydrophobicContact CD2-CD1 3.94Å; L751-Y797 HydrophobicContact CD2-CE1 4.39Å; L751-Y797 HydrophobicContact CG-CD1 4.03Å; L751-M798 WeakPolarHBondContact CA-O 3.36Å; L751-L799 HydrophobicContact CD1-CB 4.41Å; L751-L799 HydrophobicContact CD1-CD1 4.14Å
752	K	95.2	Very high	90.6	Very high	25 Å²	25	50.1 Å²	50.1	11%	0.109	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	111.7	172.7	-168.1	-175.2	-161.3	-173.8	0	107.9	V736 L754 E771 Y797 M798 L800 D864	V736-K752 HydrophobicContact CG2-CB 4.28Å; V736-K752 HydrophobicContact CG2-CG 4.16Å; K752-L754 HydrophobicContact CD-CD2 4.4Å; K752-L754 HydrophobicContact CG-CD2 3.98Å; K752-L754 HydrophobicContact CG-CG 4.34Å; K752-E771 IonicContact NZ-OE1 3.13Å; K752-E771 PolarHBondContact NZ-OE1 2.99Å; K752-E771 IonicContact NZ-OE2 3.34Å; K752-E771 PolarHBondContact NZ-OE2 2.84Å; K752-Y797 CarbonylContact O-C 3.27Å; K752-Y797 WeakPolarHBondContact O-CA 3.41Å; K752-M798 HydrophobicContact CB-CB 4.25Å; K752-M798 HydrophobicContact CD-SD 4.24Å; K752-M798 PolarHBondContact N-O 2.69Å; K752-M798 PolarHBondContact O-N 3.4Å; K752-L800 HydrophobicContact CB-CD1 3.98Å; K752-D864 IonicContact NZ-OD1 3.65Å; K752-D864 PolarHBondContact NZ-OD1 3.5Å
753	R	94.2	Very high	90.1	Very high	40 Å²	40	54.7 Å²	54.7	15%	0.151	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.6	-177.2	179.9	-179.1	-170.8	-146.9	5.3	109.3	G734 R735 L751 Y795 Y797 E1020	G734-R753 WeakPolarHBondContact CA-O 3.37Å; R735-R753 PolarHBondContact N-O 2.7Å; R735-R753 PolarHBondContact O-N 2.86Å; L751-R753 PolarHBondContact O-N 3.39Å; R753-Y795 HydrophobicContact CG-CD1 3.68Å; R753-Y795 HydrophobicContact CG-CE1 4.36Å; R753-Y795 HydrophobicContact CG-CG 3.99Å; R753-Y797 HydrophobicContact CB-CD1 3.99Å; R753-Y797 HydrophobicContact CB-CE1 4.07Å; R753-Y797 HydrophobicContact CG-CD1 3.84Å; R753-Y797 HydrophobicContact CG-CE1 3.46Å; R753-Y797 VanDerWaalsContact CG-CE1 3.46Å; R753-Y797 PolarHBondContact NE-OH 3.05Å; R753-E1020 IonicContact CZ-OE2 2.72Å; R753-E1020 IonicContact NH1-OE1 2.76Å; R753-E1020 IonicContact NH1-OE2 3.89Å; R753-E1020 PolarHBondContact NH1-OE2 2.93Å; R753-E1020 IonicContact NH2-OE2 3.21Å
754	L	93.2	Very high	89.6	Confident	11 Å²	11	48 Å²	48	6%	0.058	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.3	-172.2	-50.6	174.5	0	0	0	111	F733 K752 K756 I759 V768 Y795 V796 M798	F733-L754 HydrophobicContact CB-CD2 4.27Å; F733-L754 WeakPolarHBondContact O-CA 3.47Å; K752-L754 HydrophobicContact CD-CD2 4.4Å; K752-L754 HydrophobicContact CG-CD2 3.98Å; K752-L754 HydrophobicContact CG-CG 4.34Å; L754-K756 PolarHBondContact O-N 3.07Å; L754-I759 HydrophobicContact CB-CD1 3.79Å; L754-V768 HydrophobicContact CD1-CG1 3.92Å; L754-V768 HydrophobicContact CD1-CG2 4.2Å; L754-Y795 WeakPolarHBondContact O-CA 3.14Å; L754-V796 HydrophobicContact CB-CG2 4Å; L754-V796 HydrophobicContact CD1-CG2 4.39Å; L754-V796 PolarHBondContact N-O 3.17Å; L754-V796 PolarHBondContact O-N 3.11Å; L754-M798 HydrophobicContact CD1-CE 4.45Å
755	Q	93.6	Very high	89.5	Confident	62 Å²	62	48.3 Å²	48.3	29%	0.29	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.1	-178.2	-68	-179.3	-1.8	0	0	111.1	F733 A757 H758 I759 Y795 A1023	F733-Q755 PolarHBondContact O-N 3.31Å; Q755-A757 PolarHBondContact O-N 3.25Å; Q755-H758 HydrophobicContact CB-CB 3.95Å; Q755-H758 PolarHBondContact O-N 3.27Å; Q755-I759 WeakPolarHBondContact O-CG1 3.28Å; Q755-I759 PolarHBondContact O-N 3.27Å; Q755-Y795 HydrophobicContact CG-CD1 4.09Å; Q755-Y795 HydrophobicContact CG-CE1 3.71Å; Q755-A1023 HydrophobicContact CB-CB 4.42Å; Q755-A1023 HydrophobicContact CG-CB 3.97Å
756	K	94.4	Very high	89.1	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-51.2	-179	-73.4	179.4	166	-170.6	0	112.7	L754 H758 I759 V760 D792 K794 V796 E1026 W1030 D1031	L754-K756 PolarHBondContact O-N 3.07Å; K756-H758 PolarHBondContact O-N 3.02Å; K756-I759 WeakPolarHBondContact O-CB 3.4Å; K756-I759 PolarHBondContact O-N 2.78Å; K756-V760 WeakPolarHBondContact O-CG2 3.15Å; K756-V760 PolarHBondContact O-N 2.85Å; K756-D792 WeakPolarHBondContact CE-O 3.43Å; K756-D792 PolarHBondContact NZ-O 3.47Å; K756-K794 WeakPolarHBondContact CB-O 3.19Å; K756-K794 PolarHBondContact N-O 3.13Å; K756-V796 HydrophobicContact CG-CG1 4.18Å; K756-E1026 HydrophobicContact CB-CB 3.61Å; K756-E1026 HydrophobicContact CB-CG 4.04Å; K756-E1026 HydrophobicContact CD-CB 4.15Å; K756-E1026 WeakPolarHBondContact CD-O 3.27Å; K756-E1026 PolarHBondContact NZ-O 2.92Å; K756-W1030 HydrophobicContact CG-CZ2 4.29Å; K756-D1031 WeakPolarHBondContact CE-OD2 3.46Å; K756-D1031 IonicContact NZ-OD1 2.72Å; K756-D1031 PolarHBondContact NZ-OD1 2.82Å; K756-D1031 IonicContact NZ-OD2 2.76Å; K756-D1031 PolarHBondContact NZ-OD2 3.45Å
757	A	91.5	Very high	88.7	Confident	25 Å²	25	41.8 Å²	41.8	21%	0.207	20%	0.202	C	C	.	.	H	α-helix	trans	-56.7	-38.8	-179.2	0	0	0	0	0	112.2	Q755 V760 Q761 P1024 E1026	Q755-A757 PolarHBondContact O-N 3.25Å; A757-V760 PolarHBondContact O-N 2.77Å; A757-Q761 VanDerWaalsContact O-CB 3.27Å; A757-Q761 WeakPolarHBondContact O-CB 3.19Å; A757-Q761 PolarHBondContact O-N 3.38Å; A757-P1024 HydrophobicContact CB-CG 3.75Å; A757-E1026 HydrophobicContact CB-CB 4.35Å; A757-E1026 HydrophobicContact CB-CG 4.48Å
758	H	86.8	Confident	88.7	Confident	56 Å²	56	39.8 Å²	39.8	26%	0.259	19%	0.194	S	C	.	.	H	α-helix	trans	-70.8	-40.3	176.9	-167.4	-168.5	0	0	0	112	G732 Q755 K756 V760 Q761 T762	G732-H758 PolarHBondContact O-CE1 2.93Å; G732-H758 PolarHBondContact O-ND1 3.36Å; Q755-H758 HydrophobicContact CB-CB 3.95Å; Q755-H758 PolarHBondContact O-N 3.27Å; K756-H758 PolarHBondContact O-N 3.02Å; H758-V760 VanDerWaalsContact C-N 3.32Å; H758-V760 PolarHBondContact O-N 2.89Å; H758-Q761 PolarHBondContact O-N 2.92Å; H758-T762 WeakPolarHBondContact O-CB 3.29Å; H758-T762 WeakPolarHBondContact O-CG2 3.27Å; H758-T762 PolarHBondContact O-N 3.05Å; H758-T762 PolarHBondContact O-OG1 2.84Å
759	I	87.4	Confident	88.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-43.9	172.9	-64.7	162.3	0	0	0	110.7	L754 Q755 K756 T762 R763 Q764 Q765 V768 V796 W1030	L754-I759 HydrophobicContact CB-CD1 3.79Å; Q755-I759 WeakPolarHBondContact O-CG1 3.28Å; Q755-I759 PolarHBondContact O-N 3.27Å; K756-I759 WeakPolarHBondContact O-CB 3.4Å; K756-I759 PolarHBondContact O-N 2.78Å; I759-T762 PolarHBondContact O-N 3.22Å; I759-T762 PolarHBondContact O-OG1 3.28Å; I759-R763 PolarHBondContact O-N 3.07Å; I759-Q764 HydrophobicContact CG2-CB 4.14Å; I759-Q764 PolarHBondContact O-N 3.44Å; I759-Q765 HydrophobicContact CG2-CB 4.45Å; I759-Q765 HydrophobicContact CG2-CG 4.11Å; I759-V768 HydrophobicContact CD1-CG1 4.29Å; I759-V768 HydrophobicContact CD1-CG2 3.98Å; I759-V768 HydrophobicContact CG1-CG2 4.15Å; I759-V768 HydrophobicContact CG2-CG2 4.11Å; I759-V796 HydrophobicContact CD1-CG2 4.02Å; I759-W1030 HydrophobicContact CB-CZ2 4.27Å; I759-W1030 HydrophobicContact CD1-CH2 3.92Å; I759-W1030 HydrophobicContact CD1-CZ2 4.01Å; I759-W1030 HydrophobicContact CG2-CH2 3.88Å; I759-W1030 HydrophobicContact CG2-CZ2 3.93Å
760	V	88.4	Confident	88.3	Confident	45 Å²	45	43.8 Å²	43.8	27%	0.273	21%	0.209	S	C	.	.	H	α-helix	trans	-67	-46.5	178.6	173.7	0	0	0	0	111.4	K756 A757 H758 T762 R763 Q765 E1026	K756-V760 WeakPolarHBondContact O-CG2 3.15Å; K756-V760 PolarHBondContact O-N 2.85Å; A757-V760 PolarHBondContact O-N 2.77Å; H758-V760 VanDerWaalsContact C-N 3.32Å; H758-V760 PolarHBondContact O-N 2.89Å; V760-T762 VanDerWaalsContact C-N 3.27Å; V760-T762 PolarHBondContact O-N 3.09Å; V760-R763 PolarHBondContact O-N 3.03Å; V760-R763 VanDerWaalsContact O-N 3.14Å; V760-Q765 HydrophobicContact CG2-CG 4.34Å; V760-E1026 HydrophobicContact CG2-CG 3.96Å; V760-E1026 WeakPolarHBondContact CG2-OE2 3.44Å
761	Q	82.4	Confident	88.1	Confident	159 Å²	159	43.6 Å²	43.6	74%	0.743	21%	0.206	S	C	*	.	H	α-helix	trans	-58.7	-38	176.9	-176.8	-179.3	5.1	0	0	112.5	A757 H758	A757-Q761 VanDerWaalsContact O-CB 3.27Å; A757-Q761 WeakPolarHBondContact O-CB 3.19Å; A757-Q761 PolarHBondContact O-N 3.38Å; H758-Q761 PolarHBondContact O-N 2.92Å
762	T	72.5	Confident	88	Confident	46 Å²	46	44.6 Å²	44.6	28%	0.282	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.7	179.7	56.3	0	0	0	0	114	F733 H758 I759 V760 Q764	F733-T762 HydrophobicContact CE1-CG2 4.19Å; F733-T762 WeakPolarHBondContact CE1-OG1 3.39Å; H758-T762 WeakPolarHBondContact O-CB 3.29Å; H758-T762 WeakPolarHBondContact O-CG2 3.27Å; H758-T762 PolarHBondContact O-N 3.05Å; H758-T762 PolarHBondContact O-OG1 2.84Å; I759-T762 PolarHBondContact O-N 3.22Å; I759-T762 PolarHBondContact O-OG1 3.28Å; V760-T762 VanDerWaalsContact C-N 3.27Å; V760-T762 PolarHBondContact O-N 3.09Å; T762-Q764 VanDerWaalsContact C-N 3.32Å; T762-Q764 WeakPolarHBondContact O-CG 3.33Å; T762-Q764 PolarHBondContact O-N 2.53Å; T762-Q764 PolarHBondContact O-NE2 3.36Å; T762-Q764 WeakPolarHBondContact OG1-CG 3.41Å
763	R	80.4	Confident	88	Confident	161 Å²	161	47.3 Å²	47.3	61%	0.608	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	35.9	178.7	-57.4	170.3	172.7	-173	-3.4	114.3	E380 I759 V760 Q765	E380-R763 WeakPolarHBondContact OE1-CD 3.35Å; E380-R763 IonicContact OE1-CZ 2.75Å; E380-R763 IonicContact OE1-NE 3.54Å; E380-R763 IonicContact OE1-NH1 2.78Å; E380-R763 PolarHBondContact OE1-NH1 2.95Å; I759-R763 PolarHBondContact O-N 3.07Å; V760-R763 PolarHBondContact O-N 3.03Å; V760-R763 VanDerWaalsContact O-N 3.14Å; R763-Q765 VanDerWaalsContact CA-OE1 3.26Å
764	Q	80	Confident	88	Confident	14 Å²	14	45.8 Å²	45.8	7%	0.065	22%	0.22	C	C	.	.			trans	-98.4	9.9	-175	-57.7	-59.6	-57.9	0	0	114.2	F733 I759 T762 E766 H767 V768	F733-Q764 HydrophobicContact CE1-CG 3.85Å; F733-Q764 HydrophobicContact CE2-CG 4.49Å; F733-Q764 HydrophobicContact CZ-CG 3.74Å; I759-Q764 HydrophobicContact CG2-CB 4.14Å; I759-Q764 PolarHBondContact O-N 3.44Å; T762-Q764 VanDerWaalsContact C-N 3.32Å; T762-Q764 WeakPolarHBondContact O-CG 3.33Å; T762-Q764 PolarHBondContact O-N 2.53Å; T762-Q764 PolarHBondContact O-NE2 3.36Å; T762-Q764 WeakPolarHBondContact OG1-CG 3.41Å; Q764-E766 VanDerWaalsContact C-N 3.27Å; Q764-E766 PolarHBondContact O-N 3.47Å; Q764-H767 PolarHBondContact O-N 2.9Å; Q764-H767 VanDerWaalsContact O-N 3.09Å; Q764-H767 PolarHBondContact OE1-ND1 2.97Å; Q764-V768 PolarHBondContact O-N 2.8Å
765	Q	87.8	Confident	88.1	Confident	53 Å²	53	45.5 Å²	45.5	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-52.4	-44.5	-177.2	-62.5	91.6	-35.3	0	0	112.2	I759 V760 R763 V768 Y769 W1030	I759-Q765 HydrophobicContact CG2-CB 4.45Å; I759-Q765 HydrophobicContact CG2-CG 4.11Å; V760-Q765 HydrophobicContact CG2-CG 4.34Å; R763-Q765 VanDerWaalsContact CA-OE1 3.26Å; Q765-V768 PolarHBondContact O-N 2.85Å; Q765-Y769 WeakPolarHBondContact O-CB 3.43Å; Q765-Y769 PolarHBondContact O-N 2.68Å; Q765-W1030 HydrophobicContact CB-CD2 3.94Å; Q765-W1030 HydrophobicContact CB-CE3 3.6Å; Q765-W1030 HydrophobicContact CB-CG 4.44Å; Q765-W1030 HydrophobicContact CB-CZ3 4.04Å; Q765-W1030 HydrophobicContact CG-CB 4.36Å; Q765-W1030 HydrophobicContact CG-CD2 3.53Å; Q765-W1030 HydrophobicContact CG-CE3 3.76Å; Q765-W1030 HydrophobicContact CG-CG 3.79Å; Q765-W1030 HydrophobicContact CG-CZ3 4.33Å
766	E	83	Confident	88.1	Confident	69 Å²	69	46.2 Å²	46.2	32%	0.322	23%	0.23	S	C	.	.	H	α-helix	trans	-65.5	-40.8	-179.5	-166.8	-177.8	128.9	0	0	111.9	S381 Q764 Y769 C770 K869	S381-E766 WeakPolarHBondContact CB-OE1 3.33Å; S381-E766 PolarHBondContact OG-OE1 2.96Å; Q764-E766 VanDerWaalsContact C-N 3.27Å; Q764-E766 PolarHBondContact O-N 3.47Å; E766-Y769 PolarHBondContact O-N 2.7Å; E766-C770 WeakPolarHBondContact O-CB 3.24Å; E766-C770 PolarHBondContact O-N 2.88Å; E766-C770 PolarHBondContact O-SG 3.23Å; E766-K869 IonicContact OE1-NZ 3.6Å
767	H	81.1	Confident	87.9	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-41.6	176.9	-70.5	147.8	0	0	0	112.3	S378 G379 Q764 Y769 C770 E771	S378-H767 PolarHBondContact OG-CE1 2.98Å; G379-H767 PolarHBondContact O-CE1 2.9Å; Q764-H767 PolarHBondContact O-N 2.9Å; Q764-H767 VanDerWaalsContact O-N 3.09Å; Q764-H767 PolarHBondContact OE1-ND1 2.97Å; H767-Y769 VanDerWaalsContact C-N 3.33Å; H767-Y769 PolarHBondContact O-N 2.78Å; H767-C770 PolarHBondContact O-N 2.74Å; H767-E771 WeakPolarHBondContact O-CB 3.41Å; H767-E771 PolarHBondContact O-N 3.35Å
768	V	90.3	Very high	88	Confident	7 Å²	7	49 Å²	49	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-66.9	-35.3	176.9	175.1	0	0	0	0	111.6	L754 I759 Q764 Q765 K772 V796 M798 W1030 F1034	L754-V768 HydrophobicContact CD1-CG1 3.92Å; L754-V768 HydrophobicContact CD1-CG2 4.2Å; I759-V768 HydrophobicContact CD1-CG1 4.29Å; I759-V768 HydrophobicContact CD1-CG2 3.98Å; I759-V768 HydrophobicContact CG1-CG2 4.15Å; I759-V768 HydrophobicContact CG2-CG2 4.11Å; Q764-V768 PolarHBondContact O-N 2.8Å; Q765-V768 PolarHBondContact O-N 2.85Å; V768-K772 PolarHBondContact O-N 2.59Å; V768-V796 HydrophobicContact CG1-CG2 4.11Å; V768-M798 HydrophobicContact CG1-CE 4.05Å; V768-W1030 HydrophobicContact CB-CH2 4.35Å; V768-W1030 HydrophobicContact CB-CZ3 4.41Å; V768-W1030 HydrophobicContact CG1-CH2 4.04Å; V768-W1030 HydrophobicContact CG1-CZ3 4.31Å; V768-F1034 HydrophobicContact CG1-CE2 4.34Å; V768-F1034 HydrophobicContact CG1-CZ 3.77Å
769	Y	91.3	Very high	88.3	Confident	79 Å²	79	50.2 Å²	50.2	31%	0.31	26%	0.264	S	S	.	.	H	α-helix	trans	-71.9	-41.1	173.5	-174.3	-117	0	0	0	112.7	Q765 E766 H767 K772 L773 N1033	Q765-Y769 WeakPolarHBondContact O-CB 3.43Å; Q765-Y769 PolarHBondContact O-N 2.68Å; E766-Y769 PolarHBondContact O-N 2.7Å; H767-Y769 VanDerWaalsContact C-N 3.33Å; H767-Y769 PolarHBondContact O-N 2.78Å; Y769-K772 PolarHBondContact O-N 3Å; Y769-L773 HydrophobicContact CD1-CD1 3.97Å; Y769-L773 HydrophobicContact CD1-CG 4.5Å; Y769-L773 HydrophobicContact CE1-CD1 3.51Å; Y769-L773 HydrophobicContact CE1-CG 4.19Å; Y769-L773 HydrophobicContact CE2-CD2 4.44Å; Y769-L773 HydrophobicContact CE2-CG 4.34Å; Y769-L773 WeakPolarHBondContact O-CG 3.45Å; Y769-L773 PolarHBondContact O-N 2.95Å; Y769-N1033 HydrophobicContact CE2-CB 3.83Å; Y769-N1033 PolarHBondContact OH-ND2 2.65Å; Y769-N1033 VanDerWaalsContact OH-ND2 3.17Å
770	C	87.5	Confident	88.7	Confident	31 Å²	31	50.8 Å²	50.8	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-41	173.2	-76.2	0	0	0	0	112.2	E766 H767 L773 I774	E766-C770 WeakPolarHBondContact O-CB 3.24Å; E766-C770 PolarHBondContact O-N 2.88Å; E766-C770 PolarHBondContact O-SG 3.23Å; H767-C770 PolarHBondContact O-N 2.74Å; C770-L773 PolarHBondContact O-N 3.38Å; C770-I774 WeakPolarHBondContact O-CB 3.45Å; C770-I774 WeakPolarHBondContact O-CG1 3.44Å; C770-I774 PolarHBondContact O-N 2.82Å
771	E	93.8	Very high	89.1	Confident	5 Å²	5	50.8 Å²	50.8	2%	0.023	27%	0.268	C	S	.	.	H	α-helix	trans	-57.7	-48.2	172.9	172.8	166.5	-140.1	0	0	110.8	K752 H767 I774 L775 M798 F865	K752-E771 IonicContact NZ-OE1 3.13Å; K752-E771 PolarHBondContact NZ-OE1 2.99Å; K752-E771 IonicContact NZ-OE2 3.34Å; K752-E771 PolarHBondContact NZ-OE2 2.84Å; H767-E771 WeakPolarHBondContact O-CB 3.41Å; H767-E771 PolarHBondContact O-N 3.35Å; E771-I774 PolarHBondContact O-N 3.14Å; E771-L775 HydrophobicContact CG-CD1 3.62Å; E771-L775 HydrophobicContact CG-CG 4.3Å; E771-L775 VanDerWaalsContact O-CB 3.3Å; E771-L775 WeakPolarHBondContact O-CB 3.38Å; E771-L775 WeakPolarHBondContact O-CG 3.41Å; E771-L775 PolarHBondContact O-N 3.26Å; E771-M798 HydrophobicContact CB-CE 4.28Å; E771-M798 HydrophobicContact CG-CE 3.95Å; E771-M798 HydrophobicContact CG-SD 4.03Å; E771-F865 HydrophobicContact CG-CB 3.99Å; E771-F865 PolarHBondContact OE1-N 3.07Å
772	K	94.3	Very high	89.8	Confident	30 Å²	30	43.5 Å²	43.5	13%	0.13	23%	0.234	C	C	.	.	H	α-helix	trans	-55.1	-55.4	173.9	174.3	175.8	176.3	163.1	0	111.1	V768 Y769 I774 L775 S776 T789 M798 N1033 F1034	V768-K772 PolarHBondContact O-N 2.59Å; Y769-K772 PolarHBondContact O-N 3Å; K772-I774 VanDerWaalsContact C-N 3.32Å; K772-I774 PolarHBondContact O-N 3.04Å; K772-L775 PolarHBondContact O-N 3.26Å; K772-S776 WeakPolarHBondContact O-CB 3.5Å; K772-S776 PolarHBondContact O-N 2.85Å; K772-S776 PolarHBondContact O-OG 3.09Å; K772-T789 HydrophobicContact CD-CG2 3.93Å; K772-T789 WeakPolarHBondContact CE-OG1 2.99Å; K772-T789 HydrophobicContact CG-CG2 4.16Å; K772-T789 PolarHBondContact NZ-OG1 2.99Å; K772-M798 HydrophobicContact CB-CE 4.33Å; K772-N1033 PolarHBondContact NZ-O 3.33Å; K772-F1034 HydrophobicContact CB-CE1 4.36Å; K772-F1034 HydrophobicContact CB-CE2 4.41Å; K772-F1034 HydrophobicContact CB-CZ 3.87Å; K772-F1034 HydrophobicContact CD-CD1 4.3Å; K772-F1034 HydrophobicContact CD-CD2 4.28Å; K772-F1034 HydrophobicContact CD-CE1 4.16Å; K772-F1034 HydrophobicContact CD-CE2 4.13Å; K772-F1034 HydrophobicContact CD-CG 4.35Å; K772-F1034 HydrophobicContact CD-CZ 4.06Å; K772-F1034 HydrophobicContact CG-CZ 4.49Å; K772-F1034 PolarHBondContact NZ-O 2.78Å
773	L	93.9	Very high	91	Very high	82 Å²	82	41.4 Å²	41.4	43%	0.429	22%	0.221	S	C	.	.	H	α-helix	trans	-61.3	-39.2	-174.9	-71.5	-179	0	0	0	112.8	Y769 C770 S777	Y769-L773 HydrophobicContact CD1-CD1 3.97Å; Y769-L773 HydrophobicContact CD1-CG 4.5Å; Y769-L773 HydrophobicContact CE1-CD1 3.51Å; Y769-L773 HydrophobicContact CE1-CG 4.19Å; Y769-L773 HydrophobicContact CE2-CD2 4.44Å; Y769-L773 HydrophobicContact CE2-CG 4.34Å; Y769-L773 WeakPolarHBondContact O-CG 3.45Å; Y769-L773 PolarHBondContact O-N 2.95Å; C770-L773 PolarHBondContact O-N 3.38Å; L773-S777 WeakPolarHBondContact O-CB 3.38Å; L773-S777 PolarHBondContact O-N 3.42Å; L773-S777 PolarHBondContact O-OG 2.81Å
774	I	94.2	Very high	91.7	Very high	8 Å²	8	34 Å²	34	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-68	-51.5	176.5	-70.7	167.9	0	0	0	109.8	C770 E771 K772 S776 S777 V778 I842 F865 A868	C770-I774 WeakPolarHBondContact O-CB 3.45Å; C770-I774 WeakPolarHBondContact O-CG1 3.44Å; C770-I774 PolarHBondContact O-N 2.82Å; E771-I774 PolarHBondContact O-N 3.14Å; K772-I774 VanDerWaalsContact C-N 3.32Å; K772-I774 PolarHBondContact O-N 3.04Å; I774-S776 VanDerWaalsContact C-N 3.27Å; I774-S776 PolarHBondContact O-N 2.83Å; I774-S777 PolarHBondContact O-N 3.4Å; I774-S777 PolarHBondContact O-OG 2.93Å; I774-S777 VanDerWaalsContact O-OG 3.04Å; I774-V778 HydrophobicContact CG2-CG1 4.3Å; I774-V778 WeakPolarHBondContact O-CG1 3.37Å; I774-V778 WeakPolarHBondContact O-CG2 3.41Å; I774-V778 PolarHBondContact O-N 3.44Å; I774-V778 VanDerWaalsContact O-N 3.1Å; I774-I842 HydrophobicContact CD1-CG2 4.12Å; I774-I842 HydrophobicContact CG2-CD1 4.13Å; I774-I842 HydrophobicContact CG2-CG2 4.24Å; I774-F865 HydrophobicContact CG2-CD1 3.57Å; I774-F865 HydrophobicContact CG2-CE1 4.12Å; I774-F865 HydrophobicContact CG2-CG 4.42Å; I774-A868 VanDerWaalsContact CD1-C 3.5Å; I774-A868 HydrophobicContact CD1-CB 3.75Å; I774-A868 WeakPolarHBondContact CD1-O 3.23Å
775	L	95	Very high	92.5	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-29.4	-179.3	-72.8	175.8	0	0	0	113.6	E771 K772 L786 L800 F865	E771-L775 HydrophobicContact CG-CD1 3.62Å; E771-L775 HydrophobicContact CG-CG 4.3Å; E771-L775 VanDerWaalsContact O-CB 3.3Å; E771-L775 WeakPolarHBondContact O-CB 3.38Å; E771-L775 WeakPolarHBondContact O-CG 3.41Å; E771-L775 PolarHBondContact O-N 3.26Å; K772-L775 PolarHBondContact O-N 3.26Å; L775-L786 HydrophobicContact CB-CB 3.81Å; L775-L786 HydrophobicContact CB-CD2 3.7Å; L775-L786 HydrophobicContact CB-CG 4.39Å; L775-L800 HydrophobicContact CD1-CD2 4.07Å; L775-F865 HydrophobicContact CD1-CB 4.36Å; L775-F865 HydrophobicContact CD2-CB 4.22Å; L775-F865 HydrophobicContact CD2-CD2 3.54Å; L775-F865 HydrophobicContact CD2-CE2 4.01Å; L775-F865 HydrophobicContact CD2-CG 3.83Å; L775-F865 HydrophobicContact CG-CB 4.05Å; L775-F865 HydrophobicContact CG-CD2 4.3Å; L775-F865 HydrophobicContact CG-CG 4.19Å
776	S	93.2	Very high	92.8	Very high	76 Å²	76	36.3 Å²	36.3	53%	0.531	20%	0.201	S	C	.	.	H	α-helix	trans	-75.1	-20.3	172.6	-70.6	0	0	0	0	114.1	K772 I774 L786	K772-S776 WeakPolarHBondContact O-CB 3.5Å; K772-S776 PolarHBondContact O-N 2.85Å; K772-S776 PolarHBondContact O-OG 3.09Å; I774-S776 VanDerWaalsContact C-N 3.27Å; I774-S776 PolarHBondContact O-N 2.83Å; S776-L786 WeakPolarHBondContact OG-CD2 3.38Å
777	S	92.2	Very high	93.3	Very high	79 Å²	79	35.5 Å²	35.5	55%	0.552	20%	0.197	S	C	*	.	H	α-helix	trans	-102.4	-13.2	-177.3	54	0	0	0	0	114.4	L773 I774	L773-S777 WeakPolarHBondContact O-CB 3.38Å; L773-S777 PolarHBondContact O-N 3.42Å; L773-S777 PolarHBondContact O-OG 2.81Å; I774-S777 PolarHBondContact O-N 3.4Å; I774-S777 PolarHBondContact O-OG 2.93Å; I774-S777 VanDerWaalsContact O-OG 3.04Å
778	V	93.1	Very high	93.9	Very high	12 Å²	12	37.7 Å²	37.7	7%	0.073	21%	0.209	C	C	.	.			trans	-98.1	138.4	179	-59.7	0	0	0	0	113.1	I774 I783 Y836 L837 I842	I774-V778 HydrophobicContact CG2-CG1 4.3Å; I774-V778 WeakPolarHBondContact O-CG1 3.37Å; I774-V778 WeakPolarHBondContact O-CG2 3.41Å; I774-V778 PolarHBondContact O-N 3.44Å; I774-V778 VanDerWaalsContact O-N 3.1Å; V778-I783 HydrophobicContact CB-CD1 4.43Å; V778-I783 HydrophobicContact CG2-CD1 4.45Å; V778-I783 HydrophobicContact CG2-CG2 3.96Å; V778-Y836 HydrophobicContact CB-CE1 3.77Å; V778-Y836 HydrophobicContact CG1-CE1 3.96Å; V778-L837 HydrophobicContact CG1-CD2 3.9Å; V778-I842 HydrophobicContact CG1-CD1 3.87Å
779	S	92.7	Very high	94.2	Very high	81 Å²	81	37.9 Å²	37.9	57%	0.566	21%	0.21	S	C	*	.			trans	-139.7	96.1	174.5	-173.5	0	0	0	0	109.7	Y836	S779-Y836 PolarHBondContact N-OH 2.68Å; S779-Y836 WeakPolarHBondContact O-CE2 3.34Å; S779-Y836 VanDerWaalsContact O-CZ 3.28Å; S779-Y836 PolarHBondContact O-OH 3.12Å
780	S	95.1	Very high	94.4	Very high	12 Å²	12	35.2 Å²	35.2	8%	0.084	20%	0.199	C	C	.	.			trans	-138.3	141.6	-176.3	173.1	0	0	0	0	110.9	F782 I783	S780-F782 PolarHBondContact O-N 2.8Å; S780-F782 VanDerWaalsContact O-N 3.12Å; S780-F782 PolarHBondContact OG-N 3.06Å; S780-I783 PolarHBondContact O-N 3.21Å
781	P	96.4	Very high	94.8	Very high	44 Å²	44	39 Å²	39	29%	0.286	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11	174.4	25.9	-32.9	0	0	0	114	K861	P781-K861 VanDerWaalsContact O-CE 3.23Å; P781-K861 WeakPolarHBondContact O-CE 3.44Å
782	F	98	Very high	94.9	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.026	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	14.4	-179.6	-50	-68.9	0	0	0	113.8	S780 C829 E832 A833 Y859 K861 L862 I991	S780-F782 PolarHBondContact O-N 2.8Å; S780-F782 VanDerWaalsContact O-N 3.12Å; S780-F782 PolarHBondContact OG-N 3.06Å; F782-C829 HydrophobicContact CD1-CB 3.86Å; F782-C829 HydrophobicContact CE1-CB 4.32Å; F782-E832 HydrophobicContact CD2-CB 3.3Å; F782-E832 HydrophobicContact CD2-CG 4.17Å; F782-E832 HydrophobicContact CE2-CB 3.39Å; F782-E832 HydrophobicContact CE2-CG 3.75Å; F782-E832 HydrophobicContact CG-CB 4.1Å; F782-E832 HydrophobicContact CZ-CB 4.28Å; F782-E832 HydrophobicContact CZ-CG 4.29Å; F782-A833 HydrophobicContact CB-CB 3.88Å; F782-Y859 HydrophobicContact CE1-CD1 4.08Å; F782-K861 CarbonylContact O-C 3.53Å; F782-K861 VanDerWaalsContact O-CA 3.3Å; F782-K861 WeakPolarHBondContact O-CA 3.33Å; F782-L862 PolarHBondContact O-N 2.81Å; F782-I991 HydrophobicContact CE1-CG2 3.99Å; F782-I991 HydrophobicContact CE2-CG2 4.43Å; F782-I991 HydrophobicContact CZ-CG2 3.63Å; F782-I991 WeakPolarHBondContact CZ-O 3.1Å
783	I	97.7	Very high	94.9	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.015	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-127.2	138.6	175	-60	175	0	0	0	108	V778 S780 R785 A833 Y836 L837 K861 F865	V778-I783 HydrophobicContact CB-CD1 4.43Å; V778-I783 HydrophobicContact CG2-CD1 4.45Å; V778-I783 HydrophobicContact CG2-CG2 3.96Å; S780-I783 PolarHBondContact O-N 3.21Å; I783-R785 PolarHBondContact O-N 3.34Å; I783-A833 HydrophobicContact CG1-CB 4.18Å; I783-Y836 HydrophobicContact CD1-CD1 3.93Å; I783-L837 HydrophobicContact CD1-CD1 4.28Å; I783-L837 HydrophobicContact CD1-CD2 3.82Å; I783-L837 HydrophobicContact CD1-CG 3.88Å; I783-K861 PolarHBondContact O-NZ 3.23Å; I783-F865 HydrophobicContact CD1-CZ 4.37Å; I783-F865 HydrophobicContact CG1-CZ 4.39Å; I783-F865 HydrophobicContact CG2-CE2 3.75Å; I783-F865 HydrophobicContact CG2-CZ 3.6Å
784	C	96	Very high	94.9	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.041	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-65.6	120.9	175.3	-67	0	0	0	0	110.1	C803 L862 C863	C784-C803 VanDerWaalsContact SG-SG 3.68Å; C784-L862 PolarHBondContact N-O 3.17Å; C784-L862 PolarHBondContact SG-O 3.46Å; C784-C863 HydrophobicContact CB-CB 4.36Å
785	R	95.4	Very high	95	Very high	99 Å²	99	41.7 Å²	41.7	37%	0.374	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-75.3	138.3	-176.3	-177.8	168	178.2	177.3	1.5	111.9	I783 F787 L800 E801	I783-R785 PolarHBondContact O-N 3.34Å; R785-F787 HydrophobicContact CB-CE1 4.4Å; R785-F787 HydrophobicContact CB-CZ 4.23Å; R785-F787 HydrophobicContact CG-CD1 4.21Å; R785-F787 HydrophobicContact CG-CE1 3.82Å; R785-F787 HydrophobicContact CG-CZ 4.15Å; R785-L800 CarbonylContact O-C 3.2Å; R785-L800 VanDerWaalsContact O-CA 3.31Å; R785-L800 WeakPolarHBondContact O-CA 3.42Å; R785-E801 HydrophobicContact CB-CB 4.34Å; R785-E801 PolarHBondContact N-OE2 3.39Å; R785-E801 VanDerWaalsContact N-OE2 3.12Å; R785-E801 PolarHBondContact O-N 3.29Å
786	L	95.2	Very high	95	Very high	16 Å²	16	41.4 Å²	41.4	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	134.5	163.4	177.7	63.7	0	0	0	109.8	L775 S776 N788 T789 M798 L800	L775-L786 HydrophobicContact CB-CB 3.81Å; L775-L786 HydrophobicContact CB-CD2 3.7Å; L775-L786 HydrophobicContact CB-CG 4.39Å; S776-L786 WeakPolarHBondContact OG-CD2 3.38Å; L786-N788 VanDerWaalsContact CD1-O 3.28Å; L786-N788 WeakPolarHBondContact CD1-O 3.44Å; L786-T789 HydrophobicContact CD1-CG2 4.15Å; L786-T789 HydrophobicContact CD2-CG2 4.18Å; L786-M798 HydrophobicContact CD1-CB 3.82Å; L786-L800 HydrophobicContact CB-CD2 3.98Å; L786-L800 HydrophobicContact CD1-CD2 3.81Å
