A0A087YGA3_POEFO Loading...

Nuclear factor kappa B subunit 1

AlphaFold DB , UniProt , Accession A0A087YGA3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 919 aa.

						>A0A087YGA3_POEFO|A0A087YGA3
MAADENYLHPSSQMFDTMIDPSYLGYSHFDPMPQMTALQSVDGPFLQILEQPKQRGFRFRYGCEGPSHGGLPGASSEKNRKTYPTVKICNYQGQARVVVQLVTALTQLPQLHAHSLVGKQCDKGICIADLQSKDSTISFPNLGILHVTKKNVAKTLEERMVEAFRMGYNCGVAIHPEVDALQGEVRVPRELSDHQRSMISSAAASQAKEMDLSVVRLMFTAFLPDSDGGFSRRLEPVVSEPIYDSKAPNASNLKIVRMDRTAGCVTGGEEVYLLCDKVQKDDIQVRFYEEDDSGLTWEALGDFSPTDVHRQFAIVFKTPKYRDQNLQKPTSVFVQLKRKSDNETSEPKPFTYHPQIIDKEEVQRKRQKTLPNFQDFSGHGGGGSGGGGGGGLYRGGGGPASGVGGPGSAGGGYYQGFSSYSYGGAAGGFSSAYSAGLGGGGGTKHALQSEAADDSGDDSDPDNDPASGAVLRGSAQSGGSAQSDAPSVDPDEALMEATRRQLDALFRYSVTGDSAYLLAPQRPLMAAQDEDGDTGLHLAVLHSQQEALTSLTQVVSALTGEEVLNMRNHLYQTPLHLAVITQQKQAAEVLLLAGADPTLTDRHGNTVLHLAAQQEGDGMVELLLRRREMRELLQFSNTAGLCAIHLAVLANRLAALRELLVGGADVEAQERSGGRTALHLATETDNVSLAGCLLLEGNAKVDSCTFNGSTPLHVAAGRGSIKLTALLMAAGADPHRENFEPLFIRDEEEEDDEEEEDDEGYISGTTPVNMAASPEVLDLLNGQEYEPRSQQAFIPPQGDLSVLDVQVKRAVCGALEAEGCWENLAHHLGLGILNTAFRLSPNPARTLLESYEVSGGTVSDLLAALRSAGGCRALSILEGALHQNPDMAEEVQNPPVQNLKADLGNDSGVCDSGVELSTA
					

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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	31.6	Very low	32	Very low	237 Å²	237	137.1 Å²	137.1	100%	1.167	75%	0.752	S	S	*	*				0	108.7	0	-62.7	165.3	178.7	0	0	104.5
2	A	29.8	Very low	31.4	Very low	101 Å²	101	135.2 Å²	135.2	84%	0.835	76%	0.756	S	S	*	*				62.4	134.5	58.9	0	0	0	0	0	111.8
3	A	33	Very low	31.3	Very low	75 Å²	75	137 Å²	137	62%	0.62	76%	0.755	S	S	*	*			cis	-169	159	-17	0	0	0	0	0	107.4
4	D	34.7	Very low	31.2	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	75%	0.75	S	S	*	*			trans	50.7	124.5	146.7	-51.2	-19.2	0	0	0	122
5	E	34.1	Very low	31	Very low	164 Å²	164	140.4 Å²	140.4	77%	0.766	75%	0.754	S	S	*	*				78.1	148.6	124.1	-78.1	-151.8	-145.8	0	0	122.1
6	N	31.2	Very low	30.7	Very low	108 Å²	108	140.1 Å²	140.1	58%	0.578	75%	0.752	S	S	*	*			cis	-167.3	-177.4	-17.3	-142.4	-23.4	0	0	0	112
7	Y	30.1	Very low	30.6	Very low	169 Å²	169	138.5 Å²	138.5	66%	0.663	75%	0.749	S	S	*	*			trans	68.5	130.3	159.3	-74.4	-68.8	0	0	0	122.9
8	L	24.7	Very low	30.3	Very low	171 Å²	171	141.5 Å²	141.5	90%	0.895	76%	0.76	S	S	*	*				-170.4	139.9	104	-99.5	168.3	0	0	0	116.3
9	H	27.9	Very low	30.3	Very low	148 Å²	148	142.5 Å²	142.5	69%	0.685	76%	0.763	S	S	*	*			trans	-61.8	-175.8	175.8	-87.3	-97.9	0	0	0	117.1
10	P	47.3	Very low	30.1	Very low	97 Å²	97	141.2 Å²	141.2	63%	0.63	76%	0.756	S	S	*	*			cis	-152.3	174.2	-44.1	45	-26.7	0	0	0	118.5
11	S	27.2	Very low	30	Very low	97 Å²	97	140.7 Å²	140.7	68%	0.678	76%	0.76	S	S	*	*			trans	44	132.2	136.4	69.2	0	0	0	0	126.6
12	S	25.3	Very low	29.8	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	73%	0.732	S	S	*	*				-171.5	137.7	124.9	-72.6	0	0	0	0	109
13	Q	30	Very low	29.7	Very low	159 Å²	159	139.4 Å²	139.4	74%	0.743	74%	0.735	S	S	*	*			cis	78.3	133.4	30.8	-69	-165.6	-3	0	0	115
14	M	30.3	Very low	29.6	Very low	139 Å²	139	144.3 Å²	144.3	69%	0.685	75%	0.75	S	S	*	*			cis	-142.2	163.3	-13.1	-65.7	-155	179.4	0	0	109
15	F	28.2	Very low	29.2	Very low	186 Å²	186	140.4 Å²	140.4	82%	0.816	74%	0.743	S	S	*	*				-178.2	168.8	85.1	-98.6	-93.9	0	0	0	107.2
16	D	26.5	Very low	29	Very low	136 Å²	136	143.4 Å²	143.4	73%	0.727	75%	0.749	S	S	*	*			cis	-145	-174.4	17.6	-158.2	-8.6	0	0	0	111.5
17	T	27.7	Very low	28.8	Very low	112 Å²	112	142.6 Å²	142.6	69%	0.687	75%	0.752	S	S	*	*			trans	-121.5	142.4	-159.3	54.4	0	0	0	0	117
18	M	26.6	Very low	28.7	Very low	193 Å²	193	143.8 Å²	143.8	95%	0.951	76%	0.764	S	S	*	*			trans	-148.9	159.4	144.3	-76.7	-154	-175.4	0	0	109
19	I	30.3	Very low	28.8	Very low	160 Å²	160	144.1 Å²	144.1	82%	0.821	76%	0.758	S	S	*	*			trans	-125.9	139.1	-160.6	-71.4	176.7	0	0	0	113.9
20	D	26.1	Very low	28.8	Very low	117 Å²	117	144 Å²	144	63%	0.626	76%	0.762	S	S	*	*			trans	50	110.6	159.7	-164.2	41.8	0	0	0	121	S22	D20-S22 PolarHBondContact OD2-OG 3.37Å
21	P	28.2	Very low	27.9	Very low	130 Å²	130	145.2 Å²	145.2	84%	0.844	77%	0.77	S	S	*	*			trans	-107.2	83.2	161.5	37	-25.5	0	0	0	111.8
22	S	26.1	Very low	27.8	Very low	82 Å²	82	147.3 Å²	147.3	57%	0.573	77%	0.771	S	S	*	*			trans	-87.5	134	169.9	42.2	0	0	0	0	111.8	D20	D20-S22 PolarHBondContact OD2-OG 3.37Å
23	Y	28.1	Very low	28.1	Very low	229 Å²	229	147 Å²	147	90%	0.898	77%	0.766	S	S	*	*			trans	64.2	98.7	180	-78	-93.6	0	0	0	118.9
24	L	31	Very low	27.9	Very low	178 Å²	178	148.8 Å²	148.8	93%	0.932	78%	0.775	S	S	*	*			trans	160.2	117.6	143.6	-90.4	161.5	0	0	0	108.1
25	G	26.1	Very low	27.7	Very low	60 Å²	60	149 Å²	149	62%	0.619	78%	0.776	S	S	*	*			cis	123.2	88.2	-5.6	0	0	0	0	0	113.3
26	Y	29.5	Very low	27.9	Very low	226 Å²	226	146.4 Å²	146.4	89%	0.886	78%	0.775	S	S	*	*			trans	-173.2	116.2	144.6	-103.4	-65.2	0	0	0	112.7
27	S	28.1	Very low	28.1	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	78%	0.776	S	S	*	*			trans	32.2	100.7	151.4	-54.8	0	0	0	0	121
28	H	28.4	Very low	28.3	Very low	194 Å²	194	147.1 Å²	147.1	90%	0.898	79%	0.786	S	S	*	*			trans	-113.6	127.6	138.7	-142	-69.3	0	0	0	107
29	F	26.8	Very low	29.1	Very low	178 Å²	178	146.2 Å²	146.2	78%	0.781	78%	0.78	S	S	*	*			trans	-86.1	136.7	-177.1	-93.2	-97.1	0	0	0	111.5
30	D	27.7	Very low	29.4	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	78%	0.775	S	S	*	*			trans	-67.2	136.4	157.9	-68	-62.2	0	0	0	109.9	M32	D30-M32 PolarHBondContact O-N 2.89Å; D30-M32 VanDerWaalsContact O-N 3.15Å
31	P	27.7	Very low	30.6	Very low	124 Å²	124	143.5 Å²	143.5	81%	0.805	78%	0.779	S	S	*	*			trans	-70.4	106.9	161.7	29.6	-30.2	0	0	0	108.2
32	M	25.7	Very low	32.2	Very low	141 Å²	141	144.7 Å²	144.7	70%	0.695	78%	0.779	S	S	*	*			trans	-52.6	150.8	171.6	-75.4	-172.7	73.4	0	0	110.8	D30 Q34	D30-M32 PolarHBondContact O-N 2.89Å; D30-M32 VanDerWaalsContact O-N 3.15Å; M32-Q34 PolarHBondContact O-N 3.23Å
33	P	30.5	Very low	34.8	Very low	106 Å²	106	142 Å²	142	69%	0.688	76%	0.763	S	S	*	*			trans	-54.4	132.9	159.6	27.1	-34.1	0	0	0	108	M35	P33-M35 PolarHBondContact O-N 3.22Å
34	Q	27.3	Very low	37.6	Very low	198 Å²	198	133.7 Å²	133.7	93%	0.925	74%	0.737	S	S	*	*			trans	-71.3	76.4	178.5	-75.5	-176.6	-36.4	0	0	110.5	M32 T36	M32-Q34 PolarHBondContact O-N 3.23Å; Q34-T36 PolarHBondContact O-N 3.12Å
35	M	25.3	Very low	40.5	Very low	144 Å²	144	129.3 Å²	129.3	71%	0.709	71%	0.711	S	S	*	*			trans	-49.6	131.1	149.9	-70	-176.5	65.6	0	0	107.7	P33 A37	P33-M35 PolarHBondContact O-N 3.22Å; M35-A37 PolarHBondContact O-N 2.71Å
36	T	32.3	Very low	43.7	Very low	130 Å²	130	127 Å²	127	80%	0.798	69%	0.685	S	S	*	*			trans	-7.8	98.1	167.5	50.2	0	0	0	0	113.3	Q34 L38	Q34-T36 PolarHBondContact O-N 3.12Å; T36-L38 PolarHBondContact O-N 3.41Å; T36-L38 VanDerWaalsContact O-N 3.16Å
37	A	30	Very low	46.7	Very low	91 Å²	91	120.4 Å²	120.4	75%	0.752	66%	0.662	S	S	*	*			trans	-53.4	126	175.9	0	0	0	0	0	108.5	M35 Q39	M35-A37 PolarHBondContact O-N 2.71Å; A37-Q39 PolarHBondContact O-N 2.8Å; A37-Q39 VanDerWaalsContact O-N 3.11Å
38	L	33.4	Very low	49.9	Very low	172 Å²	172	117.2 Å²	117.2	90%	0.901	64%	0.637	S	S	*	*			trans	-52	121.9	178.7	-79.7	160.7	0	0	0	108.6	T36 S40	T36-L38 PolarHBondContact O-N 3.41Å; T36-L38 VanDerWaalsContact O-N 3.16Å; L38-S40 PolarHBondContact O-N 2.88Å
39	Q	41.5	Very low	53.1	Low	174 Å²	174	112.4 Å²	112.4	81%	0.813	62%	0.618	S	S	*	*			trans	-54.2	115.9	-177.2	-70.3	174.1	-43.9	0	0	109.5	A37 V41	A37-Q39 PolarHBondContact O-N 2.8Å; A37-Q39 VanDerWaalsContact O-N 3.11Å; Q39-V41 WeakPolarHBondContact O-CG2 3.49Å; Q39-V41 PolarHBondContact O-N 2.9Å
40	S	37.4	Very low	56.3	Low	102 Å²	102	105.2 Å²	105.2	71%	0.713	59%	0.587	S	S	*	*			trans	-68.3	98.2	170.1	35.9	0	0	0	0	108.2	L38 D42 G43	L38-S40 PolarHBondContact O-N 2.88Å; S40-D42 PolarHBondContact O-N 3.26Å; S40-G43 PolarHBondContact O-N 3.1Å
41	V	50.5	Low	59.6	Low	118 Å²	118	100.9 Å²	100.9	72%	0.715	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-25.1	-161.2	-175.4	0	0	0	0	114.1	Q39 N90	Q39-V41 WeakPolarHBondContact O-CG2 3.49Å; Q39-V41 PolarHBondContact O-N 2.9Å; V41-N90 PolarHBondContact O-ND2 3.01Å
42	D	63.2	Low	62.8	Low	156 Å²	156	95 Å²	95	83%	0.834	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	1.2	-177.6	-61.4	-54.3	0	0	0	115.2	S40	S40-D42 PolarHBondContact O-N 3.26Å
43	G	79.4	Confident	65.9	Low	25 Å²	25	92 Å²	92	26%	0.258	51%	0.507	S	S	.	.	S	Bend	trans	-80.3	147.2	-179.1	0	0	0	0	0	114	S40 N90	S40-G43 PolarHBondContact O-N 3.1Å; G43-N90 VanDerWaalsContact O-CB 3.27Å; G43-N90 WeakPolarHBondContact O-CB 3.5Å; G43-N90 PolarHBondContact O-ND2 2.96Å
44	P	88.5	Confident	68.8	Low	54 Å²	54	91.1 Å²	91.1	35%	0.351	49%	0.493	S	S	.	.			trans	-69.9	133.8	168.5	30.3	-34.1	0	0	0	110.9	C89 L223 L234	P44-C89 WeakPolarHBondContact CA-O 3.39Å; P44-L223 HydrophobicContact CB-CD1 4.27Å; P44-L223 HydrophobicContact CG-CD1 4.15Å; P44-L234 HydrophobicContact CB-CD1 4.41Å; P44-L234 HydrophobicContact CB-CD2 4.2Å; P44-L234 HydrophobicContact CG-CD2 3.94Å
45	F	91.3	Very high	71.7	Confident	87 Å²	87	83.8 Å²	83.8	38%	0.382	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	157.7	-178.4	70.6	-87.7	0	0	0	112.6	Q47 I88 C89	F45-Q47 HydrophobicContact CD2-CB 4.48Å; F45-Q47 HydrophobicContact CE2-CB 4.16Å; F45-I88 CarbonylContact O-C 3.59Å; F45-I88 WeakPolarHBondContact O-CA 3.46Å; F45-C89 HydrophobicContact CD1-CB 3.81Å; F45-C89 HydrophobicContact CD2-CB 4.09Å; F45-C89 HydrophobicContact CE1-CB 3.39Å; F45-C89 HydrophobicContact CE2-CB 3.7Å; F45-C89 HydrophobicContact CG-CB 4.15Å; F45-C89 HydrophobicContact CZ-CB 3.33Å; F45-C89 PolarHBondContact N-O 3.19Å; F45-C89 VanDerWaalsContact N-O 3.09Å; F45-C89 PolarHBondContact O-N 2.95Å
46	L	92.4	Very high	74.6	Confident	12 Å²	12	79 Å²	79	6%	0.063	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	142	177.4	-171.8	63.8	0	0	0	110.3	V86 I88 F219 A221 V237	L46-V86 HydrophobicContact CD1-CB 4.09Å; L46-V86 HydrophobicContact CD1-CG2 3.89Å; L46-I88 HydrophobicContact CD1-CG1 4.07Å; L46-F219 HydrophobicContact CD2-CB 3.71Å; L46-F219 WeakPolarHBondContact CD2-O 3.3Å; L46-A221 HydrophobicContact CD1-CB 4.22Å; L46-A221 HydrophobicContact CD2-CB 4.26Å; L46-V237 HydrophobicContact CB-CG2 3.98Å; L46-V237 HydrophobicContact CD2-CG2 4.32Å; L46-V237 HydrophobicContact CG-CG2 4.22Å; L46-V237 WeakPolarHBondContact O-CG2 3.16Å
47	Q	93.9	Very high	77.4	Confident	86 Å²	86	73.9 Å²	73.9	40%	0.402	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.5	179	-175.9	177.6	9.7	0	0	110.5	F45 V86 K87 C89	F45-Q47 HydrophobicContact CD2-CB 4.48Å; F45-Q47 HydrophobicContact CE2-CB 4.16Å; Q47-V86 CarbonylContact O-C 3.57Å; Q47-V86 VanDerWaalsContact O-CA 3.28Å; Q47-V86 WeakPolarHBondContact O-CA 3.48Å; Q47-K87 PolarHBondContact N-O 3.39Å; Q47-K87 PolarHBondContact O-N 3.22Å; Q47-C89 PolarHBondContact OE1-SG 3.24Å
48	I	95.4	Very high	80.3	Confident	25 Å²	25	73 Å²	73	13%	0.128	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	123.6	168.7	-59	174	0	0	0	108.2	E50 Q51 V86 F219 V237	I48-E50 VanDerWaalsContact CG2-C 3.45Å; I48-E50 WeakPolarHBondContact CG2-O 3.32Å; I48-Q51 HydrophobicContact CG2-CG 4.18Å; I48-V86 HydrophobicContact CG1-CG1 4.01Å; I48-F219 HydrophobicContact CD1-CD2 3.98Å; I48-F219 HydrophobicContact CD1-CE2 3.86Å; I48-F219 HydrophobicContact CG1-CD2 4.13Å; I48-F219 HydrophobicContact CG1-CE2 4.16Å; I48-V237 HydrophobicContact CD1-CG1 3.84Å; I48-V237 HydrophobicContact CG1-CG1 3.89Å
49	L	93.9	Very high	83.2	Confident	93 Å²	93	65 Å²	65	49%	0.487	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-40.3	171.9	-66.5	-175.2	0	0	0	111.5	T85 K87 T136	L49-T85 HydrophobicContact CB-CG2 4.36Å; L49-T85 HydrophobicContact CD1-CG2 4.41Å; L49-T85 PolarHBondContact N-O 3.04Å; L49-K87 HydrophobicContact CD1-CB 3.84Å; L49-K87 HydrophobicContact CD1-CD 4.29Å; L49-K87 HydrophobicContact CD2-CB 4.13Å; L49-K87 HydrophobicContact CD2-CD 4.27Å; L49-K87 HydrophobicContact CG-CB 3.79Å; L49-T136 HydrophobicContact CD1-CG2 3.68Å
50	E	94.9	Very high	85.7	Confident	28 Å²	28	59.1 Å²	59.1	13%	0.131	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	118.7	173.4	177.7	160.3	-144.2	0	0	110	I48 G73 A74 S75 T82 Y83 P84 T85	I48-E50 VanDerWaalsContact CG2-C 3.45Å; I48-E50 WeakPolarHBondContact CG2-O 3.32Å; E50-G73 WeakPolarHBondContact OE1-CA 3.36Å; E50-A74 PolarHBondContact OE1-N 3.37Å; E50-S75 WeakPolarHBondContact OE1-CB 3.36Å; E50-S75 PolarHBondContact OE1-N 3.41Å; E50-S75 PolarHBondContact OE1-OG 3.01Å; E50-T82 VanDerWaalsContact CD-OG1 3.26Å; E50-T82 WeakPolarHBondContact OE1-CB 3.49Å; E50-T82 PolarHBondContact OE1-OG1 2.95Å; E50-T82 WeakPolarHBondContact OE2-CB 3.28Å; E50-T82 PolarHBondContact OE2-OG1 2.77Å; E50-Y83 PolarHBondContact OE2-N 3.02Å; E50-P84 WeakPolarHBondContact O-CA 3.19Å; E50-T85 PolarHBondContact N-O 3.2Å; E50-T85 PolarHBondContact O-N 3.45Å
51	Q	96.1	Very high	88.3	Confident	52 Å²	52	58.6 Å²	58.6	24%	0.243	30%	0.3	C	S	.	.			trans	-66.8	153.5	172.1	-69.4	-71.9	3.8	0	0	110.7	I48 G73 A74 S239 E240	I48-Q51 HydrophobicContact CG2-CG 4.18Å; Q51-G73 CarbonylContact O-C 3.56Å; Q51-G73 WeakPolarHBondContact O-CA 3.33Å; Q51-A74 HydrophobicContact CB-CB 4.27Å; Q51-A74 WeakPolarHBondContact O-CB 3.31Å; Q51-A74 PolarHBondContact O-N 3.41Å; Q51-S239 VanDerWaalsContact OE1-CA 3.3Å; Q51-E240 HydrophobicContact CG-CG 4.2Å
52	P	95.3	Very high	90	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-64.7	154.4	168	31.9	-36.1	0	0	0	110.9	Q54 L71 P84 L217 I242	P52-Q54 PolarHBondContact O-N 2.88Å; P52-L71 HydrophobicContact CB-CD1 4.41Å; P52-L71 HydrophobicContact CB-CD2 3.86Å; P52-L71 HydrophobicContact CB-CG 4.21Å; P52-P84 HydrophobicContact CB-CG 4Å; P52-L217 HydrophobicContact CB-CD1 4.2Å; P52-L217 HydrophobicContact CG-CD1 4.2Å; P52-I242 HydrophobicContact CB-CD1 3.75Å; P52-I242 HydrophobicContact CB-CG1 3.89Å; P52-I242 HydrophobicContact CG-CD1 3.8Å; P52-I242 HydrophobicContact CG-CG1 3.73Å
53	K	92.4	Very high	91.1	Very high	80 Å²	80	54.4 Å²	54.4	35%	0.348	30%	0.295	S	S	.	.			trans	-68.9	115.2	174	-166.1	170.4	-173.4	154.3	0	110	R55 P72	K53-R55 VanDerWaalsContact C-N 3.33Å; K53-R55 PolarHBondContact O-N 3.32Å; K53-P72 HydrophobicContact CB-CB 4.49Å; K53-P72 HydrophobicContact CB-CG 3.92Å; K53-P72 WeakPolarHBondContact CB-O 3.46Å; K53-P72 HydrophobicContact CD-CG 3.91Å; K53-P72 PolarHBondContact N-O 3.44Å
54	Q	90.8	Very high	91.4	Very high	87 Å²	87	55.1 Å²	55.1	41%	0.407	29%	0.292	S	S	.	.			trans	-61.1	-36.2	-173.2	-63.3	177.8	-10.5	0	0	113.5	P52 E240 P241 I242 Y243	P52-Q54 PolarHBondContact O-N 2.88Å; Q54-E240 HydrophobicContact CG-CB 4.08Å; Q54-P241 WeakPolarHBondContact CA-O 3.37Å; Q54-P241 WeakPolarHBondContact CB-O 3.35Å; Q54-P241 WeakPolarHBondContact CG-O 3.41Å; Q54-I242 WeakPolarHBondContact O-CA 3.49Å; Q54-Y243 WeakPolarHBondContact O-CD2 3.45Å; Q54-Y243 PolarHBondContact O-N 3.45Å
55	R	87.9	Confident	90.9	Very high	44 Å²	44	54.1 Å²	54.1	17%	0.166	29%	0.291	C	S	.	.	S	Bend	trans	-138.3	157.1	-172.9	-64.5	-172.3	178.7	-138.8	2	113	K53 F57 Y243 R338 D341 E343	K53-R55 VanDerWaalsContact C-N 3.33Å; K53-R55 PolarHBondContact O-N 3.32Å; R55-F57 VanDerWaalsContact C-N 3.34Å; R55-Y243 HydrophobicContact CG-CD2 3.83Å; R55-Y243 HydrophobicContact CG-CG 4.44Å; R55-R338 VanDerWaalsContact NH1-NH1 3.17Å; R55-D341 IonicContact CZ-OD2 3.05Å; R55-D341 IonicContact NH1-OD2 2.72Å; R55-D341 PolarHBondContact NH1-OD2 3.48Å; R55-D341 IonicContact NH2-OD2 2.73Å; R55-D341 PolarHBondContact NH2-OD2 2.86Å; R55-E343 WeakPolarHBondContact CD-OE1 3.08Å; R55-E343 IonicContact CZ-OE2 3.42Å; R55-E343 IonicContact NE-OE1 2.92Å; R55-E343 IonicContact NH1-OE1 3.86Å; R55-E343 IonicContact NH1-OE2 2.73Å; R55-E343 PolarHBondContact NH1-OE2 2.75Å
56	G	85.5	Confident	90	Very high	43 Å²	43	56.2 Å²	56.2	44%	0.443	31%	0.314	S	S	.	.	S	Bend	trans	83	3.9	-177.3	0	0	0	0	0	114.9
57	F	91.3	Very high	88.5	Confident	22 Å²	22	60.7 Å²	60.7	10%	0.096	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-86.4	153.6	164	-170.8	-109.2	0	0	0	110	R55 F59 L71 I144 S245	R55-F57 VanDerWaalsContact C-N 3.34Å; F57-F59 HydrophobicContact CD1-CD1 4.04Å; F57-F59 HydrophobicContact CD1-CE1 4.21Å; F57-F59 HydrophobicContact CE1-CD1 4.31Å; F57-L71 HydrophobicContact CB-CD1 4.07Å; F57-L71 HydrophobicContact CD1-CD1 3.8Å; F57-L71 HydrophobicContact CD2-CD1 4.08Å; F57-L71 HydrophobicContact CE1-CB 4.48Å; F57-L71 HydrophobicContact CE1-CD1 4.26Å; F57-L71 HydrophobicContact CE2-CB 4.18Å; F57-L71 HydrophobicContact CG-CD1 3.7Å; F57-L71 HydrophobicContact CZ-CB 4.17Å; F57-I144 HydrophobicContact CD1-CD1 4.11Å; F57-I144 HydrophobicContact CE1-CB 4.15Å; F57-I144 HydrophobicContact CE1-CD1 3.92Å; F57-I144 HydrophobicContact CE1-CG1 4.06Å; F57-S245 VanDerWaalsContact C-OG 3.3Å; F57-S245 WeakPolarHBondContact O-CB 3.39Å; F57-S245 PolarHBondContact O-N 3.14Å; F57-S245 PolarHBondContact O-OG 2.76Å
58	R	92.3	Very high	87.1	Confident	74 Å²	74	61.1 Å²	61.1	28%	0.279	35%	0.348	S	S	.	.			trans	-118.9	127	-179.7	170.1	174.9	176.4	-172.5	7.5	110.2	R60 E64 D244 K246	R58-R60 VanDerWaalsContact NH1-NH1 3.18Å; R58-E64 IonicContact CZ-OE1 3.61Å; R58-E64 IonicContact CZ-OE2 3.96Å; R58-E64 IonicContact NE-OE1 2.73Å; R58-E64 IonicContact NE-OE2 2.71Å; R58-E64 PolarHBondContact NE-OE2 2.94Å; R58-E64 IonicContact NH1-OE2 3.59Å; R58-E64 PolarHBondContact NH1-OE2 3.32Å; R58-E64 IonicContact NH2-OE1 3.51Å; R58-E64 PolarHBondContact NH2-OE1 3.49Å; R58-E64 IonicContact NH2-OE2 3.16Å; R58-E64 PolarHBondContact NH2-OE2 3Å; R58-D244 WeakPolarHBondContact CA-OD1 3.32Å; R58-K246 HydrophobicContact CG-CG 3.88Å
59	F	93.9	Very high	86.3	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.009	37%	0.368	C	S	.	.			trans	-77.2	149	169.1	-53.4	-9.3	0	0	0	109.6	F57 H114 I144 H146 V215 I242 D244	F57-F59 HydrophobicContact CD1-CD1 4.04Å; F57-F59 HydrophobicContact CD1-CE1 4.21Å; F57-F59 HydrophobicContact CE1-CD1 4.31Å; F59-H114 AromaticContact CD2-CD2 3.53Å; F59-H114 AromaticContact CD2-NE2 3.46Å; F59-H114 WeakPolarHBondContact CD2-NE2 3.46Å; F59-H114 AromaticContact CE2-CD2 3.83Å; F59-H114 AromaticContact CE2-NE2 3.85Å; F59-I144 WeakPolarHBondContact CA-O 3.23Å; F59-I144 HydrophobicContact CB-CG2 4.24Å; F59-I144 HydrophobicContact CD1-CB 3.73Å; F59-I144 HydrophobicContact CD1-CD1 3.89Å; F59-I144 HydrophobicContact CD1-CG1 4.41Å; F59-I144 HydrophobicContact CD1-CG2 3.68Å; F59-I144 HydrophobicContact CD2-CG2 4.03Å; F59-I144 HydrophobicContact CE1-CB 4.24Å; F59-I144 HydrophobicContact CE1-CD1 3.52Å; F59-I144 HydrophobicContact CE1-CG1 4.48Å; F59-I144 HydrophobicContact CE1-CG2 4.07Å; F59-I144 HydrophobicContact CE2-CG2 4.38Å; F59-I144 HydrophobicContact CG-CB 4.15Å; F59-I144 HydrophobicContact CG-CG2 3.7Å; F59-I144 HydrophobicContact CZ-CD1 4.28Å; F59-I144 HydrophobicContact CZ-CG2 4.42Å; F59-H146 HydrophobicContact CB-CB 3.99Å; F59-V215 HydrophobicContact CE1-CG2 4.35Å; F59-V215 HydrophobicContact CE2-CG1 4.04Å; F59-V215 HydrophobicContact CE2-CG2 4.36Å; F59-V215 HydrophobicContact CZ-CG1 4.25Å; F59-V215 HydrophobicContact CZ-CG2 3.74Å; F59-I242 HydrophobicContact CE1-CG2 3.98Å; F59-I242 HydrophobicContact CZ-CG2 4.4Å; F59-D244 HydrophobicContact CB-CB 4.39Å; F59-D244 HydrophobicContact CD1-CB 4.19Å; F59-D244 HydrophobicContact CD2-CB 3.62Å; F59-D244 HydrophobicContact CE1-CB 4.3Å; F59-D244 HydrophobicContact CE2-CB 3.76Å; F59-D244 HydrophobicContact CG-CB 3.82Å; F59-D244 HydrophobicContact CZ-CB 4.08Å; F59-D244 PolarHBondContact N-OD1 2.73Å
60	R	92.9	Very high	86.1	Confident	52 Å²	52	59.1 Å²	59.1	20%	0.196	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-124.2	132.8	-167.8	-62.2	-62.8	-176.8	144.5	13.2	111.8	R58 E64 H68 I144 L145 H146	R58-R60 VanDerWaalsContact NH1-NH1 3.18Å; R60-E64 WeakPolarHBondContact CA-OE1 3.44Å; R60-E64 HydrophobicContact CB-CB 4.34Å; R60-E64 WeakPolarHBondContact CD-OE2 3.44Å; R60-E64 IonicContact CZ-OE2 2.73Å; R60-E64 IonicContact NE-OE2 2.94Å; R60-E64 IonicContact NH1-OE2 4Å; R60-E64 PolarHBondContact NH1-OE2 2.74Å; R60-H68 HydrophobicContact CG-CB 4.36Å; R60-H68 PolarHBondContact NH1-CD2 3.42Å; R60-H68 PolarHBondContact NH1-NE2 3.25Å; R60-H68 PolarHBondContact NH2-ND1 2.79Å; R60-I144 PolarHBondContact N-O 3.42Å; R60-L145 CarbonylContact O-C 3.58Å; R60-L145 VanDerWaalsContact O-CA 3.32Å; R60-L145 WeakPolarHBondContact O-CA 3.09Å; R60-H146 PolarHBondContact O-N 3.16Å
61	Y	92.4	Very high	86	Confident	91 Å²	91	57.8 Å²	57.8	36%	0.357	35%	0.35	S	S	.	.			trans	-72.8	158.6	169.5	-66.9	-86.8	0	0	0	110.6	C63 E64 H146 T148	Y61-C63 VanDerWaalsContact C-N 3.26Å; Y61-C63 PolarHBondContact O-N 3.27Å; Y61-E64 PolarHBondContact N-OE1 3.44Å; Y61-E64 VanDerWaalsContact N-OE1 3.14Å; Y61-E64 WeakPolarHBondContact O-CB 3.4Å; Y61-E64 PolarHBondContact O-N 2.82Å; Y61-H146 HydrophobicContact CD1-CB 4.35Å; Y61-H146 HydrophobicContact CE1-CB 4.29Å; Y61-H146 AromaticContact CE1-CG 3.97Å; Y61-H146 AromaticContact CE1-ND1 3.43Å; Y61-H146 WeakPolarHBondContact CE1-ND1 3.43Å; Y61-H146 AromaticContact CZ-CE1 3.85Å; Y61-H146 AromaticContact CZ-CG 3.84Å; Y61-H146 AromaticContact CZ-ND1 3.54Å; Y61-H146 PolarHBondContact OH-CE1 3.38Å; Y61-H146 VanDerWaalsContact OH-CE1 3.28Å; Y61-H146 PolarHBondContact OH-ND1 3.38Å; Y61-T148 HydrophobicContact CD1-CG2 4.06Å; Y61-T148 HydrophobicContact CE1-CG2 4.14Å
62	G	86.1	Confident	85.9	Confident	58 Å²	58	56.8 Å²	56.8	60%	0.598	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-56.8	-39.2	-179.2	0	0	0	0	0	113.5	E64 G65	G62-E64 PolarHBondContact O-N 2.74Å; G62-E64 VanDerWaalsContact O-N 3.16Å; G62-G65 PolarHBondContact O-N 3.01Å; G62-G65 VanDerWaalsContact O-N 3.16Å
63	C	86.3	Confident	85.8	Confident	127 Å²	127	56.8 Å²	56.8	86%	0.858	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-67.8	-4.1	174.5	55	0	0	0	0	115.2	Y61	Y61-C63 VanDerWaalsContact C-N 3.26Å; Y61-C63 PolarHBondContact O-N 3.27Å
64	E	85.7	Confident	85.7	Confident	40 Å²	40	55.8 Å²	55.8	19%	0.187	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-88	-6.5	171.2	-60.5	-168.8	-125	0	0	113.5	R58 R60 Y61 G62 H68	R58-E64 IonicContact CZ-OE1 3.61Å; R58-E64 IonicContact CZ-OE2 3.96Å; R58-E64 IonicContact NE-OE1 2.73Å; R58-E64 IonicContact NE-OE2 2.71Å; R58-E64 PolarHBondContact NE-OE2 2.94Å; R58-E64 IonicContact NH1-OE2 3.59Å; R58-E64 PolarHBondContact NH1-OE2 3.32Å; R58-E64 IonicContact NH2-OE1 3.51Å; R58-E64 PolarHBondContact NH2-OE1 3.49Å; R58-E64 IonicContact NH2-OE2 3.16Å; R58-E64 PolarHBondContact NH2-OE2 3Å; R60-E64 WeakPolarHBondContact CA-OE1 3.44Å; R60-E64 HydrophobicContact CB-CB 4.34Å; R60-E64 WeakPolarHBondContact CD-OE2 3.44Å; R60-E64 IonicContact CZ-OE2 2.73Å; R60-E64 IonicContact NE-OE2 2.94Å; R60-E64 IonicContact NH1-OE2 4Å; R60-E64 PolarHBondContact NH1-OE2 2.74Å; Y61-E64 PolarHBondContact N-OE1 3.44Å; Y61-E64 VanDerWaalsContact N-OE1 3.14Å; Y61-E64 WeakPolarHBondContact O-CB 3.4Å; Y61-E64 PolarHBondContact O-N 2.82Å; G62-E64 PolarHBondContact O-N 2.74Å; G62-E64 VanDerWaalsContact O-N 3.16Å; E64-H68 PolarHBondContact O-CD2 2.78Å
65	G	79	Confident	85.7	Confident	33 Å²	33	54.7 Å²	54.7	34%	0.34	36%	0.357	S	S	.	.			trans	72	170.1	-179.4	0	0	0	0	0	115.4	G62	G62-G65 PolarHBondContact O-N 3.01Å; G62-G65 VanDerWaalsContact O-N 3.16Å
66	P	72.1	Confident	85.9	Confident	131 Å²	131	53.4 Å²	53.4	85%	0.851	35%	0.354	S	S	*	.	S	Bend	trans	-87.2	-11.1	-167.6	33.5	-37	0	0	0	115.2	H68	P66-H68 VanDerWaalsContact C-N 3.34Å; P66-H68 PolarHBondContact O-N 3.03Å
67	S	60.3	Low	85.9	Confident	106 Å²	106	56.4 Å²	56.4	74%	0.741	36%	0.356	S	S	*	.			trans	-85.4	5.2	-161.1	56.5	0	0	0	0	115.7	G69	S67-G69 VanDerWaalsContact C-N 3.29Å; S67-G69 PolarHBondContact O-N 3.06Å; S67-G69 VanDerWaalsContact O-N 3.11Å
68	H	64.9	Low	85.4	Confident	96 Å²	96	65 Å²	65	44%	0.444	39%	0.394	S	S	.	.	S	Bend	trans	-80.7	11.1	-163.6	-90.4	-43.4	0	0	0	117.9	R60 E64 P66	R60-H68 HydrophobicContact CG-CB 4.36Å; R60-H68 PolarHBondContact NH1-CD2 3.42Å; R60-H68 PolarHBondContact NH1-NE2 3.25Å; R60-H68 PolarHBondContact NH2-ND1 2.79Å; E64-H68 PolarHBondContact O-CD2 2.78Å; P66-H68 VanDerWaalsContact C-N 3.34Å; P66-H68 PolarHBondContact O-N 3.03Å
69	G	78.4	Confident	84.9	Confident	52 Å²	52	69.3 Å²	69.3	54%	0.536	42%	0.423	S	S	.	.			trans	90	146.5	173.4	0	0	0	0	0	114.6	S67	S67-G69 VanDerWaalsContact C-N 3.29Å; S67-G69 PolarHBondContact O-N 3.06Å; S67-G69 VanDerWaalsContact O-N 3.11Å
70	G	88.8	Confident	84.6	Confident	24 Å²	24	76.1 Å²	76.1	25%	0.247	45%	0.448	C	S	.	.			trans	-78.8	153.6	-176.6	0	0	0	0	0	114.7	P72 L142	G70-P72 WeakPolarHBondContact O-CD 3.49Å; G70-L142 CarbonylContact C-O 3.48Å; G70-L142 WeakPolarHBondContact CA-O 3.36Å
71	L	93.1	Very high	84.5	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	47%	0.47	C	S	.	.			trans	-55.6	114.7	174.2	177.4	67	0	0	0	110.8	P52 F57 P84 L142 L217 I242	P52-L71 HydrophobicContact CB-CD1 4.41Å; P52-L71 HydrophobicContact CB-CD2 3.86Å; P52-L71 HydrophobicContact CB-CG 4.21Å; F57-L71 HydrophobicContact CB-CD1 4.07Å; F57-L71 HydrophobicContact CD1-CD1 3.8Å; F57-L71 HydrophobicContact CD2-CD1 4.08Å; F57-L71 HydrophobicContact CE1-CB 4.48Å; F57-L71 HydrophobicContact CE1-CD1 4.26Å; F57-L71 HydrophobicContact CE2-CB 4.18Å; F57-L71 HydrophobicContact CG-CD1 3.7Å; F57-L71 HydrophobicContact CZ-CB 4.17Å; L71-P84 HydrophobicContact CD2-CG 4.05Å; L71-P84 HydrophobicContact CG-CG 4.18Å; L71-P84 VanDerWaalsContact O-CD 3.27Å; L71-P84 WeakPolarHBondContact O-CD 3.34Å; L71-L142 HydrophobicContact CB-CB 4.2Å; L71-L142 VanDerWaalsContact CB-O 3.27Å; L71-L142 WeakPolarHBondContact CB-O 3.49Å; L71-L142 PolarHBondContact N-O 3.03Å; L71-L217 HydrophobicContact CD2-CD1 3.89Å; L71-I242 HydrophobicContact CD1-CD1 4.21Å; L71-I242 HydrophobicContact CD1-CG2 4.07Å; L71-I242 HydrophobicContact CD2-CD1 3.64Å
72	P	93.8	Very high	84.5	Confident	30 Å²	30	77.6 Å²	77.6	20%	0.195	46%	0.46	C	S	.	.			trans	-75	157.9	178.4	28.3	-31.8	0	0	0	112	K53 G70	K53-P72 HydrophobicContact CB-CB 4.49Å; K53-P72 HydrophobicContact CB-CG 3.92Å; K53-P72 WeakPolarHBondContact CB-O 3.46Å; K53-P72 HydrophobicContact CD-CG 3.91Å; K53-P72 PolarHBondContact N-O 3.44Å; G70-P72 WeakPolarHBondContact O-CD 3.49Å
73	G	94	Very high	84.9	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	44%	0.444	C	S	.	.	B	Isolated β-bridge	trans	-73.5	163.7	168.5	0	0	0	0	0	112.4	E50 Q51 S75 S76 T82	E50-G73 WeakPolarHBondContact OE1-CA 3.36Å; Q51-G73 CarbonylContact O-C 3.56Å; Q51-G73 WeakPolarHBondContact O-CA 3.33Å; G73-S75 VanDerWaalsContact C-N 3.26Å; G73-S75 PolarHBondContact O-N 2.96Å; G73-S76 WeakPolarHBondContact O-CB 3.26Å; G73-S76 PolarHBondContact O-N 3.34Å; G73-S76 VanDerWaalsContact O-N 3.15Å; G73-T82 PolarHBondContact N-O 2.82Å
74	A	91.3	Very high	85.3	Confident	60 Å²	60	72 Å²	72	50%	0.496	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.8	-178.1	0	0	0	0	0	113.3	E50 Q51 S76	E50-A74 PolarHBondContact OE1-N 3.37Å; Q51-A74 HydrophobicContact CB-CB 4.27Å; Q51-A74 WeakPolarHBondContact O-CB 3.31Å; Q51-A74 PolarHBondContact O-N 3.41Å; A74-S76 VanDerWaalsContact C-N 3.33Å
75	S	90.9	Very high	85.7	Confident	64 Å²	64	71.3 Å²	71.3	45%	0.448	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	11.2	176.8	71.9	0	0	0	0	114.2	E50 G73 E77 T82	E50-S75 WeakPolarHBondContact OE1-CB 3.36Å; E50-S75 PolarHBondContact OE1-N 3.41Å; E50-S75 PolarHBondContact OE1-OG 3.01Å; G73-S75 VanDerWaalsContact C-N 3.26Å; G73-S75 PolarHBondContact O-N 2.96Å; S75-E77 PolarHBondContact O-N 2.96Å; S75-T82 PolarHBondContact OG-OG1 3.37Å
76	S	90.6	Very high	86.5	Confident	16 Å²	16	69.8 Å²	69.8	11%	0.112	39%	0.386	C	S	.	.			trans	-80.4	118.4	-170	-160.9	0	0	0	0	112.5	G73 A74 K81 T82	G73-S76 WeakPolarHBondContact O-CB 3.26Å; G73-S76 PolarHBondContact O-N 3.34Å; G73-S76 VanDerWaalsContact O-N 3.15Å; A74-S76 VanDerWaalsContact C-N 3.33Å; S76-K81 WeakPolarHBondContact OG-CA 3.37Å; S76-T82 WeakPolarHBondContact CA-OG1 3.35Å; S76-T82 WeakPolarHBondContact CB-O 3.41Å; S76-T82 VanDerWaalsContact CB-OG1 3.29Å; S76-T82 WeakPolarHBondContact CB-OG1 3.47Å; S76-T82 PolarHBondContact N-OG1 2.88Å; S76-T82 VanDerWaalsContact N-OG1 3.09Å; S76-T82 PolarHBondContact OG-N 2.92Å; S76-T82 PolarHBondContact OG-O 3.48Å
77	E	86	Confident	87.5	Confident	106 Å²	106	67.1 Å²	67.1	50%	0.495	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-111.1	162.4	-177.1	-70.2	169	-128.2	0	0	111.6	S75 N79 R80	S75-E77 PolarHBondContact O-N 2.96Å; E77-N79 PolarHBondContact O-N 3Å; E77-N79 VanDerWaalsContact O-N 3.12Å; E77-R80 PolarHBondContact N-O 3.05Å; E77-R80 CarbonylContact O-C 3.2Å; E77-R80 VanDerWaalsContact O-C 3.26Å; E77-R80 PolarHBondContact O-N 3.36Å; E77-R80 VanDerWaalsContact O-N 3.15Å; E77-R80 IonicContact OE1-CZ 3.38Å; E77-R80 IonicContact OE1-NE 3.6Å; E77-R80 IonicContact OE1-NH2 3.09Å; E77-R80 PolarHBondContact OE1-NH2 3.49Å
78	K	80.1	Confident	89	Confident	204 Å²	204	62.3 Å²	62.3	89%	0.887	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.4	179.5	-70	176.4	-179.9	168.9	0	113.4
79	N	82	Confident	90.2	Very high	164 Å²	164	58.2 Å²	58.2	88%	0.877	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-12.8	-176.3	-58.5	-15.1	0	0	0	113.5	E77	E77-N79 PolarHBondContact O-N 3Å; E77-N79 VanDerWaalsContact O-N 3.12Å
80	R	88.9	Confident	90.7	Very high	144 Å²	144	60.3 Å²	60.3	54%	0.543	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-139.8	89.4	-178.3	-177.8	-177.8	61.2	-176	-6.8	108.4	E77 T82	E77-R80 PolarHBondContact N-O 3.05Å; E77-R80 CarbonylContact O-C 3.2Å; E77-R80 VanDerWaalsContact O-C 3.26Å; E77-R80 PolarHBondContact O-N 3.36Å; E77-R80 VanDerWaalsContact O-N 3.15Å; E77-R80 IonicContact OE1-CZ 3.38Å; E77-R80 IonicContact OE1-NE 3.6Å; E77-R80 IonicContact OE1-NH2 3.09Å; E77-R80 PolarHBondContact OE1-NH2 3.49Å; R80-T82 HydrophobicContact CG-CG2 4.16Å; R80-T82 PolarHBondContact O-N 2.88Å
81	K	89.3	Confident	90.5	Very high	151 Å²	151	61.4 Å²	61.4	66%	0.657	31%	0.305	S	S	*	.			trans	-74	119.4	176.9	-65.6	-178.1	-177.6	177	0	109.8	S76 Y83	S76-K81 WeakPolarHBondContact OG-CA 3.37Å; K81-Y83 HydrophobicContact CB-CE2 4.21Å
82	T	93	Very high	90	Very high	23 Å²	23	69.6 Å²	69.6	14%	0.141	34%	0.343	C	S	.	.			trans	-118.5	168.6	172.1	73.3	0	0	0	0	109.4	E50 G73 S75 S76 R80	E50-T82 VanDerWaalsContact CD-OG1 3.26Å; E50-T82 WeakPolarHBondContact OE1-CB 3.49Å; E50-T82 PolarHBondContact OE1-OG1 2.95Å; E50-T82 WeakPolarHBondContact OE2-CB 3.28Å; E50-T82 PolarHBondContact OE2-OG1 2.77Å; G73-T82 PolarHBondContact N-O 2.82Å; S75-T82 PolarHBondContact OG-OG1 3.37Å; S76-T82 WeakPolarHBondContact CA-OG1 3.35Å; S76-T82 WeakPolarHBondContact CB-O 3.41Å; S76-T82 VanDerWaalsContact CB-OG1 3.29Å; S76-T82 WeakPolarHBondContact CB-OG1 3.47Å; S76-T82 PolarHBondContact N-OG1 2.88Å; S76-T82 VanDerWaalsContact N-OG1 3.09Å; S76-T82 PolarHBondContact OG-N 2.92Å; S76-T82 PolarHBondContact OG-O 3.48Å; R80-T82 HydrophobicContact CG-CG2 4.16Å; R80-T82 PolarHBondContact O-N 2.88Å
83	Y	94	Very high	89.5	Confident	69 Å²	69	68.9 Å²	68.9	27%	0.271	34%	0.341	S	S	.	.			trans	-150.5	153	-160.3	-62.1	-72.5	0	0	0	112	E50 K81 T85 P140	E50-Y83 PolarHBondContact OE2-N 3.02Å; K81-Y83 HydrophobicContact CB-CE2 4.21Å; Y83-T85 PolarHBondContact O-N 3.08Å; Y83-T85 VanDerWaalsContact O-N 3.12Å; Y83-T85 PolarHBondContact O-OG1 2.89Å; Y83-P140 VanDerWaalsContact CD1-CA 3.43Å; Y83-P140 HydrophobicContact CD1-CB 3.84Å; Y83-P140 HydrophobicContact CD2-CB 3.73Å; Y83-P140 HydrophobicContact CE1-CB 3.87Å; Y83-P140 WeakPolarHBondContact CE1-O 3.29Å; Y83-P140 HydrophobicContact CE2-CB 3.79Å; Y83-P140 HydrophobicContact CG-CB 3.74Å
84	P	95.1	Very high	89.3	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.363	C	S	.	.			trans	-50.6	122.9	175.7	-22.6	31.3	0	0	0	110.6	E50 P52 L71 S138 F139 L217 F219	E50-P84 WeakPolarHBondContact O-CA 3.19Å; P52-P84 HydrophobicContact CB-CG 4Å; L71-P84 HydrophobicContact CD2-CG 4.05Å; L71-P84 HydrophobicContact CG-CG 4.18Å; L71-P84 VanDerWaalsContact O-CD 3.27Å; L71-P84 WeakPolarHBondContact O-CD 3.34Å; P84-S138 WeakPolarHBondContact O-CA 3.39Å; P84-F139 WeakPolarHBondContact O-CD2 3.3Å; P84-F139 PolarHBondContact O-N 3.21Å; P84-L217 HydrophobicContact CB-CD1 4.46Å; P84-F219 HydrophobicContact CB-CZ 4.46Å