787	F	93.5	Very high	95.2	Very high	51 Å²	51	38.4 Å²	38.4	22%	0.224	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-45.6	178.8	-61.6	-67.5	0	0	0	112.5	I713 F749 R785 L799 E801	I713-F787 HydrophobicContact CD1-CD1 4.05Å; I713-F787 HydrophobicContact CD1-CE1 3.33Å; I713-F787 HydrophobicContact CD1-CE2 4.16Å; I713-F787 HydrophobicContact CD1-CZ 3.4Å; I713-F787 HydrophobicContact CG1-CE1 4.49Å; I713-F787 HydrophobicContact CG2-CD1 4.31Å; F749-F787 AromaticContact CD1-CD2 3.67Å; F749-F787 HydrophobicContact CD1-CD2 3.67Å; F749-F787 AromaticContact CD1-CE2 3.78Å; F749-F787 HydrophobicContact CD1-CE2 3.78Å; F749-F787 AromaticContact CE1-CD2 3.85Å; F749-F787 HydrophobicContact CE1-CD2 3.85Å; F749-F787 AromaticContact CE1-CE2 3.92Å; F749-F787 HydrophobicContact CE1-CE2 3.92Å; F749-F787 HydrophobicContact CE1-CG 4.43Å; R785-F787 HydrophobicContact CB-CE1 4.4Å; R785-F787 HydrophobicContact CB-CZ 4.23Å; R785-F787 HydrophobicContact CG-CD1 4.21Å; R785-F787 HydrophobicContact CG-CE1 3.82Å; R785-F787 HydrophobicContact CG-CZ 4.15Å; F787-L799 HydrophobicContact CB-CD2 4.34Å; F787-L799 PolarHBondContact N-O 2.9Å; F787-E801 HydrophobicContact CE2-CB 4.02Å; F787-E801 HydrophobicContact CZ-CB 4.28Å
788	N	93.9	Very high	95.4	Very high	59 Å²	59	34.7 Å²	34.7	32%	0.316	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	168.2	179.8	-156.4	3.7	0	0	0	110.8	I717 L786 Y790 L799	I717-N788 PolarHBondContact O-ND2 3.2Å; L786-N788 VanDerWaalsContact CD1-O 3.28Å; L786-N788 WeakPolarHBondContact CD1-O 3.44Å; N788-Y790 HydrophobicContact CB-CE1 4.46Å; N788-Y790 WeakPolarHBondContact ND2-CE1 3.5Å; N788-L799 WeakPolarHBondContact O-CB 3.49Å; N788-L799 PolarHBondContact O-N 3.48Å
789	T	95.8	Very high	95.5	Very high	10 Å²	10	34.1 Å²	34.1	6%	0.061	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	160.8	170	53.6	0	0	0	0	110.7	K772 L786 Y797 M798 F1034	K772-T789 HydrophobicContact CD-CG2 3.93Å; K772-T789 WeakPolarHBondContact CE-OG1 2.99Å; K772-T789 HydrophobicContact CG-CG2 4.16Å; K772-T789 PolarHBondContact NZ-OG1 2.99Å; L786-T789 HydrophobicContact CD1-CG2 4.15Å; L786-T789 HydrophobicContact CD2-CG2 4.18Å; T789-Y797 WeakPolarHBondContact CA-O 3.38Å; T789-Y797 VanDerWaalsContact CB-O 3.27Å; T789-Y797 WeakPolarHBondContact CB-O 3.36Å; T789-M798 HydrophobicContact CG2-CB 4.47Å; T789-M798 HydrophobicContact CG2-CG 4.12Å; T789-F1034 CarbonylContact C-O 3.57Å; T789-F1034 WeakPolarHBondContact CB-O 3.02Å; T789-F1034 HydrophobicContact CG2-CD1 4.13Å; T789-F1034 HydrophobicContact CG2-CE1 4.2Å; T789-F1034 PolarHBondContact OG1-O 3.41Å
790	Y	96.3	Very high	95.7	Very high	23 Å²	23	31.3 Å²	31.3	9%	0.09	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	168.8	176	-41.2	-79.3	0	0	0	110.2	I717 L719 L722 L751 N788 Y797 L799	I717-Y790 VanDerWaalsContact O-CE1 3.29Å; I717-Y790 WeakPolarHBondContact O-CE1 3.22Å; I717-Y790 PolarHBondContact O-OH 2.88Å; L719-Y790 HydrophobicContact CB-CD1 3.98Å; L719-Y790 HydrophobicContact CB-CD2 4.06Å; L719-Y790 HydrophobicContact CB-CE1 4.33Å; L719-Y790 HydrophobicContact CB-CE2 4.41Å; L719-Y790 HydrophobicContact CB-CG 3.83Å; L719-Y790 HydrophobicContact CD1-CD2 3.85Å; L719-Y790 HydrophobicContact CD1-CE2 4.3Å; L719-Y790 HydrophobicContact CD1-CG 4.35Å; L719-Y790 HydrophobicContact CD2-CG 4.44Å; L719-Y790 HydrophobicContact CG-CD2 4.41Å; L719-Y790 HydrophobicContact CG-CG 4.43Å; L722-Y790 HydrophobicContact CD1-CE2 4.06Å; L751-Y790 HydrophobicContact CD1-CD2 4.45Å; L751-Y790 HydrophobicContact CD1-CE2 4.44Å; N788-Y790 HydrophobicContact CB-CE1 4.46Å; N788-Y790 WeakPolarHBondContact ND2-CE1 3.5Å; Y790-Y797 PolarHBondContact N-O 2.86Å; Y790-Y797 PolarHBondContact O-N 3.26Å; Y790-L799 HydrophobicContact CE2-CB 4.15Å
791	R	95.4	Very high	95.7	Very high	110 Å²	110	32.8 Å²	32.8	42%	0.415	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	150.7	172.5	64.4	-155.1	-171.4	84.2	3	111.3	Y795 V796 D1031 F1034	R791-Y795 WeakPolarHBondContact CA-O 3.31Å; R791-V796 HydrophobicContact CB-CG1 4.25Å; R791-D1031 WeakPolarHBondContact CD-O 3.45Å; R791-D1031 VanDerWaalsContact CD-OD2 3.24Å; R791-D1031 WeakPolarHBondContact CD-OD2 3.32Å; R791-D1031 IonicContact CZ-OD2 3.43Å; R791-D1031 PolarHBondContact NE-O 2.87Å; R791-D1031 IonicContact NE-OD2 2.8Å; R791-D1031 IonicContact NH1-OD1 3.56Å; R791-D1031 IonicContact NH1-OD2 2.77Å; R791-D1031 PolarHBondContact NH1-OD2 3.12Å; R791-F1034 HydrophobicContact CB-CB 4.1Å; R791-F1034 WeakPolarHBondContact CD-OXT 3.33Å; R791-F1034 HydrophobicContact CG-CB 4.41Å; R791-F1034 PolarHBondContact NE-OXT 2.92Å
792	D	94.8	Very high	95.6	Very high	53 Å²	53	31.5 Å²	31.5	28%	0.283	15%	0.147	S	C	.	.			trans	-130	-167.8	165.7	64.8	40.6	0	0	0	109.2	K756 K794 Y795 Y797	K756-D792 WeakPolarHBondContact CE-O 3.43Å; K756-D792 PolarHBondContact NZ-O 3.47Å; D792-K794 PolarHBondContact O-N 3.09Å; D792-K794 WeakPolarHBondContact OD1-CA 3.46Å; D792-K794 PolarHBondContact OD1-N 3.12Å; D792-Y795 PolarHBondContact N-O 3.24Å; D792-Y795 PolarHBondContact OD1-N 3.44Å; D792-Y797 VanDerWaalsContact OD2-CE2 3.22Å; D792-Y797 WeakPolarHBondContact OD2-CE2 3.24Å; D792-Y797 VanDerWaalsContact OD2-CZ 3.31Å; D792-Y797 PolarHBondContact OD2-OH 2.83Å
793	N	95.8	Very high	95.4	Very high	83 Å²	83	31.5 Å²	31.5	44%	0.444	15%	0.147	S	C	.	.	S	Bend	trans	-64	-20.4	179.6	-73.4	14.8	0	0	0	114.3	D1025 E1026 L1027	N793-D1025 HydrophobicContact CB-CB 4.24Å; N793-D1025 WeakPolarHBondContact CB-OD2 3.38Å; N793-D1025 PolarHBondContact ND2-OD2 2.99Å; N793-D1025 CarbonylContact O-C 3.56Å; N793-D1025 WeakPolarHBondContact O-CA 3.3Å; N793-E1026 PolarHBondContact O-N 3.34Å; N793-E1026 VanDerWaalsContact O-O 3.13Å; N793-L1027 HydrophobicContact CB-CD2 3.88Å
794	K	94.2	Very high	95.2	Very high	36 Å²	36	31.9 Å²	31.9	16%	0.157	15%	0.149	C	C	.	.	S	Bend	trans	-120.9	-29.2	-165.5	-61.8	167.3	-179	-67.7	0	112.8	K756 D792 E1022 A1023 D1025	K756-K794 WeakPolarHBondContact CB-O 3.19Å; K756-K794 PolarHBondContact N-O 3.13Å; D792-K794 PolarHBondContact O-N 3.09Å; D792-K794 WeakPolarHBondContact OD1-CA 3.46Å; D792-K794 PolarHBondContact OD1-N 3.12Å; K794-E1022 HydrophobicContact CD-CG 4.38Å; K794-E1022 WeakPolarHBondContact CE-OE1 3.4Å; K794-E1022 IonicContact NZ-OE1 3.97Å; K794-E1022 PolarHBondContact NZ-OE1 3.17Å; K794-A1023 HydrophobicContact CB-CB 4.34Å; K794-A1023 WeakPolarHBondContact CD-O 3.08Å; K794-A1023 WeakPolarHBondContact CG-O 3.49Å; K794-A1023 PolarHBondContact NZ-O 2.91Å; K794-D1025 VanDerWaalsContact CE-OD1 3.22Å; K794-D1025 WeakPolarHBondContact CE-OD1 3.45Å; K794-D1025 WeakPolarHBondContact CG-OD1 3.37Å; K794-D1025 IonicContact NZ-OD1 3.21Å; K794-D1025 PolarHBondContact NZ-OD1 3.47Å
795	Y	95.3	Very high	95.1	Very high	10 Å²	10	31.8 Å²	31.8	4%	0.039	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153.7	-171.6	-54.2	-88.2	0	0	0	112.9	R753 L754 Q755 R791 D792 A1023	R753-Y795 HydrophobicContact CG-CD1 3.68Å; R753-Y795 HydrophobicContact CG-CE1 4.36Å; R753-Y795 HydrophobicContact CG-CG 3.99Å; L754-Y795 WeakPolarHBondContact O-CA 3.14Å; Q755-Y795 HydrophobicContact CG-CD1 4.09Å; Q755-Y795 HydrophobicContact CG-CE1 3.71Å; R791-Y795 WeakPolarHBondContact CA-O 3.31Å; D792-Y795 PolarHBondContact N-O 3.24Å; D792-Y795 PolarHBondContact OD1-N 3.44Å; Y795-A1023 HydrophobicContact CE1-CB 3.95Å; Y795-A1023 HydrophobicContact CE2-CB 4.35Å; Y795-A1023 PolarHBondContact OH-N 3.29Å
796	V	96.1	Very high	95	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	149.2	157.4	-63.9	0	0	0	0	109.6	L754 K756 I759 V768 R791 W1030 D1031 F1034	L754-V796 HydrophobicContact CB-CG2 4Å; L754-V796 HydrophobicContact CD1-CG2 4.39Å; L754-V796 PolarHBondContact N-O 3.17Å; L754-V796 PolarHBondContact O-N 3.11Å; K756-V796 HydrophobicContact CG-CG1 4.18Å; I759-V796 HydrophobicContact CD1-CG2 4.02Å; V768-V796 HydrophobicContact CG1-CG2 4.11Å; R791-V796 HydrophobicContact CB-CG1 4.25Å; V796-W1030 HydrophobicContact CG1-CH2 4.31Å; V796-W1030 HydrophobicContact CG1-CZ2 4.38Å; V796-W1030 HydrophobicContact CG2-CH2 4.3Å; V796-D1031 HydrophobicContact CG1-CB 3.74Å; V796-F1034 HydrophobicContact CB-CD1 3.78Å; V796-F1034 HydrophobicContact CB-CE1 4.01Å; V796-F1034 HydrophobicContact CB-CG 4.16Å; V796-F1034 HydrophobicContact CG1-CB 4.39Å; V796-F1034 HydrophobicContact CG1-CD1 4.19Å; V796-F1034 HydrophobicContact CG1-CD2 4.36Å; V796-F1034 HydrophobicContact CG1-CG 4.05Å; V796-F1034 HydrophobicContact CG2-CD1 4.49Å; V796-F1034 HydrophobicContact CG2-CE1 4.24Å
797	Y	96.5	Very high	94.9	Very high	13 Å²	13	27.4 Å²	27.4	5%	0.051	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142	-171.2	-59.5	-98.4	0	0	0	111.1	L719 L751 K752 R753 T789 Y790 D792	L719-Y797 HydrophobicContact CD1-CD1 4.1Å; L719-Y797 HydrophobicContact CD1-CE1 4.26Å; L719-Y797 HydrophobicContact CD1-CG 4.37Å; L719-Y797 HydrophobicContact CD2-CD2 4.03Å; L719-Y797 HydrophobicContact CD2-CE1 4.41Å; L719-Y797 HydrophobicContact CD2-CE2 3.83Å; L719-Y797 HydrophobicContact CD2-CG 4.44Å; L751-Y797 HydrophobicContact CD1-CD1 4.15Å; L751-Y797 HydrophobicContact CD2-CD1 3.94Å; L751-Y797 HydrophobicContact CD2-CE1 4.39Å; L751-Y797 HydrophobicContact CG-CD1 4.03Å; K752-Y797 CarbonylContact O-C 3.27Å; K752-Y797 WeakPolarHBondContact O-CA 3.41Å; R753-Y797 HydrophobicContact CB-CD1 3.99Å; R753-Y797 HydrophobicContact CB-CE1 4.07Å; R753-Y797 HydrophobicContact CG-CD1 3.84Å; R753-Y797 HydrophobicContact CG-CE1 3.46Å; R753-Y797 VanDerWaalsContact CG-CE1 3.46Å; R753-Y797 PolarHBondContact NE-OH 3.05Å; T789-Y797 WeakPolarHBondContact CA-O 3.38Å; T789-Y797 VanDerWaalsContact CB-O 3.27Å; T789-Y797 WeakPolarHBondContact CB-O 3.36Å; Y790-Y797 PolarHBondContact N-O 2.86Å; Y790-Y797 PolarHBondContact O-N 3.26Å; D792-Y797 VanDerWaalsContact OD2-CE2 3.22Å; D792-Y797 WeakPolarHBondContact OD2-CE2 3.24Å; D792-Y797 VanDerWaalsContact OD2-CZ 3.31Å; D792-Y797 PolarHBondContact OD2-OH 2.83Å
798	M	95.9	Very high	95	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.6	170.5	-56.5	176.7	-176.5	0	0	109.5	L751 K752 L754 V768 E771 K772 L786 T789 L800 F1034	L751-M798 WeakPolarHBondContact CA-O 3.36Å; K752-M798 HydrophobicContact CB-CB 4.25Å; K752-M798 HydrophobicContact CD-SD 4.24Å; K752-M798 PolarHBondContact N-O 2.69Å; K752-M798 PolarHBondContact O-N 3.4Å; L754-M798 HydrophobicContact CD1-CE 4.45Å; V768-M798 HydrophobicContact CG1-CE 4.05Å; E771-M798 HydrophobicContact CB-CE 4.28Å; E771-M798 HydrophobicContact CG-CE 3.95Å; E771-M798 HydrophobicContact CG-SD 4.03Å; K772-M798 HydrophobicContact CB-CE 4.33Å; L786-M798 HydrophobicContact CD1-CB 3.82Å; T789-M798 HydrophobicContact CG2-CB 4.47Å; T789-M798 HydrophobicContact CG2-CG 4.12Å; M798-L800 HydrophobicContact CB-CG 4.42Å; M798-F1034 HydrophobicContact CE-CE1 3.85Å; M798-F1034 HydrophobicContact CE-CZ 3.85Å; M798-F1034 HydrophobicContact CG-CE1 4.21Å
799	L	96.6	Very high	94.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	103.8	179.2	-174	68.9	0	0	0	110.1	I717 L722 V739 F749 L751 F787 N788 Y790	I717-L799 HydrophobicContact CB-CD2 4.29Å; I717-L799 HydrophobicContact CD1-CD2 3.97Å; I717-L799 HydrophobicContact CG2-CD2 4.05Å; L722-L799 HydrophobicContact CD1-CD1 3.78Å; L722-L799 HydrophobicContact CD1-CD2 4.43Å; L722-L799 HydrophobicContact CD2-CD1 4.23Å; V739-L799 HydrophobicContact CG2-CD1 3.93Å; F749-L799 HydrophobicContact CB-CD1 3.48Å; F749-L799 VanDerWaalsContact CB-CD1 3.48Å; F749-L799 HydrophobicContact CB-CG 4.17Å; F749-L799 HydrophobicContact CD1-CD1 4.33Å; F749-L799 HydrophobicContact CD1-CD2 4.34Å; F749-L799 HydrophobicContact CD1-CG 4.17Å; F749-L799 HydrophobicContact CG-CD1 3.94Å; F749-L799 HydrophobicContact CG-CG 4.29Å; L751-L799 HydrophobicContact CD1-CB 4.41Å; L751-L799 HydrophobicContact CD1-CD1 4.14Å; F787-L799 HydrophobicContact CB-CD2 4.34Å; F787-L799 PolarHBondContact N-O 2.9Å; N788-L799 WeakPolarHBondContact O-CB 3.49Å; N788-L799 PolarHBondContact O-N 3.48Å; Y790-L799 HydrophobicContact CE2-CB 4.15Å
800	L	95.5	Very high	94.7	Very high	22 Å²	22	23 Å²	23	12%	0.115	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	166	-172.3	-56.2	167.3	0	0	0	112.4	F749 A750 K752 L775 R785 L786 M798	F749-L800 WeakPolarHBondContact CA-O 3.39Å; A750-L800 HydrophobicContact CB-CB 4.26Å; A750-L800 PolarHBondContact N-O 3.33Å; A750-L800 WeakPolarHBondContact O-CA 3.24Å; A750-L800 VanDerWaalsContact O-CB 3.3Å; A750-L800 WeakPolarHBondContact O-CB 2.97Å; A750-L800 PolarHBondContact O-N 3.27Å; K752-L800 HydrophobicContact CB-CD1 3.98Å; L775-L800 HydrophobicContact CD1-CD2 4.07Å; R785-L800 CarbonylContact O-C 3.2Å; R785-L800 VanDerWaalsContact O-CA 3.31Å; R785-L800 WeakPolarHBondContact O-CA 3.42Å; L786-L800 HydrophobicContact CB-CD2 3.98Å; L786-L800 HydrophobicContact CD1-CD2 3.81Å; M798-L800 HydrophobicContact CB-CG 4.42Å
801	E	94.5	Very high	94.6	Very high	43 Å²	43	24.3 Å²	24.3	20%	0.201	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	123.6	171.6	-175.3	-179.8	-173.2	0	0	113.3	R785 F787 C803 K861	R785-E801 HydrophobicContact CB-CB 4.34Å; R785-E801 PolarHBondContact N-OE2 3.39Å; R785-E801 VanDerWaalsContact N-OE2 3.12Å; R785-E801 PolarHBondContact O-N 3.29Å; F787-E801 HydrophobicContact CE2-CB 4.02Å; F787-E801 HydrophobicContact CZ-CB 4.28Å; E801-C803 PolarHBondContact O-N 2.93Å; E801-K861 VanDerWaalsContact OE1-CE 3.29Å; E801-K861 WeakPolarHBondContact OE1-CE 3.38Å; E801-K861 IonicContact OE1-NZ 2.7Å; E801-K861 PolarHBondContact OE1-NZ 2.68Å; E801-K861 IonicContact OE2-NZ 3.73Å; E801-K861 PolarHBondContact OE2-NZ 3.47Å
802	A	94.5	Very high	94.5	Very high	18 Å²	18	19.3 Å²	19.3	15%	0.149	10%	0.101	C	C	.	.			trans	-73.7	105.7	176.6	0	0	0	0	0	112.1	L738 A748 L804	L738-A802 HydrophobicContact CD1-CB 4.33Å; A748-A802 HydrophobicContact CB-CB 4.25Å; A748-A802 WeakPolarHBondContact O-CB 3.28Å; A802-L804 HydrophobicContact CB-CD2 4.08Å; A802-L804 HydrophobicContact CB-CG 4.2Å; A802-L804 PolarHBondContact O-N 3.11Å
803	C	94.6	Very high	94.3	Very high	5 Å²	5	20.3 Å²	20.3	3%	0.034	10%	0.101	C	C	.	.			trans	-93.8	81.3	176	-64.8	0	0	0	0	110.7	C784 E801 G805 L853 V854 F1013	C784-C803 VanDerWaalsContact SG-SG 3.68Å; E801-C803 PolarHBondContact O-N 2.93Å; C803-G805 VanDerWaalsContact C-N 3.25Å; C803-G805 PolarHBondContact O-N 3.15Å; C803-G805 VanDerWaalsContact O-N 3.15Å; C803-L853 HydrophobicContact CB-CB 3.6Å; C803-L853 HydrophobicContact CB-CD1 3.97Å; C803-L853 HydrophobicContact CB-CG 4.44Å; C803-V854 CarbonylContact C-O 3.51Å; C803-V854 VanDerWaalsContact C-O 3.26Å; C803-V854 VanDerWaalsContact O-O 3.14Å; C803-F1013 WeakPolarHBondContact O-CZ 3.41Å
804	L	93.7	Very high	94	Very high	11 Å²	11	21.1 Å²	21.1	6%	0.058	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	1	-165.2	-60.5	173.3	0	0	0	116.5	L738 A802 G806 L1004 P1007 N1012	L738-L804 HydrophobicContact CD1-CD2 3.97Å; A802-L804 HydrophobicContact CB-CD2 4.08Å; A802-L804 HydrophobicContact CB-CG 4.2Å; A802-L804 PolarHBondContact O-N 3.11Å; L804-G806 PolarHBondContact O-N 2.83Å; L804-L1004 HydrophobicContact CB-CD1 3.93Å; L804-L1004 HydrophobicContact CB-CD2 4.02Å; L804-P1007 WeakPolarHBondContact CD1-O 3.46Å; L804-N1012 PolarHBondContact O-ND2 2.69Å
805	G	93.6	Very high	93.9	Very high	5 Å²	5	21.5 Å²	21.5	5%	0.052	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.5	176.7	0	0	0	0	0	114.6	C803 V854	C803-G805 VanDerWaalsContact C-N 3.25Å; C803-G805 PolarHBondContact O-N 3.15Å; C803-G805 VanDerWaalsContact O-N 3.15Å; G805-V854 WeakPolarHBondContact CA-O 3.15Å; G805-V854 PolarHBondContact N-O 3.47Å
806	G	92.9	Very high	93.7	Very high	1 Å²	1	28 Å²	28	1%	0.01	14%	0.143	C	C	.	.			trans	92.4	179.7	178.5	0	0	0	0	0	114.5	L804 V854 N1012	L804-G806 PolarHBondContact O-N 2.83Å; G806-V854 PolarHBondContact O-N 2.91Å; G806-N1012 WeakPolarHBondContact CA-O 3.23Å
807	E	93.3	Very high	93.5	Very high	22 Å²	22	31.4 Å²	31.4	10%	0.103	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-79.6	138	173.9	-65.6	169.7	-151.6	0	0	111.1	K373 W809 T810 I811 L853	K373-E807 WeakPolarHBondContact CE-OE2 3.4Å; K373-E807 IonicContact NZ-OE1 3.31Å; K373-E807 PolarHBondContact NZ-OE1 3.3Å; K373-E807 IonicContact NZ-OE2 2.74Å; K373-E807 PolarHBondContact NZ-OE2 2.89Å; E807-W809 HydrophobicContact CB-CB 4.44Å; E807-W809 PolarHBondContact O-N 3.4Å; E807-T810 WeakPolarHBondContact O-CB 3.44Å; E807-T810 PolarHBondContact O-N 3.25Å; E807-I811 PolarHBondContact O-N 2.74Å; E807-L853 HydrophobicContact CG-CD2 3.89Å
808	L	95.6	Very high	93.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-29	172.4	-177.1	60.8	0	0	0	111.8	I811 L812 L818 C826 M852 I860 L913 F1000	L808-I811 PolarHBondContact O-N 2.98Å; L808-L812 WeakPolarHBondContact O-CB 3.26Å; L808-L812 PolarHBondContact O-N 2.85Å; L808-L818 HydrophobicContact CD1-CD1 4.06Å; L808-C826 HydrophobicContact CD2-CB 4.06Å; L808-M852 HydrophobicContact CB-CB 3.92Å; L808-M852 WeakPolarHBondContact CB-O 3.41Å; L808-M852 HydrophobicContact CD2-CB 3.97Å; L808-M852 HydrophobicContact CD2-CE 3.72Å; L808-M852 HydrophobicContact CD2-SD 3.99Å; L808-M852 PolarHBondContact N-O 3.41Å; L808-I860 HydrophobicContact CD1-CD1 4.48Å; L808-I860 HydrophobicContact CD2-CD1 4.5Å; L808-L913 HydrophobicContact CD2-CD2 3.97Å; L808-L913 HydrophobicContact CG-CD2 4.24Å; L808-F1000 HydrophobicContact CD1-CE1 4.11Å; L808-F1000 HydrophobicContact CD1-CZ 3.68Å
809	W	93.2	Very high	93.4	Very high	13 Å²	13	38 Å²	38	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-47.7	171.3	-177	88.3	0	0	0	112.9	L371 K373 E807 I811 L812 R813 P849 E850	L371-W809 WeakPolarHBondContact O-CH2 3.42Å; K373-W809 HydrophobicContact CB-CZ2 4.37Å; K373-W809 HydrophobicContact CD-CE3 4.09Å; K373-W809 HydrophobicContact CD-CH2 4.45Å; K373-W809 HydrophobicContact CD-CZ3 4Å; K373-W809 VanDerWaalsContact CE-CE3 3.43Å; K373-W809 HydrophobicContact CG-CD2 3.9Å; K373-W809 HydrophobicContact CG-CE3 3.69Å; K373-W809 HydrophobicContact CG-CH2 3.46Å; K373-W809 VanDerWaalsContact CG-CH2 3.46Å; K373-W809 HydrophobicContact CG-CZ2 3.68Å; K373-W809 HydrophobicContact CG-CZ3 3.46Å; K373-W809 VanDerWaalsContact CG-CZ3 3.46Å; E807-W809 HydrophobicContact CB-CB 4.44Å; E807-W809 PolarHBondContact O-N 3.4Å; W809-I811 VanDerWaalsContact C-N 3.3Å; W809-I811 PolarHBondContact O-N 2.93Å; W809-L812 PolarHBondContact O-N 3.26Å; W809-R813 HydrophobicContact CH2-CG 4.46Å; W809-R813 WeakPolarHBondContact O-CB 3.35Å; W809-R813 PolarHBondContact O-N 3Å; W809-P849 HydrophobicContact CB-CB 3.89Å; W809-P849 PolarHBondContact N-O 2.94Å; W809-P849 VanDerWaalsContact N-O 3.14Å; W809-E850 HydrophobicContact CB-CB 4.43Å; W809-E850 HydrophobicContact CB-CG 3.9Å; W809-E850 HydrophobicContact CD2-CG 4.37Å; W809-E850 HydrophobicContact CG-CG 3.71Å; W809-E850 PolarHBondContact NE1-OE1 2.73Å
810	T	91	Very high	93.3	Very high	14 Å²	14	40.5 Å²	40.5	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-43.5	177.6	-60.8	0	0	0	0	110.7	E807 L812 R813 D814	E807-T810 WeakPolarHBondContact O-CB 3.44Å; E807-T810 PolarHBondContact O-N 3.25Å; T810-L812 PolarHBondContact O-N 3.12Å; T810-R813 WeakPolarHBondContact O-CB 3.35Å; T810-R813 PolarHBondContact O-N 2.88Å; T810-D814 WeakPolarHBondContact O-CB 3.33Å; T810-D814 PolarHBondContact O-N 3.39Å
811	I	92.8	Very high	93.3	Very high	51 Å²	51	47.2 Å²	47.2	26%	0.262	23%	0.226	S	C	.	.	H	α-helix	trans	-67	-38.9	178.1	-55.4	173.3	0	0	0	111.5	E807 L808 W809 S815 L818 V854 F1000	E807-I811 PolarHBondContact O-N 2.74Å; L808-I811 PolarHBondContact O-N 2.98Å; W809-I811 VanDerWaalsContact C-N 3.3Å; W809-I811 PolarHBondContact O-N 2.93Å; I811-S815 VanDerWaalsContact O-CB 3.32Å; I811-S815 WeakPolarHBondContact O-CB 3.49Å; I811-S815 PolarHBondContact O-N 3.31Å; I811-S815 PolarHBondContact O-OG 2.87Å; I811-L818 HydrophobicContact CG2-CD2 4.39Å; I811-V854 HydrophobicContact CD1-CG2 3.72Å; I811-F1000 HydrophobicContact CD1-CD1 3.84Å; I811-F1000 HydrophobicContact CD1-CE1 3.78Å; I811-F1000 HydrophobicContact CG2-CE1 4.12Å
812	L	94.3	Very high	93.5	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-44.1	175.4	-179.9	66.9	0	0	0	111.9	L808 W809 T810 D814 S815 H816 L818 P849 E912 L913	L808-L812 WeakPolarHBondContact O-CB 3.26Å; L808-L812 PolarHBondContact O-N 2.85Å; W809-L812 PolarHBondContact O-N 3.26Å; T810-L812 PolarHBondContact O-N 3.12Å; L812-D814 VanDerWaalsContact C-N 3.35Å; L812-D814 PolarHBondContact O-N 3.04Å; L812-S815 PolarHBondContact O-OG 3.12Å; L812-H816 CarbonylContact O-C 3.57Å; L812-H816 VanDerWaalsContact O-CA 3.28Å; L812-H816 WeakPolarHBondContact O-CA 3.35Å; L812-H816 PolarHBondContact O-N 3.23Å; L812-L818 HydrophobicContact CD1-CG 4.02Å; L812-P849 HydrophobicContact CD2-CG 4.09Å; L812-E912 HydrophobicContact CD2-CG 3.64Å; L812-L913 HydrophobicContact CD2-CD2 4.35Å
813	R	90.4	Very high	93.6	Very high	73 Å²	73	45.4 Å²	45.4	28%	0.275	22%	0.216	S	C	.	.	H	α-helix	trans	-55	-50.6	175.7	-178.6	-166.5	74.2	-166	-1.4	110.7	L371 W809 T810 H816 D1014	L371-R813 HydrophobicContact CD2-CG 4.15Å; W809-R813 HydrophobicContact CH2-CG 4.46Å; W809-R813 WeakPolarHBondContact O-CB 3.35Å; W809-R813 PolarHBondContact O-N 3Å; T810-R813 WeakPolarHBondContact O-CB 3.35Å; T810-R813 PolarHBondContact O-N 2.88Å; R813-H816 PolarHBondContact O-N 3.06Å; R813-H816 PolarHBondContact O-ND1 2.72Å; R813-D1014 IonicContact CZ-OD1 3.26Å; R813-D1014 IonicContact NH1-OD1 2.74Å; R813-D1014 PolarHBondContact NH1-OD1 3.41Å; R813-D1014 IonicContact NH1-OD2 2.86Å; R813-D1014 IonicContact NH2-OD1 3.85Å
814	D	89.4	Confident	93.8	Very high	100 Å²	100	47.9 Å²	47.9	54%	0.535	22%	0.224	S	C	.	.	H	α-helix	trans	-80.5	-20.5	-171.6	-62.9	-12.9	0	0	0	113.3	T810 L812	T810-D814 WeakPolarHBondContact O-CB 3.33Å; T810-D814 PolarHBondContact O-N 3.39Å; L812-D814 VanDerWaalsContact C-N 3.35Å; L812-D814 PolarHBondContact O-N 3.04Å
815	S	91.8	Very high	94	Very high	45 Å²	45	47.7 Å²	47.7	32%	0.315	22%	0.223	S	C	.	.	H	α-helix	trans	-97.1	-7.2	172.2	62.1	0	0	0	0	114.4	I811 L812 H817 L818	I811-S815 VanDerWaalsContact O-CB 3.32Å; I811-S815 WeakPolarHBondContact O-CB 3.49Å; I811-S815 PolarHBondContact O-N 3.31Å; I811-S815 PolarHBondContact O-OG 2.87Å; L812-S815 PolarHBondContact O-OG 3.12Å; S815-H817 PolarHBondContact O-N 2.92Å; S815-H817 PolarHBondContact O-ND1 3.34Å; S815-H817 PolarHBondContact OG-O 2.77Å; S815-L818 WeakPolarHBondContact OG-CD2 3.47Å
816	H	90.8	Very high	94.2	Very high	146 Å²	146	47.4 Å²	47.4	68%	0.676	22%	0.221	S	C	*	.	S	Bend	trans	58.2	-23.6	-168.3	-51.4	-37.9	0	0	0	116.4	L812 R813 G916	L812-H816 CarbonylContact O-C 3.57Å; L812-H816 VanDerWaalsContact O-CA 3.28Å; L812-H816 WeakPolarHBondContact O-CA 3.35Å; L812-H816 PolarHBondContact O-N 3.23Å; R813-H816 PolarHBondContact O-N 3.06Å; R813-H816 PolarHBondContact O-ND1 2.72Å; H816-G916 WeakPolarHBondContact O-CA 3.28Å; H816-G916 PolarHBondContact O-N 3.34Å
817	H	92.3	Very high	94.5	Very high	71 Å²	71	47.4 Å²	47.4	33%	0.329	22%	0.22	S	C	.	.	S	Bend	trans	-168.5	158.3	178.2	66.1	-40.7	0	0	0	110	S815 Y946	S815-H817 PolarHBondContact O-N 2.92Å; S815-H817 PolarHBondContact O-ND1 3.34Å; S815-H817 PolarHBondContact OG-O 2.77Å; H817-Y946 AromaticContact CD2-CD1 3.36Å; H817-Y946 WeakPolarHBondContact CD2-CD1 3.37Å; H817-Y946 AromaticContact CD2-CE1 3.38Å; H817-Y946 WeakPolarHBondContact CD2-CE1 3.28Å; H817-Y946 AromaticContact NE2-CD1 3.67Å; H817-Y946 AromaticContact NE2-CE1 3.31Å; H817-Y946 VanDerWaalsContact NE2-CE1 3.31Å; H817-Y946 WeakPolarHBondContact NE2-CE1 3.22Å
818	L	95.7	Very high	94.8	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.058	22%	0.215	C	C	.	.			trans	-113.3	133.4	178.3	-57.1	179.3	0	0	0	111.6	L808 I811 L812 S815 T822 T823 L913	L808-L818 HydrophobicContact CD1-CD1 4.06Å; I811-L818 HydrophobicContact CG2-CD2 4.39Å; L812-L818 HydrophobicContact CD1-CG 4.02Å; S815-L818 WeakPolarHBondContact OG-CD2 3.47Å; L818-T822 HydrophobicContact CB-CG2 4.3Å; L818-T822 HydrophobicContact CD1-CG2 4.16Å; L818-T822 HydrophobicContact CD2-CG2 4.23Å; L818-T822 HydrophobicContact CG-CG2 4.47Å; L818-T823 WeakPolarHBondContact CB-OG1 3.48Å; L818-T823 PolarHBondContact O-OG1 2.89Å; L818-L913 WeakPolarHBondContact CB-O 3.28Å; L818-L913 HydrophobicContact CD1-CB 4.4Å; L818-L913 HydrophobicContact CD1-CD2 3.81Å; L818-L913 PolarHBondContact N-O 2.86Å
819	E	95.3	Very high	94.9	Very high	141 Å²	141	46.4 Å²	46.4	66%	0.659	22%	0.216	S	C	*	.			trans	-52.1	151.6	172.6	-61.9	-176.4	175.1	0	0	112.7	R821 T822 T823	E819-R821 PolarHBondContact O-N 2.79Å; E819-T822 PolarHBondContact O-N 3.5Å; E819-T823 WeakPolarHBondContact O-CB 3.22Å; E819-T823 PolarHBondContact O-N 2.78Å; E819-T823 PolarHBondContact O-OG1 3.05Å
820	E	94.9	Very high	95.1	Very high	53 Å²	53	45.9 Å²	45.9	25%	0.248	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-20.6	176.5	-66.5	-154.9	152.3	0	0	114.2	R824 L914 S948 A951 Y982	E820-R824 WeakPolarHBondContact O-CB 3.48Å; E820-R824 VanDerWaalsContact O-CG 3.22Å; E820-R824 WeakPolarHBondContact O-CG 3.4Å; E820-R824 PolarHBondContact O-N 2.95Å; E820-R824 PolarHBondContact O-NE 3.47Å; E820-L914 HydrophobicContact CG-CD2 3.88Å; E820-S948 WeakPolarHBondContact OE1-CB 3.34Å; E820-S948 PolarHBondContact OE1-N 3.47Å; E820-S948 PolarHBondContact OE1-OG 2.7Å; E820-S948 PolarHBondContact OE2-OG 3.19Å; E820-A951 WeakPolarHBondContact OE1-CB 3.46Å; E820-Y982 HydrophobicContact CG-CE2 4.38Å
821	R	95.7	Very high	95.5	Very high	164 Å²	164	45.2 Å²	45.2	62%	0.619	21%	0.21	S	C	*	.	H	α-helix	trans	-70.4	-52.3	171.7	-176.4	179.6	178.7	176.7	-0	111	E819 F825	E819-R821 PolarHBondContact O-N 2.79Å; R821-F825 PolarHBondContact O-N 3.28Å
822	T	97.3	Very high	95.7	Very high	23 Å²	23	43.9 Å²	43.9	14%	0.141	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-45.2	-179.4	-55.3	0	0	0	0	111	L818 E819 R824 F825 C826 P999 F1000	L818-T822 HydrophobicContact CB-CG2 4.3Å; L818-T822 HydrophobicContact CD1-CG2 4.16Å; L818-T822 HydrophobicContact CD2-CG2 4.23Å; L818-T822 HydrophobicContact CG-CG2 4.47Å; E819-T822 PolarHBondContact O-N 3.5Å; T822-R824 PolarHBondContact O-N 3.04Å; T822-F825 WeakPolarHBondContact O-CB 3.47Å; T822-F825 PolarHBondContact O-N 2.75Å; T822-C826 PolarHBondContact O-N 3.21Å; T822-C826 PolarHBondContact O-SG 3.02Å; T822-P999 HydrophobicContact CG2-CB 4.07Å; T822-P999 HydrophobicContact CG2-CG 3.86Å; T822-F1000 HydrophobicContact CG2-CE1 4.16Å; T822-F1000 HydrophobicContact CG2-CZ 3.91Å