85	T	94.6	Very high	89.3	Confident	25 Å²	25	70.8 Å²	70.8	15%	0.153	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	130.6	-169.7	-61.5	0	0	0	0	110.3	L49 E50 Y83 I137 S138	L49-T85 HydrophobicContact CB-CG2 4.36Å; L49-T85 HydrophobicContact CD1-CG2 4.41Å; L49-T85 PolarHBondContact N-O 3.04Å; E50-T85 PolarHBondContact N-O 3.2Å; E50-T85 PolarHBondContact O-N 3.45Å; Y83-T85 PolarHBondContact O-N 3.08Å; Y83-T85 VanDerWaalsContact O-N 3.12Å; Y83-T85 PolarHBondContact O-OG1 2.89Å; T85-I137 WeakPolarHBondContact CA-O 3.47Å; T85-I137 WeakPolarHBondContact CG2-O 3.44Å; T85-S138 WeakPolarHBondContact OG1-CB 3.17Å
86	V	94.9	Very high	89.3	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.8	178.7	-51.9	0	0	0	0	111.4	L46 Q47 I48 V97 T136 I137 F139 F219	L46-V86 HydrophobicContact CD1-CB 4.09Å; L46-V86 HydrophobicContact CD1-CG2 3.89Å; Q47-V86 CarbonylContact O-C 3.57Å; Q47-V86 VanDerWaalsContact O-CA 3.28Å; Q47-V86 WeakPolarHBondContact O-CA 3.48Å; I48-V86 HydrophobicContact CG1-CG1 4.01Å; V86-V97 HydrophobicContact CG2-CG1 4.27Å; V86-T136 CarbonylContact O-C 3.59Å; V86-T136 WeakPolarHBondContact O-CA 3.44Å; V86-I137 HydrophobicContact CG2-CG2 3.51Å; V86-I137 PolarHBondContact N-O 3.13Å; V86-I137 PolarHBondContact O-N 3.41Å; V86-F139 HydrophobicContact CG2-CE2 4.08Å; V86-F219 HydrophobicContact CG1-CB 4.42Å; V86-F219 HydrophobicContact CG1-CD1 3.69Å; V86-F219 HydrophobicContact CG1-CD2 3.98Å; V86-F219 HydrophobicContact CG1-CE1 3.84Å; V86-F219 HydrophobicContact CG1-CE2 4.09Å; V86-F219 HydrophobicContact CG1-CG 3.78Å; V86-F219 HydrophobicContact CG1-CZ 4.03Å; V86-F219 HydrophobicContact CG2-CD1 4.49Å
87	K	93.4	Very high	89.3	Confident	75 Å²	75	70.4 Å²	70.4	33%	0.326	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.4	180	-175.9	178.7	174.3	-172.3	0	109.9	Q47 L49 S135 T136	Q47-K87 PolarHBondContact N-O 3.39Å; Q47-K87 PolarHBondContact O-N 3.22Å; L49-K87 HydrophobicContact CD1-CB 3.84Å; L49-K87 HydrophobicContact CD1-CD 4.29Å; L49-K87 HydrophobicContact CD2-CB 4.13Å; L49-K87 HydrophobicContact CD2-CD 4.27Å; L49-K87 HydrophobicContact CG-CB 3.79Å; K87-S135 CarbonylContact C-O 3.55Å; K87-S135 VanDerWaalsContact CA-O 3.28Å; K87-S135 WeakPolarHBondContact CA-O 3.29Å; K87-S135 WeakPolarHBondContact CG-O 3.41Å; K87-T136 HydrophobicContact CB-CG2 3.95Å; K87-T136 HydrophobicContact CD-CG2 4.18Å; K87-T136 HydrophobicContact CG-CG2 3.82Å
88	I	92.7	Very high	89.5	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.4	163.2	-48.2	-178.2	0	0	0	107	F45 L46 Y91 A95 V97 L130 S135 A221 L223 L234	F45-I88 CarbonylContact O-C 3.59Å; F45-I88 WeakPolarHBondContact O-CA 3.46Å; L46-I88 HydrophobicContact CD1-CG1 4.07Å; I88-Y91 HydrophobicContact CG2-CD1 4.37Å; I88-Y91 HydrophobicContact CG2-CG 4.38Å; I88-A95 HydrophobicContact CD1-CB 3.38Å; I88-V97 HydrophobicContact CD1-CG2 4.43Å; I88-L130 HydrophobicContact CD1-CD2 3.91Å; I88-L130 HydrophobicContact CG1-CD2 4.34Å; I88-S135 PolarHBondContact N-O 3Å; I88-A221 HydrophobicContact CD1-CB 4.01Å; I88-A221 HydrophobicContact CG1-CB 4.43Å; I88-L223 HydrophobicContact CD1-CD2 4.36Å; I88-L234 HydrophobicContact CG2-CD1 3.8Å
89	C	89.4	Confident	90.2	Very high	11 Å²	11	55.8 Å²	55.8	7%	0.074	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	153.7	175.4	-74	0	0	0	0	110.2	P44 F45 Q47 Y91	P44-C89 WeakPolarHBondContact CA-O 3.39Å; F45-C89 HydrophobicContact CD1-CB 3.81Å; F45-C89 HydrophobicContact CD2-CB 4.09Å; F45-C89 HydrophobicContact CE1-CB 3.39Å; F45-C89 HydrophobicContact CE2-CB 3.7Å; F45-C89 HydrophobicContact CG-CB 4.15Å; F45-C89 HydrophobicContact CZ-CB 3.33Å; F45-C89 PolarHBondContact N-O 3.19Å; F45-C89 VanDerWaalsContact N-O 3.09Å; F45-C89 PolarHBondContact O-N 2.95Å; Q47-C89 PolarHBondContact OE1-SG 3.24Å; C89-Y91 PolarHBondContact O-N 3.2Å; C89-Y91 VanDerWaalsContact O-N 3.16Å
90	N	88.3	Confident	90.7	Very high	95 Å²	95	48.2 Å²	48.2	51%	0.508	22%	0.22	S	C	.	.	S	Bend	trans	54.8	26.9	-177.2	-59.5	-8.8	0	0	0	114.7	V41 G43	V41-N90 PolarHBondContact O-ND2 3.01Å; G43-N90 VanDerWaalsContact O-CB 3.27Å; G43-N90 WeakPolarHBondContact O-CB 3.5Å; G43-N90 PolarHBondContact O-ND2 2.96Å
91	Y	85.6	Confident	90.9	Very high	48 Å²	48	41.4 Å²	41.4	19%	0.188	19%	0.194	C	C	.	.			trans	-142.1	143.4	175	-172.6	-107.1	0	0	0	111.9	I88 C89 Q94 A95 L223	I88-Y91 HydrophobicContact CG2-CD1 4.37Å; I88-Y91 HydrophobicContact CG2-CG 4.38Å; C89-Y91 PolarHBondContact O-N 3.2Å; C89-Y91 VanDerWaalsContact O-N 3.16Å; Y91-Q94 WeakPolarHBondContact CE1-O 3.42Å; Y91-Q94 PolarHBondContact OH-O 3.08Å; Y91-A95 HydrophobicContact CE1-CB 4.41Å; Y91-L223 HydrophobicContact CD1-CD2 3.79Å; Y91-L223 HydrophobicContact CD2-CD1 3.86Å; Y91-L223 HydrophobicContact CD2-CD2 4.42Å; Y91-L223 HydrophobicContact CE1-CD2 3.76Å; Y91-L223 HydrophobicContact CE2-CD1 3.96Å; Y91-L223 HydrophobicContact CE2-CD2 4.41Å; Y91-L223 HydrophobicContact CG-CD1 4.25Å; Y91-L223 HydrophobicContact CG-CD2 4.14Å
92	Q	81.9	Confident	91.1	Very high	172 Å²	172	34.2 Å²	34.2	80%	0.804	16%	0.163	S	C	*	.			trans	-139.1	121.8	168.8	-70.5	-175.5	-16.4	0	0	108.4
93	G	84.5	Confident	91.1	Very high	14 Å²	14	33.7 Å²	33.7	14%	0.144	16%	0.16	C	C	.	.	S	Bend	trans	153.6	-177.7	-171.3	0	0	0	0	0	110.9
94	Q	89.1	Confident	90.7	Very high	100 Å²	100	31 Å²	31	47%	0.467	15%	0.152	S	C	.	.			trans	-70.9	148.3	173.8	-61.7	179.4	-17.5	0	0	110.1	Y91 L130 S132 P224 F230	Y91-Q94 WeakPolarHBondContact CE1-O 3.42Å; Y91-Q94 PolarHBondContact OH-O 3.08Å; Q94-L130 WeakPolarHBondContact CA-O 3.46Å; Q94-S132 VanDerWaalsContact CG-OG 3.26Å; Q94-S132 WeakPolarHBondContact CG-OG 3.28Å; Q94-P224 HydrophobicContact CB-CG 4.49Å; Q94-P224 WeakPolarHBondContact O-CD 3.36Å; Q94-P224 WeakPolarHBondContact O-CG 3.47Å; Q94-F230 HydrophobicContact CB-CE1 4.14Å; Q94-F230 HydrophobicContact CB-CZ 4.36Å
95	A	90.7	Very high	89.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153.5	171.7	0	0	0	0	0	110.4	I88 Y91 D129 L130 L223	I88-A95 HydrophobicContact CD1-CB 3.38Å; Y91-A95 HydrophobicContact CE1-CB 4.41Å; A95-D129 WeakPolarHBondContact O-CA 3.33Å; A95-L130 HydrophobicContact CB-CB 4.3Å; A95-L130 HydrophobicContact CB-CD2 4.28Å; A95-L130 PolarHBondContact N-O 3.48Å; A95-L130 WeakPolarHBondContact O-CB 3.43Å; A95-L130 PolarHBondContact O-N 2.93Å; A95-L223 HydrophobicContact CB-CD2 3.83Å
96	R	90.4	Very high	88.9	Confident	73 Å²	73	38.3 Å²	38.3	28%	0.275	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.1	172.5	175.1	162.3	-69.7	173	2	109.5	V98 I127 D129 A221 F222 F230	R96-V98 HydrophobicContact CG-CG2 4.26Å; R96-I127 HydrophobicContact CG-CG2 3.8Å; R96-D129 WeakPolarHBondContact CB-OD1 3.45Å; R96-D129 VanDerWaalsContact CG-OD1 3.32Å; R96-D129 WeakPolarHBondContact CG-OD1 3.44Å; R96-D129 IonicContact CZ-OD1 3.48Å; R96-D129 IonicContact CZ-OD2 3.21Å; R96-D129 IonicContact NE-OD1 2.76Å; R96-D129 PolarHBondContact NE-OD1 3.04Å; R96-D129 IonicContact NE-OD2 2.76Å; R96-D129 IonicContact NH2-OD1 3.64Å; R96-D129 PolarHBondContact NH2-OD1 3.4Å; R96-D129 IonicContact NH2-OD2 3.41Å; R96-D129 PolarHBondContact NH2-OD2 3.48Å; R96-A221 CarbonylContact O-C 3.5Å; R96-A221 WeakPolarHBondContact O-CA 3.46Å; R96-F222 HydrophobicContact CB-CB 4.45Å; R96-F222 PolarHBondContact N-O 3.08Å; R96-F222 PolarHBondContact O-N 3.28Å; R96-F230 HydrophobicContact CB-CB 4.09Å; R96-F230 HydrophobicContact CB-CD1 3.99Å; R96-F230 HydrophobicContact CB-CD2 3.92Å; R96-F230 HydrophobicContact CB-CE1 4.41Å; R96-F230 HydrophobicContact CB-CE2 4.32Å; R96-F230 HydrophobicContact CB-CG 3.74Å
97	V	91.4	Very high	87.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.6	172.5	-175.8	0	0	0	0	109.2	V86 I88 A128 I137 F139 T220 A221	V86-V97 HydrophobicContact CG2-CG1 4.27Å; I88-V97 HydrophobicContact CD1-CG2 4.43Å; V97-A128 PolarHBondContact N-O 2.8Å; V97-A128 PolarHBondContact O-N 3.49Å; V97-I137 HydrophobicContact CB-CG2 4.35Å; V97-I137 HydrophobicContact CG2-CG2 4.04Å; V97-F139 HydrophobicContact CB-CZ 4.36Å; V97-F139 HydrophobicContact CG1-CZ 3.9Å; V97-T220 WeakPolarHBondContact CA-O 3.36Å; V97-A221 HydrophobicContact CG2-CB 4.28Å
98	V	91	Very high	87.2	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.4	175.5	-178.3	0	0	0	0	108.1	R96 Q100 I125 C126 I127 Y168 F219 T220 F222	R96-V98 HydrophobicContact CG-CG2 4.26Å; V98-Q100 HydrophobicContact CG1-CG 4.4Å; V98-I125 HydrophobicContact CG1-CG2 3.43Å; V98-I125 VanDerWaalsContact CG1-CG2 3.43Å; V98-C126 CarbonylContact C-O 3.56Å; V98-C126 WeakPolarHBondContact CA-O 3.26Å; V98-I127 HydrophobicContact CG2-CG1 4.42Å; V98-Y168 HydrophobicContact CG1-CD2 4.24Å; V98-Y168 HydrophobicContact CG1-CE2 4.4Å; V98-Y168 HydrophobicContact CG2-CE1 4.27Å; V98-Y168 HydrophobicContact CG2-CE2 4.39Å; V98-F219 WeakPolarHBondContact O-CA 3.5Å; V98-T220 PolarHBondContact N-O 3.28Å; V98-T220 PolarHBondContact O-N 2.98Å; V98-F222 HydrophobicContact CB-CE2 4.07Å; V98-F222 HydrophobicContact CG2-CD2 3.9Å; V98-F222 HydrophobicContact CG2-CE2 3.62Å
99	V	93.5	Very high	86.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.6	175.2	-158.1	0	0	0	0	109.4	L116 I125 C126 F139 L217 M218 F219	V99-L116 HydrophobicContact CB-CD1 4.01Å; V99-L116 HydrophobicContact CG1-CD1 4.06Å; V99-L116 WeakPolarHBondContact O-CD1 3.37Å; V99-I125 WeakPolarHBondContact O-CG2 3.46Å; V99-C126 HydrophobicContact CB-CB 3.92Å; V99-C126 HydrophobicContact CG2-CB 4.03Å; V99-C126 PolarHBondContact N-O 3.14Å; V99-C126 PolarHBondContact O-N 3.2Å; V99-F139 HydrophobicContact CG2-CD1 4.14Å; V99-F139 HydrophobicContact CG2-CE1 3.59Å; V99-F139 HydrophobicContact CG2-CE2 4.11Å; V99-F139 HydrophobicContact CG2-CZ 3.58Å; V99-L217 HydrophobicContact CG1-CB 4.08Å; V99-L217 HydrophobicContact CG1-CD2 4.01Å; V99-L217 HydrophobicContact CG1-CG 4.47Å; V99-M218 WeakPolarHBondContact CA-O 3.33Å; V99-F219 HydrophobicContact CB-CD1 4.3Å; V99-F219 HydrophobicContact CB-CE1 4.5Å; V99-F219 HydrophobicContact CG1-CD1 3.74Å; V99-F219 HydrophobicContact CG1-CE1 3.69Å; V99-F219 HydrophobicContact CG1-CG 4.39Å; V99-F219 HydrophobicContact CG1-CZ 4.33Å; V99-F219 HydrophobicContact CG2-CD1 3.7Å; V99-F219 HydrophobicContact CG2-CE1 3.95Å
100	Q	92.4	Very high	86.9	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.023	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160	177.2	-70.2	176.1	-33.7	0	0	110.5	V98 I125 Y168 L217 M218	V98-Q100 HydrophobicContact CG1-CG 4.4Å; Q100-I125 HydrophobicContact CG-CD1 4.43Å; Q100-I125 HydrophobicContact CG-CG1 4.28Å; Q100-I125 HydrophobicContact CG-CG2 4.14Å; Q100-Y168 PolarHBondContact NE2-O 2.99Å; Q100-Y168 PolarHBondContact OE1-O 2.97Å; Q100-L217 WeakPolarHBondContact O-CA 3.31Å; Q100-M218 PolarHBondContact N-O 3.29Å; Q100-M218 PolarHBondContact O-N 3.02Å
101	L	94.4	Very high	87.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.9	170	-74.9	162.9	0	0	0	109.7	H112 H114 L116 I144 V215 R216 L217	L101-H112 HydrophobicContact CB-CB 4.03Å; L101-H112 PolarHBondContact O-N 3.27Å; L101-H114 HydrophobicContact CD1-CB 4.33Å; L101-H114 WeakPolarHBondContact CD1-O 3.46Å; L101-L116 HydrophobicContact CD1-CD2 3.68Å; L101-L116 HydrophobicContact CD1-CG 3.71Å; L101-L116 HydrophobicContact CD2-CD2 4.07Å; L101-L116 HydrophobicContact CG-CD1 4.39Å; L101-L116 HydrophobicContact CG-CD2 3.76Å; L101-L116 HydrophobicContact CG-CG 3.77Å; L101-I144 HydrophobicContact CD1-CG1 4.45Å; L101-I144 HydrophobicContact CD1-CG2 4.17Å; L101-V215 HydrophobicContact CD2-CB 3.83Å; L101-V215 HydrophobicContact CD2-CG1 4.45Å; L101-V215 HydrophobicContact CD2-CG2 3.57Å; L101-R216 WeakPolarHBondContact CA-O 3.33Å; L101-L217 HydrophobicContact CD2-CD2 3.77Å; L101-L217 HydrophobicContact CG-CD2 4.45Å
102	V	93.6	Very high	87.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	159.4	179.3	-61.7	0	0	0	0	111.4	P109 Q110 V172 R216 M218 V238	V102-P109 HydrophobicContact CB-CB 4.22Å; V102-P109 HydrophobicContact CG1-CB 4.45Å; V102-P109 HydrophobicContact CG2-CB 4.35Å; V102-Q110 CarbonylContact C-O 3.53Å; V102-Q110 WeakPolarHBondContact CA-O 3.49Å; V102-Q110 VanDerWaalsContact CB-O 3.3Å; V102-Q110 WeakPolarHBondContact CB-O 3.13Å; V102-V172 HydrophobicContact CG1-CG2 4.01Å; V102-R216 HydrophobicContact CG2-CB 3.88Å; V102-R216 PolarHBondContact N-O 3.09Å; V102-R216 PolarHBondContact O-N 3.05Å; V102-M218 HydrophobicContact CG1-CB 3.89Å; V102-M218 HydrophobicContact CG1-SD 4.48Å; V102-M218 HydrophobicContact CG2-CB 4.11Å; V102-V238 HydrophobicContact CG2-CG1 4.06Å
103	T	92.8	Very high	88	Confident	12 Å²	12	38 Å²	38	7%	0.074	20%	0.195	C	C	.	.			trans	-60	149.4	174.6	49.7	0	0	0	0	112.4	T106 Q110 M210	T103-T106 WeakPolarHBondContact CB-OG1 3.44Å; T103-T106 PolarHBondContact OG1-OG1 3.3Å; T103-Q110 HydrophobicContact CG2-CB 3.88Å; T103-Q110 PolarHBondContact N-O 3.41Å; T103-Q110 PolarHBondContact OG1-N 3.34Å; T103-Q110 PolarHBondContact OG1-O 3.33Å; T103-M210 HydrophobicContact CG2-CE 3.97Å; T103-M210 HydrophobicContact CG2-SD 3.6Å; T103-M210 VanDerWaalsContact CG2-SD 3.6Å
104	A	84.6	Confident	88.6	Confident	14 Å²	14	37.3 Å²	37.3	12%	0.116	19%	0.188	C	C	.	.	S	Bend	trans	-100.5	-26.1	-176.5	0	0	0	0	0	115.4	V214 R216 P241	A104-V214 HydrophobicContact CB-CB 4.39Å; A104-V214 HydrophobicContact CB-CG1 3.96Å; A104-V214 HydrophobicContact CB-CG2 3.66Å; A104-R216 HydrophobicContact CB-CG 4.11Å; A104-R216 PolarHBondContact O-NH1 3.46Å; A104-P241 HydrophobicContact CB-CB 4.2Å
105	L	75	Confident	88.7	Confident	128 Å²	128	33.2 Å²	33.2	67%	0.67	17%	0.171	S	C	*	.	S	Bend	trans	-111.7	-5.4	-167.2	-58	178	0	0	0	114.4	V214	L105-V214 HydrophobicContact CD1-CG1 4.34Å; L105-V214 HydrophobicContact CG-CG1 4.37Å
106	T	78.3	Confident	88.9	Confident	49 Å²	49	33.3 Å²	33.3	30%	0.301	17%	0.171	S	C	.	.	S	Bend	trans	-85.8	146.7	-179.4	53.5	0	0	0	0	111.4	T103 L108	T103-T106 WeakPolarHBondContact CB-OG1 3.44Å; T103-T106 PolarHBondContact OG1-OG1 3.3Å; T106-L108 VanDerWaalsContact CB-O 3.3Å; T106-L108 WeakPolarHBondContact CB-O 3.21Å; T106-L108 PolarHBondContact O-N 3.47Å; T106-L108 PolarHBondContact OG1-O 3.45Å
107	Q	72.6	Confident	88.9	Confident	201 Å²	201	32.4 Å²	32.4	94%	0.939	17%	0.173	S	C	*	.	S	Bend	trans	-64.3	-26.1	-176.3	-171.8	176	6.5	0	0	113.7
108	L	79.1	Confident	88.7	Confident	114 Å²	114	34 Å²	34	60%	0.597	19%	0.19	S	C	*	.	S	Bend	trans	-118.6	145	164.9	-64.7	174.2	0	0	0	108.2	T106 Q110 A173	T106-L108 VanDerWaalsContact CB-O 3.3Å; T106-L108 WeakPolarHBondContact CB-O 3.21Å; T106-L108 PolarHBondContact O-N 3.47Å; T106-L108 PolarHBondContact OG1-O 3.45Å; L108-Q110 PolarHBondContact O-N 2.99Å; L108-A173 HydrophobicContact CB-CB 4.24Å; L108-A173 HydrophobicContact CD1-CB 4.33Å
109	P	85.2	Confident	88.3	Confident	39 Å²	39	42.7 Å²	42.7	25%	0.253	23%	0.228	S	C	.	.			trans	-59.7	136.5	172.2	-21.2	33	0	0	0	111.1	V102 V172 A173 V238	V102-P109 HydrophobicContact CB-CB 4.22Å; V102-P109 HydrophobicContact CG1-CB 4.45Å; V102-P109 HydrophobicContact CG2-CB 4.35Å; P109-V172 CarbonylContact O-C 3.59Å; P109-V172 WeakPolarHBondContact O-CA 3.39Å; P109-V172 WeakPolarHBondContact O-CG1 3.27Å; P109-A173 PolarHBondContact O-N 3.25Å; P109-V238 HydrophobicContact CG-CG2 4.47Å
110	Q	90.9	Very high	87.8	Confident	36 Å²	36	47.3 Å²	47.3	17%	0.168	25%	0.25	C	C	.	.			trans	-122.3	156.3	172.2	-68.7	175.9	-9.5	0	0	108.8	V102 T103 L108 H112 V172 Q206	V102-Q110 CarbonylContact C-O 3.53Å; V102-Q110 WeakPolarHBondContact CA-O 3.49Å; V102-Q110 VanDerWaalsContact CB-O 3.3Å; V102-Q110 WeakPolarHBondContact CB-O 3.13Å; T103-Q110 HydrophobicContact CG2-CB 3.88Å; T103-Q110 PolarHBondContact N-O 3.41Å; T103-Q110 PolarHBondContact OG1-N 3.34Å; T103-Q110 PolarHBondContact OG1-O 3.33Å; L108-Q110 PolarHBondContact O-N 2.99Å; Q110-H112 PolarHBondContact O-N 2.82Å; Q110-V172 VanDerWaalsContact CA-CG1 3.48Å; Q110-Q206 VanDerWaalsContact CD-CD 3.42Å
111	L	91.6	Very high	87.6	Confident	8 Å²	8	48.6 Å²	48.6	4%	0.042	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-65.4	134.8	178	-72	179.8	0	0	0	109.8	L156 R159 M160 A163 V172 I174 M210	L111-L156 HydrophobicContact CB-CD1 4Å; L111-L156 WeakPolarHBondContact O-CD1 3.28Å; L111-R159 HydrophobicContact CD1-CB 4.39Å; L111-M160 HydrophobicContact CD1-CB 4.46Å; L111-M160 HydrophobicContact CD1-CG 3.94Å; L111-A163 HydrophobicContact CD1-CB 3.81Å; L111-V172 HydrophobicContact CB-CG1 4.46Å; L111-V172 HydrophobicContact CD2-CG1 3.98Å; L111-V172 HydrophobicContact CD2-CG2 4.38Å; L111-V172 HydrophobicContact CG-CG1 3.84Å; L111-V172 VanDerWaalsContact N-CG1 3.26Å; L111-I174 HydrophobicContact CD1-CD1 4.26Å; L111-M210 VanDerWaalsContact O-CE 3.29Å; L111-M210 WeakPolarHBondContact O-CE 3.49Å
112	H	94.1	Very high	87.1	Confident	2 Å²	2	53 Å²	53	1%	0.009	28%	0.282	C	S	.	.			trans	-90.1	144.4	174.6	-158.6	-82.3	0	0	0	111.3	L101 Q110 H114 R159 M210 D211 V214	L101-H112 HydrophobicContact CB-CB 4.03Å; L101-H112 PolarHBondContact O-N 3.27Å; Q110-H112 PolarHBondContact O-N 2.82Å; H112-H114 AromaticContact CE1-CD2 2.71Å; H112-H114 PolarHBondContact CE1-CD2 2.99Å; H112-H114 AromaticContact CE1-CE1 3.68Å; H112-H114 AromaticContact CE1-CG 2.84Å; H112-H114 AromaticContact CE1-ND1 3.06Å; H112-H114 PolarHBondContact CE1-ND1 3.27Å; H112-H114 AromaticContact CE1-NE2 3.28Å; H112-H114 PolarHBondContact CE1-NE2 3.21Å; H112-H114 VanDerWaalsContact CE1-NE2 3.28Å; H112-H114 WeakPolarHBondContact ND1-CB 3.27Å; H112-H114 AromaticContact ND1-CD2 3.83Å; H112-H114 AromaticContact ND1-CG 3.49Å; H112-H114 PolarHBondContact ND1-N 3.29Å; H112-R159 PolarHBondContact O-NH2 3.47Å; H112-M210 PolarHBondContact CD2-SD 3.18Å; H112-D211 PolarHBondContact NE2-O 3.4Å; H112-V214 PolarHBondContact NE2-O 3.1Å; H112-V214 VanDerWaalsContact NE2-O 3.15Å
113	A	93.9	Very high	86.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-66.7	-37.1	179.6	0	0	0	0	0	112.6	V147 V152 R159	A113-V147 HydrophobicContact CB-CB 4.39Å; A113-V147 HydrophobicContact CB-CG1 4.49Å; A113-V147 HydrophobicContact CB-CG2 4.42Å; A113-V147 WeakPolarHBondContact O-CG2 3.47Å; A113-V152 HydrophobicContact CB-CG1 3.9Å; A113-R159 PolarHBondContact O-NH2 3.39Å
114	H	95.3	Very high	86.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.305	C	S	.	.	S	Bend	trans	-60.6	140.6	178	-66	-9.4	0	0	0	111.5	F59 L101 H112 I144 L145 H146 V147 R159 L212	F59-H114 AromaticContact CD2-CD2 3.53Å; F59-H114 AromaticContact CD2-NE2 3.46Å; F59-H114 WeakPolarHBondContact CD2-NE2 3.46Å; F59-H114 AromaticContact CE2-CD2 3.83Å; F59-H114 AromaticContact CE2-NE2 3.85Å; L101-H114 HydrophobicContact CD1-CB 4.33Å; L101-H114 WeakPolarHBondContact CD1-O 3.46Å; H112-H114 AromaticContact CE1-CD2 2.71Å; H112-H114 PolarHBondContact CE1-CD2 2.99Å; H112-H114 AromaticContact CE1-CE1 3.68Å; H112-H114 AromaticContact CE1-CG 2.84Å; H112-H114 AromaticContact CE1-ND1 3.06Å; H112-H114 PolarHBondContact CE1-ND1 3.27Å; H112-H114 AromaticContact CE1-NE2 3.28Å; H112-H114 PolarHBondContact CE1-NE2 3.21Å; H112-H114 VanDerWaalsContact CE1-NE2 3.28Å; H112-H114 WeakPolarHBondContact ND1-CB 3.27Å; H112-H114 AromaticContact ND1-CD2 3.83Å; H112-H114 AromaticContact ND1-CG 3.49Å; H112-H114 PolarHBondContact ND1-N 3.29Å; H114-I144 HydrophobicContact CB-CG2 4Å; H114-L145 VanDerWaalsContact CA-O 3.24Å; H114-L145 WeakPolarHBondContact CA-O 3.39Å; H114-L145 VanDerWaalsContact CB-O 3.3Å; H114-L145 WeakPolarHBondContact CB-O 3.34Å; H114-H146 AromaticContact CE1-CD2 3.59Å; H114-H146 AromaticContact CE1-CE1 2.82Å; H114-H146 PolarHBondContact CE1-CE1 3.49Å; H114-H146 AromaticContact CE1-CG 3.31Å; H114-H146 AromaticContact CE1-ND1 2.8Å; H114-H146 PolarHBondContact CE1-ND1 2.88Å; H114-H146 AromaticContact CE1-NE2 3.31Å; H114-H146 PolarHBondContact CE1-NE2 3.36Å; H114-H146 VanDerWaalsContact CE1-NE2 3.31Å; H114-H146 AromaticContact NE2-CD2 3.2Å; H114-H146 PolarHBondContact NE2-CD2 3.46Å; H114-H146 AromaticContact NE2-CE1 3.74Å; H114-H146 AromaticContact NE2-CG 3.74Å; H114-H146 AromaticContact NE2-NE2 3.2Å; H114-H146 PolarHBondContact NE2-NE2 3.08Å; H114-V147 PolarHBondContact CE1-N 3.04Å; H114-V147 VanDerWaalsContact CE1-N 3.33Å; H114-V147 PolarHBondContact CE1-O 3.37Å; H114-V147 PolarHBondContact ND1-N 2.7Å; H114-R159 PolarHBondContact O-NH2 3.44Å; H114-L212 WeakPolarHBondContact CE1-CB 3.38Å; H114-L212 WeakPolarHBondContact CE1-CD2 3.29Å; H114-L212 VanDerWaalsContact NE2-CA 3.26Å; H114-L212 WeakPolarHBondContact NE2-CA 3.25Å; H114-L212 WeakPolarHBondContact NE2-CB 3.35Å; H114-L212 PolarHBondContact NE2-O 2.69Å
115	S	92.9	Very high	86.3	Confident	14 Å²	14	58.1 Å²	58.1	10%	0.098	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.6	-169.7	-65.9	0	0	0	0	112.5	L145 R159	S115-L145 PolarHBondContact N-O 2.9Å; S115-L145 WeakPolarHBondContact O-CB 3.47Å; S115-L145 PolarHBondContact O-N 3.1Å; S115-R159 VanDerWaalsContact OG-CZ 3.29Å; S115-R159 PolarHBondContact OG-NE 3.07Å; S115-R159 PolarHBondContact OG-NH2 2.65Å
116	L	92.9	Very high	87.1	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.2	167.1	-65.8	172.3	0	0	0	110	V99 L101 C121 G124 C126 L142 G143 I144 L217	V99-L116 HydrophobicContact CB-CD1 4.01Å; V99-L116 HydrophobicContact CG1-CD1 4.06Å; V99-L116 WeakPolarHBondContact O-CD1 3.37Å; L101-L116 HydrophobicContact CD1-CD2 3.68Å; L101-L116 HydrophobicContact CD1-CG 3.71Å; L101-L116 HydrophobicContact CD2-CD2 4.07Å; L101-L116 HydrophobicContact CG-CD1 4.39Å; L101-L116 HydrophobicContact CG-CD2 3.76Å; L101-L116 HydrophobicContact CG-CG 3.77Å; L116-C121 WeakPolarHBondContact O-CB 3.34Å; L116-G124 WeakPolarHBondContact CB-O 3.31Å; L116-G124 PolarHBondContact N-O 3.28Å; L116-G124 VanDerWaalsContact O-CA 3.27Å; L116-G124 WeakPolarHBondContact O-CA 3.31Å; L116-C126 HydrophobicContact CD1-CB 4.14Å; L116-L142 HydrophobicContact CD2-CD2 4.45Å; L116-G143 WeakPolarHBondContact CA-O 3.4Å; L116-I144 HydrophobicContact CD2-CG1 4.34Å; L116-L217 HydrophobicContact CD1-CD2 4.3Å; L116-L217 HydrophobicContact CD2-CD2 3.84Å
117	V	91.1	Very high	87.7	Confident	53 Å²	53	52.5 Å²	52.5	32%	0.321	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.1	176.3	-66.9	0	0	0	0	109.8	G143 L145	V117-G143 PolarHBondContact N-O 3.29Å; V117-G143 PolarHBondContact O-N 3.3Å; V117-L145 HydrophobicContact CG1-CB 3.89Å; V117-L145 HydrophobicContact CG1-CD2 4.26Å; V117-L145 HydrophobicContact CG2-CB 4.43Å
118	G	86.8	Confident	88.5	Confident	35 Å²	35	43 Å²	43	36%	0.361	23%	0.228	S	C	.	.	S	Bend	trans	150.5	177.3	-175.6	0	0	0	0	0	113.2	Q120 C121 N141	G118-Q120 PolarHBondContact O-N 3.49Å; G118-C121 PolarHBondContact O-N 2.84Å; G118-C121 VanDerWaalsContact O-N 3.1Å; G118-N141 VanDerWaalsContact CA-O 3.31Å; G118-N141 WeakPolarHBondContact CA-O 3.29Å
119	K	82.4	Confident	89	Confident	184 Å²	184	41.3 Å²	41.3	80%	0.8	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.7	-173.8	-63.7	-168.6	176.1	-169.4	0	115.8
120	Q	84.7	Confident	89.1	Confident	97 Å²	97	40 Å²	40	45%	0.453	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.1	21.6	-178.1	-70.1	175.8	-53.3	0	0	111.3	G118 C126 I127	G118-Q120 PolarHBondContact O-N 3.49Å; Q120-C126 CarbonylContact O-C 3.56Å; Q120-C126 WeakPolarHBondContact O-CA 3.5Å; Q120-C126 PolarHBondContact O-SG 2.85Å; Q120-C126 VanDerWaalsContact O-SG 3.35Å; Q120-I127 PolarHBondContact O-N 3.4Å
121	C	87.9	Confident	88.7	Confident	31 Å²	31	45.2 Å²	45.2	21%	0.209	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.3	-175.8	-50.5	0	0	0	0	111.8	L116 G118 I125	L116-C121 WeakPolarHBondContact O-CB 3.34Å; G118-C121 PolarHBondContact O-N 2.84Å; G118-C121 VanDerWaalsContact O-N 3.1Å; C121-I125 CarbonylContact C-O 3.59Å; C121-I125 WeakPolarHBondContact CA-O 3.24Å
122	D	83.7	Confident	87.8	Confident	94 Å²	94	48 Å²	48	50%	0.503	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.1	167.1	-179.3	31	0	0	0	108.8	G124 I125	D122-G124 PolarHBondContact O-N 3.42Å; D122-I125 PolarHBondContact N-O 3.24Å; D122-I125 PolarHBondContact O-N 3Å; D122-I125 VanDerWaalsContact O-O 3.07Å
123	K	80.9	Confident	86.9	Confident	113 Å²	113	57.4 Å²	57.4	49%	0.491	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	37.6	177	-67.8	150.5	-160.5	146.7	0	115.1	R159	K123-R159 PolarHBondContact O-NE 3.37Å
124	G	83.3	Confident	86.3	Confident	7 Å²	7	61.3 Å²	61.3	7%	0.072	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	10.3	178	0	0	0	0	0	116.1	L116 D122 R159	L116-G124 WeakPolarHBondContact CB-O 3.31Å; L116-G124 PolarHBondContact N-O 3.28Å; L116-G124 VanDerWaalsContact O-CA 3.27Å; L116-G124 WeakPolarHBondContact O-CA 3.31Å; D122-G124 PolarHBondContact O-N 3.42Å; G124-R159 PolarHBondContact O-NH1 2.93Å
125	I	89.9	Confident	85.7	Confident	14 Å²	14	62.8 Å²	62.8	7%	0.072	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.7	179.2	-57.2	-178.4	0	0	0	108.3	V98 V99 Q100 C121 D122 I127 Y168	V98-I125 HydrophobicContact CG1-CG2 3.43Å; V98-I125 VanDerWaalsContact CG1-CG2 3.43Å; V99-I125 WeakPolarHBondContact O-CG2 3.46Å; Q100-I125 HydrophobicContact CG-CD1 4.43Å; Q100-I125 HydrophobicContact CG-CG1 4.28Å; Q100-I125 HydrophobicContact CG-CG2 4.14Å; C121-I125 CarbonylContact C-O 3.59Å; C121-I125 WeakPolarHBondContact CA-O 3.24Å; D122-I125 PolarHBondContact N-O 3.24Å; D122-I125 PolarHBondContact O-N 3Å; D122-I125 VanDerWaalsContact O-O 3.07Å; I125-I127 HydrophobicContact CG2-CG1 4.17Å; I125-Y168 HydrophobicContact CD1-CD2 4.32Å
126	C	91.2	Very high	85.6	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.5	170.7	-166.8	0	0	0	0	110.2	V98 V99 L116 Q120 L142	V98-C126 CarbonylContact C-O 3.56Å; V98-C126 WeakPolarHBondContact CA-O 3.26Å; V99-C126 HydrophobicContact CB-CB 3.92Å; V99-C126 HydrophobicContact CG2-CB 4.03Å; V99-C126 PolarHBondContact N-O 3.14Å; V99-C126 PolarHBondContact O-N 3.2Å; L116-C126 HydrophobicContact CD1-CB 4.14Å; Q120-C126 CarbonylContact O-C 3.56Å; Q120-C126 WeakPolarHBondContact O-CA 3.5Å; Q120-C126 PolarHBondContact O-SG 2.85Å; Q120-C126 VanDerWaalsContact O-SG 3.35Å; C126-L142 HydrophobicContact CB-CD2 3.77Å
127	I	90.8	Very high	85.5	Confident	58 Å²	58	66.3 Å²	66.3	30%	0.297	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.4	175.1	-54	-178.6	0	0	0	108.2	R96 V98 Q120 I125 Y168	R96-I127 HydrophobicContact CG-CG2 3.8Å; V98-I127 HydrophobicContact CG2-CG1 4.42Å; Q120-I127 PolarHBondContact O-N 3.4Å; I125-I127 HydrophobicContact CG2-CG1 4.17Å; I127-Y168 HydrophobicContact CD1-CE2 4.17Å
128	A	90.6	Very high	85.5	Confident	2 Å²	2	66.6 Å²	66.6	2%	0.017	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.7	179.9	0	0	0	0	0	111.4	V97 I137 F139	V97-A128 PolarHBondContact N-O 2.8Å; V97-A128 PolarHBondContact O-N 3.49Å; A128-I137 HydrophobicContact CB-CD1 3.54Å; A128-I137 HydrophobicContact CB-CG1 4.43Å; A128-F139 HydrophobicContact CB-CE1 3.88Å
129	D	89.4	Confident	85.8	Confident	78 Å²	78	65 Å²	65	42%	0.417	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.7	-176.8	-70.4	-14.3	0	0	0	111.3	A95 R96	A95-D129 WeakPolarHBondContact O-CA 3.33Å; R96-D129 WeakPolarHBondContact CB-OD1 3.45Å; R96-D129 VanDerWaalsContact CG-OD1 3.32Å; R96-D129 WeakPolarHBondContact CG-OD1 3.44Å; R96-D129 IonicContact CZ-OD1 3.48Å; R96-D129 IonicContact CZ-OD2 3.21Å; R96-D129 IonicContact NE-OD1 2.76Å; R96-D129 PolarHBondContact NE-OD1 3.04Å; R96-D129 IonicContact NE-OD2 2.76Å; R96-D129 IonicContact NH2-OD1 3.64Å; R96-D129 PolarHBondContact NH2-OD1 3.4Å; R96-D129 IonicContact NH2-OD2 3.41Å; R96-D129 PolarHBondContact NH2-OD2 3.48Å
130	L	86.6	Confident	86.1	Confident	12 Å²	12	58 Å²	58	6%	0.063	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130.5	177.6	-173.7	68.7	0	0	0	110	I88 Q94 A95 D134 I137	I88-L130 HydrophobicContact CD1-CD2 3.91Å; I88-L130 HydrophobicContact CG1-CD2 4.34Å; Q94-L130 WeakPolarHBondContact CA-O 3.46Å; A95-L130 HydrophobicContact CB-CB 4.3Å; A95-L130 HydrophobicContact CB-CD2 4.28Å; A95-L130 PolarHBondContact N-O 3.48Å; A95-L130 WeakPolarHBondContact O-CB 3.43Å; A95-L130 PolarHBondContact O-N 2.93Å; L130-D134 HydrophobicContact CD1-CB 3.67Å; L130-D134 WeakPolarHBondContact CD2-O 3.22Å; L130-D134 HydrophobicContact CG-CB 4.49Å; L130-D134 WeakPolarHBondContact CG-O 3.39Å; L130-I137 HydrophobicContact CD1-CB 4.28Å
131	Q	82.1	Confident	86.2	Confident	144 Å²	144	57.2 Å²	57.2	67%	0.673	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-84.7	153.9	177.1	-60.9	-167.7	13.4	0	0	111.6	K133 D134	Q131-K133 PolarHBondContact O-N 3.36Å; Q131-D134 PolarHBondContact O-N 3.5Å
132	S	74.1	Confident	86.4	Confident	68 Å²	68	55.9 Å²	55.9	48%	0.476	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-2.6	-170.4	-34.5	0	0	0	0	117.2	Q94	Q94-S132 VanDerWaalsContact CG-OG 3.26Å; Q94-S132 WeakPolarHBondContact CG-OG 3.28Å
133	K	74.4	Confident	86.8	Confident	198 Å²	198	52.1 Å²	52.1	86%	0.861	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-20.4	177.8	-66.2	-177.1	179.6	177.9	0	113	Q131	Q131-K133 PolarHBondContact O-N 3.36Å
134	D	81.1	Confident	87.5	Confident	82 Å²	82	46.8 Å²	46.8	44%	0.439	26%	0.258	S	S	.	.			trans	-104.8	141.9	-171.4	-55.8	-53.8	0	0	0	109.8	L130 Q131	L130-D134 HydrophobicContact CD1-CB 3.67Å; L130-D134 WeakPolarHBondContact CD2-O 3.22Å; L130-D134 HydrophobicContact CG-CB 4.49Å; L130-D134 WeakPolarHBondContact CG-O 3.39Å; Q131-D134 PolarHBondContact O-N 3.5Å
135	S	82.4	Confident	87.9	Confident	32 Å²	32	49 Å²	49	22%	0.224	27%	0.267	C	S	.	.	S	Bend	trans	-107.6	-2.1	171.6	-56	0	0	0	0	112.7	K87 I88	K87-S135 CarbonylContact C-O 3.55Å; K87-S135 VanDerWaalsContact CA-O 3.28Å; K87-S135 WeakPolarHBondContact CA-O 3.29Å; K87-S135 WeakPolarHBondContact CG-O 3.41Å; I88-S135 PolarHBondContact N-O 3Å
136	T	90.3	Very high	88.2	Confident	67 Å²	67	49.3 Å²	49.3	41%	0.411	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.4	-168.8	50	0	0	0	0	111.1	L49 V86 K87	L49-T136 HydrophobicContact CD1-CG2 3.68Å; V86-T136 CarbonylContact O-C 3.59Å; V86-T136 WeakPolarHBondContact O-CA 3.44Å; K87-T136 HydrophobicContact CB-CG2 3.95Å; K87-T136 HydrophobicContact CD-CG2 4.18Å; K87-T136 HydrophobicContact CG-CG2 3.82Å
137	I	91.4	Very high	88.3	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.9	178.5	-162.6	162.2	0	0	0	110.1	T85 V86 V97 A128 L130 F139	T85-I137 WeakPolarHBondContact CA-O 3.47Å; T85-I137 WeakPolarHBondContact CG2-O 3.44Å; V86-I137 HydrophobicContact CG2-CG2 3.51Å; V86-I137 PolarHBondContact N-O 3.13Å; V86-I137 PolarHBondContact O-N 3.41Å; V97-I137 HydrophobicContact CB-CG2 4.35Å; V97-I137 HydrophobicContact CG2-CG2 4.04Å; A128-I137 HydrophobicContact CB-CD1 3.54Å; A128-I137 HydrophobicContact CB-CG1 4.43Å; L130-I137 HydrophobicContact CD1-CB 4.28Å; I137-F139 HydrophobicContact CG1-CZ 4.47Å; I137-F139 HydrophobicContact CG2-CE2 3.99Å; I137-F139 HydrophobicContact CG2-CZ 3.85Å
138	S	91.8	Very high	88.3	Confident	58 Å²	58	50 Å²	50	41%	0.406	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.5	-177.7	65	0	0	0	0	110.6	P84 T85 P140	P84-S138 WeakPolarHBondContact O-CA 3.39Å; T85-S138 WeakPolarHBondContact OG1-CB 3.17Å; S138-P140 VanDerWaalsContact C-CD 3.45Å; S138-P140 WeakPolarHBondContact O-CD 3.3Å
139	F	92.5	Very high	88.3	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	31%	0.314	C	S	.	.			trans	-119.9	72.3	-168.8	-60	-82.3	0	0	0	112.6	P84 V86 V97 V99 A128 I137 N141 L142 F219	P84-F139 WeakPolarHBondContact O-CD2 3.3Å; P84-F139 PolarHBondContact O-N 3.21Å; V86-F139 HydrophobicContact CG2-CE2 4.08Å; V97-F139 HydrophobicContact CB-CZ 4.36Å; V97-F139 HydrophobicContact CG1-CZ 3.9Å; V99-F139 HydrophobicContact CG2-CD1 4.14Å; V99-F139 HydrophobicContact CG2-CE1 3.59Å; V99-F139 HydrophobicContact CG2-CE2 4.11Å; V99-F139 HydrophobicContact CG2-CZ 3.58Å; A128-F139 HydrophobicContact CB-CE1 3.88Å; I137-F139 HydrophobicContact CG1-CZ 4.47Å; I137-F139 HydrophobicContact CG2-CE2 3.99Å; I137-F139 HydrophobicContact CG2-CZ 3.85Å; F139-N141 VanDerWaalsContact C-N 3.34Å; F139-N141 PolarHBondContact O-N 2.93Å; F139-L142 HydrophobicContact CB-CD1 3.54Å; F139-L142 HydrophobicContact CB-CG 3.81Å; F139-L142 HydrophobicContact CG-CD1 4.22Å; F139-F219 AromaticContact CD2-CE1 3.84Å; F139-F219 HydrophobicContact CD2-CE1 3.84Å; F139-F219 AromaticContact CE2-CD1 3.87Å; F139-F219 HydrophobicContact CE2-CD1 3.87Å; F139-F219 AromaticContact CE2-CE1 3.61Å; F139-F219 HydrophobicContact CE2-CE1 3.61Å; F139-F219 HydrophobicContact CZ-CD1 4.37Å; F139-F219 HydrophobicContact CZ-CE1 4.42Å