823	T	97.9	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-47.2	176.2	-69	0	0	0	0	111.9	L818 E819 F825 C826 L827 L913 L914	L818-T823 WeakPolarHBondContact CB-OG1 3.48Å; L818-T823 PolarHBondContact O-OG1 2.89Å; E819-T823 WeakPolarHBondContact O-CB 3.22Å; E819-T823 PolarHBondContact O-N 2.78Å; E819-T823 PolarHBondContact O-OG1 3.05Å; T823-F825 VanDerWaalsContact C-N 3.34Å; T823-F825 PolarHBondContact O-N 2.78Å; T823-C826 PolarHBondContact O-N 3.05Å; T823-L827 HydrophobicContact CG2-CD1 3.58Å; T823-L827 HydrophobicContact CG2-CG 4.19Å; T823-L827 WeakPolarHBondContact O-CB 2.98Å; T823-L827 VanDerWaalsContact O-CG 3.24Å; T823-L827 WeakPolarHBondContact O-CG 3.38Å; T823-L827 PolarHBondContact O-N 2.95Å; T823-L913 HydrophobicContact CG2-CB 3.91Å; T823-L913 HydrophobicContact CG2-CD1 4.24Å; T823-L914 HydrophobicContact CG2-CD2 3.91Å; T823-L914 HydrophobicContact CG2-CG 4.04Å
824	R	97.9	Very high	96.3	Very high	57 Å²	57	40.2 Å²	40.2	22%	0.215	19%	0.188	C	C	.	.	H	α-helix	trans	-64.7	-34.5	177.6	-74	-178.7	-60.5	152.7	5.9	113.4	E820 T822 A828 Y982 F983 F986	E820-R824 WeakPolarHBondContact O-CB 3.48Å; E820-R824 VanDerWaalsContact O-CG 3.22Å; E820-R824 WeakPolarHBondContact O-CG 3.4Å; E820-R824 PolarHBondContact O-N 2.95Å; E820-R824 PolarHBondContact O-NE 3.47Å; T822-R824 PolarHBondContact O-N 3.04Å; R824-A828 VanDerWaalsContact O-CB 3.3Å; R824-A828 WeakPolarHBondContact O-CB 3.4Å; R824-A828 PolarHBondContact O-N 3.1Å; R824-Y982 WeakPolarHBondContact CD-O 3.32Å; R824-Y982 HydrophobicContact CG-CD1 3.97Å; R824-Y982 HydrophobicContact CG-CD2 4.48Å; R824-Y982 HydrophobicContact CG-CE1 3.47Å; R824-Y982 VanDerWaalsContact CG-CE1 3.47Å; R824-Y982 HydrophobicContact CG-CE2 4.03Å; R824-Y982 HydrophobicContact CG-CG 4.45Å; R824-Y982 VanDerWaalsContact CG-CZ 3.5Å; R824-Y982 PolarHBondContact NH1-O 2.74Å; R824-Y982 VanDerWaalsContact NH1-O 3.08Å; R824-F983 HydrophobicContact CB-CD1 4.33Å; R824-F983 HydrophobicContact CB-CE1 3.93Å; R824-F983 HydrophobicContact CG-CD1 4.34Å; R824-F983 HydrophobicContact CG-CE1 4.04Å; R824-F986 HydrophobicContact CB-CD2 4.26Å; R824-F986 HydrophobicContact CB-CE2 4.16Å
825	F	98.3	Very high	96.6	Very high	6 Å²	6	36 Å²	36	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-47.2	173.1	-177.4	-86.1	0	0	0	111.5	R821 T822 T823 A828 C829 G858 Y859 I991 L996 P999 F1000	R821-F825 PolarHBondContact O-N 3.28Å; T822-F825 WeakPolarHBondContact O-CB 3.47Å; T822-F825 PolarHBondContact O-N 2.75Å; T823-F825 VanDerWaalsContact C-N 3.34Å; T823-F825 PolarHBondContact O-N 2.78Å; F825-A828 PolarHBondContact O-N 3.13Å; F825-C829 PolarHBondContact O-N 3.2Å; F825-G858 WeakPolarHBondContact CE1-O 3.49Å; F825-Y859 HydrophobicContact CE2-CE1 4.22Å; F825-Y859 AromaticContact CZ-CD1 3.92Å; F825-Y859 HydrophobicContact CZ-CD1 3.92Å; F825-Y859 HydrophobicContact CZ-CD2 4.4Å; F825-Y859 AromaticContact CZ-CE1 3.86Å; F825-Y859 HydrophobicContact CZ-CE1 3.86Å; F825-Y859 HydrophobicContact CZ-CE2 4.33Å; F825-Y859 HydrophobicContact CZ-CG 4.2Å; F825-I991 HydrophobicContact CD2-CD1 3.73Å; F825-I991 HydrophobicContact CE2-CD1 3.57Å; F825-I991 HydrophobicContact CG-CD1 4.46Å; F825-I991 HydrophobicContact CZ-CD1 4.2Å; F825-L996 HydrophobicContact CD2-CD2 4.08Å; F825-L996 HydrophobicContact CE2-CD2 4.32Å; F825-L996 HydrophobicContact CE2-CG 4.42Å; F825-P999 HydrophobicContact CB-CG 4.08Å; F825-P999 VanDerWaalsContact CD1-CD 3.48Å; F825-P999 HydrophobicContact CD1-CG 3.92Å; F825-P999 VanDerWaalsContact CG-CD 3.44Å; F825-P999 HydrophobicContact CG-CG 3.98Å; F825-F1000 HydrophobicContact CD1-CE2 4.23Å; F825-F1000 HydrophobicContact CE1-CD2 4.43Å; F825-F1000 HydrophobicContact CE1-CE2 4.47Å
826	C	98.3	Very high	96.9	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-46.5	178.6	-58.3	0	0	0	0	112.1	L808 T822 T823 A828 C829 C830 M852 I860 L913 F1000	L808-C826 HydrophobicContact CD2-CB 4.06Å; T822-C826 PolarHBondContact O-N 3.21Å; T822-C826 PolarHBondContact O-SG 3.02Å; T823-C826 PolarHBondContact O-N 3.05Å; C826-A828 VanDerWaalsContact C-N 3.32Å; C826-A828 PolarHBondContact O-N 2.8Å; C826-C829 PolarHBondContact O-N 3.25Å; C826-C830 PolarHBondContact O-N 2.83Å; C826-C830 VanDerWaalsContact O-N 3.11Å; C826-M852 HydrophobicContact CB-CE 4.48Å; C826-I860 HydrophobicContact CB-CG1 4.34Å; C826-L913 HydrophobicContact CB-CD1 4.18Å; C826-F1000 WeakPolarHBondContact SG-CZ 3.39Å
827	L	98.5	Very high	97.2	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-36.7	177.7	-67.4	169.1	0	0	0	111.7	T823 C830 I831 L906 L909 T910 L913 F954 Y982 F983	T823-L827 HydrophobicContact CG2-CD1 3.58Å; T823-L827 HydrophobicContact CG2-CG 4.19Å; T823-L827 WeakPolarHBondContact O-CB 2.98Å; T823-L827 VanDerWaalsContact O-CG 3.24Å; T823-L827 WeakPolarHBondContact O-CG 3.38Å; T823-L827 PolarHBondContact O-N 2.95Å; L827-C830 WeakPolarHBondContact O-CB 3.1Å; L827-C830 PolarHBondContact O-N 3.16Å; L827-I831 HydrophobicContact CB-CD1 4.45Å; L827-I831 WeakPolarHBondContact O-CB 3Å; L827-I831 WeakPolarHBondContact O-CD1 3.34Å; L827-I831 WeakPolarHBondContact O-CG1 3.39Å; L827-I831 PolarHBondContact O-N 3.28Å; L827-L906 HydrophobicContact CD2-CD1 3.65Å; L827-L906 HydrophobicContact CD2-CG 4.48Å; L827-L909 HydrophobicContact CD2-CD2 3.87Å; L827-L909 HydrophobicContact CD2-CG 4.07Å; L827-T910 HydrophobicContact CD1-CG2 3.74Å; L827-T910 WeakPolarHBondContact CD1-OG1 3.35Å; L827-T910 WeakPolarHBondContact CD2-OG1 3.41Å; L827-L913 HydrophobicContact CD2-CD1 4.26Å; L827-L913 HydrophobicContact CG-CD1 4.34Å; L827-F954 HydrophobicContact CD1-CE1 4.44Å; L827-Y982 HydrophobicContact CD1-CE1 4Å; L827-F983 HydrophobicContact CB-CZ 3.99Å
828	A	98.5	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-45.8	177.9	0	0	0	0	0	112.4	R824 F825 C826 C830 I831 E832 F983 F986 W988 I991	R824-A828 VanDerWaalsContact O-CB 3.3Å; R824-A828 WeakPolarHBondContact O-CB 3.4Å; R824-A828 PolarHBondContact O-N 3.1Å; F825-A828 PolarHBondContact O-N 3.13Å; C826-A828 VanDerWaalsContact C-N 3.32Å; C826-A828 PolarHBondContact O-N 2.8Å; A828-C830 VanDerWaalsContact C-N 3.31Å; A828-C830 PolarHBondContact O-N 2.78Å; A828-I831 PolarHBondContact O-N 3.23Å; A828-E832 PolarHBondContact O-N 3.18Å; A828-F983 HydrophobicContact CB-CE1 4.46Å; A828-F986 HydrophobicContact CB-CD1 4.4Å; A828-F986 HydrophobicContact CB-CE1 3.36Å; A828-F986 HydrophobicContact CB-CE2 4.47Å; A828-F986 HydrophobicContact CB-CZ 3.41Å; A828-F986 VanDerWaalsContact CB-CZ 3.41Å; A828-W988 HydrophobicContact CB-CE3 4.33Å; A828-W988 HydrophobicContact CB-CH2 3.87Å; A828-W988 HydrophobicContact CB-CZ3 3.66Å; A828-I991 HydrophobicContact CB-CD1 4.4Å; A828-I991 HydrophobicContact CB-CG1 4.01Å
829	C	98.4	Very high	97.1	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-59.1	-41.5	172.8	-67.4	0	0	0	0	112.1	F782 F825 C826 E832 A833 I860	F782-C829 HydrophobicContact CD1-CB 3.86Å; F782-C829 HydrophobicContact CE1-CB 4.32Å; F825-C829 PolarHBondContact O-N 3.2Å; C826-C829 PolarHBondContact O-N 3.25Å; C829-E832 PolarHBondContact O-N 3.15Å; C829-A833 PolarHBondContact O-N 3.07Å; C829-A833 VanDerWaalsContact O-N 3.1Å; C829-I860 HydrophobicContact CB-CB 3.8Å; C829-I860 HydrophobicContact CB-CG1 4.45Å
830	C	98.3	Very high	96.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-62.8	-41.4	174.5	-177.8	0	0	0	0	112.5	C826 L827 A828 A833 L834 L847 M852 L906	C826-C830 PolarHBondContact O-N 2.83Å; C826-C830 VanDerWaalsContact O-N 3.11Å; L827-C830 WeakPolarHBondContact O-CB 3.1Å; L827-C830 PolarHBondContact O-N 3.16Å; A828-C830 VanDerWaalsContact C-N 3.31Å; A828-C830 PolarHBondContact O-N 2.78Å; C830-A833 WeakPolarHBondContact O-CB 3.44Å; C830-A833 PolarHBondContact O-N 3.38Å; C830-L834 WeakPolarHBondContact O-CG 3.48Å; C830-L834 PolarHBondContact O-N 2.88Å; C830-L847 WeakPolarHBondContact SG-CD1 3.41Å; C830-L847 VanDerWaalsContact SG-CD2 3.57Å; C830-M852 HydrophobicContact CB-CE 4.04Å; C830-L906 HydrophobicContact CB-CD1 4.46Å
831	I	98.5	Very high	96.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65	-39.8	179.9	-76.2	160.4	0	0	0	111	L827 A828 L834 D835 L906 I974 I977 R978 F983 W988	L827-I831 HydrophobicContact CB-CD1 4.45Å; L827-I831 WeakPolarHBondContact O-CB 3Å; L827-I831 WeakPolarHBondContact O-CD1 3.34Å; L827-I831 WeakPolarHBondContact O-CG1 3.39Å; L827-I831 PolarHBondContact O-N 3.28Å; A828-I831 PolarHBondContact O-N 3.23Å; I831-L834 PolarHBondContact O-N 2.96Å; I831-D835 WeakPolarHBondContact O-CB 3.09Å; I831-D835 PolarHBondContact O-N 3Å; I831-L906 HydrophobicContact CD1-CD2 4.14Å; I831-L906 HydrophobicContact CG1-CD1 4.23Å; I831-L906 HydrophobicContact CG1-CD2 3.77Å; I831-I974 HydrophobicContact CG2-CD1 3.99Å; I831-I974 HydrophobicContact CG2-CG1 3.97Å; I831-I974 WeakPolarHBondContact O-CD1 3.49Å; I831-I977 HydrophobicContact CD1-CG2 3.51Å; I831-I977 HydrophobicContact CG1-CG2 4.01Å; I831-R978 HydrophobicContact CG2-CG 4.05Å; I831-F983 HydrophobicContact CD1-CE2 3.78Å; I831-F983 HydrophobicContact CD1-CZ 3.65Å; I831-W988 HydrophobicContact CB-CH2 4.09Å; I831-W988 HydrophobicContact CB-CZ3 4.12Å; I831-W988 HydrophobicContact CD1-CH2 3.82Å; I831-W988 HydrophobicContact CG2-CH2 3.77Å; I831-W988 HydrophobicContact CG2-CZ3 3.76Å
832	E	98.1	Very high	96.7	Very high	24 Å²	24	19.5 Å²	19.5	11%	0.112	8%	0.084	C	C	.	.	H	α-helix	trans	-66.8	-36.6	172.8	-63.4	-50.2	134.4	0	0	112.7	F782 A828 C829 Y836 R978 W988 I991 V992	F782-E832 HydrophobicContact CD2-CB 3.3Å; F782-E832 HydrophobicContact CD2-CG 4.17Å; F782-E832 HydrophobicContact CE2-CB 3.39Å; F782-E832 HydrophobicContact CE2-CG 3.75Å; F782-E832 HydrophobicContact CG-CB 4.1Å; F782-E832 HydrophobicContact CZ-CB 4.28Å; F782-E832 HydrophobicContact CZ-CG 4.29Å; A828-E832 PolarHBondContact O-N 3.18Å; C829-E832 PolarHBondContact O-N 3.15Å; E832-Y836 WeakPolarHBondContact O-CB 3.45Å; E832-Y836 PolarHBondContact O-N 3.41Å; E832-Y836 VanDerWaalsContact O-N 3.12Å; E832-R978 IonicContact OE1-CZ 3.58Å; E832-R978 VanDerWaalsContact OE1-CZ 3.24Å; E832-R978 IonicContact OE1-NE 2.7Å; E832-R978 PolarHBondContact OE1-NE 3.12Å; E832-R978 IonicContact OE1-NH2 3.21Å; E832-R978 PolarHBondContact OE1-NH2 2.78Å; E832-R978 IonicContact OE2-CZ 3.45Å; E832-R978 IonicContact OE2-NE 2.69Å; E832-R978 IonicContact OE2-NH2 2.73Å; E832-R978 PolarHBondContact OE2-NH2 3.12Å; E832-W988 WeakPolarHBondContact OE1-CZ3 3.18Å; E832-I991 HydrophobicContact CG-CG2 3.88Å; E832-V992 HydrophobicContact CG-CG2 4.07Å
833	A	98.3	Very high	96.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.6	-44.4	174.2	0	0	0	0	0	112.2	F782 I783 C829 C830 Y836 L837 L862	F782-A833 HydrophobicContact CB-CB 3.88Å; I783-A833 HydrophobicContact CG1-CB 4.18Å; C829-A833 PolarHBondContact O-N 3.07Å; C829-A833 VanDerWaalsContact O-N 3.1Å; C830-A833 WeakPolarHBondContact O-CB 3.44Å; C830-A833 PolarHBondContact O-N 3.38Å; A833-Y836 WeakPolarHBondContact O-CB 3.16Å; A833-Y836 PolarHBondContact O-N 3.48Å; A833-L837 WeakPolarHBondContact O-CG 3.47Å; A833-L837 PolarHBondContact O-N 2.94Å; A833-L862 HydrophobicContact CB-CD1 3.62Å; A833-L862 HydrophobicContact CB-CG 3.81Å
834	L	98.1	Very high	96.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.4	-41.2	176.6	-69.1	178.3	0	0	0	112.2	C830 I831 Y836 L837 H838 L847 D902 I974	C830-L834 WeakPolarHBondContact O-CG 3.48Å; C830-L834 PolarHBondContact O-N 2.88Å; I831-L834 PolarHBondContact O-N 2.96Å; L834-Y836 VanDerWaalsContact C-N 3.28Å; L834-Y836 PolarHBondContact O-N 3.42Å; L834-L837 PolarHBondContact O-N 3.11Å; L834-H838 WeakPolarHBondContact O-CB 3.46Å; L834-H838 PolarHBondContact O-CD2 3.48Å; L834-H838 PolarHBondContact O-N 3.25Å; L834-L847 HydrophobicContact CD1-CD2 4.29Å; L834-D902 HydrophobicContact CD1-CB 4.3Å; L834-D902 HydrophobicContact CD2-CB 3.88Å; L834-I974 HydrophobicContact CB-CD1 4.23Å
835	D	96.7	Very high	96.5	Very high	11 Å²	11	16.4 Å²	16.4	6%	0.059	7%	0.069	C	C	.	.	H	α-helix	trans	-58.5	-43.5	174.8	-160.8	-3.6	0	0	0	110.9	I831 R839 I974 R978	I831-D835 WeakPolarHBondContact O-CB 3.09Å; I831-D835 PolarHBondContact O-N 3Å; D835-R839 VanDerWaalsContact CG-NH2 3.25Å; D835-R839 WeakPolarHBondContact O-CB 3.24Å; D835-R839 WeakPolarHBondContact O-CG 3.18Å; D835-R839 PolarHBondContact O-N 3.06Å; D835-R839 VanDerWaalsContact O-N 3.14Å; D835-R839 IonicContact OD1-CZ 2.87Å; D835-R839 IonicContact OD1-NE 3.64Å; D835-R839 PolarHBondContact OD1-NE 3.49Å; D835-R839 IonicContact OD1-NH2 2.71Å; D835-R839 PolarHBondContact OD1-NH2 3.02Å; D835-R839 IonicContact OD2-CZ 2.75Å; D835-R839 IonicContact OD2-NE 2.66Å; D835-R839 IonicContact OD2-NH2 2.93Å; D835-R839 PolarHBondContact OD2-NH2 2.87Å; D835-I974 HydrophobicContact CB-CD1 3.93Å; D835-I974 HydrophobicContact CB-CG2 4Å; D835-I974 WeakPolarHBondContact OD1-CG2 3.46Å; D835-R978 IonicContact OD2-CZ 3.6Å; D835-R978 IonicContact OD2-NH1 2.69Å; D835-R978 PolarHBondContact OD2-NH1 3.32Å; D835-R978 IonicContact OD2-NH2 2.73Å; D835-R978 PolarHBondContact OD2-NH2 2.84Å
836	Y	97.1	Very high	96.3	Very high	45 Å²	45	16.5 Å²	16.5	18%	0.176	7%	0.07	C	C	.	.	H	α-helix	trans	-59.8	-50.1	175.5	-173	-83	0	0	0	111.8	V778 S779 I783 E832 A833 L834 H840	V778-Y836 HydrophobicContact CB-CE1 3.77Å; V778-Y836 HydrophobicContact CG1-CE1 3.96Å; S779-Y836 PolarHBondContact N-OH 2.68Å; S779-Y836 WeakPolarHBondContact O-CE2 3.34Å; S779-Y836 VanDerWaalsContact O-CZ 3.28Å; S779-Y836 PolarHBondContact O-OH 3.12Å; I783-Y836 HydrophobicContact CD1-CD1 3.93Å; E832-Y836 WeakPolarHBondContact O-CB 3.45Å; E832-Y836 PolarHBondContact O-N 3.41Å; E832-Y836 VanDerWaalsContact O-N 3.12Å; A833-Y836 WeakPolarHBondContact O-CB 3.16Å; A833-Y836 PolarHBondContact O-N 3.48Å; L834-Y836 VanDerWaalsContact C-N 3.28Å; L834-Y836 PolarHBondContact O-N 3.42Å; Y836-H840 AromaticContact CD1-ND1 3.77Å; Y836-H840 AromaticContact CE1-CE1 3.58Å; Y836-H840 AromaticContact CE1-ND1 3.56Å; Y836-H840 AromaticContact CE2-CE1 3.61Å; Y836-H840 AromaticContact CZ-CE1 3.32Å; Y836-H840 AromaticContact CZ-ND1 3.82Å; Y836-H840 PolarHBondContact O-N 2.68Å; Y836-H840 PolarHBondContact O-ND1 2.7Å
837	L	97	Very high	96.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.9	-45.8	-178	-69.3	171.8	0	0	0	112.8	V778 I783 A833 L834 R839 H840 G841 I842 Y844 F865	V778-L837 HydrophobicContact CG1-CD2 3.9Å; I783-L837 HydrophobicContact CD1-CD1 4.28Å; I783-L837 HydrophobicContact CD1-CD2 3.82Å; I783-L837 HydrophobicContact CD1-CG 3.88Å; A833-L837 WeakPolarHBondContact O-CG 3.47Å; A833-L837 PolarHBondContact O-N 2.94Å; L834-L837 PolarHBondContact O-N 3.11Å; L837-R839 VanDerWaalsContact C-N 3.31Å; L837-R839 PolarHBondContact O-N 2.96Å; L837-H840 CarbonylContact O-C 3.52Å; L837-H840 WeakPolarHBondContact O-CA 3.33Å; L837-H840 PolarHBondContact O-N 2.95Å; L837-G841 PolarHBondContact O-N 2.89Å; L837-I842 CarbonylContact C-O 3.56Å; L837-I842 HydrophobicContact CB-CB 4.28Å; L837-I842 HydrophobicContact CD2-CB 4.2Å; L837-I842 HydrophobicContact CD2-CD1 4.11Å; L837-I842 HydrophobicContact CD2-CG2 4.05Å; L837-I842 PolarHBondContact O-N 2.69Å; L837-Y844 HydrophobicContact CD1-CD2 4.24Å; L837-Y844 HydrophobicContact CD1-CG 4.42Å; L837-F865 HydrophobicContact CD1-CE1 3.76Å; L837-F865 HydrophobicContact CD1-CZ 4.08Å; L837-F865 HydrophobicContact CD2-CE1 3.84Å; L837-F865 HydrophobicContact CG-CE1 4.46Å
838	H	94.8	Very high	96.2	Very high	13 Å²	13	16.9 Å²	16.9	6%	0.06	7%	0.072	C	C	.	.	H	α-helix	trans	-64	-36.2	-178.3	-62.7	178.2	0	0	0	111.6	L834 H840 G841 I842 F899 D902 Y903	L834-H838 WeakPolarHBondContact O-CB 3.46Å; L834-H838 PolarHBondContact O-CD2 3.48Å; L834-H838 PolarHBondContact O-N 3.25Å; H838-H840 VanDerWaalsContact C-N 3.3Å; H838-H840 PolarHBondContact O-N 2.94Å; H838-G841 PolarHBondContact O-N 2.99Å; H838-G841 VanDerWaalsContact O-N 3.12Å; H838-I842 PolarHBondContact CD2-O 2.92Å; H838-F899 HydrophobicContact CB-CD1 4.33Å; H838-F899 HydrophobicContact CB-CG 4.19Å; H838-F899 AromaticContact CD2-CD1 3.69Å; H838-F899 AromaticContact CD2-CG 3.99Å; H838-F899 AromaticContact CG-CG 3.92Å; H838-D902 IonicContact NE2-OD2 3.24Å; H838-Y903 AromaticContact CE1-CE1 3.39Å; H838-Y903 WeakPolarHBondContact CE1-CE1 3.47Å; H838-Y903 AromaticContact CE1-CZ 3.66Å; H838-Y903 AromaticContact ND1-CE1 3.57Å; H838-Y903 AromaticContact ND1-CZ 3.48Å; H838-Y903 PolarHBondContact ND1-OH 3.36Å; H838-Y903 VanDerWaalsContact ND1-OH 3.07Å
839	R	91.3	Very high	96	Very high	137 Å²	137	16.9 Å²	16.9	52%	0.517	7%	0.072	S	C	.	.	H	α-helix	trans	-64	-32.3	172.5	-73.4	175.1	-164.5	-160	8.7	113.4	D835 L837 G841	D835-R839 VanDerWaalsContact CG-NH2 3.25Å; D835-R839 WeakPolarHBondContact O-CB 3.24Å; D835-R839 WeakPolarHBondContact O-CG 3.18Å; D835-R839 PolarHBondContact O-N 3.06Å; D835-R839 VanDerWaalsContact O-N 3.14Å; D835-R839 IonicContact OD1-CZ 2.87Å; D835-R839 IonicContact OD1-NE 3.64Å; D835-R839 PolarHBondContact OD1-NE 3.49Å; D835-R839 IonicContact OD1-NH2 2.71Å; D835-R839 PolarHBondContact OD1-NH2 3.02Å; D835-R839 IonicContact OD2-CZ 2.75Å; D835-R839 IonicContact OD2-NE 2.66Å; D835-R839 IonicContact OD2-NH2 2.93Å; D835-R839 PolarHBondContact OD2-NH2 2.87Å; L837-R839 VanDerWaalsContact C-N 3.31Å; L837-R839 PolarHBondContact O-N 2.96Å; R839-G841 VanDerWaalsContact C-N 3.26Å
840	H	91.3	Very high	95.8	Very high	86 Å²	86	17.6 Å²	17.6	40%	0.398	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	8.3	174.9	-67.2	87.1	0	0	0	112.9	Y836 L837 H838 I842 Y870	Y836-H840 AromaticContact CD1-ND1 3.77Å; Y836-H840 AromaticContact CE1-CE1 3.58Å; Y836-H840 AromaticContact CE1-ND1 3.56Å; Y836-H840 AromaticContact CE2-CE1 3.61Å; Y836-H840 AromaticContact CZ-CE1 3.32Å; Y836-H840 AromaticContact CZ-ND1 3.82Å; Y836-H840 PolarHBondContact O-N 2.68Å; Y836-H840 PolarHBondContact O-ND1 2.7Å; L837-H840 CarbonylContact O-C 3.52Å; L837-H840 WeakPolarHBondContact O-CA 3.33Å; L837-H840 PolarHBondContact O-N 2.95Å; H838-H840 VanDerWaalsContact C-N 3.3Å; H838-H840 PolarHBondContact O-N 2.94Å; H840-I842 VanDerWaalsContact C-N 3.32Å; H840-I842 HydrophobicContact CB-CD1 3.97Å; H840-I842 HydrophobicContact CB-CG1 4.43Å; H840-I842 PolarHBondContact O-N 2.81Å; H840-Y870 WeakPolarHBondContact O-CD2 3.34Å; H840-Y870 WeakPolarHBondContact O-CE2 3.26Å
841	G	90.5	Very high	95.6	Very high	1 Å²	1	18 Å²	18	1%	0.01	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	17	177.9	0	0	0	0	0	114.7	L837 H838 R839 I871 G872	L837-G841 PolarHBondContact O-N 2.89Å; H838-G841 PolarHBondContact O-N 2.99Å; H838-G841 VanDerWaalsContact O-N 3.12Å; R839-G841 VanDerWaalsContact C-N 3.26Å; G841-I871 PolarHBondContact O-N 3.34Å; G841-G872 PolarHBondContact O-N 3.29Å
842	I	94.9	Very high	95.6	Very high	4 Å²	4	18 Å²	18	2%	0.021	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.8	-176	-58.7	159.5	0	0	0	109.6	I774 V778 L837 H838 H840 A868 K869 Y870	I774-I842 HydrophobicContact CD1-CG2 4.12Å; I774-I842 HydrophobicContact CG2-CD1 4.13Å; I774-I842 HydrophobicContact CG2-CG2 4.24Å; V778-I842 HydrophobicContact CG1-CD1 3.87Å; L837-I842 CarbonylContact C-O 3.56Å; L837-I842 HydrophobicContact CB-CB 4.28Å; L837-I842 HydrophobicContact CD2-CB 4.2Å; L837-I842 HydrophobicContact CD2-CD1 4.11Å; L837-I842 HydrophobicContact CD2-CG2 4.05Å; L837-I842 PolarHBondContact O-N 2.69Å; H838-I842 PolarHBondContact CD2-O 2.92Å; H840-I842 VanDerWaalsContact C-N 3.32Å; H840-I842 HydrophobicContact CB-CD1 3.97Å; H840-I842 HydrophobicContact CB-CG1 4.43Å; H840-I842 PolarHBondContact O-N 2.81Å; I842-A868 HydrophobicContact CG2-CB 4.32Å; I842-K869 WeakPolarHBondContact CA-O 3.47Å; I842-Y870 HydrophobicContact CG1-CD2 4.09Å
843	V	96.1	Very high	95.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	140.2	168.3	67	0	0	0	0	108.8	R845 A868 K869 I871 F899 D902	V843-R845 HydrophobicContact CB-CG 4.27Å; V843-R845 HydrophobicContact CG1-CG 3.87Å; V843-R845 HydrophobicContact CG2-CG 3.64Å; V843-A868 CarbonylContact O-C 3.42Å; V843-A868 VanDerWaalsContact O-CA 3.23Å; V843-A868 WeakPolarHBondContact O-CA 3.39Å; V843-K869 HydrophobicContact CG1-CB 4.34Å; V843-K869 PolarHBondContact N-O 3Å; V843-K869 PolarHBondContact O-N 3.39Å; V843-I871 HydrophobicContact CB-CD1 4.05Å; V843-I871 HydrophobicContact CB-CG1 4.5Å; V843-I871 HydrophobicContact CG1-CD1 3.96Å; V843-I871 HydrophobicContact CG1-CG1 4.25Å; V843-I871 HydrophobicContact CG1-CG2 4.05Å; V843-F899 HydrophobicContact CB-CD1 3.89Å; V843-F899 HydrophobicContact CB-CE1 4.18Å; V843-F899 HydrophobicContact CG2-CD1 4.34Å; V843-D902 WeakPolarHBondContact CG2-OD2 3.4Å
844	Y	97	Very high	95.5	Very high	1 Å²	1	18.2 Å²	18.2	0%	0.004	8%	0.079	C	C	.	.			trans	-95.2	-46.2	-168.9	179	-108.7	0	0	0	113.6	L837 D846 L847 N851 L862 C863 D864 F865 F867 A868 D902	L837-Y844 HydrophobicContact CD1-CD2 4.24Å; L837-Y844 HydrophobicContact CD1-CG 4.42Å; Y844-D846 VanDerWaalsContact C-N 3.31Å; Y844-D846 VanDerWaalsContact CE1-C 3.47Å; Y844-D846 PolarHBondContact O-N 3.42Å; Y844-D846 VanDerWaalsContact O-N 3.15Å; Y844-L847 HydrophobicContact CD1-CB 4.09Å; Y844-L847 HydrophobicContact CE1-CB 4.17Å; Y844-N851 VanDerWaalsContact OH-CB 3.26Å; Y844-N851 WeakPolarHBondContact OH-CB 3.44Å; Y844-N851 PolarHBondContact OH-ND2 3.29Å; Y844-L862 HydrophobicContact CD1-CD1 4.44Å; Y844-L862 HydrophobicContact CE1-CD1 4.43Å; Y844-C863 PolarHBondContact OH-O 3.39Å; Y844-D864 PolarHBondContact OH-O 3.02Å; Y844-F865 AromaticContact CD2-CD1 3.97Å; Y844-F865 HydrophobicContact CD2-CD1 3.97Å; Y844-F865 AromaticContact CD2-CE1 3.7Å; Y844-F865 HydrophobicContact CD2-CE1 3.7Å; Y844-F865 HydrophobicContact CD2-CE2 4.42Å; Y844-F865 HydrophobicContact CD2-CG 4.45Å; Y844-F865 AromaticContact CD2-CZ 3.95Å; Y844-F865 HydrophobicContact CD2-CZ 3.95Å; Y844-F865 HydrophobicContact CE2-CD1 4.09Å; Y844-F865 AromaticContact CE2-CD2 4Å; Y844-F865 HydrophobicContact CE2-CD2 4Å; Y844-F865 AromaticContact CE2-CE1 3.96Å; Y844-F865 HydrophobicContact CE2-CE1 3.96Å; Y844-F865 AromaticContact CE2-CE2 3.86Å; Y844-F865 HydrophobicContact CE2-CE2 3.86Å; Y844-F865 HydrophobicContact CE2-CG 4.12Å; Y844-F865 AromaticContact CE2-CZ 3.84Å; Y844-F865 HydrophobicContact CE2-CZ 3.84Å; Y844-F867 CarbonylContact O-C 3.58Å; Y844-A868 HydrophobicContact CD2-CB 4.33Å; Y844-A868 PolarHBondContact O-N 3.17Å; Y844-D902 PolarHBondContact N-OD2 2.85Å
845	R	96	Very high	95.3	Very high	14 Å²	14	18.8 Å²	18.8	5%	0.053	8%	0.082	C	C	.	.			trans	68.5	-4.4	166.6	-50.8	-171.5	-67	163.5	9.5	119	V843 F867 T879 C881 G882 H897 D902	V843-R845 HydrophobicContact CB-CG 4.27Å; V843-R845 HydrophobicContact CG1-CG 3.87Å; V843-R845 HydrophobicContact CG2-CG 3.64Å; R845-F867 HydrophobicContact CB-CB 4.43Å; R845-F867 VanDerWaalsContact CZ-O 3.23Å; R845-F867 PolarHBondContact NE-O 3.36Å; R845-F867 PolarHBondContact NH2-O 3.36Å; R845-T879 PolarHBondContact NH1-O 3.46Å; R845-C881 PolarHBondContact NH1-SG 3.04Å; R845-G882 WeakPolarHBondContact O-CA 3.4Å; R845-H897 VanDerWaalsContact CD-NE2 3.28Å; R845-H897 WeakPolarHBondContact CD-NE2 3.22Å; R845-H897 PolarHBondContact NH1-NE2 3.12Å; R845-D902 WeakPolarHBondContact CA-OD1 3.38Å; R845-D902 PolarHBondContact N-OD1 2.98Å
846	D	95.5	Very high	95.1	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.037	10%	0.104	C	C	.	.			trans	-130.3	40.7	172.9	-151.6	39.5	0	0	0	114.1	Y844 K848 N851 F867 T883	Y844-D846 VanDerWaalsContact C-N 3.31Å; Y844-D846 VanDerWaalsContact CE1-C 3.47Å; Y844-D846 PolarHBondContact O-N 3.42Å; Y844-D846 VanDerWaalsContact O-N 3.15Å; D846-K848 PolarHBondContact O-N 3.32Å; D846-K848 IonicContact OD1-NZ 2.72Å; D846-K848 WeakPolarHBondContact OD2-CE 2.94Å; D846-K848 IonicContact OD2-NZ 3.62Å; D846-K848 PolarHBondContact OD2-NZ 2.95Å; D846-N851 PolarHBondContact O-ND2 3.37Å; D846-N851 PolarHBondContact OD2-ND2 3.48Å; D846-N851 VanDerWaalsContact OD2-ND2 3.17Å; D846-F867 HydrophobicContact CB-CD2 3.67Å; D846-F867 HydrophobicContact CB-CE2 4.23Å; D846-F867 HydrophobicContact CB-CG 4.46Å; D846-T883 WeakPolarHBondContact OD1-CB 3.43Å; D846-T883 PolarHBondContact OD1-N 3.1Å; D846-T883 PolarHBondContact OD1-OG1 3.12Å
847	L	97.3	Very high	94.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.			trans	-67.6	115	177.7	178.8	61.9	0	0	0	111.8	C830 L834 Y844 M852 L862 Y886 L906 L909	C830-L847 WeakPolarHBondContact SG-CD1 3.41Å; C830-L847 VanDerWaalsContact SG-CD2 3.57Å; L834-L847 HydrophobicContact CD1-CD2 4.29Å; Y844-L847 HydrophobicContact CD1-CB 4.09Å; Y844-L847 HydrophobicContact CE1-CB 4.17Å; L847-M852 HydrophobicContact CD1-CG 4.4Å; L847-M852 HydrophobicContact CD1-SD 3.96Å; L847-L862 HydrophobicContact CD1-CD2 3.99Å; L847-Y886 WeakPolarHBondContact O-CD1 3.42Å; L847-Y886 WeakPolarHBondContact O-CE1 3.4Å; L847-L906 HydrophobicContact CD2-CB 4.17Å; L847-L906 HydrophobicContact CD2-CD1 4.25Å; L847-L909 HydrophobicContact CD1-CD2 3.98Å; L847-L909 HydrophobicContact CD2-CD2 4.06Å; L847-L909 HydrophobicContact CG-CD2 4.03Å
848	K	95.8	Very high	94.8	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.035	12%	0.122	C	C	.	.	S	Bend	trans	-159.5	163.5	177.2	63.6	-170.7	169.9	-167.1	0	110.5	R374 D846 E850 N851 M852 T883 Y886	R374-K848 PolarHBondContact O-NZ 3.04Å; D846-K848 PolarHBondContact O-N 3.32Å; D846-K848 IonicContact OD1-NZ 2.72Å; D846-K848 WeakPolarHBondContact OD2-CE 2.94Å; D846-K848 IonicContact OD2-NZ 3.62Å; D846-K848 PolarHBondContact OD2-NZ 2.95Å; K848-E850 HydrophobicContact CD-CB 4.21Å; K848-E850 HydrophobicContact CG-CB 4.1Å; K848-E850 WeakPolarHBondContact CG-OE2 3.13Å; K848-E850 PolarHBondContact O-N 3.22Å; K848-N851 VanDerWaalsContact CE-CG 3.43Å; K848-N851 WeakPolarHBondContact CE-OD1 3.12Å; K848-N851 HydrophobicContact CG-CB 4.36Å; K848-N851 PolarHBondContact O-N 2.82Å; K848-N851 VanDerWaalsContact O-N 3.13Å; K848-M852 WeakPolarHBondContact O-CG 3.26Å; K848-T883 HydrophobicContact CD-CG2 4.21Å; K848-T883 WeakPolarHBondContact CD-OG1 3.24Å; K848-T883 PolarHBondContact NZ-OG1 3.44Å; K848-Y886 HydrophobicContact CB-CD2 4.27Å; K848-Y886 HydrophobicContact CB-CE2 3.92Å
849	P	95.9	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-57.9	-28.9	180	-25.6	35.3	0	0	0	114.9	W809 L812 N851 M852 Y886 L909 E912 L913	W809-P849 HydrophobicContact CB-CB 3.89Å; W809-P849 PolarHBondContact N-O 2.94Å; W809-P849 VanDerWaalsContact N-O 3.14Å; L812-P849 HydrophobicContact CD2-CG 4.09Å; P849-N851 VanDerWaalsContact C-N 3.3Å; P849-N851 PolarHBondContact O-N 2.8Å; P849-M852 PolarHBondContact O-N 2.75Å; P849-Y886 WeakPolarHBondContact CD-OH 3.44Å; P849-L909 HydrophobicContact CG-CD1 3.82Å; P849-E912 HydrophobicContact CG-CG 4.46Å; P849-L913 HydrophobicContact CG-CD2 4.33Å
850	E	92.8	Very high	95.2	Very high	17 Å²	17	18.9 Å²	18.9	8%	0.079	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-64.5	-34.9	177.9	-65	89.5	146.3	0	0	111.9	K373 R374 W809 K848 M852	K373-E850 HydrophobicContact CB-CG 4.35Å; R374-E850 WeakPolarHBondContact CB-OE1 3.45Å; R374-E850 PolarHBondContact N-OE1 2.76Å; W809-E850 HydrophobicContact CB-CB 4.43Å; W809-E850 HydrophobicContact CB-CG 3.9Å; W809-E850 HydrophobicContact CD2-CG 4.37Å; W809-E850 HydrophobicContact CG-CG 3.71Å; W809-E850 PolarHBondContact NE1-OE1 2.73Å; K848-E850 HydrophobicContact CD-CB 4.21Å; K848-E850 HydrophobicContact CG-CB 4.1Å; K848-E850 WeakPolarHBondContact CG-OE2 3.13Å; K848-E850 PolarHBondContact O-N 3.22Å; E850-M852 VanDerWaalsContact C-N 3.27Å; E850-M852 PolarHBondContact O-N 2.83Å
851	N	95.3	Very high	95.6	Very high	10 Å²	10	15.1 Å²	15.1	5%	0.053	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-92.2	15.9	-178.4	-60.2	8.9	0	0	0	112.6	Y844 D846 K848 P849 L862 C863	Y844-N851 VanDerWaalsContact OH-CB 3.26Å; Y844-N851 WeakPolarHBondContact OH-CB 3.44Å; Y844-N851 PolarHBondContact OH-ND2 3.29Å; D846-N851 PolarHBondContact O-ND2 3.37Å; D846-N851 PolarHBondContact OD2-ND2 3.48Å; D846-N851 VanDerWaalsContact OD2-ND2 3.17Å; K848-N851 VanDerWaalsContact CE-CG 3.43Å; K848-N851 WeakPolarHBondContact CE-OD1 3.12Å; K848-N851 HydrophobicContact CG-CB 4.36Å; K848-N851 PolarHBondContact O-N 2.82Å; K848-N851 VanDerWaalsContact O-N 3.13Å; P849-N851 VanDerWaalsContact C-N 3.3Å; P849-N851 PolarHBondContact O-N 2.8Å; N851-L862 WeakPolarHBondContact O-CA 3.47Å; N851-C863 VanDerWaalsContact C-SG 3.57Å; N851-C863 VanDerWaalsContact CA-SG 3.58Å; N851-C863 PolarHBondContact O-N 3.26Å; N851-C863 PolarHBondContact O-SG 3.03Å
852	M	97.5	Very high	95.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	101.6	-178.5	-68.9	178.3	73	0	0	109.5	L808 C826 C830 L847 K848 P849 E850 I860 K861 L862 L909	L808-M852 HydrophobicContact CB-CB 3.92Å; L808-M852 WeakPolarHBondContact CB-O 3.41Å; L808-M852 HydrophobicContact CD2-CB 3.97Å; L808-M852 HydrophobicContact CD2-CE 3.72Å; L808-M852 HydrophobicContact CD2-SD 3.99Å; L808-M852 PolarHBondContact N-O 3.41Å; C826-M852 HydrophobicContact CB-CE 4.48Å; C830-M852 HydrophobicContact CB-CE 4.04Å; L847-M852 HydrophobicContact CD1-CG 4.4Å; L847-M852 HydrophobicContact CD1-SD 3.96Å; K848-M852 WeakPolarHBondContact O-CG 3.26Å; P849-M852 PolarHBondContact O-N 2.75Å; E850-M852 VanDerWaalsContact C-N 3.27Å; E850-M852 PolarHBondContact O-N 2.83Å; M852-I860 HydrophobicContact CB-CG2 3.88Å; M852-I860 HydrophobicContact CE-CG2 3.8Å; M852-I860 HydrophobicContact CG-CG2 4.36Å; M852-K861 WeakPolarHBondContact CA-O 3.28Å; M852-L862 HydrophobicContact CG-CD2 3.83Å; M852-L909 HydrophobicContact CE-CD2 4.02Å; M852-L909 HydrophobicContact SD-CD1 3.94Å; M852-L909 HydrophobicContact SD-CD2 3.56Å; M852-L909 VanDerWaalsContact SD-CD2 3.56Å; M852-L909 HydrophobicContact SD-CG 4.4Å
853	L	96.9	Very high	95.9	Very high	28 Å²	28	16 Å²	16	15%	0.147	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	141.3	-177.7	-58.7	-177.9	0	0	0	111.8	C803 E807 I860 K861 C863	C803-L853 HydrophobicContact CB-CB 3.6Å; C803-L853 HydrophobicContact CB-CD1 3.97Å; C803-L853 HydrophobicContact CB-CG 4.44Å; E807-L853 HydrophobicContact CG-CD2 3.89Å; L853-I860 CarbonylContact O-C 3.52Å; L853-I860 WeakPolarHBondContact O-CA 3.45Å; L853-K861 PolarHBondContact N-O 3.04Å; L853-K861 PolarHBondContact O-N 3.25Å; L853-C863 HydrophobicContact CD1-CB 3.86Å; L853-C863 HydrophobicContact CG-CB 4.11Å
854	V	96.7	Very high	95.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.2	172.9	-168.5	0	0	0	0	109.3	C803 G805 G806 I811 I860 F1000 V1002	C803-V854 CarbonylContact C-O 3.51Å; C803-V854 VanDerWaalsContact C-O 3.26Å; C803-V854 VanDerWaalsContact O-O 3.14Å; G805-V854 WeakPolarHBondContact CA-O 3.15Å; G805-V854 PolarHBondContact N-O 3.47Å; G806-V854 PolarHBondContact O-N 2.91Å; I811-V854 HydrophobicContact CD1-CG2 3.72Å; V854-I860 HydrophobicContact CB-CD1 4.43Å; V854-I860 HydrophobicContact CG2-CD1 3.76Å; V854-F1000 HydrophobicContact CG1-CB 4.29Å; V854-F1000 HydrophobicContact CG1-CD2 4.32Å; V854-F1000 HydrophobicContact CG1-CG 4.24Å; V854-V1002 HydrophobicContact CG1-CG2 3.8Å
855	T	94.6	Very high	95.5	Very high	12 Å²	12	19.2 Å²	19.2	7%	0.074	10%	0.102	C	C	.	.	P	Polyproline II helix	trans	-77.8	166.4	174.6	56.2	0	0	0	0	111.8	K857 G858 Y859 K861	T855-K857 PolarHBondContact O-N 3.12Å; T855-K857 VanDerWaalsContact O-N 3.12Å; T855-G858 WeakPolarHBondContact O-CA 3.46Å; T855-G858 PolarHBondContact O-N 2.95Å; T855-Y859 WeakPolarHBondContact CB-O 3.41Å; T855-Y859 WeakPolarHBondContact CG2-O 3.41Å; T855-Y859 PolarHBondContact N-O 2.59Å; T855-Y859 WeakPolarHBondContact OG1-CA 3.47Å; T855-Y859 WeakPolarHBondContact OG1-CB 3.38Å; T855-Y859 PolarHBondContact OG1-N 3Å; T855-Y859 PolarHBondContact OG1-O 3.33Å; T855-K861 HydrophobicContact CG2-CD 3.82Å; T855-K861 HydrophobicContact CG2-CG 3.79Å
856	S	92	Very high	95.1	Very high	75 Å²	75	19.3 Å²	19.3	52%	0.524	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.4	170.9	53.1	0	0	0	0	114.1	G858	S856-G858 VanDerWaalsContact C-N 3.34Å
857	K	93	Very high	94.8	Very high	127 Å²	127	20.4 Å²	20.4	55%	0.552	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	1.8	172.4	-62.7	-176.2	-177.8	178	0	113.9	T855 Y859	T855-K857 PolarHBondContact O-N 3.12Å; T855-K857 VanDerWaalsContact O-N 3.12Å; K857-Y859 VanDerWaalsContact C-N 3.28Å; K857-Y859 HydrophobicContact CB-CD2 4.18Å; K857-Y859 PolarHBondContact O-N 3.29Å
858	G	95.1	Very high	94.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	69.9	17.4	-175.1	0	0	0	0	0	114.9	F825 T855 S856 T998 F1000	F825-G858 WeakPolarHBondContact CE1-O 3.49Å; T855-G858 WeakPolarHBondContact O-CA 3.46Å; T855-G858 PolarHBondContact O-N 2.95Å; S856-G858 VanDerWaalsContact C-N 3.34Å; G858-T998 WeakPolarHBondContact O-CB 3.18Å; G858-T998 PolarHBondContact O-OG1 2.75Å; G858-F1000 WeakPolarHBondContact O-CD2 3.21Å
859	Y	97.6	Very high	94.4	Very high	6 Å²	6	21.9 Å²	21.9	2%	0.024	12%	0.118	C	C	.	.			trans	-91.4	147.7	170.6	-83.9	-97.2	0	0	0	110.9	F782 F825 T855 K857 I991 Q994 T995 L996	F782-Y859 HydrophobicContact CE1-CD1 4.08Å; F825-Y859 HydrophobicContact CE2-CE1 4.22Å; F825-Y859 AromaticContact CZ-CD1 3.92Å; F825-Y859 HydrophobicContact CZ-CD1 3.92Å; F825-Y859 HydrophobicContact CZ-CD2 4.4Å; F825-Y859 AromaticContact CZ-CE1 3.86Å; F825-Y859 HydrophobicContact CZ-CE1 3.86Å; F825-Y859 HydrophobicContact CZ-CE2 4.33Å; F825-Y859 HydrophobicContact CZ-CG 4.2Å; T855-Y859 WeakPolarHBondContact CB-O 3.41Å; T855-Y859 WeakPolarHBondContact CG2-O 3.41Å; T855-Y859 PolarHBondContact N-O 2.59Å; T855-Y859 WeakPolarHBondContact OG1-CA 3.47Å; T855-Y859 WeakPolarHBondContact OG1-CB 3.38Å; T855-Y859 PolarHBondContact OG1-N 3Å; T855-Y859 PolarHBondContact OG1-O 3.33Å; K857-Y859 VanDerWaalsContact C-N 3.28Å; K857-Y859 HydrophobicContact CB-CD2 4.18Å; K857-Y859 PolarHBondContact O-N 3.29Å; Y859-I991 HydrophobicContact CE1-CD1 4.02Å; Y859-Q994 HydrophobicContact CD1-CG 4.18Å; Y859-Q994 HydrophobicContact CE1-CB 4.21Å; Y859-Q994 HydrophobicContact CE1-CG 4.11Å; Y859-Q994 HydrophobicContact CE2-CB 4.13Å; Y859-Q994 HydrophobicContact CG-CG 4.45Å; Y859-Q994 WeakPolarHBondContact OH-CA 3.29Å; Y859-Q994 PolarHBondContact OH-O 3.22Å; Y859-T995 PolarHBondContact OH-N 3.4Å; Y859-L996 WeakPolarHBondContact OH-CA 3.44Å; Y859-L996 PolarHBondContact OH-N 3.49Å; Y859-L996 PolarHBondContact OH-O 3.04Å
860	I	98	Very high	94.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	142.9	177.2	-52.4	-57.9	0	0	0	111.2	L808 C826 C829 M852 L853 V854 F1000	L808-I860 HydrophobicContact CD1-CD1 4.48Å; L808-I860 HydrophobicContact CD2-CD1 4.5Å; C826-I860 HydrophobicContact CB-CG1 4.34Å; C829-I860 HydrophobicContact CB-CB 3.8Å; C829-I860 HydrophobicContact CB-CG1 4.45Å; M852-I860 HydrophobicContact CB-CG2 3.88Å; M852-I860 HydrophobicContact CE-CG2 3.8Å; M852-I860 HydrophobicContact CG-CG2 4.36Å; L853-I860 CarbonylContact O-C 3.52Å; L853-I860 WeakPolarHBondContact O-CA 3.45Å; V854-I860 HydrophobicContact CB-CD1 4.43Å; V854-I860 HydrophobicContact CG2-CD1 3.76Å; I860-F1000 HydrophobicContact CD1-CD2 4.48Å; I860-F1000 HydrophobicContact CD1-CE2 3.76Å; I860-F1000 HydrophobicContact CD1-CZ 4.19Å; I860-F1000 HydrophobicContact CG1-CE2 4.4Å
861	K	98.3	Very high	94.1	Very high	7 Å²	7	29.8 Å²	29.8	3%	0.03	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147	164.4	-64.3	-170.4	176.5	-140.6	0	111.7	P781 F782 I783 E801 M852 L853 T855	P781-K861 VanDerWaalsContact O-CE 3.23Å; P781-K861 WeakPolarHBondContact O-CE 3.44Å; F782-K861 CarbonylContact O-C 3.53Å; F782-K861 VanDerWaalsContact O-CA 3.3Å; F782-K861 WeakPolarHBondContact O-CA 3.33Å; I783-K861 PolarHBondContact O-NZ 3.23Å; E801-K861 VanDerWaalsContact OE1-CE 3.29Å; E801-K861 WeakPolarHBondContact OE1-CE 3.38Å; E801-K861 IonicContact OE1-NZ 2.7Å; E801-K861 PolarHBondContact OE1-NZ 2.68Å; E801-K861 IonicContact OE2-NZ 3.73Å; E801-K861 PolarHBondContact OE2-NZ 3.47Å; M852-K861 WeakPolarHBondContact CA-O 3.28Å; L853-K861 PolarHBondContact N-O 3.04Å; L853-K861 PolarHBondContact O-N 3.25Å; T855-K861 HydrophobicContact CG2-CD 3.82Å; T855-K861 HydrophobicContact CG2-CG 3.79Å
862	L	98	Very high	93.4	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135.6	166.6	-59	-172.4	0	0	0	110.5	F782 C784 A833 Y844 L847 N851 M852 F865	F782-L862 PolarHBondContact O-N 2.81Å; C784-L862 PolarHBondContact N-O 3.17Å; C784-L862 PolarHBondContact SG-O 3.46Å; A833-L862 HydrophobicContact CB-CD1 3.62Å; A833-L862 HydrophobicContact CB-CG 3.81Å; Y844-L862 HydrophobicContact CD1-CD1 4.44Å; Y844-L862 HydrophobicContact CE1-CD1 4.43Å; L847-L862 HydrophobicContact CD1-CD2 3.99Å; N851-L862 WeakPolarHBondContact O-CA 3.47Å; M852-L862 HydrophobicContact CG-CD2 3.83Å; L862-F865 HydrophobicContact CB-CE2 4.33Å; L862-F865 HydrophobicContact CB-CZ 4.39Å
863	C	94.3	Very high	92.5	Very high	22 Å²	22	34.3 Å²	34.3	15%	0.149	18%	0.175	C	C	.	.			trans	-118.6	-168.4	170.9	71.8	0	0	0	0	110.9	C784 Y844 N851 L853	C784-C863 HydrophobicContact CB-CB 4.36Å; Y844-C863 PolarHBondContact OH-O 3.39Å; N851-C863 VanDerWaalsContact C-SG 3.57Å; N851-C863 VanDerWaalsContact CA-SG 3.58Å; N851-C863 PolarHBondContact O-N 3.26Å; N851-C863 PolarHBondContact O-SG 3.03Å; L853-C863 HydrophobicContact CD1-CB 3.86Å; L853-C863 HydrophobicContact CG-CB 4.11Å
864	D	90.8	Very high	91.3	Very high	69 Å²	69	33.8 Å²	33.8	37%	0.369	18%	0.177	S	C	.	.			trans	39.1	95	178.4	-157.9	14.1	0	0	0	115.8	K752 Y844	K752-D864 IonicContact NZ-OD1 3.65Å; K752-D864 PolarHBondContact NZ-OD1 3.5Å; Y844-D864 PolarHBondContact OH-O 3.02Å
865	F	93.5	Very high	90.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.			trans	-101	16.7	-175	-82.9	-108.5	0	0	0	112.5	E771 I774 L775 I783 L837 Y844 L862 F867 A868	E771-F865 HydrophobicContact CG-CB 3.99Å; E771-F865 PolarHBondContact OE1-N 3.07Å; I774-F865 HydrophobicContact CG2-CD1 3.57Å; I774-F865 HydrophobicContact CG2-CE1 4.12Å; I774-F865 HydrophobicContact CG2-CG 4.42Å; L775-F865 HydrophobicContact CD1-CB 4.36Å; L775-F865 HydrophobicContact CD2-CB 4.22Å; L775-F865 HydrophobicContact CD2-CD2 3.54Å; L775-F865 HydrophobicContact CD2-CE2 4.01Å; L775-F865 HydrophobicContact CD2-CG 3.83Å; L775-F865 HydrophobicContact CG-CB 4.05Å; L775-F865 HydrophobicContact CG-CD2 4.3Å; L775-F865 HydrophobicContact CG-CG 4.19Å; I783-F865 HydrophobicContact CD1-CZ 4.37Å; I783-F865 HydrophobicContact CG1-CZ 4.39Å; I783-F865 HydrophobicContact CG2-CE2 3.75Å; I783-F865 HydrophobicContact CG2-CZ 3.6Å; L837-F865 HydrophobicContact CD1-CE1 3.76Å; L837-F865 HydrophobicContact CD1-CZ 4.08Å; L837-F865 HydrophobicContact CD2-CE1 3.84Å; L837-F865 HydrophobicContact CG-CE1 4.46Å; Y844-F865 AromaticContact CD2-CD1 3.97Å; Y844-F865 HydrophobicContact CD2-CD1 3.97Å; Y844-F865 AromaticContact CD2-CE1 3.7Å; Y844-F865 HydrophobicContact CD2-CE1 3.7Å; Y844-F865 HydrophobicContact CD2-CE2 4.42Å; Y844-F865 HydrophobicContact CD2-CG 4.45Å; Y844-F865 AromaticContact CD2-CZ 3.95Å; Y844-F865 HydrophobicContact CD2-CZ 3.95Å; Y844-F865 HydrophobicContact CE2-CD1 4.09Å; Y844-F865 AromaticContact CE2-CD2 4Å; Y844-F865 HydrophobicContact CE2-CD2 4Å; Y844-F865 AromaticContact CE2-CE1 3.96Å; Y844-F865 HydrophobicContact CE2-CE1 3.96Å; Y844-F865 AromaticContact CE2-CE2 3.86Å; Y844-F865 HydrophobicContact CE2-CE2 3.86Å; Y844-F865 HydrophobicContact CE2-CG 4.12Å; Y844-F865 AromaticContact CE2-CZ 3.84Å; Y844-F865 HydrophobicContact CE2-CZ 3.84Å; L862-F865 HydrophobicContact CB-CE2 4.33Å; L862-F865 HydrophobicContact CB-CZ 4.39Å; F865-F867 PolarHBondContact O-N 3.19Å; F865-F867 VanDerWaalsContact O-N 3.12Å; F865-A868 HydrophobicContact CB-CB 4.05Å; F865-A868 HydrophobicContact CD1-CB 3.55Å; F865-A868 HydrophobicContact CE1-CB 4.43Å; F865-A868 HydrophobicContact CG-CB 4.2Å; F865-A868 WeakPolarHBondContact O-CB 3.36Å; F865-A868 PolarHBondContact O-N 2.93Å
866	G	87.8	Confident	90	Very high	15 Å²	15	38.6 Å²	38.6	16%	0.155	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.6	-177.4	0	0	0	0	0	115.7
867	F	89.3	Confident	89.8	Confident	30 Å²	30	35.7 Å²	35.7	13%	0.132	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-0.6	173	-52.3	-17.2	0	0	0	113.6	S378 Y844 R845 D846 F865 C881	S378-F867 VanDerWaalsContact CB-CE1 3.47Å; Y844-F867 CarbonylContact O-C 3.58Å; R845-F867 HydrophobicContact CB-CB 4.43Å; R845-F867 VanDerWaalsContact CZ-O 3.23Å; R845-F867 PolarHBondContact NE-O 3.36Å; R845-F867 PolarHBondContact NH2-O 3.36Å; D846-F867 HydrophobicContact CB-CD2 3.67Å; D846-F867 HydrophobicContact CB-CE2 4.23Å; D846-F867 HydrophobicContact CB-CG 4.46Å; F865-F867 PolarHBondContact O-N 3.19Å; F865-F867 VanDerWaalsContact O-N 3.12Å; F867-C881 HydrophobicContact CD2-CB 4.3Å; F867-C881 HydrophobicContact CG-CB 4.27Å
868	A	93.6	Very high	89.4	Confident	3 Å²	3	30.3 Å²	30.3	3%	0.025	15%	0.153	C	C	.	.			trans	-66.5	144.1	176	0	0	0	0	0	109.9	I774 I842 V843 Y844 F865	I774-A868 VanDerWaalsContact CD1-C 3.5Å; I774-A868 HydrophobicContact CD1-CB 3.75Å; I774-A868 WeakPolarHBondContact CD1-O 3.23Å; I842-A868 HydrophobicContact CG2-CB 4.32Å; V843-A868 CarbonylContact O-C 3.42Å; V843-A868 VanDerWaalsContact O-CA 3.23Å; V843-A868 WeakPolarHBondContact O-CA 3.39Å; Y844-A868 HydrophobicContact CD2-CB 4.33Å; Y844-A868 PolarHBondContact O-N 3.17Å; F865-A868 HydrophobicContact CB-CB 4.05Å; F865-A868 HydrophobicContact CD1-CB 3.55Å; F865-A868 HydrophobicContact CE1-CB 4.43Å; F865-A868 HydrophobicContact CG-CB 4.2Å; F865-A868 WeakPolarHBondContact O-CB 3.36Å; F865-A868 PolarHBondContact O-N 2.93Å
869	K	92.5	Very high	88.7	Confident	36 Å²	36	30.7 Å²	30.7	16%	0.157	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	129.6	-179.2	-165.8	154.8	-173.1	162.9	0	110.8	S381 E766 I842 V843 I871	S381-K869 PolarHBondContact OG-NZ 3.33Å; E766-K869 IonicContact OE1-NZ 3.6Å; I842-K869 WeakPolarHBondContact CA-O 3.47Å; V843-K869 HydrophobicContact CG1-CB 4.34Å; V843-K869 PolarHBondContact N-O 3Å; V843-K869 PolarHBondContact O-N 3.39Å; K869-I871 HydrophobicContact CB-CG2 4.38Å; K869-I871 HydrophobicContact CG-CG2 4.2Å; K869-I871 PolarHBondContact O-N 3.17Å
870	Y	92.1	Very high	88	Confident	162 Å²	162	30.9 Å²	30.9	64%	0.635	16%	0.156	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	114.4	162.8	-175.7	-87.1	0	0	0	107.8	H840 I842	H840-Y870 WeakPolarHBondContact O-CD2 3.34Å; H840-Y870 WeakPolarHBondContact O-CE2 3.26Å; I842-Y870 HydrophobicContact CG1-CD2 4.09Å
871	I	89.2	Confident	87.4	Confident	22 Å²	22	31.1 Å²	31.1	11%	0.113	16%	0.158	C	C	.	.			trans	-109.6	-25	174.7	57.1	172.4	0	0	0	111.2	G841 V843 K869 Q875 T877 D898 F899	G841-I871 PolarHBondContact O-N 3.34Å; V843-I871 HydrophobicContact CB-CD1 4.05Å; V843-I871 HydrophobicContact CB-CG1 4.5Å; V843-I871 HydrophobicContact CG1-CD1 3.96Å; V843-I871 HydrophobicContact CG1-CG1 4.25Å; V843-I871 HydrophobicContact CG1-CG2 4.05Å; K869-I871 HydrophobicContact CB-CG2 4.38Å; K869-I871 HydrophobicContact CG-CG2 4.2Å; K869-I871 PolarHBondContact O-N 3.17Å; I871-Q875 WeakPolarHBondContact O-CB 3.44Å; I871-Q875 WeakPolarHBondContact O-CG 3.22Å; I871-T877 HydrophobicContact CG2-CG2 4.04Å; I871-D898 HydrophobicContact CD1-CB 4.17Å; I871-F899 HydrophobicContact CD1-CD1 4.17Å; I871-F899 HydrophobicContact CD1-CE1 3.67Å; I871-F899 HydrophobicContact CD1-CZ 3.95Å; I871-F899 HydrophobicContact CG1-CE1 3.69Å; I871-F899 HydrophobicContact CG1-CZ 3.86Å
872	G	80.8	Confident	86.9	Confident	9 Å²	9	30.8 Å²	30.8	9%	0.093	16%	0.157	C	C	.	.			trans	82.2	157.6	-171.7	0	0	0	0	0	112.2	G841 G874 Q875	G841-G872 PolarHBondContact O-N 3.29Å; G872-G874 PolarHBondContact O-N 3.14Å; G872-Q875 PolarHBondContact O-N 2.87Å
873	I	78.5	Confident	86.4	Confident	96 Å²	96	30.8 Å²	30.8	49%	0.492	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	127	-175.8	-53.2	176.5	0	0	0	109.6	N535	N535-I873 WeakPolarHBondContact ND2-CG2 3.33Å
874	G	71	Confident	86.2	Confident	17 Å²	17	30.2 Å²	30.2	18%	0.175	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	25.4	177.9	0	0	0	0	0	114.8	L538 G872	L538-G874 VanDerWaalsContact CD2-CA 3.49Å; L538-G874 WeakPolarHBondContact CD2-O 3.14Å; G872-G874 PolarHBondContact O-N 3.14Å
875	Q	80.1	Confident	86.4	Confident	85 Å²	85	28.1 Å²	28.1	40%	0.397	14%	0.141	S	C	.	.			trans	-116.1	168.8	170.1	-54.9	-58.9	-20.2	0	0	110.6	I871 G872	I871-Q875 WeakPolarHBondContact O-CB 3.44Å; I871-Q875 WeakPolarHBondContact O-CG 3.22Å; G872-Q875 PolarHBondContact O-N 2.87Å
876	K	85.3	Confident	86.5	Confident	27 Å²	27	28.2 Å²	28.2	12%	0.117	14%	0.141	C	C	.	.			trans	-127.4	162.9	176.9	-71.9	-177.2	176.4	-178.1	0	111.1	I516 D542 W878 H897 D898	I516-K876 HydrophobicContact CD1-CD 4.13Å; D542-K876 IonicContact OD1-NZ 3.64Å; D542-K876 PolarHBondContact OD1-NZ 3.35Å; D542-K876 VanDerWaalsContact OD2-CE 3.27Å; D542-K876 WeakPolarHBondContact OD2-CE 3.33Å; D542-K876 IonicContact OD2-NZ 2.72Å; D542-K876 PolarHBondContact OD2-NZ 3.33Å; K876-W878 HydrophobicContact CB-CH2 3.85Å; K876-W878 HydrophobicContact CB-CZ2 4.27Å; K876-W878 HydrophobicContact CB-CZ3 4.18Å; K876-W878 WeakPolarHBondContact O-CZ3 3.34Å; K876-H897 CarbonylContact C-O 3.56Å; K876-H897 VanDerWaalsContact CA-O 3.29Å; K876-H897 WeakPolarHBondContact CA-O 3.42Å; K876-D898 WeakPolarHBondContact CE-OD2 3.5Å; K876-D898 HydrophobicContact CG-CB 4.22Å
877	T	86.2	Confident	86.8	Confident	14 Å²	14	27.8 Å²	27.8	9%	0.086	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-132.2	159	170.9	-163.1	0	0	0	0	111.5	I871 G896 H897	I871-T877 HydrophobicContact CG2-CG2 4.04Å; T877-G896 WeakPolarHBondContact O-CA 3.32Å; T877-H897 WeakPolarHBondContact CG2-NE2 3.42Å; T877-H897 PolarHBondContact N-O 2.87Å; T877-H897 PolarHBondContact O-CE1 3.38Å; T877-H897 PolarHBondContact O-N 3.32Å; T877-H897 PolarHBondContact O-ND1 3.24Å
878	W	85.4	Confident	87.1	Confident	15 Å²	15	26.4 Å²	26.4	6%	0.057	13%	0.13	C	C	.	.			trans	-121.9	3.4	-173.2	-68.7	-100	0	0	0	113.1	M508 M509 L513 I516 K876 F880 N894	M508-W878 PolarHBondContact O-NE1 2.96Å; M509-W878 HydrophobicContact CB-CB 4.48Å; M509-W878 HydrophobicContact CB-CD2 4.16Å; M509-W878 HydrophobicContact CB-CE3 4.2Å; M509-W878 HydrophobicContact CB-CG 4.27Å; M509-W878 HydrophobicContact CG-CD2 4.18Å; M509-W878 HydrophobicContact CG-CE3 3.71Å; M509-W878 HydrophobicContact CG-CZ3 4.13Å; L513-W878 HydrophobicContact CD1-CZ3 4.46Å; L513-W878 HydrophobicContact CD2-CH2 3.63Å; L513-W878 HydrophobicContact CD2-CZ3 3.93Å; L513-W878 HydrophobicContact CG-CH2 3.7Å; L513-W878 HydrophobicContact CG-CZ2 4.49Å; L513-W878 HydrophobicContact CG-CZ3 3.97Å; I516-W878 HydrophobicContact CD1-CH2 4.28Å; I516-W878 HydrophobicContact CD1-CZ2 4.22Å; K876-W878 HydrophobicContact CB-CH2 3.85Å; K876-W878 HydrophobicContact CB-CZ2 4.27Å; K876-W878 HydrophobicContact CB-CZ3 4.18Å; K876-W878 WeakPolarHBondContact O-CZ3 3.34Å; W878-F880 PolarHBondContact O-N 3.34Å; W878-F880 VanDerWaalsContact O-N 3.08Å; W878-N894 PolarHBondContact O-OD1 3.47Å
879	T	80.9	Confident	87	Confident	7 Å²	7	26.3 Å²	26.3	4%	0.043	13%	0.129	C	C	.	.			trans	-69.2	106.4	175.3	-52	0	0	0	0	109.8	R845 C881 H897	R845-T879 PolarHBondContact NH1-O 3.46Å; T879-C881 PolarHBondContact O-N 2.96Å; T879-H897 PolarHBondContact O-CE1 3.44Å; T879-H897 VanDerWaalsContact O-CE1 3.31Å
880	F	83.3	Confident	86.9	Confident	11 Å²	11	25 Å²	25	5%	0.048	12%	0.123	C	C	.	.			trans	-63.1	112.7	173.9	-178	-89.9	0	0	0	110.3	V377 G379 Y480 W878 V887 V891 I892 Y929	V377-F880 HydrophobicContact CG2-CE1 3.8Å; G379-F880 PolarHBondContact N-O 3.24Å; Y480-F880 HydrophobicContact CD1-CD2 4.49Å; Y480-F880 HydrophobicContact CD1-CE1 4.1Å; Y480-F880 AromaticContact CD1-CE2 3.86Å; Y480-F880 HydrophobicContact CD1-CE2 3.86Å; Y480-F880 AromaticContact CD1-CZ 3.65Å; Y480-F880 HydrophobicContact CD1-CZ 3.65Å; Y480-F880 HydrophobicContact CE1-CE2 4.27Å; Y480-F880 HydrophobicContact CE1-CZ 4.42Å; W878-F880 PolarHBondContact O-N 3.34Å; W878-F880 VanDerWaalsContact O-N 3.08Å; F880-V887 HydrophobicContact CE2-CG1 4.01Å; F880-V887 HydrophobicContact CZ-CG1 4.34Å; F880-V891 HydrophobicContact CD2-CG1 3.86Å; F880-V891 HydrophobicContact CE2-CG1 4.24Å; F880-I892 HydrophobicContact CE2-CG1 4.39Å; F880-Y929 HydrophobicContact CZ-CE1 4.2Å; F880-Y929 HydrophobicContact CZ-CE2 4.15Å; F880-Y929 AromaticContact CZ-CZ 3.72Å
881	C	84.5	Confident	86.9	Confident	5 Å²	5	17.7 Å²	17.7	3%	0.034	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	169.9	178.8	63.8	0	0	0	0	112.1	V377 S378 R845 F867 T879	V377-C881 CarbonylContact O-C 3.52Å; V377-C881 WeakPolarHBondContact O-CA 3.41Å; S378-C881 WeakPolarHBondContact OG-CB 3.22Å; R845-C881 PolarHBondContact NH1-SG 3.04Å; F867-C881 HydrophobicContact CD2-CB 4.3Å; F867-C881 HydrophobicContact CG-CB 4.27Å; T879-C881 PolarHBondContact O-N 2.96Å
882	G	87	Confident	86.7	Confident	1 Å²	1	17 Å²	17	1%	0.01	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.8	170.9	-179.3	0	0	0	0	0	112.8	V377 R845	V377-G882 VanDerWaalsContact CG2-O 3.29Å; V377-G882 WeakPolarHBondContact CG2-O 3.45Å; V377-G882 PolarHBondContact N-O 3.31Å; V377-G882 PolarHBondContact O-N 3.31Å; R845-G882 WeakPolarHBondContact O-CA 3.4Å
883	T	89.1	Confident	86.7	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.098	C	C	.	.			trans	-78.5	127.6	177.4	-61.7	0	0	0	0	111.1	R374 G376 D846 K848 E885 Y886 V887	R374-T883 HydrophobicContact CB-CG2 3.59Å; G376-T883 WeakPolarHBondContact CA-OG1 3.13Å; D846-T883 WeakPolarHBondContact OD1-CB 3.43Å; D846-T883 PolarHBondContact OD1-N 3.1Å; D846-T883 PolarHBondContact OD1-OG1 3.12Å; K848-T883 HydrophobicContact CD-CG2 4.21Å; K848-T883 WeakPolarHBondContact CD-OG1 3.24Å; K848-T883 PolarHBondContact NZ-OG1 3.44Å; T883-E885 VanDerWaalsContact C-N 3.31Å; T883-E885 PolarHBondContact O-N 3.21Å; T883-Y886 HydrophobicContact CG2-CD2 4.37Å; T883-Y886 WeakPolarHBondContact O-CA 3.43Å; T883-Y886 WeakPolarHBondContact O-CB 3.44Å; T883-Y886 PolarHBondContact O-N 3.16Å; T883-V887 WeakPolarHBondContact O-CG2 3.12Å; T883-V887 PolarHBondContact O-N 2.84Å
884	P	90	Very high	86.7	Confident	10 Å²	10	15.3 Å²	15.3	7%	0.065	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-37.7	-162.2	-32.5	37.3	0	0	0	117.1	Y886 P925 I928 Y929	P884-Y886 PolarHBondContact O-N 2.62Å; P884-P925 HydrophobicContact CB-CB 4.21Å; P884-P925 HydrophobicContact CG-CB 4.23Å; P884-P925 HydrophobicContact CG-CG 4.37Å; P884-I928 HydrophobicContact CB-CD1 4.24Å; P884-I928 HydrophobicContact CB-CG2 4.49Å; P884-I928 WeakPolarHBondContact O-CG2 3.44Å; P884-Y929 HydrophobicContact CB-CE1 3.84Å
885	E	93.5	Very high	87	Confident	24 Å²	24	20.2 Å²	20.2	11%	0.112	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.9	178.7	-61.8	82.1	177.2	0	0	113.3	T883 P918 I928	T883-E885 VanDerWaalsContact C-N 3.31Å; T883-E885 PolarHBondContact O-N 3.21Å; E885-P918 HydrophobicContact CB-CB 3.92Å; E885-P918 HydrophobicContact CB-CG 3.72Å; E885-P918 HydrophobicContact CG-CB 4.42Å; E885-P918 HydrophobicContact CG-CG 3.7Å; E885-I928 HydrophobicContact CG-CD1 3.9Å; E885-I928 HydrophobicContact CG-CG2 4.39Å; E885-I928 VanDerWaalsContact OE1-CD1 3.32Å; E885-I928 WeakPolarHBondContact OE1-CD1 3.26Å
886	Y	96.4	Very high	87.1	Confident	3 Å²	3	16.3 Å²	16.3	1%	0.012	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-20.4	-177.7	-76.8	-93.7	0	0	0	113.7	L847 K848 P849 T883 P884 A888 W904 S905 I908 L909 E912	L847-Y886 WeakPolarHBondContact O-CD1 3.42Å; L847-Y886 WeakPolarHBondContact O-CE1 3.4Å; K848-Y886 HydrophobicContact CB-CD2 4.27Å; K848-Y886 HydrophobicContact CB-CE2 3.92Å; P849-Y886 WeakPolarHBondContact CD-OH 3.44Å; T883-Y886 HydrophobicContact CG2-CD2 4.37Å; T883-Y886 WeakPolarHBondContact O-CA 3.43Å; T883-Y886 WeakPolarHBondContact O-CB 3.44Å; T883-Y886 PolarHBondContact O-N 3.16Å; P884-Y886 PolarHBondContact O-N 2.62Å; Y886-A888 PolarHBondContact O-N 3.45Å; Y886-W904 PolarHBondContact O-NE1 2.77Å; Y886-S905 PolarHBondContact O-OG 2.92Å; Y886-I908 HydrophobicContact CD1-CB 3.59Å; Y886-I908 HydrophobicContact CD1-CG1 4.39Å; Y886-I908 HydrophobicContact CD1-CG2 3.44Å; Y886-I908 VanDerWaalsContact CD1-CG2 3.44Å; Y886-I908 HydrophobicContact CD2-CG2 4Å; Y886-I908 HydrophobicContact CE1-CB 3.65Å; Y886-I908 HydrophobicContact CE1-CG2 3.39Å; Y886-I908 HydrophobicContact CE2-CG2 3.92Å; Y886-I908 HydrophobicContact CG-CB 4.29Å; Y886-I908 HydrophobicContact CG-CG2 3.77Å; Y886-L909 HydrophobicContact CE1-CB 4.01Å; Y886-E912 PolarHBondContact OH-OE2 3.26Å
887	V	94.3	Very high	87.3	Confident	6 Å²	6	15.2 Å²	15.2	4%	0.036	8%	0.077	C	C	.	.			trans	-59.8	130.6	-177.2	-173.6	0	0	0	0	111.6	F880 T883 V891 I892 W904 Y929	F880-V887 HydrophobicContact CE2-CG1 4.01Å; F880-V887 HydrophobicContact CZ-CG1 4.34Å; T883-V887 WeakPolarHBondContact O-CG2 3.12Å; T883-V887 PolarHBondContact O-N 2.84Å; V887-V891 HydrophobicContact CG1-CB 3.61Å; V887-V891 HydrophobicContact CG1-CG1 3.69Å; V887-V891 HydrophobicContact CG1-CG2 4.36Å; V887-I892 HydrophobicContact CB-CG1 4.34Å; V887-I892 HydrophobicContact CG1-CD1 4.39Å; V887-I892 HydrophobicContact CG1-CG1 3.77Å; V887-W904 PolarHBondContact O-NE1 3.32Å; V887-Y929 HydrophobicContact CB-CE1 4.44Å; V887-Y929 HydrophobicContact CG2-CE1 4.44Å