140	P	88.3	Confident	88.3	Confident	37 Å²	37	64.7 Å²	64.7	24%	0.24	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.4	-166.7	28.4	-36.3	0	0	0	116.5	Y83 S138	Y83-P140 VanDerWaalsContact CD1-CA 3.43Å; Y83-P140 HydrophobicContact CD1-CB 3.84Å; Y83-P140 HydrophobicContact CD2-CB 3.73Å; Y83-P140 HydrophobicContact CE1-CB 3.87Å; Y83-P140 WeakPolarHBondContact CE1-O 3.29Å; Y83-P140 HydrophobicContact CE2-CB 3.79Å; Y83-P140 HydrophobicContact CG-CB 3.74Å; S138-P140 VanDerWaalsContact C-CD 3.45Å; S138-P140 WeakPolarHBondContact O-CD 3.3Å
141	N	88.1	Confident	88.5	Confident	81 Å²	81	68.1 Å²	68.1	43%	0.433	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	29.2	-171.9	-63.4	-72	0	0	0	113.3	G118 F139	G118-N141 VanDerWaalsContact CA-O 3.31Å; G118-N141 WeakPolarHBondContact CA-O 3.29Å; F139-N141 VanDerWaalsContact C-N 3.34Å; F139-N141 PolarHBondContact O-N 2.93Å
142	L	91.7	Very high	89.1	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	32%	0.324	C	S	.	.			trans	-79.1	115.9	175.6	-65.5	178.1	0	0	0	111.4	G70 L71 L116 C126 F139 L217	G70-L142 CarbonylContact C-O 3.48Å; G70-L142 WeakPolarHBondContact CA-O 3.36Å; L71-L142 HydrophobicContact CB-CB 4.2Å; L71-L142 VanDerWaalsContact CB-O 3.27Å; L71-L142 WeakPolarHBondContact CB-O 3.49Å; L71-L142 PolarHBondContact N-O 3.03Å; L116-L142 HydrophobicContact CD2-CD2 4.45Å; C126-L142 HydrophobicContact CB-CD2 3.77Å; F139-L142 HydrophobicContact CB-CD1 3.54Å; F139-L142 HydrophobicContact CB-CG 3.81Å; F139-L142 HydrophobicContact CG-CD1 4.22Å; L142-L217 HydrophobicContact CD1-CD1 4.39Å
143	G	92.6	Very high	89.9	Confident	15 Å²	15	60.4 Å²	60.4	16%	0.155	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	159.4	161.4	0	0	0	0	0	111.5	L116 V117	L116-G143 WeakPolarHBondContact CA-O 3.4Å; V117-G143 PolarHBondContact N-O 3.29Å; V117-G143 PolarHBondContact O-N 3.3Å
144	I	94.2	Very high	90.8	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111.1	173.8	-61.8	165.5	0	0	0	108	F57 F59 R60 L101 H114 L116 V215 I242	F57-I144 HydrophobicContact CD1-CD1 4.11Å; F57-I144 HydrophobicContact CE1-CB 4.15Å; F57-I144 HydrophobicContact CE1-CD1 3.92Å; F57-I144 HydrophobicContact CE1-CG1 4.06Å; F59-I144 WeakPolarHBondContact CA-O 3.23Å; F59-I144 HydrophobicContact CB-CG2 4.24Å; F59-I144 HydrophobicContact CD1-CB 3.73Å; F59-I144 HydrophobicContact CD1-CD1 3.89Å; F59-I144 HydrophobicContact CD1-CG1 4.41Å; F59-I144 HydrophobicContact CD1-CG2 3.68Å; F59-I144 HydrophobicContact CD2-CG2 4.03Å; F59-I144 HydrophobicContact CE1-CB 4.24Å; F59-I144 HydrophobicContact CE1-CD1 3.52Å; F59-I144 HydrophobicContact CE1-CG1 4.48Å; F59-I144 HydrophobicContact CE1-CG2 4.07Å; F59-I144 HydrophobicContact CE2-CG2 4.38Å; F59-I144 HydrophobicContact CG-CB 4.15Å; F59-I144 HydrophobicContact CG-CG2 3.7Å; F59-I144 HydrophobicContact CZ-CD1 4.28Å; F59-I144 HydrophobicContact CZ-CG2 4.42Å; R60-I144 PolarHBondContact N-O 3.42Å; L101-I144 HydrophobicContact CD1-CG1 4.45Å; L101-I144 HydrophobicContact CD1-CG2 4.17Å; H114-I144 HydrophobicContact CB-CG2 4Å; L116-I144 HydrophobicContact CD2-CG1 4.34Å; I144-V215 HydrophobicContact CD1-CG2 3.95Å; I144-I242 HydrophobicContact CD1-CD1 4.23Å; I144-I242 HydrophobicContact CD1-CG2 4.27Å
145	L	93.4	Very high	91.3	Very high	53 Å²	53	54.9 Å²	54.9	28%	0.277	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	113.5	178.2	-178.4	75.7	0	0	0	109.6	R60 H114 S115 V117	R60-L145 CarbonylContact O-C 3.58Å; R60-L145 VanDerWaalsContact O-CA 3.32Å; R60-L145 WeakPolarHBondContact O-CA 3.09Å; H114-L145 VanDerWaalsContact CA-O 3.24Å; H114-L145 WeakPolarHBondContact CA-O 3.39Å; H114-L145 VanDerWaalsContact CB-O 3.3Å; H114-L145 WeakPolarHBondContact CB-O 3.34Å; S115-L145 PolarHBondContact N-O 2.9Å; S115-L145 WeakPolarHBondContact O-CB 3.47Å; S115-L145 PolarHBondContact O-N 3.1Å; V117-L145 HydrophobicContact CG1-CB 3.89Å; V117-L145 HydrophobicContact CG1-CD2 4.26Å; V117-L145 HydrophobicContact CG2-CB 4.43Å
146	H	94.3	Very high	91.8	Very high	20 Å²	20	53.4 Å²	53.4	9%	0.093	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-77.2	119.3	179.7	-166.2	-56.2	0	0	0	110.8	F59 R60 Y61 H114	F59-H146 HydrophobicContact CB-CB 3.99Å; R60-H146 PolarHBondContact O-N 3.16Å; Y61-H146 HydrophobicContact CD1-CB 4.35Å; Y61-H146 HydrophobicContact CE1-CB 4.29Å; Y61-H146 AromaticContact CE1-CG 3.97Å; Y61-H146 AromaticContact CE1-ND1 3.43Å; Y61-H146 WeakPolarHBondContact CE1-ND1 3.43Å; Y61-H146 AromaticContact CZ-CE1 3.85Å; Y61-H146 AromaticContact CZ-CG 3.84Å; Y61-H146 AromaticContact CZ-ND1 3.54Å; Y61-H146 PolarHBondContact OH-CE1 3.38Å; Y61-H146 VanDerWaalsContact OH-CE1 3.28Å; Y61-H146 PolarHBondContact OH-ND1 3.38Å; H114-H146 AromaticContact CE1-CD2 3.59Å; H114-H146 AromaticContact CE1-CE1 2.82Å; H114-H146 PolarHBondContact CE1-CE1 3.49Å; H114-H146 AromaticContact CE1-CG 3.31Å; H114-H146 AromaticContact CE1-ND1 2.8Å; H114-H146 PolarHBondContact CE1-ND1 2.88Å; H114-H146 AromaticContact CE1-NE2 3.31Å; H114-H146 PolarHBondContact CE1-NE2 3.36Å; H114-H146 VanDerWaalsContact CE1-NE2 3.31Å; H114-H146 AromaticContact NE2-CD2 3.2Å; H114-H146 PolarHBondContact NE2-CD2 3.46Å; H114-H146 AromaticContact NE2-CE1 3.74Å; H114-H146 AromaticContact NE2-CG 3.74Å; H114-H146 AromaticContact NE2-NE2 3.2Å; H114-H146 PolarHBondContact NE2-NE2 3.08Å
147	V	93.6	Very high	91.9	Very high	14 Å²	14	52.6 Å²	52.6	9%	0.085	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-78.5	140.9	174.7	169.9	0	0	0	0	110.6	A113 H114 N151 V152 T155	A113-V147 HydrophobicContact CB-CB 4.39Å; A113-V147 HydrophobicContact CB-CG1 4.49Å; A113-V147 HydrophobicContact CB-CG2 4.42Å; A113-V147 WeakPolarHBondContact O-CG2 3.47Å; H114-V147 PolarHBondContact CE1-N 3.04Å; H114-V147 VanDerWaalsContact CE1-N 3.33Å; H114-V147 PolarHBondContact CE1-O 3.37Å; H114-V147 PolarHBondContact ND1-N 2.7Å; V147-N151 HydrophobicContact CG1-CB 4.09Å; V147-V152 HydrophobicContact CG1-CG2 4.19Å; V147-T155 HydrophobicContact CG2-CG2 4.03Å
148	T	91.3	Very high	91.8	Very high	61 Å²	61	56.1 Å²	56.1	37%	0.374	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-71.3	146.6	176.8	64.4	0	0	0	0	110.9	Y61 K150 N151 V152	Y61-T148 HydrophobicContact CD1-CG2 4.06Å; Y61-T148 HydrophobicContact CE1-CG2 4.14Å; T148-K150 PolarHBondContact O-N 3.24Å; T148-N151 PolarHBondContact O-N 3.49Å; T148-V152 PolarHBondContact O-N 3.18Å
149	K	90.1	Very high	91.7	Very high	188 Å²	188	54.6 Å²	54.6	82%	0.817	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.2	-176.1	-169.8	167.7	-177.9	172.4	0	113.9	L212	K149-L212 HydrophobicContact CB-CD1 4.43Å
150	K	89.9	Confident	91.5	Very high	200 Å²	200	54.5 Å²	54.5	87%	0.87	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.1	173.8	-67.2	-177	179	179.1	0	113	T148	T148-K150 PolarHBondContact O-N 3.24Å
151	N	91.4	Very high	91.5	Very high	83 Å²	83	54.1 Å²	54.1	44%	0.444	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-8.7	-167.2	-64.6	9.4	0	0	0	113.8	V147 T148 A153 K154 T155	V147-N151 HydrophobicContact CG1-CB 4.09Å; T148-N151 PolarHBondContact O-N 3.49Å; N151-A153 VanDerWaalsContact C-N 3.33Å; N151-A153 PolarHBondContact O-N 3.17Å; N151-K154 PolarHBondContact O-N 3.19Å; N151-K154 VanDerWaalsContact O-N 3.13Å; N151-T155 PolarHBondContact O-N 2.98Å; N151-T155 PolarHBondContact O-OG1 2.99Å
152	V	93.1	Very high	91.4	Very high	8 Å²	8	51.5 Å²	51.5	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-47.7	-49.1	-174.1	-177.4	0	0	0	0	112.8	A113 V147 T148 L156 A207 M210 L212	A113-V152 HydrophobicContact CB-CG1 3.9Å; V147-V152 HydrophobicContact CG1-CG2 4.19Å; T148-V152 PolarHBondContact O-N 3.18Å; V152-L156 WeakPolarHBondContact O-CB 3.43Å; V152-L156 PolarHBondContact O-N 3.24Å; V152-A207 HydrophobicContact CB-CB 4.42Å; V152-A207 HydrophobicContact CG1-CB 3.8Å; V152-M210 HydrophobicContact CG1-CB 4.32Å; V152-M210 HydrophobicContact CG1-CG 4.2Å; V152-L212 HydrophobicContact CG1-CD2 4.42Å; V152-L212 HydrophobicContact CG2-CD1 3.98Å; V152-L212 HydrophobicContact CG2-CD2 4Å
153	A	92.8	Very high	91	Very high	42 Å²	42	51.4 Å²	51.4	35%	0.347	26%	0.256	S	S	.	.	H	α-helix	trans	-66.1	-44.9	-177.5	0	0	0	0	0	112.8	N151 L156 E157 A207	N151-A153 VanDerWaalsContact C-N 3.33Å; N151-A153 PolarHBondContact O-N 3.17Å; A153-L156 PolarHBondContact O-N 3.34Å; A153-E157 PolarHBondContact O-N 3.01Å; A153-A207 HydrophobicContact CB-CB 3.88Å
154	K	93	Very high	90.5	Very high	139 Å²	139	50.9 Å²	50.9	60%	0.604	25%	0.249	S	C	*	.	H	α-helix	trans	-62.1	-51.2	177.9	177	178.9	169.5	-179.2	0	110.9	N151 L156 E157 E158	N151-K154 PolarHBondContact O-N 3.19Å; N151-K154 VanDerWaalsContact O-N 3.13Å; K154-L156 VanDerWaalsContact C-N 3.3Å; K154-L156 PolarHBondContact O-N 3.45Å; K154-E157 PolarHBondContact O-N 2.89Å; K154-E158 WeakPolarHBondContact CE-OE1 3.42Å; K154-E158 IonicContact NZ-OE1 3.7Å; K154-E158 WeakPolarHBondContact O-CG 3.39Å; K154-E158 PolarHBondContact O-N 3.31Å
155	T	91.6	Very high	89.8	Confident	26 Å²	26	55.4 Å²	55.4	16%	0.16	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-34.8	179.7	-55.8	0	0	0	0	111.7	V147 N151 E158 R159	V147-T155 HydrophobicContact CG2-CG2 4.03Å; N151-T155 PolarHBondContact O-N 2.98Å; N151-T155 PolarHBondContact O-OG1 2.99Å; T155-E158 PolarHBondContact O-N 3.43Å; T155-R159 HydrophobicContact CG2-CG 4.46Å; T155-R159 WeakPolarHBondContact O-CB 3.44Å; T155-R159 WeakPolarHBondContact O-CG 3.23Å; T155-R159 PolarHBondContact O-N 2.83Å
156	L	92.1	Very high	89.1	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-40.5	175.2	-174.9	58.7	0	0	0	112.3	L111 V152 A153 K154 R159 M160 A203 Q206 A207 M210	L111-L156 HydrophobicContact CB-CD1 4Å; L111-L156 WeakPolarHBondContact O-CD1 3.28Å; V152-L156 WeakPolarHBondContact O-CB 3.43Å; V152-L156 PolarHBondContact O-N 3.24Å; A153-L156 PolarHBondContact O-N 3.34Å; K154-L156 VanDerWaalsContact C-N 3.3Å; K154-L156 PolarHBondContact O-N 3.45Å; L156-R159 PolarHBondContact O-N 3Å; L156-M160 HydrophobicContact CD1-CE 4.03Å; L156-M160 HydrophobicContact CD1-CG 4.5Å; L156-M160 HydrophobicContact CD2-CE 4.16Å; L156-M160 HydrophobicContact CG-CE 3.91Å; L156-M160 HydrophobicContact CG-SD 4.26Å; L156-M160 VanDerWaalsContact O-CG 3.32Å; L156-M160 WeakPolarHBondContact O-CG 3.18Å; L156-M160 PolarHBondContact O-N 2.68Å; L156-A203 HydrophobicContact CB-CB 4.27Å; L156-A203 HydrophobicContact CD2-CB 4.35Å; L156-A203 HydrophobicContact CG-CB 4.1Å; L156-Q206 HydrophobicContact CD2-CB 3.86Å; L156-A207 HydrophobicContact CD2-CB 4.26Å; L156-M210 HydrophobicContact CD1-CE 4.32Å; L156-M210 HydrophobicContact CD2-CE 3.8Å
157	E	92.1	Very high	88.1	Confident	51 Å²	51	55.4 Å²	55.4	24%	0.238	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-49.1	173.5	-172.6	-177.8	147.3	0	0	111.2	A153 K154 R159 M160 V161 I199 S200 A203	A153-E157 PolarHBondContact O-N 3.01Å; K154-E157 PolarHBondContact O-N 2.89Å; E157-R159 VanDerWaalsContact C-N 3.28Å; E157-R159 PolarHBondContact O-N 2.78Å; E157-M160 PolarHBondContact O-N 2.81Å; E157-V161 HydrophobicContact CG-CG2 4.45Å; E157-V161 WeakPolarHBondContact O-CB 3.09Å; E157-V161 WeakPolarHBondContact O-CG2 3.36Å; E157-V161 PolarHBondContact O-N 2.87Å; E157-I199 HydrophobicContact CG-CG2 4.21Å; E157-S200 VanDerWaalsContact CD-CB 3.47Å; E157-S200 WeakPolarHBondContact OE2-CB 3.45Å; E157-S200 PolarHBondContact OE2-OG 3.1Å; E157-A203 HydrophobicContact CB-CB 3.9Å
158	E	90.3	Very high	87.3	Confident	97 Å²	97	55.9 Å²	55.9	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-55.9	-41.5	177.3	-70.6	165	167.6	0	0	111.9	K154 T155 E162	K154-E158 WeakPolarHBondContact CE-OE1 3.42Å; K154-E158 IonicContact NZ-OE1 3.7Å; K154-E158 WeakPolarHBondContact O-CG 3.39Å; K154-E158 PolarHBondContact O-N 3.31Å; T155-E158 PolarHBondContact O-N 3.43Å; E158-E162 WeakPolarHBondContact O-CB 3.37Å; E158-E162 PolarHBondContact O-N 3.26Å
159	R	89.4	Confident	86.3	Confident	25 Å²	25	53.3 Å²	53.3	9%	0.094	25%	0.252	C	S	.	.	H	α-helix	trans	-69	-41.7	176.9	-68.1	-68.4	-152	86.2	58.6	113.3	L111 H112 A113 H114 S115 K123 G124 T155 L156 E157 E162 A163	L111-R159 HydrophobicContact CD1-CB 4.39Å; H112-R159 PolarHBondContact O-NH2 3.47Å; A113-R159 PolarHBondContact O-NH2 3.39Å; H114-R159 PolarHBondContact O-NH2 3.44Å; S115-R159 VanDerWaalsContact OG-CZ 3.29Å; S115-R159 PolarHBondContact OG-NE 3.07Å; S115-R159 PolarHBondContact OG-NH2 2.65Å; K123-R159 PolarHBondContact O-NE 3.37Å; G124-R159 PolarHBondContact O-NH1 2.93Å; T155-R159 HydrophobicContact CG2-CG 4.46Å; T155-R159 WeakPolarHBondContact O-CB 3.44Å; T155-R159 WeakPolarHBondContact O-CG 3.23Å; T155-R159 PolarHBondContact O-N 2.83Å; L156-R159 PolarHBondContact O-N 3Å; E157-R159 VanDerWaalsContact C-N 3.28Å; E157-R159 PolarHBondContact O-N 2.78Å; R159-E162 PolarHBondContact O-N 3.4Å; R159-A163 VanDerWaalsContact O-CB 3.25Å; R159-A163 WeakPolarHBondContact O-CB 3.41Å; R159-A163 PolarHBondContact O-N 2.99Å
160	M	89.1	Confident	85.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.2	-72.8	172.8	168.1	0	0	111.4	L111 L156 E157 F164 I174 I199 A203 Q206	L111-M160 HydrophobicContact CD1-CB 4.46Å; L111-M160 HydrophobicContact CD1-CG 3.94Å; L156-M160 HydrophobicContact CD1-CE 4.03Å; L156-M160 HydrophobicContact CD1-CG 4.5Å; L156-M160 HydrophobicContact CD2-CE 4.16Å; L156-M160 HydrophobicContact CG-CE 3.91Å; L156-M160 HydrophobicContact CG-SD 4.26Å; L156-M160 VanDerWaalsContact O-CG 3.32Å; L156-M160 WeakPolarHBondContact O-CG 3.18Å; L156-M160 PolarHBondContact O-N 2.68Å; E157-M160 PolarHBondContact O-N 2.81Å; M160-F164 WeakPolarHBondContact O-CB 3.34Å; M160-F164 PolarHBondContact O-N 2.75Å; M160-I174 HydrophobicContact CB-CD1 4.2Å; M160-I174 HydrophobicContact CB-CG2 4.21Å; M160-I174 HydrophobicContact CE-CG2 4.27Å; M160-I174 HydrophobicContact CG-CD1 4.17Å; M160-I174 HydrophobicContact CG-CG1 4.21Å; M160-I174 HydrophobicContact CG-CG2 4Å; M160-I174 HydrophobicContact SD-CG2 3.85Å; M160-I199 HydrophobicContact CB-CG2 3.41Å; M160-I199 VanDerWaalsContact CB-CG2 3.41Å; M160-I199 HydrophobicContact CG-CG2 4.37Å; M160-I199 HydrophobicContact SD-CG2 4.1Å; M160-A203 HydrophobicContact SD-CB 3.82Å; M160-Q206 HydrophobicContact CE-CG 4.47Å
161	V	87.6	Confident	84	Confident	28 Å²	28	37 Å²	37	17%	0.17	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-48.4	173.4	162.2	0	0	0	0	111.2	E157 R165 L191 I199	E157-V161 HydrophobicContact CG-CG2 4.45Å; E157-V161 WeakPolarHBondContact O-CB 3.09Å; E157-V161 WeakPolarHBondContact O-CG2 3.36Å; E157-V161 PolarHBondContact O-N 2.87Å; V161-R165 WeakPolarHBondContact O-CB 3.47Å; V161-R165 PolarHBondContact O-N 3.1Å; V161-L191 HydrophobicContact CB-CD1 4.18Å; V161-L191 HydrophobicContact CG1-CD1 3.72Å; V161-L191 HydrophobicContact CG2-CD1 4.09Å; V161-I199 HydrophobicContact CG2-CG2 4.09Å
162	E	84.9	Confident	83.5	Confident	26 Å²	26	33.5 Å²	33.5	12%	0.121	17%	0.174	C	C	.	.	H	α-helix	trans	-67.5	-42	178.9	-169.3	67.3	-94.2	0	0	112.3	E158 R159 F164 R165 M166	E158-E162 WeakPolarHBondContact O-CB 3.37Å; E158-E162 PolarHBondContact O-N 3.26Å; R159-E162 PolarHBondContact O-N 3.4Å; E162-F164 PolarHBondContact O-N 2.86Å; E162-R165 PolarHBondContact O-N 3.44Å; E162-R165 IonicContact OE1-CZ 2.71Å; E162-R165 IonicContact OE1-NE 2.89Å; E162-R165 PolarHBondContact OE1-NE 2.95Å; E162-R165 IonicContact OE1-NH2 3.61Å; E162-R165 PolarHBondContact OE1-NH2 3.22Å; E162-R165 IonicContact OE2-CZ 3.48Å; E162-R165 IonicContact OE2-NE 3.47Å; E162-R165 IonicContact OE2-NH2 3.74Å; E162-R165 PolarHBondContact OE2-NH2 3.1Å; E162-M166 HydrophobicContact CG-CG 4.43Å; E162-M166 WeakPolarHBondContact O-CB 3.48Å; E162-M166 WeakPolarHBondContact O-CG 3.49Å; E162-M166 PolarHBondContact O-N 2.77Å; E162-M166 WeakPolarHBondContact OE1-CE 3.45Å; E162-M166 WeakPolarHBondContact OE1-CG 3.42Å
163	A	83.4	Confident	82.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-41.2	177.3	0	0	0	0	0	112.1	L111 R159 G167 Y168 N169	L111-A163 HydrophobicContact CD1-CB 3.81Å; R159-A163 VanDerWaalsContact O-CB 3.25Å; R159-A163 WeakPolarHBondContact O-CB 3.41Å; R159-A163 PolarHBondContact O-N 2.99Å; A163-G167 CarbonylContact O-C 3.55Å; A163-G167 PolarHBondContact O-N 3.09Å; A163-G167 VanDerWaalsContact O-N 3.09Å; A163-Y168 PolarHBondContact O-N 3.12Å; A163-N169 HydrophobicContact CB-CB 4.45Å
164	F	81.9	Confident	82.2	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-67	-43.5	173.2	-177.1	-91.1	0	0	0	112.1	M160 E162 M166 G167 V178 L181 R189 L191 I199	M160-F164 WeakPolarHBondContact O-CB 3.34Å; M160-F164 PolarHBondContact O-N 2.75Å; E162-F164 PolarHBondContact O-N 2.86Å; F164-M166 VanDerWaalsContact C-N 3.34Å; F164-M166 PolarHBondContact O-N 3.23Å; F164-G167 PolarHBondContact O-N 2.95Å; F164-V178 HydrophobicContact CD2-CG1 3.47Å; F164-V178 VanDerWaalsContact CD2-CG1 3.47Å; F164-V178 HydrophobicContact CE2-CG1 3.79Å; F164-V178 HydrophobicContact CG-CG1 4.41Å; F164-L181 HydrophobicContact CE2-CB 4.41Å; F164-L181 HydrophobicContact CE2-CD1 4.46Å; F164-L181 HydrophobicContact CZ-CD1 4.41Å; F164-R189 HydrophobicContact CD1-CB 4.26Å; F164-R189 HydrophobicContact CE1-CB 3.92Å; F164-L191 HydrophobicContact CD1-CD1 4.35Å; F164-L191 HydrophobicContact CD1-CD2 3.37Å; F164-L191 HydrophobicContact CD1-CG 3.73Å; F164-L191 HydrophobicContact CE1-CD2 3.6Å; F164-L191 HydrophobicContact CE1-CG 4.04Å; F164-L191 HydrophobicContact CG-CD2 4.07Å; F164-L191 HydrophobicContact CZ-CD2 4.45Å; F164-I199 HydrophobicContact CB-CD1 4.5Å
165	R	81.4	Confident	81.6	Confident	98 Å²	98	28.6 Å²	28.6	37%	0.37	15%	0.15	S	C	.	.	H	α-helix	trans	-59.1	-44.5	179	-178.4	170.1	73.5	167	-1.3	111.9	V161 E162 P188 R189	V161-R165 WeakPolarHBondContact O-CB 3.47Å; V161-R165 PolarHBondContact O-N 3.1Å; E162-R165 PolarHBondContact O-N 3.44Å; E162-R165 IonicContact OE1-CZ 2.71Å; E162-R165 IonicContact OE1-NE 2.89Å; E162-R165 PolarHBondContact OE1-NE 2.95Å; E162-R165 IonicContact OE1-NH2 3.61Å; E162-R165 PolarHBondContact OE1-NH2 3.22Å; E162-R165 IonicContact OE2-CZ 3.48Å; E162-R165 IonicContact OE2-NE 3.47Å; E162-R165 IonicContact OE2-NH2 3.74Å; E162-R165 PolarHBondContact OE2-NH2 3.1Å; R165-P188 HydrophobicContact CG-CB 4.03Å; R165-P188 WeakPolarHBondContact O-CA 3.31Å; R165-R189 PolarHBondContact O-N 2.96Å
166	M	76.9	Confident	80.8	Confident	64 Å²	64	32 Å²	32	32%	0.315	17%	0.173	S	C	.	.	H	α-helix	trans	-85.6	-5.6	-178.5	-64.3	-64.5	-170.4	0	0	114.2	E162 F164 Y168	E162-M166 HydrophobicContact CG-CG 4.43Å; E162-M166 WeakPolarHBondContact O-CB 3.48Å; E162-M166 WeakPolarHBondContact O-CG 3.49Å; E162-M166 PolarHBondContact O-N 2.77Å; E162-M166 WeakPolarHBondContact OE1-CE 3.45Å; E162-M166 WeakPolarHBondContact OE1-CG 3.42Å; F164-M166 VanDerWaalsContact C-N 3.34Å; F164-M166 PolarHBondContact O-N 3.23Å; M166-Y168 VanDerWaalsContact C-N 3.27Å; M166-Y168 HydrophobicContact CB-CD1 4.48Å; M166-Y168 HydrophobicContact CB-CD2 3.68Å; M166-Y168 HydrophobicContact CB-CE2 3.86Å; M166-Y168 HydrophobicContact CB-CG 4.01Å; M166-Y168 HydrophobicContact CG-CD2 4.48Å; M166-Y168 HydrophobicContact CG-CE2 4.43Å; M166-Y168 PolarHBondContact O-N 3.33Å
167	G	74.4	Confident	79.8	Confident	8 Å²	8	37.7 Å²	37.7	8%	0.082	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	22	-174.3	0	0	0	0	0	114.2	A163 F164 N169	A163-G167 CarbonylContact O-C 3.55Å; A163-G167 PolarHBondContact O-N 3.09Å; A163-G167 VanDerWaalsContact O-N 3.09Å; F164-G167 PolarHBondContact O-N 2.95Å; G167-N169 VanDerWaalsContact C-N 3.34Å
168	Y	77.6	Confident	78.9	Confident	25 Å²	25	35.4 Å²	35.4	10%	0.098	19%	0.189	C	C	.	.			trans	-97.5	33.2	177.2	-56.6	-24.7	0	0	0	112.1	V98 Q100 I125 I127 A163 M166 V185 F222	V98-Y168 HydrophobicContact CG1-CD2 4.24Å; V98-Y168 HydrophobicContact CG1-CE2 4.4Å; V98-Y168 HydrophobicContact CG2-CE1 4.27Å; V98-Y168 HydrophobicContact CG2-CE2 4.39Å; Q100-Y168 PolarHBondContact NE2-O 2.99Å; Q100-Y168 PolarHBondContact OE1-O 2.97Å; I125-Y168 HydrophobicContact CD1-CD2 4.32Å; I127-Y168 HydrophobicContact CD1-CE2 4.17Å; A163-Y168 PolarHBondContact O-N 3.12Å; M166-Y168 VanDerWaalsContact C-N 3.27Å; M166-Y168 HydrophobicContact CB-CD1 4.48Å; M166-Y168 HydrophobicContact CB-CD2 3.68Å; M166-Y168 HydrophobicContact CB-CE2 3.86Å; M166-Y168 HydrophobicContact CB-CG 4.01Å; M166-Y168 HydrophobicContact CG-CD2 4.48Å; M166-Y168 HydrophobicContact CG-CE2 4.43Å; M166-Y168 PolarHBondContact O-N 3.33Å; Y168-V185 HydrophobicContact CE1-CG1 3.87Å; Y168-F222 HydrophobicContact CD1-CE2 4.2Å; Y168-F222 AromaticContact CD1-CZ 3.83Å; Y168-F222 HydrophobicContact CD1-CZ 3.83Å; Y168-F222 HydrophobicContact CE1-CE2 4.14Å; Y168-F222 HydrophobicContact CE1-CZ 4.03Å
169	N	68.5	Low	78	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	18%	0.175	C	C	.	.			trans	-100	12.7	174.9	69.4	-52.1	0	0	0	113.3	A163 G167 I174	A163-N169 HydrophobicContact CB-CB 4.45Å; G167-N169 VanDerWaalsContact C-N 3.34Å; N169-I174 HydrophobicContact CB-CD1 3.89Å
170	C	66	Low	76.6	Confident	6 Å²	6	34.8 Å²	34.8	4%	0.041	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	132.5	178.4	57.5	0	0	0	0	112.3	V172	C170-V172 VanDerWaalsContact C-N 3.33Å
171	G	67.3	Low	75.2	Confident	39 Å²	39	38.8 Å²	38.8	40%	0.402	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	3.6	-178.8	0	0	0	0	0	115
172	V	80.7	Confident	73.8	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.055	24%	0.239	C	C	.	.	S	Bend	trans	-130.2	136	-176.7	-168.1	0	0	0	0	109.6	V102 P109 Q110 L111 C170 M218	V102-V172 HydrophobicContact CG1-CG2 4.01Å; P109-V172 CarbonylContact O-C 3.59Å; P109-V172 WeakPolarHBondContact O-CA 3.39Å; P109-V172 WeakPolarHBondContact O-CG1 3.27Å; Q110-V172 VanDerWaalsContact CA-CG1 3.48Å; L111-V172 HydrophobicContact CB-CG1 4.46Å; L111-V172 HydrophobicContact CD2-CG1 3.98Å; L111-V172 HydrophobicContact CD2-CG2 4.38Å; L111-V172 HydrophobicContact CG-CG1 3.84Å; L111-V172 VanDerWaalsContact N-CG1 3.26Å; C170-V172 VanDerWaalsContact C-N 3.33Å; V172-M218 HydrophobicContact CG2-CE 3.48Å; V172-M218 VanDerWaalsContact CG2-CE 3.48Å; V172-M218 HydrophobicContact CG2-SD 3.69Å
173	A	78.3	Confident	72.3	Confident	23 Å²	23	43.8 Å²	43.8	19%	0.19	26%	0.257	C	S	.	.			trans	-89.4	116.3	-179.8	0	0	0	0	0	111.5	L108 P109 Q206	L108-A173 HydrophobicContact CB-CB 4.24Å; L108-A173 HydrophobicContact CD1-CB 4.33Å; P109-A173 PolarHBondContact O-N 3.25Å; A173-Q206 PolarHBondContact O-NE2 3.17Å; A173-Q206 VanDerWaalsContact O-NE2 3.13Å
174	I	79.7	Confident	70.8	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.036	29%	0.288	C	S	.	.	S	Bend	trans	-105.8	-62.7	173.5	-60.4	178.5	0	0	0	108.8	L111 M160 N169 D179 I199 A202	L111-I174 HydrophobicContact CD1-CD1 4.26Å; M160-I174 HydrophobicContact CB-CD1 4.2Å; M160-I174 HydrophobicContact CB-CG2 4.21Å; M160-I174 HydrophobicContact CE-CG2 4.27Å; M160-I174 HydrophobicContact CG-CD1 4.17Å; M160-I174 HydrophobicContact CG-CG1 4.21Å; M160-I174 HydrophobicContact CG-CG2 4Å; M160-I174 HydrophobicContact SD-CG2 3.85Å; N169-I174 HydrophobicContact CB-CD1 3.89Å; I174-D179 WeakPolarHBondContact CB-OD1 3.25Å; I174-D179 PolarHBondContact N-OD1 3.24Å; I174-D179 PolarHBondContact N-OD2 3.16Å; I174-I199 HydrophobicContact CG2-CG1 4.18Å; I174-A202 WeakPolarHBondContact O-CB 3.39Å
175	H	80.7	Confident	69.6	Low	56 Å²	56	51.7 Å²	51.7	26%	0.259	30%	0.296	S	S	.	.			trans	-160.6	136.2	173.3	-175.8	-94.7	0	0	0	109.4	E177 V178 D179 M198	H175-E177 VanDerWaalsContact C-N 3.27Å; H175-E177 IonicContact CE1-OE2 3.43Å; H175-E177 PolarHBondContact ND1-N 3.5Å; H175-E177 PolarHBondContact O-N 2.97Å; H175-V178 HydrophobicContact CB-CB 4.27Å; H175-V178 HydrophobicContact CB-CG2 4.04Å; H175-V178 CarbonylContact O-C 3.6Å; H175-V178 WeakPolarHBondContact O-CA 3.46Å; H175-V178 WeakPolarHBondContact O-CB 3.47Å; H175-V178 PolarHBondContact O-N 3.39Å; H175-D179 VanDerWaalsContact C-OD2 3.28Å; H175-D179 PolarHBondContact N-OD2 3.37Å; H175-D179 WeakPolarHBondContact O-CB 3.29Å; H175-D179 PolarHBondContact O-N 3.3Å; H175-M198 WeakPolarHBondContact CE1-CE 3.28Å
176	P	74.3	Confident	68.2	Low	99 Å²	99	51.6 Å²	51.6	64%	0.643	30%	0.296	S	S	*	.	H	α-helix	trans	-50.3	-38.2	-172.2	-31.7	36.6	0	0	0	116	A180	P176-A180 WeakPolarHBondContact O-CB 3.39Å; P176-A180 PolarHBondContact O-N 2.99Å
177	E	70.4	Confident	67.2	Low	118 Å²	118	53.6 Å²	53.6	55%	0.551	31%	0.311	S	S	*	.	H	α-helix	trans	-76.4	-23.7	178.8	-61.5	176.7	158.3	0	0	113.8	H175 M198	H175-E177 VanDerWaalsContact C-N 3.27Å; H175-E177 IonicContact CE1-OE2 3.43Å; H175-E177 PolarHBondContact ND1-N 3.5Å; H175-E177 PolarHBondContact O-N 2.97Å; E177-M198 WeakPolarHBondContact OE2-CE 3.48Å
178	V	73.9	Confident	66.6	Low	3 Å²	3	57.4 Å²	57.4	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-82.5	-41	173.2	178.9	0	0	0	0	109.5	F164 H175 A180 L181 I199	F164-V178 HydrophobicContact CD2-CG1 3.47Å; F164-V178 VanDerWaalsContact CD2-CG1 3.47Å; F164-V178 HydrophobicContact CE2-CG1 3.79Å; F164-V178 HydrophobicContact CG-CG1 4.41Å; H175-V178 HydrophobicContact CB-CB 4.27Å; H175-V178 HydrophobicContact CB-CG2 4.04Å; H175-V178 CarbonylContact O-C 3.6Å; H175-V178 WeakPolarHBondContact O-CA 3.46Å; H175-V178 WeakPolarHBondContact O-CB 3.47Å; H175-V178 PolarHBondContact O-N 3.39Å; V178-A180 VanDerWaalsContact C-N 3.31Å; V178-A180 PolarHBondContact O-N 3.49Å; V178-L181 PolarHBondContact O-N 3.25Å; V178-I199 HydrophobicContact CG1-CD1 4.41Å; V178-I199 HydrophobicContact CG1-CG1 4.49Å; V178-I199 HydrophobicContact CG2-CG1 4.33Å
179	D	70.9	Confident	66.2	Low	30 Å²	30	58.6 Å²	58.6	16%	0.16	34%	0.339	C	S	.	.	H	α-helix	trans	-74.2	-21.4	-177.7	-57.6	-24.3	0	0	0	112.6	I174 H175 L181 Q182	I174-D179 WeakPolarHBondContact CB-OD1 3.25Å; I174-D179 PolarHBondContact N-OD1 3.24Å; I174-D179 PolarHBondContact N-OD2 3.16Å; H175-D179 VanDerWaalsContact C-OD2 3.28Å; H175-D179 PolarHBondContact N-OD2 3.37Å; H175-D179 WeakPolarHBondContact O-CB 3.29Å; H175-D179 PolarHBondContact O-N 3.3Å; D179-L181 PolarHBondContact O-N 3Å; D179-Q182 WeakPolarHBondContact O-CG 3.45Å
180	A	61.3	Low	66.1	Low	79 Å²	79	67.2 Å²	67.2	65%	0.653	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.5	170.1	0	0	0	0	0	113.5	P176 V178 Q182	P176-A180 WeakPolarHBondContact O-CB 3.39Å; P176-A180 PolarHBondContact O-N 2.99Å; V178-A180 VanDerWaalsContact C-N 3.31Å; V178-A180 PolarHBondContact O-N 3.49Å; A180-Q182 VanDerWaalsContact C-N 3.34Å; A180-Q182 PolarHBondContact O-N 3.42Å
181	L	60.1	Low	66.6	Low	84 Å²	84	68.1 Å²	68.1	44%	0.44	38%	0.383	S	S	.	.			trans	-90.5	57.3	-176.9	-65.6	170.1	0	0	0	112.2	F164 V178 D179 G183 R189	F164-L181 HydrophobicContact CE2-CB 4.41Å; F164-L181 HydrophobicContact CE2-CD1 4.46Å; F164-L181 HydrophobicContact CZ-CD1 4.41Å; V178-L181 PolarHBondContact O-N 3.25Å; D179-L181 PolarHBondContact O-N 3Å; L181-G183 PolarHBondContact O-N 2.87Å; L181-R189 PolarHBondContact O-NH1 3.4Å
182	Q	56.6	Low	67.3	Low	110 Å²	110	68.9 Å²	68.9	51%	0.514	38%	0.382	S	S	.	.			trans	-78.2	59.7	174.4	-61.3	-167.9	21.8	0	0	112.8	D179 A180	D179-Q182 WeakPolarHBondContact O-CG 3.45Å; A180-Q182 VanDerWaalsContact C-N 3.34Å; A180-Q182 PolarHBondContact O-N 3.42Å
183	G	53.2	Low	67.3	Low	49 Å²	49	74.8 Å²	74.8	51%	0.505	41%	0.414	S	S	.	.			trans	-74.4	-179.5	170.6	0	0	0	0	0	113.8	L181 R189	L181-G183 PolarHBondContact O-N 2.87Å; G183-R189 PolarHBondContact O-NH2 2.92Å
184	E	51.9	Low	67.6	Low	141 Å²	141	79.5 Å²	79.5	66%	0.659	43%	0.431	S	S	*	.			trans	-64.6	159.9	-179.4	-63.6	179.9	-167.8	0	0	114.1	R189	E184-R189 PolarHBondContact O-NH2 3.15Å; E184-R189 VanDerWaalsContact O-NH2 3.17Å
185	V	56.8	Low	67.7	Low	31 Å²	31	81.1 Å²	81.1	19%	0.188	44%	0.439	C	S	.	.	S	Bend	trans	-86.3	-7.6	-175.8	-172.8	0	0	0	0	112.6	Y168 V187 F222	Y168-V185 HydrophobicContact CE1-CG1 3.87Å; V185-V187 PolarHBondContact O-N 3.47Å; V185-F222 HydrophobicContact CG2-CD1 4.13Å; V185-F222 HydrophobicContact CG2-CE1 3.81Å
186	R	53	Low	68	Low	96 Å²	96	83.4 Å²	83.4	36%	0.362	45%	0.445	S	S	.	.	S	Bend	trans	-80.6	-13.5	-163.6	-78.2	176	166.5	-162.1	-8.8	116.5	D225 D227	R186-D225 IonicContact CZ-OD2 2.81Å; R186-D225 IonicContact NH2-OD2 3.2Å; R186-D227 IonicContact CZ-OD2 3.51Å; R186-D227 IonicContact NH1-OD2 3.97Å; R186-D227 PolarHBondContact NH1-OD2 3.43Å; R186-D227 IonicContact NH2-OD2 2.87Å; R186-D227 PolarHBondContact NH2-OD2 2.85Å
187	V	56.4	Low	68.6	Low	106 Å²	106	82.3 Å²	82.3	64%	0.642	44%	0.44	S	S	*	.	S	Bend	trans	-133.7	124.9	-175.5	-175.6	0	0	0	0	109.7	V185 R189	V185-V187 PolarHBondContact O-N 3.47Å; V187-R189 PolarHBondContact O-N 3.11Å
188	P	60.2	Low	69.4	Low	88 Å²	88	78.9 Å²	78.9	57%	0.571	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-56.8	120.3	171.7	-24.8	34.8	0	0	0	110.6	R165	R165-P188 HydrophobicContact CG-CB 4.03Å; R165-P188 WeakPolarHBondContact O-CA 3.31Å
189	R	69.1	Low	70	Confident	49 Å²	49	78.8 Å²	78.8	19%	0.185	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-80.7	131.4	-175.3	-59.9	-177.2	-166.9	165.5	7.6	111.7	F164 R165 L181 G183 E184 V187	F164-R189 HydrophobicContact CD1-CB 4.26Å; F164-R189 HydrophobicContact CE1-CB 3.92Å; R165-R189 PolarHBondContact O-N 2.96Å; L181-R189 PolarHBondContact O-NH1 3.4Å; G183-R189 PolarHBondContact O-NH2 2.92Å; E184-R189 PolarHBondContact O-NH2 3.15Å; E184-R189 VanDerWaalsContact O-NH2 3.17Å; V187-R189 PolarHBondContact O-N 3.11Å
190	E	67.6	Low	71	Confident	188 Å²	188	79.4 Å²	79.4	88%	0.879	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-71.7	134.4	163	-63.9	-173.5	165.1	0	0	109.4
191	L	75.8	Confident	72.4	Confident	26 Å²	26	79.4 Å²	79.4	14%	0.136	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-95.9	124.5	178.6	-85.9	156.4	0	0	0	109.3	V161 F164 Q195 I199	V161-L191 HydrophobicContact CB-CD1 4.18Å; V161-L191 HydrophobicContact CG1-CD1 3.72Å; V161-L191 HydrophobicContact CG2-CD1 4.09Å; F164-L191 HydrophobicContact CD1-CD1 4.35Å; F164-L191 HydrophobicContact CD1-CD2 3.37Å; F164-L191 HydrophobicContact CD1-CG 3.73Å; F164-L191 HydrophobicContact CE1-CD2 3.6Å; F164-L191 HydrophobicContact CE1-CG 4.04Å; F164-L191 HydrophobicContact CG-CD2 4.07Å; F164-L191 HydrophobicContact CZ-CD2 4.45Å; L191-Q195 HydrophobicContact CD2-CB 3.77Å; L191-I199 HydrophobicContact CD2-CD1 3.75Å
192	S	81.6	Confident	73.8	Confident	54 Å²	54	76 Å²	76	38%	0.378	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-67	152.4	167.1	64.9	0	0	0	0	111.2	H194 Q195 R196	S192-H194 PolarHBondContact O-N 3.13Å; S192-Q195 PolarHBondContact O-N 3.32Å; S192-Q195 VanDerWaalsContact OG-CD 3.24Å; S192-Q195 WeakPolarHBondContact OG-CG 3.46Å; S192-Q195 PolarHBondContact OG-N 2.83Å; S192-Q195 PolarHBondContact OG-OE1 3.17Å; S192-R196 PolarHBondContact O-N 3.46Å
193	D	82.6	Confident	75.5	Confident	134 Å²	134	70.9 Å²	70.9	72%	0.717	39%	0.386	S	S	*	.	H	α-helix	trans	-58.8	-31.3	178.6	-60.2	-47.8	0	0	0	112.6	R196 S197	D193-R196 PolarHBondContact O-N 3.24Å; D193-S197 WeakPolarHBondContact O-CB 3.45Å; D193-S197 PolarHBondContact O-N 3.14Å
194	H	83.7	Confident	77.3	Confident	122 Å²	122	70.7 Å²	70.7	57%	0.565	38%	0.38	S	S	*	.	H	α-helix	trans	-64.2	-51.2	172.5	179.8	45.5	0	0	0	111.5	S192 R196 S197 M198	S192-H194 PolarHBondContact O-N 3.13Å; H194-R196 VanDerWaalsContact C-N 3.29Å; H194-R196 PolarHBondContact O-N 3Å; H194-S197 PolarHBondContact O-N 3.18Å; H194-M198 VanDerWaalsContact O-CG 3.25Å; H194-M198 WeakPolarHBondContact O-CG 3.42Å; H194-M198 PolarHBondContact O-N 3.19Å