888	A	95.2	Very high	87.6	Confident	1 Å²	1	15.6 Å²	15.6	1%	0.008	8%	0.079	C	C	.	.			trans	-78.8	153.5	-177.4	0	0	0	0	0	113.4	Y886 E890 V891 I892 A901 W904	Y886-A888 PolarHBondContact O-N 3.45Å; A888-E890 VanDerWaalsContact C-N 3.33Å; A888-E890 WeakPolarHBondContact CB-OE2 3.27Å; A888-E890 PolarHBondContact O-N 2.95Å; A888-V891 HydrophobicContact CB-CG2 4.19Å; A888-V891 WeakPolarHBondContact O-CB 3.09Å; A888-V891 PolarHBondContact O-N 3.41Å; A888-I892 PolarHBondContact O-N 3.46Å; A888-I892 VanDerWaalsContact O-N 3.16Å; A888-A901 HydrophobicContact CB-CB 4.33Å; A888-W904 HydrophobicContact CB-CB 3.83Å; A888-W904 HydrophobicContact CB-CD2 4.16Å; A888-W904 HydrophobicContact CB-CG 3.6Å
889	P	92.2	Very high	88	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-53.4	-40.8	-176.1	-28.6	35	0	0	0	115.3	V891 I892 L893 W904 T932 L933 F961	P889-V891 VanDerWaalsContact C-N 3.29Å; P889-V891 PolarHBondContact O-N 2.93Å; P889-I892 PolarHBondContact O-N 2.99Å; P889-L893 WeakPolarHBondContact O-CB 3.05Å; P889-L893 VanDerWaalsContact O-CG 3.25Å; P889-L893 WeakPolarHBondContact O-CG 3.5Å; P889-L893 PolarHBondContact O-N 3.07Å; P889-W904 HydrophobicContact CG-CE3 4.07Å; P889-W904 HydrophobicContact CG-CH2 3.68Å; P889-W904 HydrophobicContact CG-CZ2 4.14Å; P889-W904 HydrophobicContact CG-CZ3 3.62Å; P889-T932 HydrophobicContact CG-CG2 3.98Å; P889-L933 HydrophobicContact CB-CD2 4.19Å; P889-F961 HydrophobicContact CB-CD2 4.05Å; P889-F961 HydrophobicContact CB-CE2 3.95Å; P889-F961 HydrophobicContact CB-CZ 4.38Å; P889-F961 HydrophobicContact CG-CD2 4.13Å; P889-F961 HydrophobicContact CG-CE2 4.45Å
890	E	90.8	Very high	88.7	Confident	9 Å²	9	16 Å²	16	4%	0.042	8%	0.081	C	C	.	.	H	α-helix	trans	-67.6	-28	179.6	70.3	-80.6	-162.4	0	0	113	A888 N894 Q895 H897 R966	A888-E890 VanDerWaalsContact C-N 3.33Å; A888-E890 WeakPolarHBondContact CB-OE2 3.27Å; A888-E890 PolarHBondContact O-N 2.95Å; E890-N894 PolarHBondContact O-N 2.74Å; E890-N894 VanDerWaalsContact O-N 3.1Å; E890-Q895 HydrophobicContact CB-CB 4.43Å; E890-Q895 PolarHBondContact O-N 2.67Å; E890-H897 HydrophobicContact CG-CB 3.89Å; E890-R966 IonicContact OE1-CZ 2.88Å; E890-R966 IonicContact OE1-NH1 3.74Å; E890-R966 PolarHBondContact OE1-NH1 2.74Å; E890-R966 IonicContact OE1-NH2 3.76Å; E890-R966 IonicContact OE2-CZ 2.77Å; E890-R966 IonicContact OE2-NH1 2.69Å; E890-R966 PolarHBondContact OE2-NH1 3.18Å; E890-R966 IonicContact OE2-NH2 2.67Å; E890-R966 PolarHBondContact OE2-NH2 3Å
891	V	90.2	Very high	89.3	Confident	7 Å²	7	15.7 Å²	15.7	4%	0.042	8%	0.081	C	C	.	.	H	α-helix	trans	-73.6	-45.5	173.6	-170.7	0	0	0	0	109.4	F880 V887 A888 P889 L893 N894 H897 A901	F880-V891 HydrophobicContact CD2-CG1 3.86Å; F880-V891 HydrophobicContact CE2-CG1 4.24Å; V887-V891 HydrophobicContact CG1-CB 3.61Å; V887-V891 HydrophobicContact CG1-CG1 3.69Å; V887-V891 HydrophobicContact CG1-CG2 4.36Å; A888-V891 HydrophobicContact CB-CG2 4.19Å; A888-V891 WeakPolarHBondContact O-CB 3.09Å; A888-V891 PolarHBondContact O-N 3.41Å; P889-V891 VanDerWaalsContact C-N 3.29Å; P889-V891 PolarHBondContact O-N 2.93Å; V891-L893 VanDerWaalsContact C-N 3.27Å; V891-L893 PolarHBondContact O-N 3.32Å; V891-N894 PolarHBondContact O-N 2.85Å; V891-H897 HydrophobicContact CG2-CB 3.8Å; V891-A901 HydrophobicContact CG2-CB 4.47Å
892	I	85.7	Confident	90	Very high	9 Å²	9	15.5 Å²	15.5	5%	0.046	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-34.3	176.3	-63.6	164.7	0	0	0	111.9	Y480 F880 V887 A888 P889 N894 Y929 T932 L933	Y480-I892 HydrophobicContact CE1-CG2 4.18Å; F880-I892 HydrophobicContact CE2-CG1 4.39Å; V887-I892 HydrophobicContact CB-CG1 4.34Å; V887-I892 HydrophobicContact CG1-CD1 4.39Å; V887-I892 HydrophobicContact CG1-CG1 3.77Å; A888-I892 PolarHBondContact O-N 3.46Å; A888-I892 VanDerWaalsContact O-N 3.16Å; P889-I892 PolarHBondContact O-N 2.99Å; I892-N894 VanDerWaalsContact C-N 3.35Å; I892-Y929 HydrophobicContact CD1-CD1 3.71Å; I892-Y929 HydrophobicContact CD1-CG 4.21Å; I892-Y929 HydrophobicContact CG1-CD1 3.9Å; I892-Y929 HydrophobicContact CG1-CG 4.27Å; I892-Y929 HydrophobicContact CG2-CG 4.32Å; I892-T932 HydrophobicContact CD1-CG2 3.47Å; I892-T932 VanDerWaalsContact CD1-CG2 3.47Å; I892-L933 HydrophobicContact CB-CD2 4.24Å; I892-L933 HydrophobicContact CG2-CD1 3.82Å; I892-L933 HydrophobicContact CG2-CD2 3.95Å; I892-L933 HydrophobicContact CG2-CG 3.94Å
893	L	81.7	Confident	90.5	Very high	44 Å²	44	16.2 Å²	16.2	23%	0.23	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.1	176.7	-64.7	170	0	0	0	113.5	P889 V891 Q895 L933 F961	P889-L893 WeakPolarHBondContact O-CB 3.05Å; P889-L893 VanDerWaalsContact O-CG 3.25Å; P889-L893 WeakPolarHBondContact O-CG 3.5Å; P889-L893 PolarHBondContact O-N 3.07Å; V891-L893 VanDerWaalsContact C-N 3.27Å; V891-L893 PolarHBondContact O-N 3.32Å; L893-Q895 VanDerWaalsContact C-N 3.26Å; L893-Q895 HydrophobicContact CB-CG 3.82Å; L893-Q895 PolarHBondContact O-N 3.49Å; L893-L933 HydrophobicContact CD1-CD2 3.98Å; L893-L933 HydrophobicContact CD2-CD1 4.18Å; L893-L933 HydrophobicContact CD2-CD2 4Å; L893-L933 HydrophobicContact CG-CD2 3.75Å; L893-F961 HydrophobicContact CD1-CZ 3.97Å
894	N	78.3	Confident	91	Very high	24 Å²	24	16.1 Å²	16.1	13%	0.128	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	40.2	-176.4	-160.6	17.2	0	0	0	114.8	M508 W878 E890 V891 I892 G896	M508-N894 WeakPolarHBondContact CB-ND2 3.43Å; M508-N894 WeakPolarHBondContact CG-ND2 3.38Å; W878-N894 PolarHBondContact O-OD1 3.47Å; E890-N894 PolarHBondContact O-N 2.74Å; E890-N894 VanDerWaalsContact O-N 3.1Å; V891-N894 PolarHBondContact O-N 2.85Å; I892-N894 VanDerWaalsContact C-N 3.35Å; N894-G896 VanDerWaalsContact C-N 3.27Å; N894-G896 PolarHBondContact O-N 2.81Å
895	Q	77.5	Confident	91.4	Very high	121 Å²	121	16 Å²	16	57%	0.565	8%	0.08	S	C	*	.	S	Bend	trans	-85	1.9	-177.1	-67.4	179.5	-12.3	0	0	113.6	E890 L893	E890-Q895 HydrophobicContact CB-CB 4.43Å; E890-Q895 PolarHBondContact O-N 2.67Å; L893-Q895 VanDerWaalsContact C-N 3.26Å; L893-Q895 HydrophobicContact CB-CG 3.82Å; L893-Q895 PolarHBondContact O-N 3.49Å
896	G	82.3	Confident	91.6	Very high	3 Å²	3	14.9 Å²	14.9	3%	0.031	8%	0.075	C	C	.	.			trans	82.4	133.1	-168.2	0	0	0	0	0	111.4	T877 N894	T877-G896 WeakPolarHBondContact O-CA 3.32Å; N894-G896 VanDerWaalsContact C-N 3.27Å; N894-G896 PolarHBondContact O-N 2.81Å
897	H	89.9	Confident	91.7	Very high	3 Å²	3	14.7 Å²	14.7	1%	0.014	8%	0.075	C	C	.	.	B	Isolated β-bridge	trans	-130.8	157.2	-175.9	61.3	-85.3	0	0	0	113.1	R845 K876 T877 T879 E890 V891 A901	R845-H897 VanDerWaalsContact CD-NE2 3.28Å; R845-H897 WeakPolarHBondContact CD-NE2 3.22Å; R845-H897 PolarHBondContact NH1-NE2 3.12Å; K876-H897 CarbonylContact C-O 3.56Å; K876-H897 VanDerWaalsContact CA-O 3.29Å; K876-H897 WeakPolarHBondContact CA-O 3.42Å; T877-H897 WeakPolarHBondContact CG2-NE2 3.42Å; T877-H897 PolarHBondContact N-O 2.87Å; T877-H897 PolarHBondContact O-CE1 3.38Å; T877-H897 PolarHBondContact O-N 3.32Å; T877-H897 PolarHBondContact O-ND1 3.24Å; T879-H897 PolarHBondContact O-CE1 3.44Å; T879-H897 VanDerWaalsContact O-CE1 3.31Å; E890-H897 HydrophobicContact CG-CB 3.89Å; V891-H897 HydrophobicContact CG2-CB 3.8Å; H897-A901 HydrophobicContact CB-CB 4.49Å
898	D	91.4	Very high	91.8	Very high	23 Å²	23	14.4 Å²	14.4	12%	0.123	7%	0.073	C	C	.	.			trans	-139	-161.7	-177.9	58.5	44.4	0	0	0	110.4	I871 K876 A900 A901	I871-D898 HydrophobicContact CD1-CB 4.17Å; K876-D898 WeakPolarHBondContact CE-OD2 3.5Å; K876-D898 HydrophobicContact CG-CB 4.22Å; D898-A900 PolarHBondContact O-N 2.68Å; D898-A900 WeakPolarHBondContact OD1-CB 3.41Å; D898-A900 PolarHBondContact OD1-N 3.24Å; D898-A901 WeakPolarHBondContact O-CB 3.49Å; D898-A901 PolarHBondContact O-N 2.95Å
899	F	94.5	Very high	92	Very high	28 Å²	28	14.4 Å²	14.4	12%	0.123	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-21	177.5	-46.1	-49.8	0	0	0	114.9	H838 V843 I871 A901 D902	H838-F899 HydrophobicContact CB-CD1 4.33Å; H838-F899 HydrophobicContact CB-CG 4.19Å; H838-F899 AromaticContact CD2-CD1 3.69Å; H838-F899 AromaticContact CD2-CG 3.99Å; H838-F899 AromaticContact CG-CG 3.92Å; V843-F899 HydrophobicContact CB-CD1 3.89Å; V843-F899 HydrophobicContact CB-CE1 4.18Å; V843-F899 HydrophobicContact CG2-CD1 4.34Å; I871-F899 HydrophobicContact CD1-CD1 4.17Å; I871-F899 HydrophobicContact CD1-CE1 3.67Å; I871-F899 HydrophobicContact CD1-CZ 3.95Å; I871-F899 HydrophobicContact CG1-CE1 3.69Å; I871-F899 HydrophobicContact CG1-CZ 3.86Å; F899-A901 PolarHBondContact O-N 2.84Å; F899-D902 PolarHBondContact O-N 3.47Å
900	A	94.8	Very high	92.3	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-66.4	-19	175.5	0	0	0	0	0	113.6	D898 W904 R966 V969	D898-A900 PolarHBondContact O-N 2.68Å; D898-A900 WeakPolarHBondContact OD1-CB 3.41Å; D898-A900 PolarHBondContact OD1-N 3.24Å; A900-W904 PolarHBondContact O-N 3.02Å; A900-R966 WeakPolarHBondContact O-CD 3.48Å; A900-R966 PolarHBondContact O-NH1 3.46Å; A900-V969 HydrophobicContact CB-CG2 3.59Å
901	A	96.9	Very high	92.5	Very high	6 Å²	6	14.8 Å²	14.8	5%	0.05	7%	0.074	C	C	.	.	H	α-helix	trans	-66.6	-41.2	172.8	0	0	0	0	0	111.4	A888 V891 H897 D898 F899 Y903 W904 S905	A888-A901 HydrophobicContact CB-CB 4.33Å; V891-A901 HydrophobicContact CG2-CB 4.47Å; H897-A901 HydrophobicContact CB-CB 4.49Å; D898-A901 WeakPolarHBondContact O-CB 3.49Å; D898-A901 PolarHBondContact O-N 2.95Å; F899-A901 PolarHBondContact O-N 2.84Å; A901-Y903 VanDerWaalsContact C-N 3.3Å; A901-Y903 PolarHBondContact O-N 2.91Å; A901-W904 WeakPolarHBondContact O-CB 3.35Å; A901-W904 PolarHBondContact O-N 3.21Å; A901-W904 VanDerWaalsContact O-N 3.12Å; A901-S905 PolarHBondContact O-N 3.3Å; A901-S905 PolarHBondContact O-OG 3.3Å
902	D	98.1	Very high	92.8	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-68.3	-29.8	178.2	-70.7	-42.9	0	0	0	112.2	L834 H838 V843 Y844 R845 F899 S905 L906	L834-D902 HydrophobicContact CD1-CB 4.3Å; L834-D902 HydrophobicContact CD2-CB 3.88Å; H838-D902 IonicContact NE2-OD2 3.24Å; V843-D902 WeakPolarHBondContact CG2-OD2 3.4Å; Y844-D902 PolarHBondContact N-OD2 2.85Å; R845-D902 WeakPolarHBondContact CA-OD1 3.38Å; R845-D902 PolarHBondContact N-OD1 2.98Å; F899-D902 PolarHBondContact O-N 3.47Å; D902-S905 PolarHBondContact O-N 2.89Å; D902-L906 WeakPolarHBondContact O-CB 3.24Å; D902-L906 PolarHBondContact O-N 2.92Å
903	Y	98.2	Very high	93.4	Very high	16 Å²	16	14.1 Å²	14.1	6%	0.063	7%	0.07	C	C	.	.	H	α-helix	trans	-69	-34	170.8	-56.5	-33.1	0	0	0	112.9	H838 A901 G907 L958 G968 V969 I974 I977	H838-Y903 AromaticContact CE1-CE1 3.39Å; H838-Y903 WeakPolarHBondContact CE1-CE1 3.47Å; H838-Y903 AromaticContact CE1-CZ 3.66Å; H838-Y903 AromaticContact ND1-CE1 3.57Å; H838-Y903 AromaticContact ND1-CZ 3.48Å; H838-Y903 PolarHBondContact ND1-OH 3.36Å; H838-Y903 VanDerWaalsContact ND1-OH 3.07Å; A901-Y903 VanDerWaalsContact C-N 3.3Å; A901-Y903 PolarHBondContact O-N 2.91Å; Y903-G907 PolarHBondContact O-N 3.19Å; Y903-L958 WeakPolarHBondContact O-CB 3.17Å; Y903-L958 WeakPolarHBondContact O-CD2 3.3Å; Y903-G968 WeakPolarHBondContact CE2-O 3.39Å; Y903-G968 PolarHBondContact OH-O 2.97Å; Y903-V969 HydrophobicContact CD2-CG2 3.69Å; Y903-V969 HydrophobicContact CE2-CG2 3.93Å; Y903-I974 HydrophobicContact CE1-CD1 4.06Å; Y903-I977 HydrophobicContact CD1-CD1 3.57Å; Y903-I977 HydrophobicContact CE1-CD1 3.83Å; Y903-I977 HydrophobicContact CG-CD1 4.12Å
904	W	98.3	Very high	94.1	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62.9	-49.6	169.9	168.7	-80.1	0	0	0	110.2	Y886 V887 A888 P889 A900 A901 L906 G907 I908 F920 T932 C959	Y886-W904 PolarHBondContact O-NE1 2.77Å; V887-W904 PolarHBondContact O-NE1 3.32Å; A888-W904 HydrophobicContact CB-CB 3.83Å; A888-W904 HydrophobicContact CB-CD2 4.16Å; A888-W904 HydrophobicContact CB-CG 3.6Å; P889-W904 HydrophobicContact CG-CE3 4.07Å; P889-W904 HydrophobicContact CG-CH2 3.68Å; P889-W904 HydrophobicContact CG-CZ2 4.14Å; P889-W904 HydrophobicContact CG-CZ3 3.62Å; A900-W904 PolarHBondContact O-N 3.02Å; A901-W904 WeakPolarHBondContact O-CB 3.35Å; A901-W904 PolarHBondContact O-N 3.21Å; A901-W904 VanDerWaalsContact O-N 3.12Å; W904-L906 VanDerWaalsContact C-N 3.28Å; W904-L906 PolarHBondContact O-N 2.72Å; W904-G907 WeakPolarHBondContact O-CA 3.45Å; W904-G907 PolarHBondContact O-N 2.76Å; W904-I908 HydrophobicContact CZ2-CD1 4.17Å; W904-I908 PolarHBondContact O-N 3.3Å; W904-I908 VanDerWaalsContact O-N 3.12Å; W904-F920 AromaticContact CH2-CE2 3.96Å; W904-F920 HydrophobicContact CH2-CE2 3.96Å; W904-F920 HydrophobicContact CH2-CZ 4.15Å; W904-F920 HydrophobicContact CZ2-CD2 4.28Å; W904-F920 AromaticContact CZ2-CE2 3.5Å; W904-F920 HydrophobicContact CZ2-CE2 3.5Å; W904-F920 VanDerWaalsContact CZ2-CE2 3.5Å; W904-F920 HydrophobicContact CZ2-CZ 4.14Å; W904-T932 HydrophobicContact CH2-CG2 4.16Å; W904-T932 HydrophobicContact CZ2-CG2 3.63Å; W904-C959 HydrophobicContact CD2-CB 4.44Å; W904-C959 VanDerWaalsContact CE3-CA 3.5Å; W904-C959 HydrophobicContact CE3-CB 3.95Å; W904-C959 HydrophobicContact CH2-CB 4.2Å; W904-C959 HydrophobicContact CZ3-CB 3.82Å; W904-C959 WeakPolarHBondContact CZ3-O 3.38Å
905	S	98.4	Very high	94.8	Very high	7 Å²	7	12.5 Å²	12.5	5%	0.049	6%	0.063	C	C	.	.	H	α-helix	trans	-58.8	-35.9	177.8	-56.3	0	0	0	0	112.9	Y886 A901 D902 G907 I908 L909	Y886-S905 PolarHBondContact O-OG 2.92Å; A901-S905 PolarHBondContact O-N 3.3Å; A901-S905 PolarHBondContact O-OG 3.3Å; D902-S905 PolarHBondContact O-N 2.89Å; S905-G907 VanDerWaalsContact C-N 3.28Å; S905-G907 PolarHBondContact O-N 3.36Å; S905-I908 WeakPolarHBondContact O-CB 3.49Å; S905-I908 PolarHBondContact O-N 3.48Å; S905-L909 WeakPolarHBondContact O-CB 3.36Å; S905-L909 PolarHBondContact O-N 2.9Å
906	L	98.6	Very high	95.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62.7	-33.1	173	-175.4	69.9	0	0	0	112.4	L827 C830 I831 L847 D902 W904 L909 T910 L958 I977	L827-L906 HydrophobicContact CD2-CD1 3.65Å; L827-L906 HydrophobicContact CD2-CG 4.48Å; C830-L906 HydrophobicContact CB-CD1 4.46Å; I831-L906 HydrophobicContact CD1-CD2 4.14Å; I831-L906 HydrophobicContact CG1-CD1 4.23Å; I831-L906 HydrophobicContact CG1-CD2 3.77Å; L847-L906 HydrophobicContact CD2-CB 4.17Å; L847-L906 HydrophobicContact CD2-CD1 4.25Å; D902-L906 WeakPolarHBondContact O-CB 3.24Å; D902-L906 PolarHBondContact O-N 2.92Å; W904-L906 VanDerWaalsContact C-N 3.28Å; W904-L906 PolarHBondContact O-N 2.72Å; L906-L909 HydrophobicContact CD1-CD2 4.46Å; L906-T910 WeakPolarHBondContact O-CB 3.49Å; L906-T910 PolarHBondContact O-N 2.74Å; L906-T910 PolarHBondContact O-OG1 2.85Å; L906-L958 HydrophobicContact CB-CD1 4.35Å; L906-L958 HydrophobicContact CD2-CD1 4.11Å; L906-L958 HydrophobicContact CD2-CD2 4.25Å; L906-L958 HydrophobicContact CG-CD1 4.07Å; L906-I977 HydrophobicContact CD2-CD1 4.01Å; L906-I977 HydrophobicContact CD2-CG2 4.05Å
907	G	98.1	Very high	96	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-71.1	-40.4	173.9	0	0	0	0	0	112.7	Y903 W904 S905 T910 F911	Y903-G907 PolarHBondContact O-N 3.19Å; W904-G907 WeakPolarHBondContact O-CA 3.45Å; W904-G907 PolarHBondContact O-N 2.76Å; S905-G907 VanDerWaalsContact C-N 3.28Å; S905-G907 PolarHBondContact O-N 3.36Å; G907-T910 PolarHBondContact O-N 3.23Å; G907-F911 PolarHBondContact O-N 3.17Å; G907-F911 VanDerWaalsContact O-N 3.11Å
908	I	97.9	Very high	96.2	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.4	-48	171.7	-55.7	-56.3	0	0	0	110.3	Y886 W904 S905 T910 F911 E912 P918 P919 F920	Y886-I908 HydrophobicContact CD1-CB 3.59Å; Y886-I908 HydrophobicContact CD1-CG1 4.39Å; Y886-I908 HydrophobicContact CD1-CG2 3.44Å; Y886-I908 VanDerWaalsContact CD1-CG2 3.44Å; Y886-I908 HydrophobicContact CD2-CG2 4Å; Y886-I908 HydrophobicContact CE1-CB 3.65Å; Y886-I908 HydrophobicContact CE1-CG2 3.39Å; Y886-I908 HydrophobicContact CE2-CG2 3.92Å; Y886-I908 HydrophobicContact CG-CB 4.29Å; Y886-I908 HydrophobicContact CG-CG2 3.77Å; W904-I908 HydrophobicContact CZ2-CD1 4.17Å; W904-I908 PolarHBondContact O-N 3.3Å; W904-I908 VanDerWaalsContact O-N 3.12Å; S905-I908 WeakPolarHBondContact O-CB 3.49Å; S905-I908 PolarHBondContact O-N 3.48Å; I908-T910 VanDerWaalsContact C-N 3.34Å; I908-T910 PolarHBondContact O-N 3.31Å; I908-F911 WeakPolarHBondContact O-CB 3.22Å; I908-F911 PolarHBondContact O-N 2.59Å; I908-F911 VanDerWaalsContact O-N 3.15Å; I908-E912 PolarHBondContact O-N 2.82Å; I908-P918 HydrophobicContact CG2-CB 4.04Å; I908-P919 HydrophobicContact CD1-CG 3.68Å; I908-F920 HydrophobicContact CD1-CD2 3.82Å; I908-F920 HydrophobicContact CD1-CE2 3.71Å
909	L	98.1	Very high	96.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-58	-44.5	176.1	-178.9	66.1	0	0	0	111.7	L827 L847 P849 M852 Y886 S905 L906 F911 E912 L913	L827-L909 HydrophobicContact CD2-CD2 3.87Å; L827-L909 HydrophobicContact CD2-CG 4.07Å; L847-L909 HydrophobicContact CD1-CD2 3.98Å; L847-L909 HydrophobicContact CD2-CD2 4.06Å; L847-L909 HydrophobicContact CG-CD2 4.03Å; P849-L909 HydrophobicContact CG-CD1 3.82Å; M852-L909 HydrophobicContact CE-CD2 4.02Å; M852-L909 HydrophobicContact SD-CD1 3.94Å; M852-L909 HydrophobicContact SD-CD2 3.56Å; M852-L909 VanDerWaalsContact SD-CD2 3.56Å; M852-L909 HydrophobicContact SD-CG 4.4Å; Y886-L909 HydrophobicContact CE1-CB 4.01Å; S905-L909 WeakPolarHBondContact O-CB 3.36Å; S905-L909 PolarHBondContact O-N 2.9Å; L906-L909 HydrophobicContact CD1-CD2 4.46Å; L909-F911 VanDerWaalsContact C-N 3.29Å; L909-F911 PolarHBondContact O-N 3.05Å; L909-E912 PolarHBondContact O-N 3.41Å; L909-L913 HydrophobicContact CD1-CD1 3.93Å; L909-L913 HydrophobicContact CD1-CD2 4.18Å; L909-L913 HydrophobicContact CD1-CG 3.87Å; L909-L913 HydrophobicContact CD2-CD1 4.41Å; L909-L913 HydrophobicContact CG-CD1 3.81Å; L909-L913 HydrophobicContact CG-CG 4.14Å; L909-L913 WeakPolarHBondContact O-CB 3.49Å; L909-L913 VanDerWaalsContact O-CG 3.28Å; L909-L913 WeakPolarHBondContact O-CG 3.21Å; L909-L913 PolarHBondContact O-N 3.43Å
910	T	98.1	Very high	96.2	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.2	-38.5	178	-54.5	0	0	0	0	111.8	L827 L906 G907 I908 L914 F954 I955 Y982	L827-T910 HydrophobicContact CD1-CG2 3.74Å; L827-T910 WeakPolarHBondContact CD1-OG1 3.35Å; L827-T910 WeakPolarHBondContact CD2-OG1 3.41Å; L906-T910 WeakPolarHBondContact O-CB 3.49Å; L906-T910 PolarHBondContact O-N 2.74Å; L906-T910 PolarHBondContact O-OG1 2.85Å; G907-T910 PolarHBondContact O-N 3.23Å; I908-T910 VanDerWaalsContact C-N 3.34Å; I908-T910 PolarHBondContact O-N 3.31Å; T910-L914 HydrophobicContact CG2-CD1 4.16Å; T910-L914 WeakPolarHBondContact O-CD1 3.32Å; T910-L914 VanDerWaalsContact O-CG 3.26Å; T910-L914 WeakPolarHBondContact O-CG 3.45Å; T910-L914 PolarHBondContact O-N 2.99Å; T910-F954 HydrophobicContact CG2-CD1 3.97Å; T910-F954 HydrophobicContact CG2-CE1 4.3Å; T910-I955 HydrophobicContact CG2-CD1 4.13Å; T910-I955 HydrophobicContact CG2-CG1 3.87Å; T910-Y982 HydrophobicContact CG2-CE1 4.15Å
911	F	96.7	Very high	95.9	Very high	18 Å²	18	9.6 Å²	9.6	8%	0.079	6%	0.058	C	C	.	.	H	α-helix	trans	-66.9	-47	175.2	-176.4	-84	0	0	0	111.6	G907 I908 L909 L914 T915 A917 P919 L941 I947 I955	G907-F911 PolarHBondContact O-N 3.17Å; G907-F911 VanDerWaalsContact O-N 3.11Å; I908-F911 WeakPolarHBondContact O-CB 3.22Å; I908-F911 PolarHBondContact O-N 2.59Å; I908-F911 VanDerWaalsContact O-N 3.15Å; L909-F911 VanDerWaalsContact C-N 3.29Å; L909-F911 PolarHBondContact O-N 3.05Å; F911-L914 PolarHBondContact O-N 3.2Å; F911-T915 WeakPolarHBondContact CD1-OG1 3.47Å; F911-T915 HydrophobicContact CE1-CG2 4.27Å; F911-T915 VanDerWaalsContact CE1-OG1 3.28Å; F911-T915 WeakPolarHBondContact CE1-OG1 3.4Å; F911-T915 HydrophobicContact CE2-CG2 4.36Å; F911-T915 HydrophobicContact CZ-CG2 4.16Å; F911-T915 WeakPolarHBondContact O-CB 3.46Å; F911-T915 WeakPolarHBondContact O-CG2 3.5Å; F911-T915 PolarHBondContact O-N 2.91Å; F911-T915 PolarHBondContact O-OG1 2.87Å; F911-A917 VanDerWaalsContact CD1-O 3.27Å; F911-A917 WeakPolarHBondContact CD1-O 3.43Å; F911-A917 VanDerWaalsContact CE1-O 3.29Å; F911-A917 WeakPolarHBondContact CE1-O 3.28Å; F911-P919 HydrophobicContact CB-CG 4.25Å; F911-P919 HydrophobicContact CD1-CB 3.73Å; F911-P919 VanDerWaalsContact CD1-CD 3.46Å; F911-P919 HydrophobicContact CD1-CG 4Å; F911-P919 HydrophobicContact CD2-CB 4.2Å; F911-P919 HydrophobicContact CE1-CB 3.86Å; F911-P919 HydrophobicContact CE2-CB 4.35Å; F911-P919 HydrophobicContact CG-CB 3.9Å; F911-P919 HydrophobicContact CG-CG 4.06Å; F911-P919 HydrophobicContact CZ-CB 4.17Å; F911-L941 HydrophobicContact CD2-CD1 4.23Å; F911-L941 HydrophobicContact CD2-CD2 4.49Å; F911-L941 HydrophobicContact CE2-CD1 4.21Å; F911-L941 HydrophobicContact CE2-CD2 3.7Å; F911-L941 HydrophobicContact CE2-CG 4.49Å; F911-L941 HydrophobicContact CZ-CD2 4.27Å; F911-I947 HydrophobicContact CD2-CD1 3.48Å; F911-I947 VanDerWaalsContact CD2-CD1 3.48Å; F911-I947 HydrophobicContact CE2-CD1 3.4Å; F911-I947 VanDerWaalsContact CE2-CD1 3.4Å; F911-I947 HydrophobicContact CZ-CD1 4.4Å; F911-I955 HydrophobicContact CB-CD1 4.1Å; F911-I955 HydrophobicContact CD2-CD1 4.29Å
912	E	96.4	Very high	95.3	Very high	2 Å²	2	10.3 Å²	10.3	1%	0.009	6%	0.064	C	C	.	.	H	α-helix	trans	-64.7	-46.6	-178.1	174.3	149.5	-156.2	0	0	112.5	R374 L812 P849 Y886 I908 L909 L914 T915 G916 P918	R374-E912 IonicContact CZ-OE1 3.75Å; R374-E912 VanDerWaalsContact CZ-OE1 3.26Å; R374-E912 IonicContact CZ-OE2 3.6Å; R374-E912 IonicContact NH1-OE1 2.82Å; R374-E912 PolarHBondContact NH1-OE1 3.17Å; R374-E912 IonicContact NH1-OE2 2.81Å; R374-E912 PolarHBondContact NH1-OE2 3.08Å; R374-E912 IonicContact NH2-OE1 2.73Å; R374-E912 PolarHBondContact NH2-OE1 2.69Å; R374-E912 IonicContact NH2-OE2 3.71Å; L812-E912 HydrophobicContact CD2-CG 3.64Å; P849-E912 HydrophobicContact CG-CG 4.46Å; Y886-E912 PolarHBondContact OH-OE2 3.26Å; I908-E912 PolarHBondContact O-N 2.82Å; L909-E912 PolarHBondContact O-N 3.41Å; E912-L914 PolarHBondContact O-N 2.99Å; E912-T915 PolarHBondContact O-N 3.08Å; E912-G916 PolarHBondContact O-N 3.17Å; E912-P918 WeakPolarHBondContact OE2-CD 3.39Å
913	L	97.3	Very high	94.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.5	-32.6	178	-64.8	174.8	0	0	0	112.4	L808 L812 L818 T823 C826 L827 P849 L909	L808-L913 HydrophobicContact CD2-CD2 3.97Å; L808-L913 HydrophobicContact CG-CD2 4.24Å; L812-L913 HydrophobicContact CD2-CD2 4.35Å; L818-L913 WeakPolarHBondContact CB-O 3.28Å; L818-L913 HydrophobicContact CD1-CB 4.4Å; L818-L913 HydrophobicContact CD1-CD2 3.81Å; L818-L913 PolarHBondContact N-O 2.86Å; T823-L913 HydrophobicContact CG2-CB 3.91Å; T823-L913 HydrophobicContact CG2-CD1 4.24Å; C826-L913 HydrophobicContact CB-CD1 4.18Å; L827-L913 HydrophobicContact CD2-CD1 4.26Å; L827-L913 HydrophobicContact CG-CD1 4.34Å; P849-L913 HydrophobicContact CG-CD2 4.33Å; L909-L913 HydrophobicContact CD1-CD1 3.93Å; L909-L913 HydrophobicContact CD1-CD2 4.18Å; L909-L913 HydrophobicContact CD1-CG 3.87Å; L909-L913 HydrophobicContact CD2-CD1 4.41Å; L909-L913 HydrophobicContact CG-CD1 3.81Å; L909-L913 HydrophobicContact CG-CG 4.14Å; L909-L913 WeakPolarHBondContact O-CB 3.49Å; L909-L913 VanDerWaalsContact O-CG 3.28Å; L909-L913 WeakPolarHBondContact O-CG 3.21Å; L909-L913 PolarHBondContact O-N 3.43Å
914	L	96.3	Very high	93.1	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-81.5	-15.4	177.7	-66.9	174.1	0	0	0	114.5	E820 T823 T910 F911 E912 Y946 I947 A951	E820-L914 HydrophobicContact CG-CD2 3.88Å; T823-L914 HydrophobicContact CG2-CD2 3.91Å; T823-L914 HydrophobicContact CG2-CG 4.04Å; T910-L914 HydrophobicContact CG2-CD1 4.16Å; T910-L914 WeakPolarHBondContact O-CD1 3.32Å; T910-L914 VanDerWaalsContact O-CG 3.26Å; T910-L914 WeakPolarHBondContact O-CG 3.45Å; T910-L914 PolarHBondContact O-N 2.99Å; F911-L914 PolarHBondContact O-N 3.2Å; E912-L914 PolarHBondContact O-N 2.99Å; L914-Y946 VanDerWaalsContact O-CB 3.24Å; L914-Y946 WeakPolarHBondContact O-CB 3.45Å; L914-I947 HydrophobicContact CB-CG1 4.37Å; L914-I947 HydrophobicContact CD1-CG1 4.36Å; L914-I947 HydrophobicContact CD1-CG2 4.47Å; L914-A951 HydrophobicContact CD1-CB 3.67Å
915	T	93.7	Very high	92.1	Very high	31 Å²	31	18.8 Å²	18.8	19%	0.19	12%	0.117	C	C	.	.	H	α-helix	trans	-136.3	-5.8	-166.4	65.3	0	0	0	0	115.6	F911 E912 A917 N944 I947	F911-T915 WeakPolarHBondContact CD1-OG1 3.47Å; F911-T915 HydrophobicContact CE1-CG2 4.27Å; F911-T915 VanDerWaalsContact CE1-OG1 3.28Å; F911-T915 WeakPolarHBondContact CE1-OG1 3.4Å; F911-T915 HydrophobicContact CE2-CG2 4.36Å; F911-T915 HydrophobicContact CZ-CG2 4.16Å; F911-T915 WeakPolarHBondContact O-CB 3.46Å; F911-T915 WeakPolarHBondContact O-CG2 3.5Å; F911-T915 PolarHBondContact O-N 2.91Å; F911-T915 PolarHBondContact O-OG1 2.87Å; E912-T915 PolarHBondContact O-N 3.08Å; T915-A917 VanDerWaalsContact C-N 3.31Å; T915-A917 PolarHBondContact O-N 2.92Å; T915-A917 PolarHBondContact OG1-O 2.88Å; T915-A917 VanDerWaalsContact OG1-O 3.05Å; T915-N944 VanDerWaalsContact CG2-ND2 3.27Å; T915-N944 WeakPolarHBondContact CG2-ND2 3.22Å; T915-I947 HydrophobicContact CG2-CD1 3.83Å; T915-I947 HydrophobicContact CG2-CG1 3.92Å
916	G	92.5	Very high	91	Very high	25 Å²	25	20.6 Å²	20.6	26%	0.258	13%	0.126	S	C	.	.	S	Bend	trans	85.3	-10.1	-179.9	0	0	0	0	0	115.6	H816 E912	H816-G916 WeakPolarHBondContact O-CA 3.28Å; H816-G916 PolarHBondContact O-N 3.34Å; E912-G916 PolarHBondContact O-N 3.17Å
917	A	92.1	Very high	90.1	Very high	12 Å²	12	25.6 Å²	25.6	10%	0.099	15%	0.148	C	C	.	.	S	Bend	trans	-156.9	154.9	-176.9	0	0	0	0	0	112.1	L370 F911 T915	L370-A917 HydrophobicContact CD2-CB 3.98Å; F911-A917 VanDerWaalsContact CD1-O 3.27Å; F911-A917 WeakPolarHBondContact CD1-O 3.43Å; F911-A917 VanDerWaalsContact CE1-O 3.29Å; F911-A917 WeakPolarHBondContact CE1-O 3.28Å; T915-A917 VanDerWaalsContact C-N 3.31Å; T915-A917 PolarHBondContact O-N 2.92Å; T915-A917 PolarHBondContact OG1-O 2.88Å; T915-A917 VanDerWaalsContact OG1-O 3.05Å
918	P	93.6	Very high	89.6	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.006	15%	0.148	C	C	.	.			trans	-73.9	160.3	-175.1	27.7	-31.7	0	0	0	112.3	E885 I908 E912 F920 Q921	E885-P918 HydrophobicContact CB-CB 3.92Å; E885-P918 HydrophobicContact CB-CG 3.72Å; E885-P918 HydrophobicContact CG-CB 4.42Å; E885-P918 HydrophobicContact CG-CG 3.7Å; I908-P918 HydrophobicContact CG2-CB 4.04Å; E912-P918 WeakPolarHBondContact OE2-CD 3.39Å; P918-F920 VanDerWaalsContact C-N 3.32Å; P918-F920 PolarHBondContact O-N 3.25Å; P918-Q921 HydrophobicContact CG-CG 3.9Å; P918-Q921 WeakPolarHBondContact O-CG 3.35Å; P918-Q921 PolarHBondContact O-NE2 3.03Å