195	Q	81.6	Confident	79.2	Confident	40 Å²	40	66.9 Å²	66.9	19%	0.187	37%	0.369	C	S	.	.	H	α-helix	trans	-60.4	-38.6	176.3	-72.4	159.4	-41.8	0	0	112	L191 S192 M198 I199	L191-Q195 HydrophobicContact CD2-CB 3.77Å; S192-Q195 PolarHBondContact O-N 3.32Å; S192-Q195 VanDerWaalsContact OG-CD 3.24Å; S192-Q195 WeakPolarHBondContact OG-CG 3.46Å; S192-Q195 PolarHBondContact OG-N 2.83Å; S192-Q195 PolarHBondContact OG-OE1 3.17Å; Q195-M198 PolarHBondContact O-N 3.01Å; Q195-I199 WeakPolarHBondContact O-CB 3.35Å; Q195-I199 VanDerWaalsContact O-CG1 3.29Å; Q195-I199 WeakPolarHBondContact O-CG1 3.33Å; Q195-I199 PolarHBondContact O-N 3.1Å
196	R	86.1	Confident	80.8	Confident	105 Å²	105	66.2 Å²	66.2	40%	0.396	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-47.5	173.8	-175.4	-179.1	-59.4	-74.5	-2.2	111.9	S192 D193 H194 M198 I199 S200	S192-R196 PolarHBondContact O-N 3.46Å; D193-R196 PolarHBondContact O-N 3.24Å; H194-R196 VanDerWaalsContact C-N 3.29Å; H194-R196 PolarHBondContact O-N 3Å; R196-M198 VanDerWaalsContact C-N 3.33Å; R196-M198 PolarHBondContact O-N 2.81Å; R196-I199 PolarHBondContact O-N 3.49Å; R196-S200 WeakPolarHBondContact O-CB 3.25Å; R196-S200 PolarHBondContact O-N 3.31Å
197	S	87.1	Confident	82.6	Confident	76 Å²	76	62.7 Å²	62.7	53%	0.531	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-40.1	177.1	-173.6	0	0	0	0	112.4	D193 H194 S200 S201	D193-S197 WeakPolarHBondContact O-CB 3.45Å; D193-S197 PolarHBondContact O-N 3.14Å; H194-S197 PolarHBondContact O-N 3.18Å; S197-S200 PolarHBondContact O-N 2.97Å; S197-S201 WeakPolarHBondContact O-CB 3.27Å; S197-S201 PolarHBondContact O-N 2.89Å
198	M	87.3	Confident	84.2	Confident	46 Å²	46	65.8 Å²	65.8	23%	0.227	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-41.5	175.9	-63.8	-64.6	-80.8	0	0	112	H175 E177 H194 Q195 R196 S201 A202	H175-M198 WeakPolarHBondContact CE1-CE 3.28Å; E177-M198 WeakPolarHBondContact OE2-CE 3.48Å; H194-M198 VanDerWaalsContact O-CG 3.25Å; H194-M198 WeakPolarHBondContact O-CG 3.42Å; H194-M198 PolarHBondContact O-N 3.19Å; Q195-M198 PolarHBondContact O-N 3.01Å; R196-M198 VanDerWaalsContact C-N 3.33Å; R196-M198 PolarHBondContact O-N 2.81Å; M198-S201 PolarHBondContact O-N 3.15Å; M198-A202 WeakPolarHBondContact O-CB 3.39Å; M198-A202 PolarHBondContact O-N 3.04Å
199	I	88.2	Confident	85.5	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.7	-44.9	174.9	-71.8	168.4	0	0	0	111.3	E157 M160 V161 F164 I174 V178 L191 Q195 R196 S201 A202 A203	E157-I199 HydrophobicContact CG-CG2 4.21Å; M160-I199 HydrophobicContact CB-CG2 3.41Å; M160-I199 VanDerWaalsContact CB-CG2 3.41Å; M160-I199 HydrophobicContact CG-CG2 4.37Å; M160-I199 HydrophobicContact SD-CG2 4.1Å; V161-I199 HydrophobicContact CG2-CG2 4.09Å; F164-I199 HydrophobicContact CB-CD1 4.5Å; I174-I199 HydrophobicContact CG2-CG1 4.18Å; V178-I199 HydrophobicContact CG1-CD1 4.41Å; V178-I199 HydrophobicContact CG1-CG1 4.49Å; V178-I199 HydrophobicContact CG2-CG1 4.33Å; L191-I199 HydrophobicContact CD2-CD1 3.75Å; Q195-I199 WeakPolarHBondContact O-CB 3.35Å; Q195-I199 VanDerWaalsContact O-CG1 3.29Å; Q195-I199 WeakPolarHBondContact O-CG1 3.33Å; Q195-I199 PolarHBondContact O-N 3.1Å; R196-I199 PolarHBondContact O-N 3.49Å; I199-S201 PolarHBondContact O-N 3.43Å; I199-A202 PolarHBondContact O-N 2.86Å; I199-A203 WeakPolarHBondContact O-CB 3.34Å; I199-A203 PolarHBondContact O-N 3.43Å
200	S	90.6	Very high	86.4	Confident	43 Å²	43	67.6 Å²	67.6	30%	0.301	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-43.1	177	-170	0	0	0	0	111.8	E157 R196 S197 A203 A204	E157-S200 VanDerWaalsContact CD-CB 3.47Å; E157-S200 WeakPolarHBondContact OE2-CB 3.45Å; E157-S200 PolarHBondContact OE2-OG 3.1Å; R196-S200 WeakPolarHBondContact O-CB 3.25Å; R196-S200 PolarHBondContact O-N 3.31Å; S197-S200 PolarHBondContact O-N 2.97Å; S200-A203 PolarHBondContact O-N 3.42Å; S200-A204 VanDerWaalsContact O-CB 3.31Å; S200-A204 WeakPolarHBondContact O-CB 3.49Å; S200-A204 PolarHBondContact O-N 3.15Å
201	S	91.4	Very high	87.5	Confident	80 Å²	80	61.5 Å²	61.5	56%	0.559	34%	0.336	S	S	*	.	H	α-helix	trans	-61.7	-44.7	174.2	-171.8	0	0	0	0	112.4	S197 M198 I199 A204 S205	S197-S201 WeakPolarHBondContact O-CB 3.27Å; S197-S201 PolarHBondContact O-N 2.89Å; M198-S201 PolarHBondContact O-N 3.15Å; I199-S201 PolarHBondContact O-N 3.43Å; S201-A204 PolarHBondContact O-N 3.29Å; S201-S205 PolarHBondContact O-N 3.01Å; S201-S205 VanDerWaalsContact O-N 3.07Å
202	A	89.3	Confident	88.3	Confident	13 Å²	13	61.6 Å²	61.6	11%	0.107	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-46.6	176.1	0	0	0	0	0	111.9	I174 M198 I199 A204 S205 Q206	I174-A202 WeakPolarHBondContact O-CB 3.39Å; M198-A202 WeakPolarHBondContact O-CB 3.39Å; M198-A202 PolarHBondContact O-N 3.04Å; I199-A202 PolarHBondContact O-N 2.86Å; A202-A204 PolarHBondContact O-N 3.41Å; A202-S205 PolarHBondContact O-N 2.99Å; A202-S205 VanDerWaalsContact O-N 3.14Å; A202-Q206 WeakPolarHBondContact O-CG 3.44Å; A202-Q206 PolarHBondContact O-N 3.11Å
203	A	92.1	Very high	88.8	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.008	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-45.6	175.8	0	0	0	0	0	111.8	L156 E157 M160 I199 S200 S205 Q206 A207	L156-A203 HydrophobicContact CB-CB 4.27Å; L156-A203 HydrophobicContact CD2-CB 4.35Å; L156-A203 HydrophobicContact CG-CB 4.1Å; E157-A203 HydrophobicContact CB-CB 3.9Å; M160-A203 HydrophobicContact SD-CB 3.82Å; I199-A203 WeakPolarHBondContact O-CB 3.34Å; I199-A203 PolarHBondContact O-N 3.43Å; S200-A203 PolarHBondContact O-N 3.42Å; A203-S205 PolarHBondContact O-N 3.22Å; A203-Q206 PolarHBondContact O-N 3.03Å; A203-A207 WeakPolarHBondContact O-CB 3.38Å; A203-A207 PolarHBondContact O-N 2.96Å
204	A	91.6	Very high	89.3	Confident	45 Å²	45	53.3 Å²	53.3	37%	0.372	29%	0.289	S	S	.	.	H	α-helix	trans	-66.6	-19.1	177.3	0	0	0	0	0	114	S200 S201 A202 K208	S200-A204 VanDerWaalsContact O-CB 3.31Å; S200-A204 WeakPolarHBondContact O-CB 3.49Å; S200-A204 PolarHBondContact O-N 3.15Å; S201-A204 PolarHBondContact O-N 3.29Å; A202-A204 PolarHBondContact O-N 3.41Å; A204-K208 WeakPolarHBondContact O-CE 3.4Å; A204-K208 PolarHBondContact O-NZ 3.31Å
205	S	90.8	Very high	89.9	Confident	62 Å²	62	47.5 Å²	47.5	43%	0.434	26%	0.262	S	S	.	.	H	α-helix	trans	-85.1	-57.4	170.2	-158.5	0	0	0	0	111.4	S201 A202 A203 A207 K208	S201-S205 PolarHBondContact O-N 3.01Å; S201-S205 VanDerWaalsContact O-N 3.07Å; A202-S205 PolarHBondContact O-N 2.99Å; A202-S205 VanDerWaalsContact O-N 3.14Å; A203-S205 PolarHBondContact O-N 3.22Å; S205-A207 VanDerWaalsContact C-N 3.27Å; S205-A207 PolarHBondContact O-N 3.29Å; S205-K208 WeakPolarHBondContact O-CB 3.42Å; S205-K208 PolarHBondContact O-N 3.42Å
206	Q	89.9	Confident	90.5	Very high	17 Å²	17	48.9 Å²	48.9	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-34.9	-177.1	-66.5	-175	11.3	0	0	112.2	Q110 L156 M160 A173 A202 A203 K208 E209 M210	Q110-Q206 VanDerWaalsContact CD-CD 3.42Å; L156-Q206 HydrophobicContact CD2-CB 3.86Å; M160-Q206 HydrophobicContact CE-CG 4.47Å; A173-Q206 PolarHBondContact O-NE2 3.17Å; A173-Q206 VanDerWaalsContact O-NE2 3.13Å; A202-Q206 WeakPolarHBondContact O-CG 3.44Å; A202-Q206 PolarHBondContact O-N 3.11Å; A203-Q206 PolarHBondContact O-N 3.03Å; Q206-K208 PolarHBondContact O-N 3.42Å; Q206-K208 VanDerWaalsContact O-N 3.11Å; Q206-E209 PolarHBondContact O-N 2.69Å; Q206-E209 VanDerWaalsContact O-N 3.16Å; Q206-M210 PolarHBondContact O-N 3.22Å; Q206-M210 VanDerWaalsContact O-N 3.1Å
207	A	90.9	Very high	90.9	Very high	21 Å²	21	43.9 Å²	43.9	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-15.6	177	0	0	0	0	0	115	V152 A153 L156 A203 S205	V152-A207 HydrophobicContact CB-CB 4.42Å; V152-A207 HydrophobicContact CG1-CB 3.8Å; A153-A207 HydrophobicContact CB-CB 3.88Å; L156-A207 HydrophobicContact CD2-CB 4.26Å; A203-A207 WeakPolarHBondContact O-CB 3.38Å; A203-A207 PolarHBondContact O-N 2.96Å; S205-A207 VanDerWaalsContact C-N 3.27Å; S205-A207 PolarHBondContact O-N 3.29Å
208	K	89.7	Confident	91.2	Very high	172 Å²	172	40.3 Å²	40.3	75%	0.748	22%	0.222	S	C	*	.	H	α-helix	trans	-82.2	-30.1	176.2	-64.9	168.2	-176.8	158.9	0	112.8	A204 S205 Q206	A204-K208 WeakPolarHBondContact O-CE 3.4Å; A204-K208 PolarHBondContact O-NZ 3.31Å; S205-K208 WeakPolarHBondContact O-CB 3.42Å; S205-K208 PolarHBondContact O-N 3.42Å; Q206-K208 PolarHBondContact O-N 3.42Å; Q206-K208 VanDerWaalsContact O-N 3.11Å
209	E	87.4	Confident	91.5	Very high	154 Å²	154	38.1 Å²	38.1	72%	0.72	21%	0.211	S	C	*	.	H	α-helix	trans	-100.6	-5.6	-176.8	-63.7	174.6	-172.1	0	0	112	Q206 D211	Q206-E209 PolarHBondContact O-N 2.69Å; Q206-E209 VanDerWaalsContact O-N 3.16Å; E209-D211 PolarHBondContact O-N 3.43Å
210	M	89.7	Confident	91.7	Very high	21 Å²	21	38.3 Å²	38.3	10%	0.103	21%	0.212	C	C	.	.			trans	-64.4	112.2	-179.4	-167.4	66.6	64.5	0	0	113	T103 L111 H112 V152 L156 Q206 L212	T103-M210 HydrophobicContact CG2-CE 3.97Å; T103-M210 HydrophobicContact CG2-SD 3.6Å; T103-M210 VanDerWaalsContact CG2-SD 3.6Å; L111-M210 VanDerWaalsContact O-CE 3.29Å; L111-M210 WeakPolarHBondContact O-CE 3.49Å; H112-M210 PolarHBondContact CD2-SD 3.18Å; V152-M210 HydrophobicContact CG1-CB 4.32Å; V152-M210 HydrophobicContact CG1-CG 4.2Å; L156-M210 HydrophobicContact CD1-CE 4.32Å; L156-M210 HydrophobicContact CD2-CE 3.8Å; Q206-M210 PolarHBondContact O-N 3.22Å; Q206-M210 VanDerWaalsContact O-N 3.1Å; M210-L212 HydrophobicContact CG-CD2 3.95Å; M210-L212 PolarHBondContact O-N 3.25Å
211	D	91.1	Very high	91.7	Very high	59 Å²	59	36.3 Å²	36.3	32%	0.316	20%	0.198	S	C	.	.			trans	-80.1	114.1	169.4	-171.2	-9.9	0	0	0	110.5	H112 E209 S213 V214	H112-D211 PolarHBondContact NE2-O 3.4Å; E209-D211 PolarHBondContact O-N 3.43Å; D211-S213 VanDerWaalsContact C-N 3.29Å; D211-S213 VanDerWaalsContact CG-OG 3.26Å; D211-S213 VanDerWaalsContact OD1-CB 3.3Å; D211-S213 WeakPolarHBondContact OD1-CB 3.47Å; D211-S213 PolarHBondContact OD1-N 2.75Å; D211-S213 PolarHBondContact OD1-OG 3.33Å; D211-S213 PolarHBondContact OD2-OG 3.18Å; D211-V214 HydrophobicContact CB-CG1 4.13Å
212	L	92.5	Very high	91.6	Very high	28 Å²	28	32.6 Å²	32.6	15%	0.147	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.6	178.9	-55.8	-178.1	0	0	0	113.2	H114 K149 V152 M210	H114-L212 WeakPolarHBondContact CE1-CB 3.38Å; H114-L212 WeakPolarHBondContact CE1-CD2 3.29Å; H114-L212 VanDerWaalsContact NE2-CA 3.26Å; H114-L212 WeakPolarHBondContact NE2-CA 3.25Å; H114-L212 WeakPolarHBondContact NE2-CB 3.35Å; H114-L212 PolarHBondContact NE2-O 2.69Å; K149-L212 HydrophobicContact CB-CD1 4.43Å; V152-L212 HydrophobicContact CG1-CD2 4.42Å; V152-L212 HydrophobicContact CG2-CD1 3.98Å; V152-L212 HydrophobicContact CG2-CD2 4Å; M210-L212 HydrophobicContact CG-CD2 3.95Å; M210-L212 PolarHBondContact O-N 3.25Å
213	S	91.9	Very high	91.6	Very high	12 Å²	12	32.2 Å²	32.2	8%	0.084	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-13.8	-179.1	72.2	0	0	0	0	114.5	D211 Y243 D244 N249	D211-S213 VanDerWaalsContact C-N 3.29Å; D211-S213 VanDerWaalsContact CG-OG 3.26Å; D211-S213 VanDerWaalsContact OD1-CB 3.3Å; D211-S213 WeakPolarHBondContact OD1-CB 3.47Å; D211-S213 PolarHBondContact OD1-N 2.75Å; D211-S213 PolarHBondContact OD1-OG 3.33Å; D211-S213 PolarHBondContact OD2-OG 3.18Å; S213-Y243 WeakPolarHBondContact O-CA 3.4Å; S213-D244 PolarHBondContact O-N 2.71Å; S213-N249 PolarHBondContact OG-ND2 3.05Å
214	V	93.2	Very high	91.4	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139.4	-174.8	65.8	0	0	0	0	112.6	A104 L105 H112 D211 P241 I242 Y243	A104-V214 HydrophobicContact CB-CB 4.39Å; A104-V214 HydrophobicContact CB-CG1 3.96Å; A104-V214 HydrophobicContact CB-CG2 3.66Å; L105-V214 HydrophobicContact CD1-CG1 4.34Å; L105-V214 HydrophobicContact CG-CG1 4.37Å; H112-V214 PolarHBondContact NE2-O 3.1Å; H112-V214 VanDerWaalsContact NE2-O 3.15Å; D211-V214 HydrophobicContact CB-CG1 4.13Å; V214-P241 HydrophobicContact CG2-CB 3.77Å; V214-I242 WeakPolarHBondContact CA-O 3.44Å; V214-Y243 HydrophobicContact CB-CD1 3.77Å; V214-Y243 HydrophobicContact CB-CE1 4.06Å; V214-Y243 HydrophobicContact CG2-CD1 3.53Å; V214-Y243 HydrophobicContact CG2-CE1 3.55Å; V214-Y243 HydrophobicContact CG2-CG 4.05Å
215	V	94.8	Very high	90.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162	178.5	-56.8	0	0	0	0	111.1	F59 L101 I144 P241 I242	F59-V215 HydrophobicContact CE1-CG2 4.35Å; F59-V215 HydrophobicContact CE2-CG1 4.04Å; F59-V215 HydrophobicContact CE2-CG2 4.36Å; F59-V215 HydrophobicContact CZ-CG1 4.25Å; F59-V215 HydrophobicContact CZ-CG2 3.74Å; L101-V215 HydrophobicContact CD2-CB 3.83Å; L101-V215 HydrophobicContact CD2-CG1 4.45Å; L101-V215 HydrophobicContact CD2-CG2 3.57Å; I144-V215 HydrophobicContact CD1-CG2 3.95Å; V215-P241 WeakPolarHBondContact O-CA 3.36Å; V215-I242 HydrophobicContact CG2-CB 4.04Å; V215-I242 HydrophobicContact CG2-CD1 4.38Å; V215-I242 PolarHBondContact N-O 3.04Å; V215-I242 PolarHBondContact O-N 2.78Å
216	R	95.1	Very high	90.3	Very high	69 Å²	69	36 Å²	36	26%	0.26	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.8	165.9	-81.9	175.2	136.1	143.6	-2	109.9	L101 V102 A104 V238 S239 E240 P241	L101-R216 WeakPolarHBondContact CA-O 3.33Å; V102-R216 HydrophobicContact CG2-CB 3.88Å; V102-R216 PolarHBondContact N-O 3.09Å; V102-R216 PolarHBondContact O-N 3.05Å; A104-R216 HydrophobicContact CB-CG 4.11Å; A104-R216 PolarHBondContact O-NH1 3.46Å; R216-V238 HydrophobicContact CB-CG1 3.69Å; R216-V238 HydrophobicContact CG-CG1 4.18Å; R216-S239 WeakPolarHBondContact CD-O 3.42Å; R216-S239 WeakPolarHBondContact CG-O 3.3Å; R216-S239 PolarHBondContact NE-O 2.97Å; R216-E240 IonicContact NH2-OE2 3.97Å; R216-E240 PolarHBondContact NH2-OE2 3.29Å; R216-P241 HydrophobicContact CG-CB 4.16Å
217	L	94.9	Very high	89.6	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127.8	168.8	-61.9	172.9	0	0	0	108.5	P52 L71 P84 V99 Q100 L101 L116 L142 F219 V238 S239 I242	P52-L217 HydrophobicContact CB-CD1 4.2Å; P52-L217 HydrophobicContact CG-CD1 4.2Å; L71-L217 HydrophobicContact CD2-CD1 3.89Å; P84-L217 HydrophobicContact CB-CD1 4.46Å; V99-L217 HydrophobicContact CG1-CB 4.08Å; V99-L217 HydrophobicContact CG1-CD2 4.01Å; V99-L217 HydrophobicContact CG1-CG 4.47Å; Q100-L217 WeakPolarHBondContact O-CA 3.31Å; L101-L217 HydrophobicContact CD2-CD2 3.77Å; L101-L217 HydrophobicContact CG-CD2 4.45Å; L116-L217 HydrophobicContact CD1-CD2 4.3Å; L116-L217 HydrophobicContact CD2-CD2 3.84Å; L142-L217 HydrophobicContact CD1-CD1 4.39Å; L217-F219 HydrophobicContact CB-CE2 3.85Å; L217-F219 HydrophobicContact CB-CZ 3.93Å; L217-F219 HydrophobicContact CD1-CE2 4.42Å; L217-F219 HydrophobicContact CD1-CZ 3.8Å; L217-V238 CarbonylContact O-C 3.58Å; L217-V238 WeakPolarHBondContact O-CA 3.25Å; L217-S239 PolarHBondContact N-OG 2.87Å; L217-S239 PolarHBondContact O-N 3.04Å; L217-I242 HydrophobicContact CD1-CD1 4.17Å; L217-I242 HydrophobicContact CG-CD1 3.92Å
218	M	93.6	Very high	88.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.5	164.3	-173.1	-177.8	72.7	0	0	108.9	V99 Q100 V102 V172 P236 V238	V99-M218 WeakPolarHBondContact CA-O 3.33Å; Q100-M218 PolarHBondContact N-O 3.29Å; Q100-M218 PolarHBondContact O-N 3.02Å; V102-M218 HydrophobicContact CG1-CB 3.89Å; V102-M218 HydrophobicContact CG1-SD 4.48Å; V102-M218 HydrophobicContact CG2-CB 4.11Å; V172-M218 HydrophobicContact CG2-CE 3.48Å; V172-M218 VanDerWaalsContact CG2-CE 3.48Å; V172-M218 HydrophobicContact CG2-SD 3.69Å; M218-P236 HydrophobicContact CG-CB 3.82Å; M218-P236 HydrophobicContact SD-CB 3.67Å; M218-P236 HydrophobicContact SD-CG 4.31Å; M218-V238 HydrophobicContact CB-CG2 4.36Å; M218-V238 HydrophobicContact CG-CG2 4.09Å