919	P	93.3	Very high	89.1	Confident	13 Å²	13	25.9 Å²	25.9	8%	0.084	15%	0.149	C	C	.	.	S	Bend	trans	-71.6	-25.8	-175.2	27.8	-30.9	0	0	0	113	I908 F911 I936 L939	I908-P919 HydrophobicContact CD1-CG 3.68Å; F911-P919 HydrophobicContact CB-CG 4.25Å; F911-P919 HydrophobicContact CD1-CB 3.73Å; F911-P919 VanDerWaalsContact CD1-CD 3.46Å; F911-P919 HydrophobicContact CD1-CG 4Å; F911-P919 HydrophobicContact CD2-CB 4.2Å; F911-P919 HydrophobicContact CE1-CB 3.86Å; F911-P919 HydrophobicContact CE2-CB 4.35Å; F911-P919 HydrophobicContact CG-CB 3.9Å; F911-P919 HydrophobicContact CG-CG 4.06Å; F911-P919 HydrophobicContact CZ-CB 4.17Å; P919-I936 HydrophobicContact CB-CD1 4.08Å; P919-I936 HydrophobicContact CG-CD1 4.07Å; P919-L939 HydrophobicContact CB-CD1 3.6Å; P919-L939 VanDerWaalsContact O-CD1 3.28Å; P919-L939 WeakPolarHBondContact O-CD1 3.18Å
920	F	92.5	Very high	88.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-111.7	80.7	-177.9	-53.6	-67.1	0	0	0	111.4	W904 I908 P918 I928 K931 I936 L939	W904-F920 AromaticContact CH2-CE2 3.96Å; W904-F920 HydrophobicContact CH2-CE2 3.96Å; W904-F920 HydrophobicContact CH2-CZ 4.15Å; W904-F920 HydrophobicContact CZ2-CD2 4.28Å; W904-F920 AromaticContact CZ2-CE2 3.5Å; W904-F920 HydrophobicContact CZ2-CE2 3.5Å; W904-F920 VanDerWaalsContact CZ2-CE2 3.5Å; W904-F920 HydrophobicContact CZ2-CZ 4.14Å; I908-F920 HydrophobicContact CD1-CD2 3.82Å; I908-F920 HydrophobicContact CD1-CE2 3.71Å; P918-F920 VanDerWaalsContact C-N 3.32Å; P918-F920 PolarHBondContact O-N 3.25Å; F920-I928 HydrophobicContact CB-CG2 4.27Å; F920-I928 VanDerWaalsContact O-CG2 3.32Å; F920-I928 WeakPolarHBondContact O-CG2 3.05Å; F920-K931 HydrophobicContact CB-CB 4.34Å; F920-K931 HydrophobicContact CD1-CB 3.87Å; F920-I936 HydrophobicContact CE2-CD1 4.07Å; F920-I936 HydrophobicContact CZ-CB 4.33Å; F920-I936 HydrophobicContact CZ-CD1 3.85Å; F920-L939 HydrophobicContact CD1-CD1 3.79Å; F920-L939 HydrophobicContact CD1-CD2 4.45Å; F920-L939 HydrophobicContact CD1-CG 4.45Å; F920-L939 HydrophobicContact CE1-CD1 3.54Å; F920-L939 HydrophobicContact CE1-CD2 4.49Å; F920-L939 HydrophobicContact CE1-CG 4.08Å; F920-L939 HydrophobicContact CZ-CD1 4.14Å
921	Q	88.2	Confident	87.9	Confident	67 Å²	67	33.4 Å²	33.4	31%	0.313	18%	0.184	S	C	.	.			trans	-103.7	144.3	178.5	-69.4	167.3	60.4	0	0	113.2	P918 K931	P918-Q921 HydrophobicContact CG-CG 3.9Å; P918-Q921 WeakPolarHBondContact O-CG 3.35Å; P918-Q921 PolarHBondContact O-NE2 3.03Å; Q921-K931 WeakPolarHBondContact O-CE 3.4Å; Q921-K931 PolarHBondContact O-NZ 3.18Å
922	A	85.1	Confident	87.6	Confident	21 Å²	21	32.6 Å²	32.6	17%	0.174	18%	0.18	C	C	.	.			trans	-163.4	168.1	163	0	0	0	0	0	111.4	E924 K927 I928	A922-E924 PolarHBondContact O-N 3.23Å; A922-E924 VanDerWaalsContact O-N 3.12Å; A922-K927 HydrophobicContact CB-CB 3.36Å; A922-K927 HydrophobicContact CB-CD 4.24Å; A922-K927 HydrophobicContact CB-CG 4.45Å; A922-I928 HydrophobicContact CB-CG1 4.02Å
923	S	78.7	Confident	87.2	Confident	75 Å²	75	34.6 Å²	34.6	52%	0.524	19%	0.191	S	C	.	.	S	Bend	trans	-67.8	-5.7	179.6	75.2	0	0	0	0	115.9	K927	S923-K927 PolarHBondContact OG-NZ 2.69Å; S923-K927 VanDerWaalsContact OG-NZ 3.1Å
924	E	71.2	Confident	86.8	Confident	65 Å²	65	42 Å²	42	30%	0.304	22%	0.223	S	C	.	.	S	Bend	trans	-149.6	130.8	-168.4	-68.3	-81.8	-170.9	0	0	108	K459 A922 I926 K927 I928	K459-E924 IonicContact NZ-OE1 2.72Å; A922-E924 PolarHBondContact O-N 3.23Å; A922-E924 VanDerWaalsContact O-N 3.12Å; E924-I926 VanDerWaalsContact C-N 3.26Å; E924-I926 HydrophobicContact CB-CG2 4.19Å; E924-I926 PolarHBondContact O-N 3.29Å; E924-I926 VanDerWaalsContact O-N 3.16Å; E924-K927 HydrophobicContact CB-CB 4.43Å; E924-K927 HydrophobicContact CB-CD 4Å; E924-K927 HydrophobicContact CB-CG 4.07Å; E924-K927 HydrophobicContact CG-CD 4.28Å; E924-K927 WeakPolarHBondContact O-CB 3.18Å; E924-K927 PolarHBondContact O-N 2.95Å; E924-I928 PolarHBondContact O-N 3.4Å
925	P	76.8	Confident	86.4	Confident	55 Å²	55	42.3 Å²	42.3	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-53.3	-38.2	-178.4	-30.1	36.5	0	0	0	114.2	P884 K927 I928 Y929	P884-P925 HydrophobicContact CB-CB 4.21Å; P884-P925 HydrophobicContact CG-CB 4.23Å; P884-P925 HydrophobicContact CG-CG 4.37Å; P925-K927 VanDerWaalsContact C-N 3.26Å; P925-K927 PolarHBondContact O-N 3.23Å; P925-I928 WeakPolarHBondContact O-CA 3.48Å; P925-I928 WeakPolarHBondContact O-CB 3.48Å; P925-I928 PolarHBondContact O-N 2.95Å; P925-Y929 HydrophobicContact CB-CE2 3.96Å; P925-Y929 VanDerWaalsContact O-CD2 3.3Å; P925-Y929 WeakPolarHBondContact O-CD2 3.4Å; P925-Y929 VanDerWaalsContact O-CG 3.28Å; P925-Y929 PolarHBondContact O-N 3.43Å
926	I	75.2	Confident	86.2	Confident	45 Å²	45	41 Å²	41	23%	0.231	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-33.6	176.7	-171.7	58.5	0	0	0	113.1	L410 L476 Y480 E924 Y929 M930	L410-I926 HydrophobicContact CD2-CD1 3.99Å; L476-I926 HydrophobicContact CD2-CB 4.34Å; L476-I926 HydrophobicContact CD2-CD1 3.66Å; L476-I926 HydrophobicContact CD2-CG1 3.79Å; Y480-I926 HydrophobicContact CD2-CD1 4.21Å; Y480-I926 HydrophobicContact CE2-CD1 3.53Å; E924-I926 VanDerWaalsContact C-N 3.26Å; E924-I926 HydrophobicContact CB-CG2 4.19Å; E924-I926 PolarHBondContact O-N 3.29Å; E924-I926 VanDerWaalsContact O-N 3.16Å; I926-Y929 HydrophobicContact CD1-CD2 4.48Å; I926-M930 HydrophobicContact CD1-CE 4.37Å; I926-M930 WeakPolarHBondContact O-CB 3.46Å; I926-M930 WeakPolarHBondContact O-CG 3.36Å; I926-M930 PolarHBondContact O-N 3.18Å
927	K	81.3	Confident	85.9	Confident	105 Å²	105	43.8 Å²	43.8	46%	0.457	23%	0.227	S	C	.	.	H	α-helix	trans	-75.2	-28.1	176.2	-64.2	176	-167.4	167.7	0	111.6	A922 S923 E924 P925 K931	A922-K927 HydrophobicContact CB-CB 3.36Å; A922-K927 HydrophobicContact CB-CD 4.24Å; A922-K927 HydrophobicContact CB-CG 4.45Å; S923-K927 PolarHBondContact OG-NZ 2.69Å; S923-K927 VanDerWaalsContact OG-NZ 3.1Å; E924-K927 HydrophobicContact CB-CB 4.43Å; E924-K927 HydrophobicContact CB-CD 4Å; E924-K927 HydrophobicContact CB-CG 4.07Å; E924-K927 HydrophobicContact CG-CD 4.28Å; E924-K927 WeakPolarHBondContact O-CB 3.18Å; E924-K927 PolarHBondContact O-N 2.95Å; P925-K927 VanDerWaalsContact C-N 3.26Å; P925-K927 PolarHBondContact O-N 3.23Å; K927-K931 WeakPolarHBondContact O-CG 3.41Å; K927-K931 PolarHBondContact O-N 3.36Å
928	I	87.2	Confident	85.3	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-66.9	-53.6	170.7	-67.5	164.8	0	0	0	109.2	P884 E885 F920 A922 E924 P925 M930 K931 T932	P884-I928 HydrophobicContact CB-CD1 4.24Å; P884-I928 HydrophobicContact CB-CG2 4.49Å; P884-I928 WeakPolarHBondContact O-CG2 3.44Å; E885-I928 HydrophobicContact CG-CD1 3.9Å; E885-I928 HydrophobicContact CG-CG2 4.39Å; E885-I928 VanDerWaalsContact OE1-CD1 3.32Å; E885-I928 WeakPolarHBondContact OE1-CD1 3.26Å; F920-I928 HydrophobicContact CB-CG2 4.27Å; F920-I928 VanDerWaalsContact O-CG2 3.32Å; F920-I928 WeakPolarHBondContact O-CG2 3.05Å; A922-I928 HydrophobicContact CB-CG1 4.02Å; E924-I928 PolarHBondContact O-N 3.4Å; P925-I928 WeakPolarHBondContact O-CA 3.48Å; P925-I928 WeakPolarHBondContact O-CB 3.48Å; P925-I928 PolarHBondContact O-N 2.95Å; I928-M930 VanDerWaalsContact C-N 3.28Å; I928-M930 PolarHBondContact O-N 3.11Å; I928-K931 CarbonylContact O-C 3.53Å; I928-K931 WeakPolarHBondContact O-CA 3.3Å; I928-K931 WeakPolarHBondContact O-CB 3.34Å; I928-K931 PolarHBondContact O-N 3.5Å; I928-T932 PolarHBondContact O-N 2.81Å; I928-T932 PolarHBondContact O-OG1 3.16Å
929	Y	86.2	Confident	84.5	Confident	3 Å²	3	49.3 Å²	49.3	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-42	177.5	-54.6	-32.2	0	0	0	112.1	Y480 F880 P884 V887 I892 P925 I926 K931 T932 L933	Y480-Y929 AromaticContact CD1-CD2 3.7Å; Y480-Y929 HydrophobicContact CD1-CD2 3.7Å; Y480-Y929 AromaticContact CD1-CE2 3.49Å; Y480-Y929 HydrophobicContact CD1-CE2 3.49Å; Y480-Y929 VanDerWaalsContact CD1-CE2 3.49Å; Y480-Y929 HydrophobicContact CD2-CD2 4.31Å; Y480-Y929 HydrophobicContact CD2-CE2 4.3Å; Y480-Y929 AromaticContact CE1-CD2 3.7Å; Y480-Y929 HydrophobicContact CE1-CD2 3.7Å; Y480-Y929 AromaticContact CE1-CE2 4Å; Y480-Y929 HydrophobicContact CE1-CE2 4Å; Y480-Y929 HydrophobicContact CE1-CG 4.46Å; Y480-Y929 HydrophobicContact CE2-CD2 4.3Å; Y480-Y929 HydrophobicContact CG-CD2 4.02Å; Y480-Y929 AromaticContact CG-CE2 3.66Å; Y480-Y929 HydrophobicContact CG-CE2 3.66Å; F880-Y929 HydrophobicContact CZ-CE1 4.2Å; F880-Y929 HydrophobicContact CZ-CE2 4.15Å; F880-Y929 AromaticContact CZ-CZ 3.72Å; P884-Y929 HydrophobicContact CB-CE1 3.84Å; V887-Y929 HydrophobicContact CB-CE1 4.44Å; V887-Y929 HydrophobicContact CG2-CE1 4.44Å; I892-Y929 HydrophobicContact CD1-CD1 3.71Å; I892-Y929 HydrophobicContact CD1-CG 4.21Å; I892-Y929 HydrophobicContact CG1-CD1 3.9Å; I892-Y929 HydrophobicContact CG1-CG 4.27Å; I892-Y929 HydrophobicContact CG2-CG 4.32Å; P925-Y929 HydrophobicContact CB-CE2 3.96Å; P925-Y929 VanDerWaalsContact O-CD2 3.3Å; P925-Y929 WeakPolarHBondContact O-CD2 3.4Å; P925-Y929 VanDerWaalsContact O-CG 3.28Å; P925-Y929 PolarHBondContact O-N 3.43Å; I926-Y929 HydrophobicContact CD1-CD2 4.48Å; Y929-K931 PolarHBondContact O-N 3.11Å; Y929-T932 PolarHBondContact O-N 3.41Å; Y929-L933 WeakPolarHBondContact O-CG 3.35Å; Y929-L933 PolarHBondContact O-N 3.14Å
930	M	83.6	Confident	83.6	Confident	71 Å²	71	51 Å²	51	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-68.9	-13.7	175.3	-72.7	-68	163.4	0	0	115.1	L410 I926 I928 K934	L410-M930 HydrophobicContact CD2-CE 3.27Å; L410-M930 HydrophobicContact CG-CE 4.5Å; I926-M930 HydrophobicContact CD1-CE 4.37Å; I926-M930 WeakPolarHBondContact O-CB 3.46Å; I926-M930 WeakPolarHBondContact O-CG 3.36Å; I926-M930 PolarHBondContact O-N 3.18Å; I928-M930 VanDerWaalsContact C-N 3.28Å; I928-M930 PolarHBondContact O-N 3.11Å; M930-K934 WeakPolarHBondContact O-CD 3.22Å; M930-K934 VanDerWaalsContact O-CE 3.26Å; M930-K934 WeakPolarHBondContact O-CE 3.27Å; M930-K934 WeakPolarHBondContact O-CG 3.34Å
931	K	88.5	Confident	82.8	Confident	87 Å²	87	52 Å²	52	38%	0.378	29%	0.289	S	S	.	.	H	α-helix	trans	-88.5	-45.4	166	-72.4	-180	172.8	-171	0	110.8	F920 Q921 K927 I928 Y929 L933 K934	F920-K931 HydrophobicContact CB-CB 4.34Å; F920-K931 HydrophobicContact CD1-CB 3.87Å; Q921-K931 WeakPolarHBondContact O-CE 3.4Å; Q921-K931 PolarHBondContact O-NZ 3.18Å; K927-K931 WeakPolarHBondContact O-CG 3.41Å; K927-K931 PolarHBondContact O-N 3.36Å; I928-K931 CarbonylContact O-C 3.53Å; I928-K931 WeakPolarHBondContact O-CA 3.3Å; I928-K931 WeakPolarHBondContact O-CB 3.34Å; I928-K931 PolarHBondContact O-N 3.5Å; Y929-K931 PolarHBondContact O-N 3.11Å; K931-L933 VanDerWaalsContact C-N 3.3Å; K931-L933 PolarHBondContact O-N 3.43Å; K931-K934 WeakPolarHBondContact O-CB 3.39Å; K931-K934 PolarHBondContact O-N 3.45Å
932	T	90.2	Very high	82	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-52.9	-45.5	175.1	-63.7	0	0	0	0	112.2	P889 I892 W904 I928 Y929 K934 G935	P889-T932 HydrophobicContact CG-CG2 3.98Å; I892-T932 HydrophobicContact CD1-CG2 3.47Å; I892-T932 VanDerWaalsContact CD1-CG2 3.47Å; W904-T932 HydrophobicContact CH2-CG2 4.16Å; W904-T932 HydrophobicContact CZ2-CG2 3.63Å; I928-T932 PolarHBondContact O-N 2.81Å; I928-T932 PolarHBondContact O-OG1 3.16Å; Y929-T932 PolarHBondContact O-N 3.41Å; T932-K934 PolarHBondContact O-N 3.3Å; T932-K934 VanDerWaalsContact O-N 3.16Å; T932-G935 PolarHBondContact O-N 3.03Å
933	L	88.7	Confident	81.3	Confident	45 Å²	45	60.6 Å²	60.6	24%	0.236	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-8	178.3	-66	-178.7	0	0	0	114.8	P889 I892 L893 Y929 K931 F961	P889-L933 HydrophobicContact CB-CD2 4.19Å; I892-L933 HydrophobicContact CB-CD2 4.24Å; I892-L933 HydrophobicContact CG2-CD1 3.82Å; I892-L933 HydrophobicContact CG2-CD2 3.95Å; I892-L933 HydrophobicContact CG2-CG 3.94Å; L893-L933 HydrophobicContact CD1-CD2 3.98Å; L893-L933 HydrophobicContact CD2-CD1 4.18Å; L893-L933 HydrophobicContact CD2-CD2 4Å; L893-L933 HydrophobicContact CG-CD2 3.75Å; Y929-L933 WeakPolarHBondContact O-CG 3.35Å; Y929-L933 PolarHBondContact O-N 3.14Å; K931-L933 VanDerWaalsContact C-N 3.3Å; K931-L933 PolarHBondContact O-N 3.43Å; L933-F961 HydrophobicContact CD2-CE2 4.4Å
934	K	88.1	Confident	81.4	Confident	154 Å²	154	59.2 Å²	59.2	67%	0.67	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.4	169.1	-64.6	172.2	-176.5	175.2	0	112.6	M930 K931 T932 A938	M930-K934 WeakPolarHBondContact O-CD 3.22Å; M930-K934 VanDerWaalsContact O-CE 3.26Å; M930-K934 WeakPolarHBondContact O-CE 3.27Å; M930-K934 WeakPolarHBondContact O-CG 3.34Å; K931-K934 WeakPolarHBondContact O-CB 3.39Å; K931-K934 PolarHBondContact O-N 3.45Å; T932-K934 PolarHBondContact O-N 3.3Å; T932-K934 VanDerWaalsContact O-N 3.16Å; K934-A938 HydrophobicContact CB-CB 4.03Å
935	G	88.4	Confident	82.1	Confident	10 Å²	10	64.4 Å²	64.4	10%	0.103	35%	0.349	C	S	.	.			trans	80.4	158.6	178.7	0	0	0	0	0	114.2	T932 D937 A938	T932-G935 PolarHBondContact O-N 3.03Å; G935-D937 PolarHBondContact O-N 2.8Å; G935-A938 WeakPolarHBondContact O-CB 3.45Å; G935-A938 PolarHBondContact O-N 2.88Å
936	I	89.3	Confident	82.7	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-60	-30.2	-177.7	-162.2	70.7	0	0	0	113	P919 F920 A938 L939 L941 I955 R956 C959	P919-I936 HydrophobicContact CB-CD1 4.08Å; P919-I936 HydrophobicContact CG-CD1 4.07Å; F920-I936 HydrophobicContact CE2-CD1 4.07Å; F920-I936 HydrophobicContact CZ-CB 4.33Å; F920-I936 HydrophobicContact CZ-CD1 3.85Å; I936-A938 PolarHBondContact O-N 3.1Å; I936-L939 HydrophobicContact CD1-CD1 4.32Å; I936-L939 PolarHBondContact O-N 2.86Å; I936-L941 HydrophobicContact CD1-CD1 3.86Å; I936-L941 HydrophobicContact CG1-CD1 3.72Å; I936-I955 HydrophobicContact CD1-CG2 4.21Å; I936-I955 HydrophobicContact CG1-CG2 4.18Å; I936-R956 HydrophobicContact CG2-CG 4.42Å; I936-C959 HydrophobicContact CB-CB 3.82Å; I936-C959 HydrophobicContact CD1-CB 4.13Å; I936-C959 HydrophobicContact CG1-CB 3.92Å; I936-C959 HydrophobicContact CG2-CB 4.02Å; I936-C959 WeakPolarHBondContact CG2-O 3.22Å
937	D	85.4	Confident	83.5	Confident	82 Å²	82	65.1 Å²	65.1	44%	0.439	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-68.3	-19.8	-178.9	-71.7	-18.7	0	0	0	113.1	G935 L939 R956 R960	G935-D937 PolarHBondContact O-N 2.8Å; D937-L939 VanDerWaalsContact C-N 3.27Å; D937-L939 PolarHBondContact O-N 3.27Å; D937-R956 IonicContact OD1-CZ 3.73Å; D937-R956 IonicContact OD1-NE 2.68Å; D937-R956 PolarHBondContact OD1-NE 3.12Å; D937-R956 IonicContact OD1-NH2 2.76Å; D937-R956 PolarHBondContact OD1-NH2 2.82Å; D937-R956 IonicContact OD2-NH2 3.95Å; D937-R956 PolarHBondContact OD2-NH2 2.83Å; D937-R960 IonicContact OD2-NH1 2.7Å
938	A	79.1	Confident	84.1	Confident	68 Å²	68	62 Å²	62	56%	0.562	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-77.4	-6	179.3	0	0	0	0	0	114.4	K934 G935 I936	K934-A938 HydrophobicContact CB-CB 4.03Å; G935-A938 WeakPolarHBondContact O-CB 3.45Å; G935-A938 PolarHBondContact O-N 2.88Å; I936-A938 PolarHBondContact O-N 3.1Å
939	L	77.6	Confident	84.4	Confident	61 Å²	61	67.6 Å²	67.6	32%	0.319	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-97.4	-0.9	-172.1	-64.6	178	0	0	0	115.2	P919 F920 I936 D937 L941	P919-L939 HydrophobicContact CB-CD1 3.6Å; P919-L939 VanDerWaalsContact O-CD1 3.28Å; P919-L939 WeakPolarHBondContact O-CD1 3.18Å; F920-L939 HydrophobicContact CD1-CD1 3.79Å; F920-L939 HydrophobicContact CD1-CD2 4.45Å; F920-L939 HydrophobicContact CD1-CG 4.45Å; F920-L939 HydrophobicContact CE1-CD1 3.54Å; F920-L939 HydrophobicContact CE1-CD2 4.49Å; F920-L939 HydrophobicContact CE1-CG 4.08Å; F920-L939 HydrophobicContact CZ-CD1 4.14Å; I936-L939 HydrophobicContact CD1-CD1 4.32Å; I936-L939 PolarHBondContact O-N 2.86Å; D937-L939 VanDerWaalsContact C-N 3.27Å; D937-L939 PolarHBondContact O-N 3.27Å; L939-L941 VanDerWaalsContact C-N 3.28Å; L939-L941 HydrophobicContact CB-CD2 3.44Å; L939-L941 VanDerWaalsContact CB-CD2 3.44Å; L939-L941 HydrophobicContact CB-CG 4.01Å; L939-L941 HydrophobicContact CD1-CD2 4.14Å; L939-L941 HydrophobicContact CG-CD2 4.48Å; L939-L941 PolarHBondContact O-N 3.15Å
940	G	74.7	Confident	84.8	Confident	48 Å²	48	71.1 Å²	71.1	50%	0.495	38%	0.38	S	S	.	.			trans	67	23.1	176	0	0	0	0	0	115.2	A942 Q943	G940-A942 PolarHBondContact O-N 3.42Å; G940-Q943 PolarHBondContact O-N 2.89Å
941	L	75.4	Confident	85.4	Confident	21 Å²	21	67.8 Å²	67.8	11%	0.11	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-53.8	-18.7	-165.8	-57.5	-168.4	0	0	0	116.9	F911 I936 L939 Q943 N944 L952 I955	F911-L941 HydrophobicContact CD2-CD1 4.23Å; F911-L941 HydrophobicContact CD2-CD2 4.49Å; F911-L941 HydrophobicContact CE2-CD1 4.21Å; F911-L941 HydrophobicContact CE2-CD2 3.7Å; F911-L941 HydrophobicContact CE2-CG 4.49Å; F911-L941 HydrophobicContact CZ-CD2 4.27Å; I936-L941 HydrophobicContact CD1-CD1 3.86Å; I936-L941 HydrophobicContact CG1-CD1 3.72Å; L939-L941 VanDerWaalsContact C-N 3.28Å; L939-L941 HydrophobicContact CB-CD2 3.44Å; L939-L941 VanDerWaalsContact CB-CD2 3.44Å; L939-L941 HydrophobicContact CB-CG 4.01Å; L939-L941 HydrophobicContact CD1-CD2 4.14Å; L939-L941 HydrophobicContact CG-CD2 4.48Å; L939-L941 PolarHBondContact O-N 3.15Å; L941-Q943 PolarHBondContact O-N 2.87Å; L941-Q943 VanDerWaalsContact O-N 3.13Å; L941-N944 PolarHBondContact O-N 2.89Å; L941-L952 HydrophobicContact CB-CD1 3.62Å; L941-L952 HydrophobicContact CD1-CD1 4.37Å; L941-I955 HydrophobicContact CD1-CG2 4.44Å
942	A	70.8	Confident	85.7	Confident	85 Å²	85	64.5 Å²	64.5	70%	0.702	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-64.1	-12.9	-179.1	0	0	0	0	0	114.6	G940 L952	G940-A942 PolarHBondContact O-N 3.42Å; A942-L952 HydrophobicContact CB-CD2 4.04Å
943	Q	70.1	Confident	85.9	Confident	185 Å²	185	68.4 Å²	68.4	86%	0.864	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-92.5	-1.7	178	-65.6	177.4	-16.6	0	0	113.7	G940 L941 K945	G940-Q943 PolarHBondContact O-N 2.89Å; L941-Q943 PolarHBondContact O-N 2.87Å; L941-Q943 VanDerWaalsContact O-N 3.13Å; Q943-K945 PolarHBondContact O-N 2.91Å
944	N	81.4	Confident	86.3	Confident	46 Å²	46	66.2 Å²	66.2	25%	0.246	36%	0.356	C	S	.	.			trans	-80.8	111	-177.7	-169.7	-33.5	0	0	0	112	T915 L941 Y946 I947	T915-N944 VanDerWaalsContact CG2-ND2 3.27Å; T915-N944 WeakPolarHBondContact CG2-ND2 3.22Å; L941-N944 PolarHBondContact O-N 2.89Å; N944-Y946 PolarHBondContact O-N 3.49Å; N944-Y946 WeakPolarHBondContact OD1-CD2 3.27Å; N944-Y946 PolarHBondContact OD1-N 3.1Å; N944-I947 HydrophobicContact CB-CD1 4.06Å; N944-I947 HydrophobicContact CB-CG1 4.21Å; N944-I947 PolarHBondContact O-N 3.23Å; N944-I947 VanDerWaalsContact O-N 3.14Å
945	K	87	Confident	86.7	Confident	174 Å²	174	58.9 Å²	58.9	76%	0.757	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-20.8	-178.5	70.1	179.9	-174	178	0	115.7	Q943	Q943-K945 PolarHBondContact O-N 2.91Å
946	Y	88.2	Confident	87.1	Confident	98 Å²	98	63.5 Å²	63.5	38%	0.384	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.6	-178.2	-59.6	-75.6	0	0	0	113.9	H817 L914 N944	H817-Y946 AromaticContact CD2-CD1 3.36Å; H817-Y946 WeakPolarHBondContact CD2-CD1 3.37Å; H817-Y946 AromaticContact CD2-CE1 3.38Å; H817-Y946 WeakPolarHBondContact CD2-CE1 3.28Å; H817-Y946 AromaticContact NE2-CD1 3.67Å; H817-Y946 AromaticContact NE2-CE1 3.31Å; H817-Y946 VanDerWaalsContact NE2-CE1 3.31Å; H817-Y946 WeakPolarHBondContact NE2-CE1 3.22Å; L914-Y946 VanDerWaalsContact O-CB 3.24Å; L914-Y946 WeakPolarHBondContact O-CB 3.45Å; N944-Y946 PolarHBondContact O-N 3.49Å; N944-Y946 WeakPolarHBondContact OD1-CD2 3.27Å; N944-Y946 PolarHBondContact OD1-N 3.1Å
947	I	92	Very high	87.3	Confident	16 Å²	16	68.2 Å²	68.2	8%	0.082	36%	0.356	C	S	.	.	S	Bend	trans	-110.2	108.6	-172.8	-55.5	-178.7	0	0	0	109.3	F911 L914 T915 N944 A951 L952 I955	F911-I947 HydrophobicContact CD2-CD1 3.48Å; F911-I947 VanDerWaalsContact CD2-CD1 3.48Å; F911-I947 HydrophobicContact CE2-CD1 3.4Å; F911-I947 VanDerWaalsContact CE2-CD1 3.4Å; F911-I947 HydrophobicContact CZ-CD1 4.4Å; L914-I947 HydrophobicContact CB-CG1 4.37Å; L914-I947 HydrophobicContact CD1-CG1 4.36Å; L914-I947 HydrophobicContact CD1-CG2 4.47Å; T915-I947 HydrophobicContact CG2-CD1 3.83Å; T915-I947 HydrophobicContact CG2-CG1 3.92Å; N944-I947 HydrophobicContact CB-CD1 4.06Å; N944-I947 HydrophobicContact CB-CG1 4.21Å; N944-I947 PolarHBondContact O-N 3.23Å; N944-I947 VanDerWaalsContact O-N 3.14Å; I947-A951 HydrophobicContact CG2-CB 3.69Å; I947-L952 HydrophobicContact CG2-CB 3.9Å; I947-I955 HydrophobicContact CD1-CD1 4.35Å; I947-I955 HydrophobicContact CG2-CD1 4.13Å
948	S	93.7	Very high	87.9	Confident	40 Å²	40	64.3 Å²	64.3	28%	0.28	34%	0.335	S	S	.	.			trans	-63.1	159	174.1	74.2	0	0	0	0	111.8	E820 K950 A951 L952	E820-S948 WeakPolarHBondContact OE1-CB 3.34Å; E820-S948 PolarHBondContact OE1-N 3.47Å; E820-S948 PolarHBondContact OE1-OG 2.7Å; E820-S948 PolarHBondContact OE2-OG 3.19Å; S948-K950 PolarHBondContact O-N 2.93Å; S948-K950 PolarHBondContact OG-N 2.71Å; S948-A951 PolarHBondContact O-N 3.12Å; S948-A951 PolarHBondContact OG-N 3.06Å; S948-L952 WeakPolarHBondContact O-CB 3.11Å; S948-L952 PolarHBondContact O-N 2.72Å
949	L	93.1	Very high	88.8	Confident	120 Å²	120	61.1 Å²	61.1	63%	0.628	31%	0.309	S	S	*	.	H	α-helix	trans	-54.4	-28.8	174	-176.8	60.7	0	0	0	112.8	Q953	L949-Q953 WeakPolarHBondContact O-CB 3.49Å; L949-Q953 VanDerWaalsContact O-CG 3.24Å; L949-Q953 WeakPolarHBondContact O-CG 3.49Å; L949-Q953 PolarHBondContact O-N 3.2Å; L949-Q953 VanDerWaalsContact O-N 3.09Å
950	K	95.4	Very high	89.5	Confident	78 Å²	78	62.5 Å²	62.5	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-72.2	-44.5	175.5	-69.9	179.3	163.2	-154.1	0	112.1	S948 F954 K981 Y982	S948-K950 PolarHBondContact O-N 2.93Å; S948-K950 PolarHBondContact OG-N 2.71Å; K950-F954 WeakPolarHBondContact O-CB 3.48Å; K950-F954 PolarHBondContact O-N 2.93Å; K950-F954 VanDerWaalsContact O-N 3.12Å; K950-K981 WeakPolarHBondContact CD-O 3.41Å; K950-K981 WeakPolarHBondContact CE-O 3.49Å; K950-K981 PolarHBondContact NZ-O 2.95Å; K950-K981 VanDerWaalsContact NZ-O 3.08Å; K950-Y982 HydrophobicContact CB-CD2 4.08Å
951	A	96.2	Very high	90.2	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-43.6	174.4	0	0	0	0	0	111.4	E820 L914 I947 S948 Q953 F954 I955 Y982	E820-A951 WeakPolarHBondContact OE1-CB 3.46Å; L914-A951 HydrophobicContact CD1-CB 3.67Å; I947-A951 HydrophobicContact CG2-CB 3.69Å; S948-A951 PolarHBondContact O-N 3.12Å; S948-A951 PolarHBondContact OG-N 3.06Å; A951-Q953 PolarHBondContact O-N 3.46Å; A951-F954 WeakPolarHBondContact O-CB 3.3Å; A951-F954 PolarHBondContact O-N 3.3Å; A951-F954 VanDerWaalsContact O-N 3.09Å; A951-I955 WeakPolarHBondContact O-CG1 3.34Å; A951-I955 PolarHBondContact O-N 2.76Å; A951-Y982 HydrophobicContact CB-CD2 4.06Å; A951-Y982 HydrophobicContact CB-CE2 3.61Å
952	L	94.7	Very high	90.7	Very high	18 Å²	18	66.4 Å²	66.4	9%	0.094	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-44.1	177.1	179.4	62.1	0	0	0	112.1	L941 A942 I947 S948 F954 R956	L941-L952 HydrophobicContact CB-CD1 3.62Å; L941-L952 HydrophobicContact CD1-CD1 4.37Å; A942-L952 HydrophobicContact CB-CD2 4.04Å; I947-L952 HydrophobicContact CG2-CB 3.9Å; S948-L952 WeakPolarHBondContact O-CB 3.11Å; S948-L952 PolarHBondContact O-N 2.72Å; L952-F954 VanDerWaalsContact C-N 3.3Å; L952-F954 PolarHBondContact O-N 3.03Å; L952-R956 HydrophobicContact CD1-CG 4.17Å; L952-R956 WeakPolarHBondContact O-CB 3.38Å; L952-R956 WeakPolarHBondContact O-CG 3.32Å; L952-R956 PolarHBondContact O-N 3.14Å
953	Q	94.8	Very high	91.6	Very high	82 Å²	82	63.1 Å²	63.1	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-65	-33.8	175	-75.7	175.2	10.4	0	0	112.4	L949 A951 R957	L949-Q953 WeakPolarHBondContact O-CB 3.49Å; L949-Q953 VanDerWaalsContact O-CG 3.24Å; L949-Q953 WeakPolarHBondContact O-CG 3.49Å; L949-Q953 PolarHBondContact O-N 3.2Å; L949-Q953 VanDerWaalsContact O-N 3.09Å; A951-Q953 PolarHBondContact O-N 3.46Å; Q953-R957 WeakPolarHBondContact O-CB 3.49Å; Q953-R957 WeakPolarHBondContact O-CG 3.35Å; Q953-R957 PolarHBondContact O-N 2.79Å
954	F	97.1	Very high	92.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.1	-52.5	176.3	-174.4	-116.5	0	0	0	111.2	L827 T910 K950 A951 L952 R956 R957 L958 L967 I977 H980 Y982 F983	L827-F954 HydrophobicContact CD1-CE1 4.44Å; T910-F954 HydrophobicContact CG2-CD1 3.97Å; T910-F954 HydrophobicContact CG2-CE1 4.3Å; K950-F954 WeakPolarHBondContact O-CB 3.48Å; K950-F954 PolarHBondContact O-N 2.93Å; K950-F954 VanDerWaalsContact O-N 3.12Å; A951-F954 WeakPolarHBondContact O-CB 3.3Å; A951-F954 PolarHBondContact O-N 3.3Å; A951-F954 VanDerWaalsContact O-N 3.09Å; L952-F954 VanDerWaalsContact C-N 3.3Å; L952-F954 PolarHBondContact O-N 3.03Å; F954-R956 PolarHBondContact O-N 3.36Å; F954-R957 PolarHBondContact O-N 3.47Å; F954-R957 VanDerWaalsContact O-N 3.11Å; F954-L958 HydrophobicContact CD1-CD1 3.82Å; F954-L958 HydrophobicContact CD2-CD1 4.32Å; F954-L958 HydrophobicContact CE1-CD1 3.45Å; F954-L958 VanDerWaalsContact CE1-CD1 3.45Å; F954-L958 HydrophobicContact CE2-CD1 4.01Å; F954-L958 HydrophobicContact CG-CD1 4.25Å; F954-L958 HydrophobicContact CZ-CD1 3.55Å; F954-L958 HydrophobicContact CZ-CG 4.49Å; F954-L958 PolarHBondContact O-N 2.81Å; F954-L967 HydrophobicContact CD2-CD2 3.6Å; F954-L967 HydrophobicContact CE2-CD2 3.59Å; F954-I977 HydrophobicContact CE2-CG2 3.61Å; F954-I977 HydrophobicContact CZ-CG2 3.62Å; F954-H980 HydrophobicContact CD2-CB 3.9Å; F954-H980 AromaticContact CD2-CG 3.64Å; F954-H980 AromaticContact CD2-ND1 3.41Å; F954-H980 WeakPolarHBondContact CD2-ND1 3.2Å; F954-H980 HydrophobicContact CE2-CB 4.17Å; F954-H980 AromaticContact CG-ND1 3.89Å; F954-H980 PolarHBondContact N-CE1 3.37Å; F954-Y982 HydrophobicContact CB-CD1 4.37Å; F954-Y982 HydrophobicContact CB-CG 4.45Å; F954-Y982 AromaticContact CD1-CD1 3.76Å; F954-Y982 HydrophobicContact CD1-CD1 3.76Å; F954-Y982 HydrophobicContact CD1-CE1 4.22Å; F954-Y982 HydrophobicContact CE1-CD1 4.14Å; F954-Y982 HydrophobicContact CG-CD1 4.06Å; F954-F983 HydrophobicContact CE1-CE2 4.18Å; F954-F983 HydrophobicContact CE2-CD2 4.37Å; F954-F983 AromaticContact CE2-CE2 3.88Å; F954-F983 HydrophobicContact CE2-CE2 3.88Å; F954-F983 HydrophobicContact CZ-CD2 4.45Å; F954-F983 AromaticContact CZ-CE2 3.55Å; F954-F983 HydrophobicContact CZ-CE2 3.55Å; F954-F983 HydrophobicContact CZ-CZ 4.35Å
955	I	97.1	Very high	92.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.6	-48	177.1	-65.1	161	0	0	0	110.8	T910 F911 I936 L941 I947 A951 R957 L958 C959	T910-I955 HydrophobicContact CG2-CD1 4.13Å; T910-I955 HydrophobicContact CG2-CG1 3.87Å; F911-I955 HydrophobicContact CB-CD1 4.1Å; F911-I955 HydrophobicContact CD2-CD1 4.29Å; I936-I955 HydrophobicContact CD1-CG2 4.21Å; I936-I955 HydrophobicContact CG1-CG2 4.18Å; L941-I955 HydrophobicContact CD1-CG2 4.44Å; I947-I955 HydrophobicContact CD1-CD1 4.35Å; I947-I955 HydrophobicContact CG2-CD1 4.13Å; A951-I955 WeakPolarHBondContact O-CG1 3.34Å; A951-I955 PolarHBondContact O-N 2.76Å; I955-R957 VanDerWaalsContact C-N 3.26Å; I955-R957 PolarHBondContact O-N 2.9Å; I955-L958 PolarHBondContact O-N 3.34Å; I955-C959 WeakPolarHBondContact O-CB 3.49Å; I955-C959 PolarHBondContact O-N 2.85Å
956	R	95.2	Very high	92.9	Very high	106 Å²	106	48.2 Å²	48.2	40%	0.4	22%	0.219	S	C	.	.	H	α-helix	trans	-67.4	-19.8	180	-69	-178.3	74.1	-168.2	0.6	114.3	I936 D937 L952 F954	I936-R956 HydrophobicContact CG2-CG 4.42Å; D937-R956 IonicContact OD1-CZ 3.73Å; D937-R956 IonicContact OD1-NE 2.68Å; D937-R956 PolarHBondContact OD1-NE 3.12Å; D937-R956 IonicContact OD1-NH2 2.76Å; D937-R956 PolarHBondContact OD1-NH2 2.82Å; D937-R956 IonicContact OD2-NH2 3.95Å; D937-R956 PolarHBondContact OD2-NH2 2.83Å; L952-R956 HydrophobicContact CD1-CG 4.17Å; L952-R956 WeakPolarHBondContact O-CB 3.38Å; L952-R956 WeakPolarHBondContact O-CG 3.32Å; L952-R956 PolarHBondContact O-N 3.14Å; F954-R956 PolarHBondContact O-N 3.36Å
957	R	95.1	Very high	93.1	Very high	105 Å²	105	43.6 Å²	43.6	40%	0.396	20%	0.201	S	C	.	.	H	α-helix	trans	-91	-25.5	173.5	-72.3	-172.6	69.2	-170.1	-2.1	113.5	Q953 F954 I955 R966 L967	Q953-R957 WeakPolarHBondContact O-CB 3.49Å; Q953-R957 WeakPolarHBondContact O-CG 3.35Å; Q953-R957 PolarHBondContact O-N 2.79Å; F954-R957 PolarHBondContact O-N 3.47Å; F954-R957 VanDerWaalsContact O-N 3.11Å; I955-R957 VanDerWaalsContact C-N 3.26Å; I955-R957 PolarHBondContact O-N 2.9Å; R957-R966 WeakPolarHBondContact O-CA 3.16Å; R957-L967 HydrophobicContact CB-CB 4.04Å; R957-L967 VanDerWaalsContact NH2-CD1 3.31Å; R957-L967 PolarHBondContact O-N 3.24Å
958	L	97.5	Very high	93	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-78	-48.8	171.2	-74.6	172.7	0	0	0	111.1	Y903 L906 F954 I955 R960 R966 L967 I977	Y903-L958 WeakPolarHBondContact O-CB 3.17Å; Y903-L958 WeakPolarHBondContact O-CD2 3.3Å; L906-L958 HydrophobicContact CB-CD1 4.35Å; L906-L958 HydrophobicContact CD2-CD1 4.11Å; L906-L958 HydrophobicContact CD2-CD2 4.25Å; L906-L958 HydrophobicContact CG-CD1 4.07Å; F954-L958 HydrophobicContact CD1-CD1 3.82Å; F954-L958 HydrophobicContact CD2-CD1 4.32Å; F954-L958 HydrophobicContact CE1-CD1 3.45Å; F954-L958 VanDerWaalsContact CE1-CD1 3.45Å; F954-L958 HydrophobicContact CE2-CD1 4.01Å; F954-L958 HydrophobicContact CG-CD1 4.25Å; F954-L958 HydrophobicContact CZ-CD1 3.55Å; F954-L958 HydrophobicContact CZ-CG 4.49Å; F954-L958 PolarHBondContact O-N 2.81Å; I955-L958 PolarHBondContact O-N 3.34Å; L958-R960 PolarHBondContact O-N 2.86Å; L958-R966 VanDerWaalsContact O-CD 3.29Å; L958-R966 WeakPolarHBondContact O-CD 3.35Å; L958-R966 VanDerWaalsContact O-CG 3.27Å; L958-R966 WeakPolarHBondContact O-CG 3.44Å; L958-L967 HydrophobicContact CD2-CB 3.98Å; L958-L967 HydrophobicContact CD2-CD2 4.34Å; L958-L967 HydrophobicContact CG-CB 4.39Å; L958-L967 HydrophobicContact CG-CD2 4.4Å; L958-I977 HydrophobicContact CD2-CD1 3.91Å; L958-I977 HydrophobicContact CD2-CG1 4.33Å
959	C	97	Very high	92.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.007	19%	0.193	C	C	.	.	S	Bend	trans	-83.2	42.6	179.2	-56.8	0	0	0	0	113.1	W904 I936 I955	W904-C959 HydrophobicContact CD2-CB 4.44Å; W904-C959 VanDerWaalsContact CE3-CA 3.5Å; W904-C959 HydrophobicContact CE3-CB 3.95Å; W904-C959 HydrophobicContact CH2-CB 4.2Å; W904-C959 HydrophobicContact CZ3-CB 3.82Å; W904-C959 WeakPolarHBondContact CZ3-O 3.38Å; I936-C959 HydrophobicContact CB-CB 3.82Å; I936-C959 HydrophobicContact CD1-CB 4.13Å; I936-C959 HydrophobicContact CG1-CB 3.92Å; I936-C959 HydrophobicContact CG2-CB 4.02Å; I936-C959 WeakPolarHBondContact CG2-O 3.22Å; I955-C959 WeakPolarHBondContact O-CB 3.49Å; I955-C959 PolarHBondContact O-N 2.85Å
960	R	93.4	Very high	91.8	Very high	89 Å²	89	37 Å²	37	34%	0.336	17%	0.166	S	C	.	.			trans	-70.1	139.5	167.4	-78.5	-65.7	-167.2	-154.2	4.3	109.8	D937 L958 E965 R966	D937-R960 IonicContact OD2-NH1 2.7Å; L958-R960 PolarHBondContact O-N 2.86Å; R960-E965 HydrophobicContact CB-CB 3.92Å; R960-E965 WeakPolarHBondContact CD-OE2 3.45Å; R960-E965 HydrophobicContact CG-CB 3.95Å; R960-E965 IonicContact NE-OE2 2.85Å; R960-R966 HydrophobicContact CB-CG 3.88Å; R960-R966 PolarHBondContact O-NE 2.55Å; R960-R966 PolarHBondContact O-NH2 3.17Å
961	F	89.6	Confident	90.7	Very high	100 Å²	100	37.8 Å²	37.8	44%	0.439	17%	0.17	S	C	.	.	S	Bend	trans	-62.8	-56.5	-177.9	-176.3	-86.5	0	0	0	110.6	P889 L893 L933 R966	P889-F961 HydrophobicContact CB-CD2 4.05Å; P889-F961 HydrophobicContact CB-CE2 3.95Å; P889-F961 HydrophobicContact CB-CZ 4.38Å; P889-F961 HydrophobicContact CG-CD2 4.13Å; P889-F961 HydrophobicContact CG-CE2 4.45Å; L893-F961 HydrophobicContact CD1-CZ 3.97Å; L933-F961 HydrophobicContact CD2-CE2 4.4Å; F961-R966 PolarHBondContact O-NH2 2.86Å
962	N	85.2	Confident	89.9	Confident	51 Å²	51	45.9 Å²	45.9	27%	0.273	20%	0.202	S	C	.	.	S	Bend	trans	-66.4	131.9	168.8	-171.9	-6.7	0	0	0	109.8	S964 E965	N962-S964 VanDerWaalsContact CG-OG 3.29Å; N962-S964 PolarHBondContact ND2-OG 3.28Å; N962-S964 PolarHBondContact OD1-N 3.1Å; N962-S964 PolarHBondContact OD1-OG 3.04Å; N962-E965 HydrophobicContact CB-CG 4.2Å; N962-E965 WeakPolarHBondContact CB-OE1 3.47Å
963	S	89.9	Confident	89.4	Confident	17 Å²	17	46.1 Å²	46.1	12%	0.119	21%	0.208	C	C	.	.	S	Bend	trans	-69	-36.9	-178.8	55.1	0	0	0	0	112.4	E965 R966 V969	S963-E965 PolarHBondContact O-N 3.01Å; S963-R966 WeakPolarHBondContact O-CB 3.49Å; S963-R966 WeakPolarHBondContact O-CG 3.41Å; S963-R966 PolarHBondContact O-N 3.49Å; S963-R966 VanDerWaalsContact O-N 3.09Å; S963-V969 WeakPolarHBondContact O-CG2 3.35Å
964	S	84.4	Confident	89.3	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.063	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22	-178.6	58.9	0	0	0	0	114.3	N962	N962-S964 VanDerWaalsContact CG-OG 3.29Å; N962-S964 PolarHBondContact ND2-OG 3.28Å; N962-S964 PolarHBondContact OD1-N 3.1Å; N962-S964 PolarHBondContact OD1-OG 3.04Å
965	E	86.5	Confident	89.1	Confident	80 Å²	80	47.4 Å²	47.4	37%	0.374	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-13.2	175.9	-71.8	-180	-131.5	0	0	114.3	R960 N962 S963	R960-E965 HydrophobicContact CB-CB 3.92Å; R960-E965 WeakPolarHBondContact CD-OE2 3.45Å; R960-E965 HydrophobicContact CG-CB 3.95Å; R960-E965 IonicContact NE-OE2 2.85Å; N962-E965 HydrophobicContact CB-CG 4.2Å; N962-E965 WeakPolarHBondContact CB-OE1 3.47Å; S963-E965 PolarHBondContact O-N 3.01Å
966	R	94.1	Very high	88.9	Confident	3 Å²	3	48.9 Å²	48.9	1%	0.011	22%	0.221	C	C	.	.	S	Bend	trans	-69.1	141.6	-169.3	-66.3	-178.7	-171.5	147.5	14.5	112.4	E890 A900 R957 L958 R960 F961 S963 G968 V969	E890-R966 IonicContact OE1-CZ 2.88Å; E890-R966 IonicContact OE1-NH1 3.74Å; E890-R966 PolarHBondContact OE1-NH1 2.74Å; E890-R966 IonicContact OE1-NH2 3.76Å; E890-R966 IonicContact OE2-CZ 2.77Å; E890-R966 IonicContact OE2-NH1 2.69Å; E890-R966 PolarHBondContact OE2-NH1 3.18Å; E890-R966 IonicContact OE2-NH2 2.67Å; E890-R966 PolarHBondContact OE2-NH2 3Å; A900-R966 WeakPolarHBondContact O-CD 3.48Å; A900-R966 PolarHBondContact O-NH1 3.46Å; R957-R966 WeakPolarHBondContact O-CA 3.16Å; L958-R966 VanDerWaalsContact O-CD 3.29Å; L958-R966 WeakPolarHBondContact O-CD 3.35Å; L958-R966 VanDerWaalsContact O-CG 3.27Å; L958-R966 WeakPolarHBondContact O-CG 3.44Å; R960-R966 HydrophobicContact CB-CG 3.88Å; R960-R966 PolarHBondContact O-NE 2.55Å; R960-R966 PolarHBondContact O-NH2 3.17Å; F961-R966 PolarHBondContact O-NH2 2.86Å; S963-R966 WeakPolarHBondContact O-CB 3.49Å; S963-R966 WeakPolarHBondContact O-CG 3.41Å; S963-R966 PolarHBondContact O-N 3.49Å; S963-R966 VanDerWaalsContact O-N 3.09Å; R966-G968 PolarHBondContact O-N 3.44Å; R966-V969 HydrophobicContact CB-CG2 3.94Å; R966-V969 WeakPolarHBondContact O-CB 3.18Å; R966-V969 PolarHBondContact O-N 3.49Å
967	L	92.9	Very high	89	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	129.8	167	-167.6	74.9	0	0	0	109.4	F954 R957 L958 E976 I977 H980	F954-L967 HydrophobicContact CD2-CD2 3.6Å; F954-L967 HydrophobicContact CE2-CD2 3.59Å; R957-L967 HydrophobicContact CB-CB 4.04Å; R957-L967 VanDerWaalsContact NH2-CD1 3.31Å; R957-L967 PolarHBondContact O-N 3.24Å; L958-L967 HydrophobicContact CD2-CB 3.98Å; L958-L967 HydrophobicContact CD2-CD2 4.34Å; L958-L967 HydrophobicContact CG-CB 4.39Å; L958-L967 HydrophobicContact CG-CD2 4.4Å; L967-E976 HydrophobicContact CD1-CB 3.84Å; L967-E976 HydrophobicContact CG-CB 4.4Å; L967-I977 HydrophobicContact CB-CG1 4.49Å; L967-I977 HydrophobicContact CD2-CB 4.42Å; L967-I977 HydrophobicContact CD2-CG1 4.12Å; L967-I977 HydrophobicContact CG-CG1 3.88Å; L967-H980 HydrophobicContact CD2-CB 4.2Å
968	G	91	Very high	89.1	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.2	-18.6	-174.7	0	0	0	0	0	114.9	Y903 R966 G973 I974	Y903-G968 WeakPolarHBondContact CE2-O 3.39Å; Y903-G968 PolarHBondContact OH-O 2.97Å; R966-G968 PolarHBondContact O-N 3.44Å; G968-G973 WeakPolarHBondContact CA-O 3.31Å; G968-G973 CarbonylContact O-C 3.26Å; G968-G973 WeakPolarHBondContact O-CA 3.3Å; G968-I974 PolarHBondContact O-N 2.93Å
969	V	86.5	Confident	88.9	Confident	29 Å²	29	44 Å²	44	18%	0.176	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-20.6	174.5	-176.5	0	0	0	0	111.7	R539 A900 Y903 S963 R966	R539-V969 PolarHBondContact NE-O 2.99Å; R539-V969 PolarHBondContact NH1-O 2.65Å; R539-V969 PolarHBondContact NH2-O 3.1Å; A900-V969 HydrophobicContact CB-CG2 3.59Å; Y903-V969 HydrophobicContact CD2-CG2 3.69Å; Y903-V969 HydrophobicContact CE2-CG2 3.93Å; S963-V969 WeakPolarHBondContact O-CG2 3.35Å; R966-V969 HydrophobicContact CB-CG2 3.94Å; R966-V969 WeakPolarHBondContact O-CB 3.18Å; R966-V969 PolarHBondContact O-N 3.49Å
970	G	74.8	Confident	89	Confident	6 Å²	6	44.5 Å²	44.5	6%	0.062	22%	0.219	C	C	.	.	S	Bend	trans	-64.8	-173.7	-171.3	0	0	0	0	0	116.5	R539 E636 Y972 G973 E976	R539-G970 PolarHBondContact NH1-O 3.16Å; E636-G970 WeakPolarHBondContact OE1-CA 3.45Å; G970-Y972 PolarHBondContact O-N 2.94Å; G970-Y972 VanDerWaalsContact O-N 3.12Å; G970-G973 WeakPolarHBondContact O-CA 3.45Å; G970-G973 PolarHBondContact O-N 3.39Å; G970-E976 WeakPolarHBondContact CA-OE1 3.28Å
971	K	71.2	Confident	89.1	Confident	95 Å²	95	46.7 Å²	46.7	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-31.6	-173.6	-174.6	169	-169.7	167	0	113.7	E636 D640 E976	E636-K971 HydrophobicContact CG-CB 3.71Å; E636-K971 PolarHBondContact OE1-N 3.42Å; D640-K971 IonicContact OD2-NZ 3.71Å; D640-K971 PolarHBondContact OD2-NZ 2.63Å; K971-E976 PolarHBondContact N-OE1 2.84Å; K971-E976 VanDerWaalsContact N-OE1 3.1Å
972	Y	80.4	Confident	89.5	Confident	170 Å²	170	42 Å²	42	67%	0.667	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.1	7	178.2	-50.1	-83.8	0	0	0	112.3	G970 Q975 E976	G970-Y972 PolarHBondContact O-N 2.94Å; G970-Y972 VanDerWaalsContact O-N 3.12Å; Y972-Q975 WeakPolarHBondContact O-CB 3.49Å; Y972-Q975 PolarHBondContact O-N 3.39Å; Y972-Q975 VanDerWaalsContact O-N 3.12Å; Y972-E976 HydrophobicContact CD2-CG 4.39Å; Y972-E976 PolarHBondContact N-OE1 3.36Å
973	G	83.9	Confident	90.1	Very high	23 Å²	23	39.9 Å²	39.9	24%	0.237	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-138.1	-178.2	0	0	0	0	0	112.3	G968 G970 Q975 E976	G968-G973 WeakPolarHBondContact CA-O 3.31Å; G968-G973 CarbonylContact O-C 3.26Å; G968-G973 WeakPolarHBondContact O-CA 3.3Å; G970-G973 WeakPolarHBondContact O-CA 3.45Å; G970-G973 PolarHBondContact O-N 3.39Å; G973-Q975 PolarHBondContact O-N 2.98Å; G973-E976 WeakPolarHBondContact O-CB 3.47Å; G973-E976 WeakPolarHBondContact O-CG 3.4Å; G973-E976 PolarHBondContact O-N 2.73Å
974	I	93.2	Very high	90.4	Very high	11 Å²	11	45.4 Å²	45.4	6%	0.056	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-14.7	177.1	-170.5	154.9	0	0	0	114.6	I831 L834 D835 Y903 G968 E976 I977 R978	I831-I974 HydrophobicContact CG2-CD1 3.99Å; I831-I974 HydrophobicContact CG2-CG1 3.97Å; I831-I974 WeakPolarHBondContact O-CD1 3.49Å; L834-I974 HydrophobicContact CB-CD1 4.23Å; D835-I974 HydrophobicContact CB-CD1 3.93Å; D835-I974 HydrophobicContact CB-CG2 4Å; D835-I974 WeakPolarHBondContact OD1-CG2 3.46Å; Y903-I974 HydrophobicContact CE1-CD1 4.06Å; G968-I974 PolarHBondContact O-N 2.93Å; I974-E976 PolarHBondContact O-N 2.77Å; I974-I977 HydrophobicContact CG1-CB 4.34Å; I974-I977 HydrophobicContact CG1-CD1 4.13Å; I974-I977 HydrophobicContact CG1-CG1 4.45Å; I974-I977 WeakPolarHBondContact O-CA 3.42Å; I974-I977 VanDerWaalsContact O-CB 3.32Å; I974-I977 WeakPolarHBondContact O-CB 3.29Å; I974-I977 PolarHBondContact O-N 2.76Å; I974-R978 PolarHBondContact O-N 2.66Å; I974-R978 VanDerWaalsContact O-N 3.14Å
975	Q	92.4	Very high	90.8	Very high	98 Å²	98	49.2 Å²	49.2	46%	0.458	26%	0.263	S	S	.	.	H	α-helix	trans	-65	-22.8	170.5	-165.7	60.4	14.6	0	0	112.7	Y972 G973 I977 R978 S979	Y972-Q975 WeakPolarHBondContact O-CB 3.49Å; Y972-Q975 PolarHBondContact O-N 3.39Å; Y972-Q975 VanDerWaalsContact O-N 3.12Å; G973-Q975 PolarHBondContact O-N 2.98Å; Q975-I977 VanDerWaalsContact C-N 3.31Å; Q975-R978 PolarHBondContact O-N 2.73Å; Q975-S979 WeakPolarHBondContact O-CB 3.34Å; Q975-S979 PolarHBondContact O-N 3.28Å; Q975-S979 PolarHBondContact O-OG 2.87Å
976	E	93.1	Very high	91.3	Very high	31 Å²	31	47 Å²	47	15%	0.145	25%	0.252	C	S	.	.	H	α-helix	trans	-68.5	-31.5	170.7	-59	-174.7	-173.7	0	0	112.1	L967 G970 K971 Y972 G973 I974 S979 H980	L967-E976 HydrophobicContact CD1-CB 3.84Å; L967-E976 HydrophobicContact CG-CB 4.4Å; G970-E976 WeakPolarHBondContact CA-OE1 3.28Å; K971-E976 PolarHBondContact N-OE1 2.84Å; K971-E976 VanDerWaalsContact N-OE1 3.1Å; Y972-E976 HydrophobicContact CD2-CG 4.39Å; Y972-E976 PolarHBondContact N-OE1 3.36Å; G973-E976 WeakPolarHBondContact O-CB 3.47Å; G973-E976 WeakPolarHBondContact O-CG 3.4Å; G973-E976 PolarHBondContact O-N 2.73Å; I974-E976 PolarHBondContact O-N 2.77Å; E976-S979 WeakPolarHBondContact CA-OG 3.22Å; E976-H980 PolarHBondContact O-N 3.12Å
977	I	96.9	Very high	91.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.5	-49.6	172.6	-55.1	-174.4	0	0	0	109	I831 Y903 L906 F954 L958 L967 I974 Q975 S979 H980 F983	I831-I977 HydrophobicContact CD1-CG2 3.51Å; I831-I977 HydrophobicContact CG1-CG2 4.01Å; Y903-I977 HydrophobicContact CD1-CD1 3.57Å; Y903-I977 HydrophobicContact CE1-CD1 3.83Å; Y903-I977 HydrophobicContact CG-CD1 4.12Å; L906-I977 HydrophobicContact CD2-CD1 4.01Å; L906-I977 HydrophobicContact CD2-CG2 4.05Å; F954-I977 HydrophobicContact CE2-CG2 3.61Å; F954-I977 HydrophobicContact CZ-CG2 3.62Å; L958-I977 HydrophobicContact CD2-CD1 3.91Å; L958-I977 HydrophobicContact CD2-CG1 4.33Å; L967-I977 HydrophobicContact CB-CG1 4.49Å; L967-I977 HydrophobicContact CD2-CB 4.42Å; L967-I977 HydrophobicContact CD2-CG1 4.12Å; L967-I977 HydrophobicContact CG-CG1 3.88Å; I974-I977 HydrophobicContact CG1-CB 4.34Å; I974-I977 HydrophobicContact CG1-CD1 4.13Å; I974-I977 HydrophobicContact CG1-CG1 4.45Å; I974-I977 WeakPolarHBondContact O-CA 3.42Å; I974-I977 VanDerWaalsContact O-CB 3.32Å; I974-I977 WeakPolarHBondContact O-CB 3.29Å; I974-I977 PolarHBondContact O-N 2.76Å; Q975-I977 VanDerWaalsContact C-N 3.31Å; I977-S979 VanDerWaalsContact C-N 3.33Å; I977-S979 PolarHBondContact O-N 2.82Å; I977-H980 WeakPolarHBondContact O-CB 3.45Å; I977-H980 PolarHBondContact O-N 2.75Å; I977-F983 WeakPolarHBondContact O-CD2 3.34Å
978	R	96.6	Very high	91.6	Very high	23 Å²	23	52.2 Å²	52.2	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-36.3	179.2	-64.9	-161.2	-177.1	86.8	-1.4	114.4	I831 E832 D835 I974 Q975 W988	I831-R978 HydrophobicContact CG2-CG 4.05Å; E832-R978 IonicContact OE1-CZ 3.58Å; E832-R978 VanDerWaalsContact OE1-CZ 3.24Å; E832-R978 IonicContact OE1-NE 2.7Å; E832-R978 PolarHBondContact OE1-NE 3.12Å; E832-R978 IonicContact OE1-NH2 3.21Å; E832-R978 PolarHBondContact OE1-NH2 2.78Å; E832-R978 IonicContact OE2-CZ 3.45Å; E832-R978 IonicContact OE2-NE 2.69Å; E832-R978 IonicContact OE2-NH2 2.73Å; E832-R978 PolarHBondContact OE2-NH2 3.12Å; D835-R978 IonicContact OD2-CZ 3.6Å; D835-R978 IonicContact OD2-NH1 2.69Å; D835-R978 PolarHBondContact OD2-NH1 3.32Å; D835-R978 IonicContact OD2-NH2 2.73Å; D835-R978 PolarHBondContact OD2-NH2 2.84Å; I974-R978 PolarHBondContact O-N 2.66Å; I974-R978 VanDerWaalsContact O-N 3.14Å; Q975-R978 PolarHBondContact O-N 2.73Å; R978-W988 HydrophobicContact CB-CD2 4.24Å; R978-W988 HydrophobicContact CB-CH2 4.45Å; R978-W988 HydrophobicContact CB-CZ2 3.88Å; R978-W988 HydrophobicContact CG-CD2 4Å; R978-W988 HydrophobicContact CG-CE3 4.03Å; R978-W988 HydrophobicContact CG-CH2 3.88Å; R978-W988 HydrophobicContact CG-CZ2 3.81Å; R978-W988 HydrophobicContact CG-CZ3 3.97Å; R978-W988 PolarHBondContact O-NE1 3.44Å; R978-W988 VanDerWaalsContact O-NE1 3.16Å
979	S	94.8	Very high	91.9	Very high	86 Å²	86	54.7 Å²	54.7	60%	0.601	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	1.2	-179.2	57.5	0	0	0	0	114.3	Q975 E976 I977	Q975-S979 WeakPolarHBondContact O-CB 3.34Å; Q975-S979 PolarHBondContact O-N 3.28Å; Q975-S979 PolarHBondContact O-OG 2.87Å; E976-S979 WeakPolarHBondContact CA-OG 3.22Å; I977-S979 VanDerWaalsContact C-N 3.33Å; I977-S979 PolarHBondContact O-N 2.82Å
980	H	97.1	Very high	92.4	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.056	29%	0.29	C	S	.	.	S	Bend	trans	-64.6	146.9	179.1	-165.7	-103	0	0	0	112.4	F954 L967 E976 I977 Y982 F983	F954-H980 HydrophobicContact CD2-CB 3.9Å; F954-H980 AromaticContact CD2-CG 3.64Å; F954-H980 AromaticContact CD2-ND1 3.41Å; F954-H980 WeakPolarHBondContact CD2-ND1 3.2Å; F954-H980 HydrophobicContact CE2-CB 4.17Å; F954-H980 AromaticContact CG-ND1 3.89Å; F954-H980 PolarHBondContact N-CE1 3.37Å; L967-H980 HydrophobicContact CD2-CB 4.2Å; E976-H980 PolarHBondContact O-N 3.12Å; I977-H980 WeakPolarHBondContact O-CB 3.45Å; I977-H980 PolarHBondContact O-N 2.75Å; H980-Y982 PolarHBondContact O-N 3.14Å; H980-F983 PolarHBondContact O-N 2.91Å
981	K	97	Very high	93.4	Very high	134 Å²	134	53.1 Å²	53.1	58%	0.583	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-56.5	-16.4	-176.4	-69.1	-175.4	177.7	-179.8	0	115.3	K950 Q984	K950-K981 WeakPolarHBondContact CD-O 3.41Å; K950-K981 WeakPolarHBondContact CE-O 3.49Å; K950-K981 PolarHBondContact NZ-O 2.95Å; K950-K981 VanDerWaalsContact NZ-O 3.08Å; K981-Q984 VanDerWaalsContact O-CB 3.28Å; K981-Q984 WeakPolarHBondContact O-CB 3.46Å
982	Y	97.5	Very high	94.5	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.008	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-70.8	-37.2	173.4	-171.1	-132.1	0	0	0	112.5	E820 R824 L827 T910 K950 A951 F954 H980 Q984	E820-Y982 HydrophobicContact CG-CE2 4.38Å; R824-Y982 WeakPolarHBondContact CD-O 3.32Å; R824-Y982 HydrophobicContact CG-CD1 3.97Å; R824-Y982 HydrophobicContact CG-CD2 4.48Å; R824-Y982 HydrophobicContact CG-CE1 3.47Å; R824-Y982 VanDerWaalsContact CG-CE1 3.47Å; R824-Y982 HydrophobicContact CG-CE2 4.03Å; R824-Y982 HydrophobicContact CG-CG 4.45Å; R824-Y982 VanDerWaalsContact CG-CZ 3.5Å; R824-Y982 PolarHBondContact NH1-O 2.74Å; R824-Y982 VanDerWaalsContact NH1-O 3.08Å; L827-Y982 HydrophobicContact CD1-CE1 4Å; T910-Y982 HydrophobicContact CG2-CE1 4.15Å; K950-Y982 HydrophobicContact CB-CD2 4.08Å; A951-Y982 HydrophobicContact CB-CD2 4.06Å; A951-Y982 HydrophobicContact CB-CE2 3.61Å; F954-Y982 HydrophobicContact CB-CD1 4.37Å; F954-Y982 HydrophobicContact CB-CG 4.45Å; F954-Y982 AromaticContact CD1-CD1 3.76Å; F954-Y982 HydrophobicContact CD1-CD1 3.76Å; F954-Y982 HydrophobicContact CD1-CE1 4.22Å; F954-Y982 HydrophobicContact CE1-CD1 4.14Å; F954-Y982 HydrophobicContact CG-CD1 4.06Å; H980-Y982 PolarHBondContact O-N 3.14Å; Y982-Q984 VanDerWaalsContact C-N 3.33Å
983	F	97.8	Very high	95.3	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.026	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-92.3	16	173.3	-64.8	-75.7	0	0	0	113.3	R824 L827 A828 I831 F954 I977 H980 G985 F986 W988	R824-F983 HydrophobicContact CB-CD1 4.33Å; R824-F983 HydrophobicContact CB-CE1 3.93Å; R824-F983 HydrophobicContact CG-CD1 4.34Å; R824-F983 HydrophobicContact CG-CE1 4.04Å; L827-F983 HydrophobicContact CB-CZ 3.99Å; A828-F983 HydrophobicContact CB-CE1 4.46Å; I831-F983 HydrophobicContact CD1-CE2 3.78Å; I831-F983 HydrophobicContact CD1-CZ 3.65Å; F954-F983 HydrophobicContact CE1-CE2 4.18Å; F954-F983 HydrophobicContact CE2-CD2 4.37Å; F954-F983 AromaticContact CE2-CE2 3.88Å; F954-F983 HydrophobicContact CE2-CE2 3.88Å; F954-F983 HydrophobicContact CZ-CD2 4.45Å; F954-F983 AromaticContact CZ-CE2 3.55Å; F954-F983 HydrophobicContact CZ-CE2 3.55Å; F954-F983 HydrophobicContact CZ-CZ 4.35Å; I977-F983 WeakPolarHBondContact O-CD2 3.34Å; H980-F983 PolarHBondContact O-N 2.91Å; F983-G985 PolarHBondContact O-N 3.29Å; F983-G985 VanDerWaalsContact O-N 3.17Å; F983-F986 HydrophobicContact CB-CB 4.06Å; F983-F986 HydrophobicContact CD1-CB 4.16Å; F983-F986 HydrophobicContact CD1-CD1 4.16Å; F983-F986 HydrophobicContact CD1-CD2 4.26Å; F983-F986 AromaticContact CD1-CG 3.92Å; F983-F986 HydrophobicContact CD1-CG 3.92Å; F983-F986 VanDerWaalsContact O-CB 3.22Å; F983-F986 WeakPolarHBondContact O-CB 3.49Å; F983-F986 PolarHBondContact O-N 2.71Å; F983-W988 HydrophobicContact CB-CZ2 3.95Å; F983-W988 HydrophobicContact CD1-CH2 4.18Å; F983-W988 AromaticContact CD1-CZ2 3.56Å; F983-W988 HydrophobicContact CD1-CZ2 3.56Å; F983-W988 AromaticContact CD2-CZ2 3.88Å; F983-W988 HydrophobicContact CD2-CZ2 3.88Å; F983-W988 HydrophobicContact CE1-CH2 4.08Å; F983-W988 AromaticContact CE1-CZ2 3.93Å; F983-W988 HydrophobicContact CE1-CZ2 3.93Å; F983-W988 HydrophobicContact CE2-CH2 4.46Å; F983-W988 HydrophobicContact CE2-CZ2 4.22Å; F983-W988 HydrophobicContact CG-CH2 4.42Å; F983-W988 AromaticContact CG-CZ2 3.53Å; F983-W988 HydrophobicContact CG-CZ2 3.53Å; F983-W988 HydrophobicContact CZ-CH2 4.24Å; F983-W988 HydrophobicContact CZ-CZ2 4.25Å
984	Q	95.7	Very high	95.8	Very high	133 Å²	133	50.1 Å²	50.1	62%	0.621	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	120.8	172.8	-175.9	-175.6	9.5	0	0	110.1	K981 Y982 F986	K981-Q984 VanDerWaalsContact O-CB 3.28Å; K981-Q984 WeakPolarHBondContact O-CB 3.46Å; Y982-Q984 VanDerWaalsContact C-N 3.33Å; Q984-F986 VanDerWaalsContact C-N 3.34Å
985	G	94.3	Very high	95.9	Very high	89 Å²	89	54.5 Å²	54.5	92%	0.918	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	16.1	-177.2	0	0	0	0	0	114.8	F983	F983-G985 PolarHBondContact O-N 3.29Å; F983-G985 VanDerWaalsContact O-N 3.17Å
986	F	96.5	Very high	96	Very high	34 Å²	34	52 Å²	52	15%	0.149	29%	0.292	C	S	.	.			trans	-89.5	134.1	176.5	-172.2	-87.6	0	0	0	111.6	R824 A828 F983 Q984 W988 I991 L996	R824-F986 HydrophobicContact CB-CD2 4.26Å; R824-F986 HydrophobicContact CB-CE2 4.16Å; A828-F986 HydrophobicContact CB-CD1 4.4Å; A828-F986 HydrophobicContact CB-CE1 3.36Å; A828-F986 HydrophobicContact CB-CE2 4.47Å; A828-F986 HydrophobicContact CB-CZ 3.41Å; A828-F986 VanDerWaalsContact CB-CZ 3.41Å; F983-F986 HydrophobicContact CB-CB 4.06Å; F983-F986 HydrophobicContact CD1-CB 4.16Å; F983-F986 HydrophobicContact CD1-CD1 4.16Å; F983-F986 HydrophobicContact CD1-CD2 4.26Å; F983-F986 AromaticContact CD1-CG 3.92Å; F983-F986 HydrophobicContact CD1-CG 3.92Å; F983-F986 VanDerWaalsContact O-CB 3.22Å; F983-F986 WeakPolarHBondContact O-CB 3.49Å; F983-F986 PolarHBondContact O-N 2.71Å; Q984-F986 VanDerWaalsContact C-N 3.34Å; F986-W988 HydrophobicContact CD1-CD2 4.06Å; F986-W988 AromaticContact CD1-CE2 3.91Å; F986-W988 HydrophobicContact CD1-CG 4.24Å; F986-W988 HydrophobicContact CD1-CZ2 4.33Å; F986-W988 HydrophobicContact CE1-CD2 4.37Å; F986-W988 PolarHBondContact O-N 2.87Å; F986-W988 VanDerWaalsContact O-N 3.16Å; F986-I991 HydrophobicContact CE1-CG1 3.62Å; F986-I991 HydrophobicContact CZ-CD1 4.18Å; F986-I991 HydrophobicContact CZ-CG1 3.75Å; F986-L996 HydrophobicContact CE1-CD2 4.48Å; F986-L996 HydrophobicContact CE2-CD2 4.34Å; F986-L996 HydrophobicContact CZ-CD2 3.96Å
987	D	96.8	Very high	96.1	Very high	72 Å²	72	55.7 Å²	55.7	39%	0.385	32%	0.317	S	S	.	.			trans	-85.1	87.2	-177.6	-178.1	16	0	0	0	112.6	A989 G990 I991 L996	D987-A989 VanDerWaalsContact C-N 3.3Å; D987-A989 PolarHBondContact O-N 2.84Å; D987-A989 WeakPolarHBondContact OD1-CB 3.44Å; D987-A989 PolarHBondContact OD1-N 2.92Å; D987-G990 PolarHBondContact O-N 2.92Å; D987-G990 PolarHBondContact OD1-N 3.12Å; D987-G990 VanDerWaalsContact OD2-CA 3.23Å; D987-G990 WeakPolarHBondContact OD2-CA 3.42Å; D987-G990 PolarHBondContact OD2-N 2.67Å; D987-I991 PolarHBondContact O-N 3.31Å; D987-L996 HydrophobicContact CB-CD1 4.33Å
988	W	97	Very high	96	Very high	41 Å²	41	57.4 Å²	57.4	16%	0.155	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-32.2	172.2	-68.7	101.9	0	0	0	113.3	A828 I831 E832 R978 F983 F986 I991 V992	A828-W988 HydrophobicContact CB-CE3 4.33Å; A828-W988 HydrophobicContact CB-CH2 3.87Å; A828-W988 HydrophobicContact CB-CZ3 3.66Å; I831-W988 HydrophobicContact CB-CH2 4.09Å; I831-W988 HydrophobicContact CB-CZ3 4.12Å; I831-W988 HydrophobicContact CD1-CH2 3.82Å; I831-W988 HydrophobicContact CG2-CH2 3.77Å; I831-W988 HydrophobicContact CG2-CZ3 3.76Å; E832-W988 WeakPolarHBondContact OE1-CZ3 3.18Å; R978-W988 HydrophobicContact CB-CD2 4.24Å; R978-W988 HydrophobicContact CB-CH2 4.45Å; R978-W988 HydrophobicContact CB-CZ2 3.88Å; R978-W988 HydrophobicContact CG-CD2 4Å; R978-W988 HydrophobicContact CG-CE3 4.03Å; R978-W988 HydrophobicContact CG-CH2 3.88Å; R978-W988 HydrophobicContact CG-CZ2 3.81Å; R978-W988 HydrophobicContact CG-CZ3 3.97Å; R978-W988 PolarHBondContact O-NE1 3.44Å; R978-W988 VanDerWaalsContact O-NE1 3.16Å; F983-W988 HydrophobicContact CB-CZ2 3.95Å; F983-W988 HydrophobicContact CD1-CH2 4.18Å; F983-W988 AromaticContact CD1-CZ2 3.56Å; F983-W988 HydrophobicContact CD1-CZ2 3.56Å; F983-W988 AromaticContact CD2-CZ2 3.88Å; F983-W988 HydrophobicContact CD2-CZ2 3.88Å; F983-W988 HydrophobicContact CE1-CH2 4.08Å; F983-W988 AromaticContact CE1-CZ2 3.93Å; F983-W988 HydrophobicContact CE1-CZ2 3.93Å; F983-W988 HydrophobicContact CE2-CH2 4.46Å; F983-W988 HydrophobicContact CE2-CZ2 4.22Å; F983-W988 HydrophobicContact CG-CH2 4.42Å; F983-W988 AromaticContact CG-CZ2 3.53Å; F983-W988 HydrophobicContact CG-CZ2 3.53Å; F983-W988 HydrophobicContact CZ-CH2 4.24Å; F983-W988 HydrophobicContact CZ-CZ2 4.25Å; F986-W988 HydrophobicContact CD1-CD2 4.06Å; F986-W988 AromaticContact CD1-CE2 3.91Å; F986-W988 HydrophobicContact CD1-CG 4.24Å; F986-W988 HydrophobicContact CD1-CZ2 4.33Å; F986-W988 HydrophobicContact CE1-CD2 4.37Å; F986-W988 PolarHBondContact O-N 2.87Å; F986-W988 VanDerWaalsContact O-N 3.16Å; W988-I991 PolarHBondContact O-N 3.36Å; W988-V992 WeakPolarHBondContact O-CG2 3.38Å; W988-V992 PolarHBondContact O-N 2.7Å; W988-V992 VanDerWaalsContact O-N 3.08Å
989	A	96.1	Very high	95.9	Very high	54 Å²	54	58 Å²	58	45%	0.446	34%	0.335	S	S	.	.	H	α-helix	trans	-71	-39.1	179.8	0	0	0	0	0	111.2	D987 V992 K993	D987-A989 VanDerWaalsContact C-N 3.3Å; D987-A989 PolarHBondContact O-N 2.84Å; D987-A989 WeakPolarHBondContact OD1-CB 3.44Å; D987-A989 PolarHBondContact OD1-N 2.92Å; A989-V992 PolarHBondContact O-N 3.01Å; A989-K993 WeakPolarHBondContact O-CB 3.42Å; A989-K993 VanDerWaalsContact O-CG 3.29Å; A989-K993 WeakPolarHBondContact O-CG 3.43Å; A989-K993 PolarHBondContact O-N 3.36Å
990	G	96.6	Very high	95.8	Very high	1 Å²	1	55 Å²	55	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-33.2	173.8	0	0	0	0	0	113.8	D987 Q994 T995 L996	D987-G990 PolarHBondContact O-N 2.92Å; D987-G990 PolarHBondContact OD1-N 3.12Å; D987-G990 VanDerWaalsContact OD2-CA 3.23Å; D987-G990 WeakPolarHBondContact OD2-CA 3.42Å; D987-G990 PolarHBondContact OD2-N 2.67Å; G990-Q994 CarbonylContact O-C 3.54Å; G990-Q994 PolarHBondContact O-N 3.05Å; G990-Q994 VanDerWaalsContact O-N 3.17Å; G990-T995 WeakPolarHBondContact CA-OG1 3.23Å; G990-T995 PolarHBondContact O-N 3.39Å; G990-L996 PolarHBondContact O-N 3.48Å
991	I	96.9	Very high	95.2	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-57	168.3	-75.1	-63.6	0	0	0	110.3	F782 F825 A828 E832 Y859 F986 D987 W988 K993 Q994 L996	F782-I991 HydrophobicContact CE1-CG2 3.99Å; F782-I991 HydrophobicContact CE2-CG2 4.43Å; F782-I991 HydrophobicContact CZ-CG2 3.63Å; F782-I991 WeakPolarHBondContact CZ-O 3.1Å; F825-I991 HydrophobicContact CD2-CD1 3.73Å; F825-I991 HydrophobicContact CE2-CD1 3.57Å; F825-I991 HydrophobicContact CG-CD1 4.46Å; F825-I991 HydrophobicContact CZ-CD1 4.2Å; A828-I991 HydrophobicContact CB-CD1 4.4Å; A828-I991 HydrophobicContact CB-CG1 4.01Å; E832-I991 HydrophobicContact CG-CG2 3.88Å; Y859-I991 HydrophobicContact CE1-CD1 4.02Å; F986-I991 HydrophobicContact CE1-CG1 3.62Å; F986-I991 HydrophobicContact CZ-CD1 4.18Å; F986-I991 HydrophobicContact CZ-CG1 3.75Å; D987-I991 PolarHBondContact O-N 3.31Å; W988-I991 PolarHBondContact O-N 3.36Å; I991-K993 PolarHBondContact O-N 3.22Å; I991-Q994 PolarHBondContact O-N 3.2Å; I991-L996 HydrophobicContact CD1-CB 4.42Å; I991-L996 HydrophobicContact CD1-CD2 3.78Å; I991-L996 HydrophobicContact CG1-CD2 3.85Å
992	V	95.1	Very high	94.7	Very high	45 Å²	45	61 Å²	61	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-60	-35.1	-175.5	172.6	0	0	0	0	112.1	L707 E832 W988 A989 Q994	L707-V992 WeakPolarHBondContact CD1-O 3.47Å; E832-V992 HydrophobicContact CG-CG2 4.07Å; W988-V992 WeakPolarHBondContact O-CG2 3.38Å; W988-V992 PolarHBondContact O-N 2.7Å; W988-V992 VanDerWaalsContact O-N 3.08Å; A989-V992 PolarHBondContact O-N 3.01Å; V992-Q994 VanDerWaalsContact C-N 3.33Å
993	K	95.4	Very high	94.2	Very high	128 Å²	128	69 Å²	69	56%	0.557	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.2	175.9	-67.7	175.9	179.6	-179.9	0	114.7	A989 I991 T995	A989-K993 WeakPolarHBondContact O-CB 3.42Å; A989-K993 VanDerWaalsContact O-CG 3.29Å; A989-K993 WeakPolarHBondContact O-CG 3.43Å; A989-K993 PolarHBondContact O-N 3.36Å; I991-K993 PolarHBondContact O-N 3.22Å; K993-T995 HydrophobicContact CB-CG2 4Å; K993-T995 PolarHBondContact O-N 3.19Å
994	Q	95.3	Very high	93.7	Very high	53 Å²	53	71.3 Å²	71.3	25%	0.248	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	32.1	-168.7	-59.9	-169.1	-24.2	0	0	114.6	Y859 G990 I991 V992	Y859-Q994 HydrophobicContact CD1-CG 4.18Å; Y859-Q994 HydrophobicContact CE1-CB 4.21Å; Y859-Q994 HydrophobicContact CE1-CG 4.11Å; Y859-Q994 HydrophobicContact CE2-CB 4.13Å; Y859-Q994 HydrophobicContact CG-CG 4.45Å; Y859-Q994 WeakPolarHBondContact OH-CA 3.29Å; Y859-Q994 PolarHBondContact OH-O 3.22Å; G990-Q994 CarbonylContact O-C 3.54Å; G990-Q994 PolarHBondContact O-N 3.05Å; G990-Q994 VanDerWaalsContact O-N 3.17Å; I991-Q994 PolarHBondContact O-N 3.2Å; V992-Q994 VanDerWaalsContact C-N 3.33Å
995	T	96.1	Very high	93.5	Very high	102 Å²	102	72.3 Å²	72.3	63%	0.626	39%	0.39	S	S	*	.			trans	-103.3	-11.1	178.6	58.7	0	0	0	0	114.2	Y859 G990 K993	Y859-T995 PolarHBondContact OH-N 3.4Å; G990-T995 WeakPolarHBondContact CA-OG1 3.23Å; G990-T995 PolarHBondContact O-N 3.39Å; K993-T995 HydrophobicContact CB-CG2 4Å; K993-T995 PolarHBondContact O-N 3.19Å
996	L	94.6	Very high	93.2	Very high	46 Å²	46	69.4 Å²	69.4	24%	0.241	36%	0.36	C	S	.	.	S	Bend	trans	-68.7	139.1	175.1	-174.8	60.2	0	0	0	110.7	F825 Y859 F986 D987 G990 I991 T998	F825-L996 HydrophobicContact CD2-CD2 4.08Å; F825-L996 HydrophobicContact CE2-CD2 4.32Å; F825-L996 HydrophobicContact CE2-CG 4.42Å; Y859-L996 WeakPolarHBondContact OH-CA 3.44Å; Y859-L996 PolarHBondContact OH-N 3.49Å; Y859-L996 PolarHBondContact OH-O 3.04Å; F986-L996 HydrophobicContact CE1-CD2 4.48Å; F986-L996 HydrophobicContact CE2-CD2 4.34Å; F986-L996 HydrophobicContact CZ-CD2 3.96Å; D987-L996 HydrophobicContact CB-CD1 4.33Å; G990-L996 PolarHBondContact O-N 3.48Å; I991-L996 HydrophobicContact CD1-CB 4.42Å; I991-L996 HydrophobicContact CD1-CD2 3.78Å; I991-L996 HydrophobicContact CG1-CD2 3.85Å; L996-T998 PolarHBondContact O-N 2.86Å
997	T	94.3	Very high	92.7	Very high	108 Å²	108	70.6 Å²	70.6	66%	0.663	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-67.1	117.8	177.5	-43.7	0	0	0	0	110.8
998	T	95	Very high	92.4	Very high	36 Å²	36	69 Å²	69	22%	0.221	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-62.7	144.6	174.9	177.5	0	0	0	0	112.2	G858 L996 F1000	G858-T998 WeakPolarHBondContact O-CB 3.18Å; G858-T998 PolarHBondContact O-OG1 2.75Å; L996-T998 PolarHBondContact O-N 2.86Å; T998-F1000 VanDerWaalsContact C-N 3.29Å; T998-F1000 PolarHBondContact OG1-N 2.85Å
999	P	94.5	Very high	92.1	Very high	37 Å²	37	68 Å²	68	24%	0.24	36%	0.36	C	S	.	.	S	Bend	trans	-73.1	-20	166.8	32.1	-36.3	0	0	0	112.8	T822 F825 R1001	T822-P999 HydrophobicContact CG2-CB 4.07Å; T822-P999 HydrophobicContact CG2-CG 3.86Å; F825-P999 HydrophobicContact CB-CG 4.08Å; F825-P999 VanDerWaalsContact CD1-CD 3.48Å; F825-P999 HydrophobicContact CD1-CG 3.92Å; F825-P999 VanDerWaalsContact CG-CD 3.44Å; F825-P999 HydrophobicContact CG-CG 3.98Å; P999-R1001 PolarHBondContact O-N 3.43Å
1000	F	91.7	Very high	91.8	Very high	21 Å²	21	69 Å²	69	9%	0.092	36%	0.355	C	S	.	.			trans	-85.4	114.7	-173	-61.5	-73.8	0	0	0	111.6	L808 I811 T822 F825 C826 V854 G858 I860 T998 V1002	L808-F1000 HydrophobicContact CD1-CE1 4.11Å; L808-F1000 HydrophobicContact CD1-CZ 3.68Å; I811-F1000 HydrophobicContact CD1-CD1 3.84Å; I811-F1000 HydrophobicContact CD1-CE1 3.78Å; I811-F1000 HydrophobicContact CG2-CE1 4.12Å; T822-F1000 HydrophobicContact CG2-CE1 4.16Å; T822-F1000 HydrophobicContact CG2-CZ 3.91Å; F825-F1000 HydrophobicContact CD1-CE2 4.23Å; F825-F1000 HydrophobicContact CE1-CD2 4.43Å; F825-F1000 HydrophobicContact CE1-CE2 4.47Å; C826-F1000 WeakPolarHBondContact SG-CZ 3.39Å; V854-F1000 HydrophobicContact CG1-CB 4.29Å; V854-F1000 HydrophobicContact CG1-CD2 4.32Å; V854-F1000 HydrophobicContact CG1-CG 4.24Å; G858-F1000 WeakPolarHBondContact O-CD2 3.21Å; I860-F1000 HydrophobicContact CD1-CD2 4.48Å; I860-F1000 HydrophobicContact CD1-CE2 3.76Å; I860-F1000 HydrophobicContact CD1-CZ 4.19Å; I860-F1000 HydrophobicContact CG1-CE2 4.4Å; T998-F1000 VanDerWaalsContact C-N 3.29Å; T998-F1000 PolarHBondContact OG1-N 2.85Å; F1000-V1002 HydrophobicContact CB-CG2 4Å; F1000-V1002 PolarHBondContact O-N 2.92Å
1001	R	85.4	Confident	91.5	Very high	236 Å²	236	72.7 Å²	72.7	89%	0.891	38%	0.381	S	S	*	.			trans	-81.3	58.2	174.3	-65.4	-177.4	179.3	-115.1	5.5	111.5	P999 K1003	P999-R1001 PolarHBondContact O-N 3.43Å; R1001-K1003 PolarHBondContact O-N 3.47Å
1002	V	86.9	Confident	91	Very high	36 Å²	36	75.2 Å²	75.2	22%	0.218	40%	0.395	C	S	.	.			trans	-59	122.1	177.2	-176.7	0	0	0	0	109.1	V854 F1000 L1004	V854-V1002 HydrophobicContact CG1-CG2 3.8Å; F1000-V1002 HydrophobicContact CB-CG2 4Å; F1000-V1002 PolarHBondContact O-N 2.92Å; V1002-L1004 HydrophobicContact CG1-CD1 4.28Å; V1002-L1004 HydrophobicContact CG1-CG 4.06Å
1003	K	86.5	Confident	90.7	Very high	172 Å²	172	74.4 Å²	74.4	75%	0.748	39%	0.387	S	S	*	.			trans	-113.6	136	169.6	-67.1	-177	179.9	-178.8	0	107.8	R1001	R1001-K1003 PolarHBondContact O-N 3.47Å
1004	L	88.1	Confident	90.1	Very high	53 Å²	53	70.4 Å²	70.4	28%	0.277	37%	0.372	S	S	.	.			trans	-137.9	133.1	175.6	-63.7	170.8	0	0	0	108	L804 V1002 G1006 D1009 N1012	L804-L1004 HydrophobicContact CB-CD1 3.93Å; L804-L1004 HydrophobicContact CB-CD2 4.02Å; V1002-L1004 HydrophobicContact CG1-CD1 4.28Å; V1002-L1004 HydrophobicContact CG1-CG 4.06Å; L1004-G1006 VanDerWaalsContact C-N 3.27Å; L1004-D1009 HydrophobicContact CB-CB 4.31Å; L1004-D1009 HydrophobicContact CD2-CB 4Å; L1004-N1012 WeakPolarHBondContact CD2-ND2 3.49Å
1005	N	89.8	Confident	89.5	Confident	154 Å²	154	79.3 Å²	79.3	82%	0.824	40%	0.404	S	S	*	.	S	Bend	trans	-82.8	-6.7	176.8	-59.6	-81.1	0	0	0	112.3	D1009	N1005-D1009 WeakPolarHBondContact CB-OD2 3.41Å; N1005-D1009 PolarHBondContact N-OD2 3.23Å; N1005-D1009 PolarHBondContact ND2-OD2 3.17Å
1006	G	88.4	Confident	88.9	Confident	29 Å²	29	78 Å²	78	30%	0.299	39%	0.39	S	S	.	.	S	Bend	trans	171.9	179.5	176.4	0	0	0	0	0	112.2	L1004 L1008 D1009	L1004-G1006 VanDerWaalsContact C-N 3.27Å; G1006-L1008 PolarHBondContact O-N 3.44Å; G1006-D1009 WeakPolarHBondContact O-CB 3.26Å; G1006-D1009 PolarHBondContact O-N 3.08Å
1007	P	86.8	Confident	88.2	Confident	59 Å²	59	80.7 Å²	80.7	38%	0.383	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.6	-180	28.3	-33.4	0	0	0	114	T746 A748 L804	T746-P1007 VanDerWaalsContact O-CB 3.3Å; T746-P1007 WeakPolarHBondContact O-CB 3.49Å; A748-P1007 WeakPolarHBondContact CB-O 3.47Å; L804-P1007 WeakPolarHBondContact CD1-O 3.46Å
1008	L	90	Very high	87.4	Confident	37 Å²	37	79.2 Å²	79.2	19%	0.194	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	10	176.5	-51.9	-178.3	0	0	0	112.7	I725 T740 A748 G1006 H1010	I725-L1008 HydrophobicContact CD1-CD1 4.09Å; I725-L1008 HydrophobicContact CG1-CD1 4.24Å; I725-L1008 HydrophobicContact CG1-CD2 4.3Å; T740-L1008 HydrophobicContact CG2-CD1 4.33Å; T740-L1008 HydrophobicContact CG2-CD2 4.36Å; A748-L1008 HydrophobicContact CB-CD2 3.95Å; G1006-L1008 PolarHBondContact O-N 3.44Å; L1008-H1010 PolarHBondContact O-N 3.45Å; L1008-H1010 PolarHBondContact O-ND1 2.96Å
1009	D	91.1	Very high	86.1	Confident	21 Å²	21	83.9 Å²	83.9	11%	0.112	42%	0.418	C	S	.	.			trans	-74.4	119.4	178	-169.7	-13.6	0	0	0	110.8	L1004 N1005 G1006 S1011	L1004-D1009 HydrophobicContact CB-CB 4.31Å; L1004-D1009 HydrophobicContact CD2-CB 4Å; N1005-D1009 WeakPolarHBondContact CB-OD2 3.41Å; N1005-D1009 PolarHBondContact N-OD2 3.23Å; N1005-D1009 PolarHBondContact ND2-OD2 3.17Å; G1006-D1009 WeakPolarHBondContact O-CB 3.26Å; G1006-D1009 PolarHBondContact O-N 3.08Å; D1009-S1011 WeakPolarHBondContact OD1-CB 3.49Å; D1009-S1011 PolarHBondContact OD1-N 3.24Å; D1009-S1011 PolarHBondContact OD1-OG 2.89Å
1010	H	88.6	Confident	84.8	Confident	74 Å²	74	86.1 Å²	86.1	34%	0.343	43%	0.425	S	S	.	.			trans	-119.1	18.3	-178.5	54.1	-85.4	0	0	0	111.8	L728 L738 L1008 N1012 F1013	L728-H1010 HydrophobicContact CD2-CB 4Å; L738-H1010 HydrophobicContact CD2-CB 4.19Å; L1008-H1010 PolarHBondContact O-N 3.45Å; L1008-H1010 PolarHBondContact O-ND1 2.96Å; H1010-N1012 PolarHBondContact O-N 3.24Å; H1010-N1012 VanDerWaalsContact O-N 3.11Å; H1010-F1013 HydrophobicContact CB-CD2 4.44Å; H1010-F1013 PolarHBondContact O-N 2.84Å; H1010-F1013 VanDerWaalsContact O-N 3.1Å
1011	S	90.3	Very high	83.9	Confident	80 Å²	80	93.7 Å²	93.7	56%	0.559	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-16	-179.7	54.8	0	0	0	0	114.8	D1009 F1013	D1009-S1011 WeakPolarHBondContact OD1-CB 3.49Å; D1009-S1011 PolarHBondContact OD1-N 3.24Å; D1009-S1011 PolarHBondContact OD1-OG 2.89Å; S1011-F1013 VanDerWaalsContact C-N 3.3Å; S1011-F1013 PolarHBondContact O-N 3.25Å
1012	N	88.2	Confident	83.6	Confident	53 Å²	53	89.2 Å²	89.2	28%	0.283	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	8.8	174.9	-54.9	-59.9	0	0	0	114	L804 G806 L1004 H1010	L804-N1012 PolarHBondContact O-ND2 2.69Å; G806-N1012 WeakPolarHBondContact CA-O 3.23Å; L1004-N1012 WeakPolarHBondContact CD2-ND2 3.49Å; H1010-N1012 PolarHBondContact O-N 3.24Å; H1010-N1012 VanDerWaalsContact O-N 3.11Å
1013	F	86.8	Confident	83.6	Confident	27 Å²	27	87.7 Å²	87.7	12%	0.118	44%	0.441	C	S	.	.	S	Bend	trans	-118.1	153.4	179.3	-68.1	-95	0	0	0	112.1	L728 C803 H1010 S1011	L728-F1013 HydrophobicContact CB-CD1 4.3Å; L728-F1013 HydrophobicContact CB-CE1 4.41Å; L728-F1013 HydrophobicContact CD2-CD1 4.31Å; L728-F1013 HydrophobicContact CD2-CD2 3.86Å; L728-F1013 HydrophobicContact CD2-CE1 4.44Å; L728-F1013 HydrophobicContact CD2-CE2 4.01Å; L728-F1013 HydrophobicContact CD2-CG 4.03Å; L728-F1013 HydrophobicContact CD2-CZ 4.29Å; L728-F1013 WeakPolarHBondContact O-CD1 3.38Å; C803-F1013 WeakPolarHBondContact O-CZ 3.41Å; H1010-F1013 HydrophobicContact CB-CD2 4.44Å; H1010-F1013 PolarHBondContact O-N 2.84Å; H1010-F1013 VanDerWaalsContact O-N 3.1Å; S1011-F1013 VanDerWaalsContact C-N 3.3Å; S1011-F1013 PolarHBondContact O-N 3.25Å
1014	D	84	Confident	83.8	Confident	44 Å²	44	83.4 Å²	83.4	24%	0.235	43%	0.431	C	S	.	.			trans	-62.9	148.2	168.4	-52	-65.3	0	0	0	109.7	K373 R813 F1016	K373-D1014 VanDerWaalsContact CE-OD2 3.26Å; K373-D1014 WeakPolarHBondContact CE-OD2 3.33Å; K373-D1014 IonicContact NZ-OD2 3.57Å; K373-D1014 PolarHBondContact NZ-OD2 2.68Å; R813-D1014 IonicContact CZ-OD1 3.26Å; R813-D1014 IonicContact NH1-OD1 2.74Å; R813-D1014 PolarHBondContact NH1-OD1 3.41Å; R813-D1014 IonicContact NH1-OD2 2.86Å; R813-D1014 IonicContact NH2-OD1 3.85Å; D1014-F1016 HydrophobicContact CB-CE2 4Å; D1014-F1016 HydrophobicContact CB-CZ 4.03Å; D1014-F1016 VanDerWaalsContact O-CD2 3.28Å; D1014-F1016 WeakPolarHBondContact O-CD2 3.43Å; D1014-F1016 VanDerWaalsContact O-CE2 3.28Å; D1014-F1016 WeakPolarHBondContact O-CE2 3.29Å
1015	R	82.1	Confident	84	Confident	241 Å²	241	84.6 Å²	84.6	91%	0.909	44%	0.437	S	S	*	.			trans	-89.2	127.4	-178.7	-64.6	-176.2	-177.5	-176.3	0.8	111.4
1016	F	83.7	Confident	84.2	Confident	75 Å²	75	78.2 Å²	78.2	33%	0.329	40%	0.403	S	S	.	.			trans	-115.9	155.3	176.3	-57.7	-85.5	0	0	0	111.3	V727 V730 D1014	V727-F1016 HydrophobicContact CB-CB 4.01Å; V727-F1016 HydrophobicContact CG1-CB 3.88Å; V727-F1016 HydrophobicContact CG1-CD2 4.31Å; V727-F1016 HydrophobicContact CG1-CG 4.24Å; V730-F1016 HydrophobicContact CB-CD1 4.5Å; V730-F1016 HydrophobicContact CG2-CB 4.44Å; V730-F1016 HydrophobicContact CG2-CD1 3.82Å; V730-F1016 HydrophobicContact CG2-CE1 4.32Å; V730-F1016 HydrophobicContact CG2-CG 4.13Å; D1014-F1016 HydrophobicContact CB-CE2 4Å; D1014-F1016 HydrophobicContact CB-CZ 4.03Å; D1014-F1016 VanDerWaalsContact O-CD2 3.28Å; D1014-F1016 WeakPolarHBondContact O-CD2 3.43Å; D1014-F1016 VanDerWaalsContact O-CE2 3.28Å; D1014-F1016 WeakPolarHBondContact O-CE2 3.29Å
1017	T	80.7	Confident	84.5	Confident	102 Å²	102	82.6 Å²	82.6	63%	0.626	42%	0.419	S	S	*	.			trans	-71.2	152.8	172.3	49.5	0	0	0	0	111.2
1018	M	76.7	Confident	84.6	Confident	77 Å²	77	83.7 Å²	83.7	38%	0.379	43%	0.428	S	S	.	.			trans	-91.7	-6.1	174.6	-60.6	-168.1	76.5	0	0	113.1	R724	R724-M1018 HydrophobicContact CG-CE 3.97Å
1019	D	67.6	Low	84.8	Confident	134 Å²	134	83.6 Å²	83.6	72%	0.717	44%	0.436	S	S	*	.			trans	-63	142.9	-177.4	-54.8	-50.9	0	0	0	111.9
1020	E	67.1	Low	84.8	Confident	84 Å²	84	85.3 Å²	85.3	39%	0.393	44%	0.441	S	S	.	.			trans	-132.1	130.8	-173.4	-78.1	171.2	-134.3	0	0	111.3	R724 R735 R753	R724-E1020 IonicContact CZ-OE1 3.51Å; R724-E1020 IonicContact NH1-OE1 3.23Å; R724-E1020 PolarHBondContact NH1-OE1 3.49Å; R724-E1020 IonicContact NH2-OE1 3.99Å; R735-E1020 IonicContact CZ-OE1 3.74Å; R735-E1020 IonicContact NH1-OE1 3.8Å; R735-E1020 PolarHBondContact NH1-OE1 3.21Å; R735-E1020 IonicContact NH2-OE1 3.21Å; R735-E1020 PolarHBondContact NH2-OE1 3.35Å; R753-E1020 IonicContact CZ-OE2 2.72Å; R753-E1020 IonicContact NH1-OE1 2.76Å; R753-E1020 IonicContact NH1-OE2 3.89Å; R753-E1020 PolarHBondContact NH1-OE2 2.93Å; R753-E1020 IonicContact NH2-OE2 3.21Å
1021	Q	73.7	Confident	85	Confident	179 Å²	179	81.9 Å²	81.9	84%	0.836	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-81.2	122.8	151.5	-173.6	172.7	5.4	0	0	107.6	A1023	Q1021-A1023 PolarHBondContact O-N 2.99Å
1022	E	78.4	Confident	85.1	Confident	142 Å²	142	80.8 Å²	80.8	66%	0.664	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-65	127.1	179.5	-166.9	-174.3	145.1	0	0	110.6	K794	K794-E1022 HydrophobicContact CD-CG 4.38Å; K794-E1022 WeakPolarHBondContact CE-OE1 3.4Å; K794-E1022 IonicContact NZ-OE1 3.97Å; K794-E1022 PolarHBondContact NZ-OE1 3.17Å
1023	A	86.1	Confident	85.1	Confident	4 Å²	4	83.2 Å²	83.2	3%	0.033	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-71	143.8	175	0	0	0	0	0	111.5	Q755 K794 Y795 Q1021	Q755-A1023 HydrophobicContact CB-CB 4.42Å; Q755-A1023 HydrophobicContact CG-CB 3.97Å; K794-A1023 HydrophobicContact CB-CB 4.34Å; K794-A1023 WeakPolarHBondContact CD-O 3.08Å; K794-A1023 WeakPolarHBondContact CG-O 3.49Å; K794-A1023 PolarHBondContact NZ-O 2.91Å; Y795-A1023 HydrophobicContact CE1-CB 3.95Å; Y795-A1023 HydrophobicContact CE2-CB 4.35Å; Y795-A1023 PolarHBondContact OH-N 3.29Å; Q1021-A1023 PolarHBondContact O-N 2.99Å
1024	P	91	Very high	85.3	Confident	83 Å²	83	83.4 Å²	83.4	54%	0.539	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-68	153.6	172.5	30	-34.5	0	0	0	111.2	A757	A757-P1024 HydrophobicContact CB-CG 3.75Å
1025	D	93.8	Very high	85.4	Confident	77 Å²	77	85.4 Å²	85.4	41%	0.412	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-65.4	142.4	175.3	-71.3	42.3	0	0	0	110.8	N793 K794 L1027	N793-D1025 HydrophobicContact CB-CB 4.24Å; N793-D1025 WeakPolarHBondContact CB-OD2 3.38Å; N793-D1025 PolarHBondContact ND2-OD2 2.99Å; N793-D1025 CarbonylContact O-C 3.56Å; N793-D1025 WeakPolarHBondContact O-CA 3.3Å; K794-D1025 VanDerWaalsContact CE-OD1 3.22Å; K794-D1025 WeakPolarHBondContact CE-OD1 3.45Å; K794-D1025 WeakPolarHBondContact CG-OD1 3.37Å; K794-D1025 IonicContact NZ-OD1 3.21Å; K794-D1025 PolarHBondContact NZ-OD1 3.47Å; D1025-L1027 HydrophobicContact CB-CG 4.47Å
1026	E	94.1	Very high	85.6	Confident	21 Å²	21	77.2 Å²	77.2	10%	0.098	42%	0.42	C	S	.	.			trans	-140.7	110.1	-179.6	-162.8	-67.9	104.1	0	0	108.3	K756 A757 V760 N793 S1028 W1030	K756-E1026 HydrophobicContact CB-CB 3.61Å; K756-E1026 HydrophobicContact CB-CG 4.04Å; K756-E1026 HydrophobicContact CD-CB 4.15Å; K756-E1026 WeakPolarHBondContact CD-O 3.27Å; K756-E1026 PolarHBondContact NZ-O 2.92Å; A757-E1026 HydrophobicContact CB-CB 4.35Å; A757-E1026 HydrophobicContact CB-CG 4.48Å; V760-E1026 HydrophobicContact CG2-CG 3.96Å; V760-E1026 WeakPolarHBondContact CG2-OE2 3.44Å; N793-E1026 PolarHBondContact O-N 3.34Å; N793-E1026 VanDerWaalsContact O-O 3.13Å; E1026-S1028 WeakPolarHBondContact OE1-CB 3.43Å; E1026-S1028 PolarHBondContact OE1-N 3.34Å; E1026-S1028 PolarHBondContact OE1-OG 3.02Å; E1026-W1030 PolarHBondContact OE2-NE1 3.44Å
1027	L	92.8	Very high	85.7	Confident	120 Å²	120	77.3 Å²	77.3	63%	0.628	43%	0.425	S	S	*	.			trans	-119.9	14.8	-161.7	-54.4	179.6	0	0	0	113.2	N793 D1025 G1029	N793-L1027 HydrophobicContact CB-CD2 3.88Å; D1025-L1027 HydrophobicContact CB-CG 4.47Å; L1027-G1029 PolarHBondContact O-N 3.36Å
1028	S	90.9	Very high	86	Confident	83 Å²	83	75.9 Å²	75.9	58%	0.58	41%	0.413	S	S	*	.	S	Bend	trans	-70.4	-9.7	-179.3	63.7	0	0	0	0	114.5	E1026 W1030	E1026-S1028 WeakPolarHBondContact OE1-CB 3.43Å; E1026-S1028 PolarHBondContact OE1-N 3.34Å; E1026-S1028 PolarHBondContact OE1-OG 3.02Å; S1028-W1030 VanDerWaalsContact C-N 3.32Å; S1028-W1030 PolarHBondContact O-N 2.88Å
1029	G	92.3	Very high	86.5	Confident	35 Å²	35	75.8 Å²	75.8	36%	0.361	42%	0.416	S	S	.	.			trans	77	9.3	169.2	0	0	0	0	0	115.6	L1027 D1031 A1032	L1027-G1029 PolarHBondContact O-N 3.36Å; G1029-D1031 WeakPolarHBondContact CA-OD1 3.26Å; G1029-D1031 PolarHBondContact O-N 3.13Å; G1029-D1031 VanDerWaalsContact O-N 3.12Å; G1029-A1032 VanDerWaalsContact O-CB 3.27Å; G1029-A1032 WeakPolarHBondContact O-CB 3.07Å; G1029-A1032 PolarHBondContact O-N 2.74Å
1030	W	92.2	Very high	87.8	Confident	57 Å²	57	71.9 Å²	71.9	22%	0.216	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.9	172.3	72.7	-87.2	0	0	0	112.5	K756 I759 Q765 V768 V796 E1026 S1028 A1032 F1034	K756-W1030 HydrophobicContact CG-CZ2 4.29Å; I759-W1030 HydrophobicContact CB-CZ2 4.27Å; I759-W1030 HydrophobicContact CD1-CH2 3.92Å; I759-W1030 HydrophobicContact CD1-CZ2 4.01Å; I759-W1030 HydrophobicContact CG2-CH2 3.88Å; I759-W1030 HydrophobicContact CG2-CZ2 3.93Å; Q765-W1030 HydrophobicContact CB-CD2 3.94Å; Q765-W1030 HydrophobicContact CB-CE3 3.6Å; Q765-W1030 HydrophobicContact CB-CG 4.44Å; Q765-W1030 HydrophobicContact CB-CZ3 4.04Å; Q765-W1030 HydrophobicContact CG-CB 4.36Å; Q765-W1030 HydrophobicContact CG-CD2 3.53Å; Q765-W1030 HydrophobicContact CG-CE3 3.76Å; Q765-W1030 HydrophobicContact CG-CG 3.79Å; Q765-W1030 HydrophobicContact CG-CZ3 4.33Å; V768-W1030 HydrophobicContact CB-CH2 4.35Å; V768-W1030 HydrophobicContact CB-CZ3 4.41Å; V768-W1030 HydrophobicContact CG1-CH2 4.04Å; V768-W1030 HydrophobicContact CG1-CZ3 4.31Å; V796-W1030 HydrophobicContact CG1-CH2 4.31Å; V796-W1030 HydrophobicContact CG1-CZ2 4.38Å; V796-W1030 HydrophobicContact CG2-CH2 4.3Å; E1026-W1030 PolarHBondContact OE2-NE1 3.44Å; S1028-W1030 VanDerWaalsContact C-N 3.32Å; S1028-W1030 PolarHBondContact O-N 2.88Å; W1030-A1032 VanDerWaalsContact C-N 3.32Å; W1030-F1034 HydrophobicContact CZ3-CE2 4.45Å
1031	D	93.1	Very high	89.3	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.011	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	3	177.3	66.9	-63.2	0	0	0	113.9	K756 R791 V796 G1029 N1033 F1034	K756-D1031 WeakPolarHBondContact CE-OD2 3.46Å; K756-D1031 IonicContact NZ-OD1 2.72Å; K756-D1031 PolarHBondContact NZ-OD1 2.82Å; K756-D1031 IonicContact NZ-OD2 2.76Å; K756-D1031 PolarHBondContact NZ-OD2 3.45Å; R791-D1031 WeakPolarHBondContact CD-O 3.45Å; R791-D1031 VanDerWaalsContact CD-OD2 3.24Å; R791-D1031 WeakPolarHBondContact CD-OD2 3.32Å; R791-D1031 IonicContact CZ-OD2 3.43Å; R791-D1031 PolarHBondContact NE-O 2.87Å; R791-D1031 IonicContact NE-OD2 2.8Å; R791-D1031 IonicContact NH1-OD1 3.56Å; R791-D1031 IonicContact NH1-OD2 2.77Å; R791-D1031 PolarHBondContact NH1-OD2 3.12Å; V796-D1031 HydrophobicContact CG1-CB 3.74Å; G1029-D1031 WeakPolarHBondContact CA-OD1 3.26Å; G1029-D1031 PolarHBondContact O-N 3.13Å; G1029-D1031 VanDerWaalsContact O-N 3.12Å; D1031-N1033 PolarHBondContact O-N 2.63Å; D1031-F1034 WeakPolarHBondContact O-CB 3.45Å; D1031-F1034 PolarHBondContact O-N 3.35Å
1032	A	92.1	Very high	90.5	Very high	57 Å²	57	62.8 Å²	62.8	47%	0.471	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-27.1	-171.8	0	0	0	0	0	114.9	G1029 W1030	G1029-A1032 VanDerWaalsContact O-CB 3.27Å; G1029-A1032 WeakPolarHBondContact O-CB 3.07Å; G1029-A1032 PolarHBondContact O-N 2.74Å; W1030-A1032 VanDerWaalsContact C-N 3.32Å
1033	N	87.8	Confident	91.5	Very high	103 Å²	103	56.2 Å²	56.2	55%	0.551	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	2.4	177.5	-69.1	-17.6	0	0	0	114.8	Y769 K772 D1031	Y769-N1033 HydrophobicContact CE2-CB 3.83Å; Y769-N1033 PolarHBondContact OH-ND2 2.65Å; Y769-N1033 VanDerWaalsContact OH-ND2 3.17Å; K772-N1033 PolarHBondContact NZ-O 3.33Å; D1031-N1033 PolarHBondContact O-N 2.63Å
1034	F	91.7	Very high	92	Very high	32 Å²	32	60.9 Å²	60.9	14%	0.14	36%	0.364	C	S	.	.			trans	-83.2	0	178.1	-93.5	-102.4	0	0	0	113.6	V768 K772 T789 R791 V796 M798 W1030 D1031	V768-F1034 HydrophobicContact CG1-CE2 4.34Å; V768-F1034 HydrophobicContact CG1-CZ 3.77Å; K772-F1034 HydrophobicContact CB-CE1 4.36Å; K772-F1034 HydrophobicContact CB-CE2 4.41Å; K772-F1034 HydrophobicContact CB-CZ 3.87Å; K772-F1034 HydrophobicContact CD-CD1 4.3Å; K772-F1034 HydrophobicContact CD-CD2 4.28Å; K772-F1034 HydrophobicContact CD-CE1 4.16Å; K772-F1034 HydrophobicContact CD-CE2 4.13Å; K772-F1034 HydrophobicContact CD-CG 4.35Å; K772-F1034 HydrophobicContact CD-CZ 4.06Å; K772-F1034 HydrophobicContact CG-CZ 4.49Å; K772-F1034 PolarHBondContact NZ-O 2.78Å; T789-F1034 CarbonylContact C-O 3.57Å; T789-F1034 WeakPolarHBondContact CB-O 3.02Å; T789-F1034 HydrophobicContact CG2-CD1 4.13Å; T789-F1034 HydrophobicContact CG2-CE1 4.2Å; T789-F1034 PolarHBondContact OG1-O 3.41Å; R791-F1034 HydrophobicContact CB-CB 4.1Å; R791-F1034 WeakPolarHBondContact CD-OXT 3.33Å; R791-F1034 HydrophobicContact CG-CB 4.41Å; R791-F1034 PolarHBondContact NE-OXT 2.92Å; V796-F1034 HydrophobicContact CB-CD1 3.78Å; V796-F1034 HydrophobicContact CB-CE1 4.01Å; V796-F1034 HydrophobicContact CB-CG 4.16Å; V796-F1034 HydrophobicContact CG1-CB 4.39Å; V796-F1034 HydrophobicContact CG1-CD1 4.19Å; V796-F1034 HydrophobicContact CG1-CD2 4.36Å; V796-F1034 HydrophobicContact CG1-CG 4.05Å; V796-F1034 HydrophobicContact CG2-CD1 4.49Å; V796-F1034 HydrophobicContact CG2-CE1 4.24Å; M798-F1034 HydrophobicContact CE-CE1 3.85Å; M798-F1034 HydrophobicContact CE-CZ 3.85Å; M798-F1034 HydrophobicContact CG-CE1 4.21Å; W1030-F1034 HydrophobicContact CZ3-CE2 4.45Å; D1031-F1034 WeakPolarHBondContact O-CB 3.45Å; D1031-F1034 PolarHBondContact O-N 3.35Å

Retrieved 1,034 of 1,034 residues in 278 ms (Link to these results)

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