219	F	93.6	Very high	88.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.6	174.7	-55.2	-91.1	0	0	0	109.6	L46 I48 P84 V86 V98 V99 F139 L217 P236 V237	L46-F219 HydrophobicContact CD2-CB 3.71Å; L46-F219 WeakPolarHBondContact CD2-O 3.3Å; I48-F219 HydrophobicContact CD1-CD2 3.98Å; I48-F219 HydrophobicContact CD1-CE2 3.86Å; I48-F219 HydrophobicContact CG1-CD2 4.13Å; I48-F219 HydrophobicContact CG1-CE2 4.16Å; P84-F219 HydrophobicContact CB-CZ 4.46Å; V86-F219 HydrophobicContact CG1-CB 4.42Å; V86-F219 HydrophobicContact CG1-CD1 3.69Å; V86-F219 HydrophobicContact CG1-CD2 3.98Å; V86-F219 HydrophobicContact CG1-CE1 3.84Å; V86-F219 HydrophobicContact CG1-CE2 4.09Å; V86-F219 HydrophobicContact CG1-CG 3.78Å; V86-F219 HydrophobicContact CG1-CZ 4.03Å; V86-F219 HydrophobicContact CG2-CD1 4.49Å; V98-F219 WeakPolarHBondContact O-CA 3.5Å; V99-F219 HydrophobicContact CB-CD1 4.3Å; V99-F219 HydrophobicContact CB-CE1 4.5Å; V99-F219 HydrophobicContact CG1-CD1 3.74Å; V99-F219 HydrophobicContact CG1-CE1 3.69Å; V99-F219 HydrophobicContact CG1-CG 4.39Å; V99-F219 HydrophobicContact CG1-CZ 4.33Å; V99-F219 HydrophobicContact CG2-CD1 3.7Å; V99-F219 HydrophobicContact CG2-CE1 3.95Å; F139-F219 AromaticContact CD2-CE1 3.84Å; F139-F219 HydrophobicContact CD2-CE1 3.84Å; F139-F219 AromaticContact CE2-CD1 3.87Å; F139-F219 HydrophobicContact CE2-CD1 3.87Å; F139-F219 AromaticContact CE2-CE1 3.61Å; F139-F219 HydrophobicContact CE2-CE1 3.61Å; F139-F219 HydrophobicContact CZ-CD1 4.37Å; F139-F219 HydrophobicContact CZ-CE1 4.42Å; L217-F219 HydrophobicContact CB-CE2 3.85Å; L217-F219 HydrophobicContact CB-CZ 3.93Å; L217-F219 HydrophobicContact CD1-CE2 4.42Å; L217-F219 HydrophobicContact CD1-CZ 3.8Å; F219-P236 WeakPolarHBondContact O-CA 3.42Å; F219-V237 PolarHBondContact N-O 3.5Å; F219-V237 PolarHBondContact O-N 3.38Å
220	T	91.3	Very high	87.9	Confident	4 Å²	4	30.1 Å²	30.1	3%	0.025	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.8	175.5	-51.9	0	0	0	0	109.5	V97 V98 F222 P236	V97-T220 WeakPolarHBondContact CA-O 3.36Å; V98-T220 PolarHBondContact N-O 3.28Å; V98-T220 PolarHBondContact O-N 2.98Å; T220-F222 HydrophobicContact CG2-CD2 4.39Å; T220-F222 HydrophobicContact CG2-CE1 4.39Å; T220-F222 HydrophobicContact CG2-CE2 3.63Å; T220-F222 HydrophobicContact CG2-CZ 3.64Å; T220-P236 HydrophobicContact CG2-CG 4.28Å
221	A	91	Very high	87.4	Confident	0 Å²	0	30 Å²	30	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.1	178.4	0	0	0	0	0	111.2	L46 I88 R96 V97 R233 L234	L46-A221 HydrophobicContact CD1-CB 4.22Å; L46-A221 HydrophobicContact CD2-CB 4.26Å; I88-A221 HydrophobicContact CD1-CB 4.01Å; I88-A221 HydrophobicContact CG1-CB 4.43Å; R96-A221 CarbonylContact O-C 3.5Å; R96-A221 WeakPolarHBondContact O-CA 3.46Å; V97-A221 HydrophobicContact CG2-CB 4.28Å; A221-R233 CarbonylContact O-C 3.59Å; A221-R233 WeakPolarHBondContact O-CA 3.34Å; A221-L234 HydrophobicContact CB-CB 4.35Å; A221-L234 HydrophobicContact CB-CD1 4.06Å; A221-L234 HydrophobicContact CB-CG 4.27Å; A221-L234 PolarHBondContact O-N 3.17Å
222	F	89.2	Confident	87	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.013	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.3	176.9	-60	-92.6	0	0	0	109.2	R96 V98 Y168 V185 T220 F230 R233	R96-F222 HydrophobicContact CB-CB 4.45Å; R96-F222 PolarHBondContact N-O 3.08Å; R96-F222 PolarHBondContact O-N 3.28Å; V98-F222 HydrophobicContact CB-CE2 4.07Å; V98-F222 HydrophobicContact CG2-CD2 3.9Å; V98-F222 HydrophobicContact CG2-CE2 3.62Å; Y168-F222 HydrophobicContact CD1-CE2 4.2Å; Y168-F222 AromaticContact CD1-CZ 3.83Å; Y168-F222 HydrophobicContact CD1-CZ 3.83Å; Y168-F222 HydrophobicContact CE1-CE2 4.14Å; Y168-F222 HydrophobicContact CE1-CZ 4.03Å; V185-F222 HydrophobicContact CG2-CD1 4.13Å; V185-F222 HydrophobicContact CG2-CE1 3.81Å; T220-F222 HydrophobicContact CG2-CD2 4.39Å; T220-F222 HydrophobicContact CG2-CE1 4.39Å; T220-F222 HydrophobicContact CG2-CE2 3.63Å; T220-F222 HydrophobicContact CG2-CZ 3.64Å; F222-F230 HydrophobicContact CB-CB 3.98Å; F222-F230 WeakPolarHBondContact O-CD1 3.35Å; F222-R233 HydrophobicContact CD1-CB 3.87Å; F222-R233 HydrophobicContact CE1-CB 3.77Å
223	L	88.8	Confident	86.7	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	147.2	177.5	-52.1	-174.1	0	0	0	110.4	P44 I88 Y91 A95 S231 R232 L234	P44-L223 HydrophobicContact CB-CD1 4.27Å; P44-L223 HydrophobicContact CG-CD1 4.15Å; I88-L223 HydrophobicContact CD1-CD2 4.36Å; Y91-L223 HydrophobicContact CD1-CD2 3.79Å; Y91-L223 HydrophobicContact CD2-CD1 3.86Å; Y91-L223 HydrophobicContact CD2-CD2 4.42Å; Y91-L223 HydrophobicContact CE1-CD2 3.76Å; Y91-L223 HydrophobicContact CE2-CD1 3.96Å; Y91-L223 HydrophobicContact CE2-CD2 4.41Å; Y91-L223 HydrophobicContact CG-CD1 4.25Å; Y91-L223 HydrophobicContact CG-CD2 4.14Å; A95-L223 HydrophobicContact CB-CD2 3.83Å; L223-S231 PolarHBondContact O-N 2.93Å; L223-R232 HydrophobicContact CB-CB 4.2Å; L223-R232 PolarHBondContact N-O 3.43Å; L223-R232 PolarHBondContact O-N 3.02Å; L223-R232 VanDerWaalsContact O-N 3.16Å; L223-L234 HydrophobicContact CD1-CD2 3.95Å; L223-L234 HydrophobicContact CD2-CD1 4.4Å; L223-L234 HydrophobicContact CG-CD2 4.21Å; L223-L234 HydrophobicContact CG-CG 4.32Å
224	P	87.9	Confident	86.5	Confident	22 Å²	22	36.8 Å²	36.8	14%	0.143	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	149.5	175.9	28.4	-35.7	0	0	0	110.2	Q94 F230 R232	Q94-P224 HydrophobicContact CB-CG 4.49Å; Q94-P224 WeakPolarHBondContact O-CD 3.36Å; Q94-P224 WeakPolarHBondContact O-CG 3.47Å; P224-F230 HydrophobicContact CB-CD1 4.08Å; P224-F230 HydrophobicContact CB-CE1 4.13Å; P224-F230 HydrophobicContact CG-CD1 4.5Å; P224-F230 HydrophobicContact CG-CE1 4.34Å; P224-R232 VanDerWaalsContact O-CZ 3.24Å; P224-R232 PolarHBondContact O-NE 2.91Å; P224-R232 PolarHBondContact O-NH2 3.02Å
225	D	82.4	Confident	86.2	Confident	50 Å²	50	42.7 Å²	42.7	27%	0.267	23%	0.23	S	C	.	.			trans	-113.2	-175.8	-179.3	-168.5	4.6	0	0	0	110	R186 D227 G228 G229 S231 R232	R186-D225 IonicContact CZ-OD2 2.81Å; R186-D225 IonicContact NH2-OD2 3.2Å; D225-D227 PolarHBondContact O-N 3.44Å; D225-G228 PolarHBondContact O-N 3.41Å; D225-G229 WeakPolarHBondContact CB-O 3.28Å; D225-G229 PolarHBondContact N-O 3.25Å; D225-S231 WeakPolarHBondContact CB-OG 3.22Å; D225-S231 PolarHBondContact OD2-OG 3.3Å; D225-R232 HydrophobicContact CB-CG 4.2Å
226	S	78.4	Confident	86	Confident	116 Å²	116	43.7 Å²	43.7	81%	0.811	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.9	-170.3	-53.6	0	0	0	0	114.1
227	D	74.6	Confident	85.8	Confident	122 Å²	122	42.4 Å²	42.4	65%	0.652	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.7	17	179.1	-31.9	-92	0	0	0	113.1	R186 D225 G229	R186-D227 IonicContact CZ-OD2 3.51Å; R186-D227 IonicContact NH1-OD2 3.97Å; R186-D227 PolarHBondContact NH1-OD2 3.43Å; R186-D227 IonicContact NH2-OD2 2.87Å; R186-D227 PolarHBondContact NH2-OD2 2.85Å; D225-D227 PolarHBondContact O-N 3.44Å; D227-G229 PolarHBondContact O-N 2.99Å; D227-G229 VanDerWaalsContact O-N 3.09Å
228	G	72.1	Confident	85.8	Confident	47 Å²	47	44.9 Å²	44.9	49%	0.485	25%	0.252	S	S	.	.	S	Bend	trans	78.8	-21.9	178.2	0	0	0	0	0	115.9	D225	D225-G228 PolarHBondContact O-N 3.41Å
229	G	76.8	Confident	85.8	Confident	31 Å²	31	44.9 Å²	44.9	32%	0.32	25%	0.252	S	S	.	.			trans	-67.6	141.1	176.8	0	0	0	0	0	113.7	D225 D227 S231	D225-G229 WeakPolarHBondContact CB-O 3.28Å; D225-G229 PolarHBondContact N-O 3.25Å; D227-G229 PolarHBondContact O-N 2.99Å; D227-G229 VanDerWaalsContact O-N 3.09Å; G229-S231 PolarHBondContact O-N 3.49Å; G229-S231 VanDerWaalsContact O-N 3.17Å
230	F	83.4	Confident	85.9	Confident	39 Å²	39	48.4 Å²	48.4	17%	0.171	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	90.3	179.3	-56.4	-76.8	0	0	0	112.3	Q94 R96 F222 P224	Q94-F230 HydrophobicContact CB-CE1 4.14Å; Q94-F230 HydrophobicContact CB-CZ 4.36Å; R96-F230 HydrophobicContact CB-CB 4.09Å; R96-F230 HydrophobicContact CB-CD1 3.99Å; R96-F230 HydrophobicContact CB-CD2 3.92Å; R96-F230 HydrophobicContact CB-CE1 4.41Å; R96-F230 HydrophobicContact CB-CE2 4.32Å; R96-F230 HydrophobicContact CB-CG 3.74Å; F222-F230 HydrophobicContact CB-CB 3.98Å; F222-F230 WeakPolarHBondContact O-CD1 3.35Å; P224-F230 HydrophobicContact CB-CD1 4.08Å; P224-F230 HydrophobicContact CB-CE1 4.13Å; P224-F230 HydrophobicContact CG-CD1 4.5Å; P224-F230 HydrophobicContact CG-CE1 4.34Å
231	S	79.4	Confident	86	Confident	19 Å²	19	48.8 Å²	48.8	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-25.1	179.1	55	0	0	0	0	114.3	L223 D225 G229 R233	L223-S231 PolarHBondContact O-N 2.93Å; D225-S231 WeakPolarHBondContact CB-OG 3.22Å; D225-S231 PolarHBondContact OD2-OG 3.3Å; G229-S231 PolarHBondContact O-N 3.49Å; G229-S231 VanDerWaalsContact O-N 3.17Å; S231-R233 PolarHBondContact O-N 3.34Å; S231-R233 VanDerWaalsContact O-N 3.14Å
232	R	82.8	Confident	86.1	Confident	126 Å²	126	48.8 Å²	48.8	48%	0.475	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	92.5	-169.4	-60.8	-171.1	-64.4	152	-4.6	111	L223 P224 D225	L223-R232 HydrophobicContact CB-CB 4.2Å; L223-R232 PolarHBondContact N-O 3.43Å; L223-R232 PolarHBondContact O-N 3.02Å; L223-R232 VanDerWaalsContact O-N 3.16Å; P224-R232 VanDerWaalsContact O-CZ 3.24Å; P224-R232 PolarHBondContact O-NE 2.91Å; P224-R232 PolarHBondContact O-NH2 3.02Å; D225-R232 HydrophobicContact CB-CG 4.2Å
233	R	85.3	Confident	86.3	Confident	98 Å²	98	51.2 Å²	51.2	37%	0.37	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	142.1	179.9	76.8	173.9	-175.5	83.3	-12.6	112.6	A221 F222 S231 E235	A221-R233 CarbonylContact O-C 3.59Å; A221-R233 WeakPolarHBondContact O-CA 3.34Å; F222-R233 HydrophobicContact CD1-CB 3.87Å; F222-R233 HydrophobicContact CE1-CB 3.77Å; S231-R233 PolarHBondContact O-N 3.34Å; S231-R233 VanDerWaalsContact O-N 3.14Å; R233-E235 IonicContact CZ-OE2 3.27Å; R233-E235 IonicContact NH1-OE2 3.9Å; R233-E235 PolarHBondContact NH1-OE2 3.24Å
234	L	88.5	Confident	86.5	Confident	17 Å²	17	51.4 Å²	51.4	9%	0.089	28%	0.282	C	S	.	.			trans	-91.6	174.2	159.1	-56.2	-170.9	0	0	0	109.6	P44 I88 A221 L223	P44-L234 HydrophobicContact CB-CD1 4.41Å; P44-L234 HydrophobicContact CB-CD2 4.2Å; P44-L234 HydrophobicContact CG-CD2 3.94Å; I88-L234 HydrophobicContact CG2-CD1 3.8Å; A221-L234 HydrophobicContact CB-CB 4.35Å; A221-L234 HydrophobicContact CB-CD1 4.06Å; A221-L234 HydrophobicContact CB-CG 4.27Å; A221-L234 PolarHBondContact O-N 3.17Å; L223-L234 HydrophobicContact CD1-CD2 3.95Å; L223-L234 HydrophobicContact CD2-CD1 4.4Å; L223-L234 HydrophobicContact CG-CD2 4.21Å; L223-L234 HydrophobicContact CG-CG 4.32Å
235	E	86.3	Confident	86.6	Confident	127 Å²	127	52 Å²	52	59%	0.593	29%	0.286	S	S	*	.			trans	-74.4	134.4	177.2	-162.8	60.2	-170.3	0	0	111	R233	R233-E235 IonicContact CZ-OE2 3.27Å; R233-E235 IonicContact NH1-OE2 3.9Å; R233-E235 PolarHBondContact NH1-OE2 3.24Å
236	P	90.2	Very high	86.9	Confident	22 Å²	22	55.6 Å²	55.6	14%	0.143	30%	0.299	C	S	.	.			trans	-65.6	149.1	-179.4	-21.7	34.2	0	0	0	113.1	M218 F219 T220	M218-P236 HydrophobicContact CG-CB 3.82Å; M218-P236 HydrophobicContact SD-CB 3.67Å; M218-P236 HydrophobicContact SD-CG 4.31Å; F219-P236 WeakPolarHBondContact O-CA 3.42Å; T220-P236 HydrophobicContact CG2-CG 4.28Å
237	V	92.1	Very high	87.3	Confident	42 Å²	42	50.5 Å²	50.5	26%	0.255	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129.5	175.7	-174	0	0	0	0	109.6	L46 I48 F219	L46-V237 HydrophobicContact CB-CG2 3.98Å; L46-V237 HydrophobicContact CD2-CG2 4.32Å; L46-V237 HydrophobicContact CG-CG2 4.22Å; L46-V237 WeakPolarHBondContact O-CG2 3.16Å; I48-V237 HydrophobicContact CD1-CG1 3.84Å; I48-V237 HydrophobicContact CG1-CG1 3.89Å; F219-V237 PolarHBondContact N-O 3.5Å; F219-V237 PolarHBondContact O-N 3.38Å
238	V	93.4	Very high	87.4	Confident	52 Å²	52	47.2 Å²	47.2	32%	0.315	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139	-178	-173.1	0	0	0	0	110.2	V102 P109 R216 L217 M218	V102-V238 HydrophobicContact CG2-CG1 4.06Å; P109-V238 HydrophobicContact CG-CG2 4.47Å; R216-V238 HydrophobicContact CB-CG1 3.69Å; R216-V238 HydrophobicContact CG-CG1 4.18Å; L217-V238 CarbonylContact O-C 3.58Å; L217-V238 WeakPolarHBondContact O-CA 3.25Å; M218-V238 HydrophobicContact CB-CG2 4.36Å; M218-V238 HydrophobicContact CG-CG2 4.09Å
239	S	95.2	Very high	87.9	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	24%	0.242	C	C	.	.			trans	-76.4	174.8	179	77.1	0	0	0	0	113.3	Q51 R216 L217	Q51-S239 VanDerWaalsContact OE1-CA 3.3Å; R216-S239 WeakPolarHBondContact CD-O 3.42Å; R216-S239 WeakPolarHBondContact CG-O 3.3Å; R216-S239 PolarHBondContact NE-O 2.97Å; L217-S239 PolarHBondContact N-OG 2.87Å; L217-S239 PolarHBondContact O-N 3.04Å
240	E	94.1	Very high	88.1	Confident	73 Å²	73	46.5 Å²	46.5	34%	0.341	23%	0.228	S	C	.	.			trans	-65.2	156	159.7	-68.6	-47.8	155.2	0	0	113	Q51 Q54 R216	Q51-E240 HydrophobicContact CG-CG 4.2Å; Q54-E240 HydrophobicContact CG-CB 4.08Å; R216-E240 IonicContact NH2-OE2 3.97Å; R216-E240 PolarHBondContact NH2-OE2 3.29Å
241	P	93.7	Very high	88.1	Confident	13 Å²	13	45 Å²	45	8%	0.084	22%	0.222	C	C	.	.			trans	-68.8	138.3	-177.7	28.8	-34.8	0	0	0	111.6	Q54 A104 V214 V215 R216 Y243	Q54-P241 WeakPolarHBondContact CA-O 3.37Å; Q54-P241 WeakPolarHBondContact CB-O 3.35Å; Q54-P241 WeakPolarHBondContact CG-O 3.41Å; A104-P241 HydrophobicContact CB-CB 4.2Å; V214-P241 HydrophobicContact CG2-CB 3.77Å; V215-P241 WeakPolarHBondContact O-CA 3.36Å; R216-P241 HydrophobicContact CG-CB 4.16Å; P241-Y243 HydrophobicContact CB-CE2 3.99Å; P241-Y243 HydrophobicContact CG-CE2 3.84Å
242	I	94.4	Very high	88.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.7	174.4	-51.2	163.1	0	0	0	106.6	P52 Q54 F59 L71 I144 V214 V215 L217	P52-I242 HydrophobicContact CB-CD1 3.75Å; P52-I242 HydrophobicContact CB-CG1 3.89Å; P52-I242 HydrophobicContact CG-CD1 3.8Å; P52-I242 HydrophobicContact CG-CG1 3.73Å; Q54-I242 WeakPolarHBondContact O-CA 3.49Å; F59-I242 HydrophobicContact CE1-CG2 3.98Å; F59-I242 HydrophobicContact CZ-CG2 4.4Å; L71-I242 HydrophobicContact CD1-CD1 4.21Å; L71-I242 HydrophobicContact CD1-CG2 4.07Å; L71-I242 HydrophobicContact CD2-CD1 3.64Å; I144-I242 HydrophobicContact CD1-CD1 4.23Å; I144-I242 HydrophobicContact CD1-CG2 4.27Å; V214-I242 WeakPolarHBondContact CA-O 3.44Å; V215-I242 HydrophobicContact CG2-CB 4.04Å; V215-I242 HydrophobicContact CG2-CD1 4.38Å; V215-I242 PolarHBondContact N-O 3.04Å; V215-I242 PolarHBondContact O-N 2.78Å; L217-I242 HydrophobicContact CD1-CD1 4.17Å; L217-I242 HydrophobicContact CG-CD1 3.92Å
243	Y	92.9	Very high	88.8	Confident	53 Å²	53	42.5 Å²	42.5	21%	0.208	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	142.2	178.3	-54.6	-97	0	0	0	110.8	Q54 R55 S213 V214 P241 S245 A250	Q54-Y243 WeakPolarHBondContact O-CD2 3.45Å; Q54-Y243 PolarHBondContact O-N 3.45Å; R55-Y243 HydrophobicContact CG-CD2 3.83Å; R55-Y243 HydrophobicContact CG-CG 4.44Å; S213-Y243 WeakPolarHBondContact O-CA 3.4Å; V214-Y243 HydrophobicContact CB-CD1 3.77Å; V214-Y243 HydrophobicContact CB-CE1 4.06Å; V214-Y243 HydrophobicContact CG2-CD1 3.53Å; V214-Y243 HydrophobicContact CG2-CE1 3.55Å; V214-Y243 HydrophobicContact CG2-CG 4.05Å; P241-Y243 HydrophobicContact CB-CE2 3.99Å; P241-Y243 HydrophobicContact CG-CE2 3.84Å; Y243-S245 PolarHBondContact O-N 3.49Å; Y243-A250 VanDerWaalsContact CB-CB 3.49Å; Y243-A250 HydrophobicContact CD1-CB 4.09Å; Y243-A250 HydrophobicContact CG-CB 4.07Å
244	D	92.8	Very high	89.1	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.053	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-74	119.6	175	-177	21.9	0	0	0	111.4	R58 F59 S213 K246 A247	R58-D244 WeakPolarHBondContact CA-OD1 3.32Å; F59-D244 HydrophobicContact CB-CB 4.39Å; F59-D244 HydrophobicContact CD1-CB 4.19Å; F59-D244 HydrophobicContact CD2-CB 3.62Å; F59-D244 HydrophobicContact CE1-CB 4.3Å; F59-D244 HydrophobicContact CE2-CB 3.76Å; F59-D244 HydrophobicContact CG-CB 3.82Å; F59-D244 HydrophobicContact CZ-CB 4.08Å; F59-D244 PolarHBondContact N-OD1 2.73Å; S213-D244 PolarHBondContact O-N 2.71Å; D244-K246 PolarHBondContact O-N 2.9Å; D244-K246 VanDerWaalsContact O-N 3.11Å; D244-K246 PolarHBondContact OD1-N 3.19Å; D244-K246 VanDerWaalsContact OD1-N 3.14Å; D244-K246 WeakPolarHBondContact OD2-CB 3.36Å; D244-A247 HydrophobicContact CB-CB 4.25Å; D244-A247 VanDerWaalsContact O-CB 3.25Å; D244-A247 WeakPolarHBondContact O-CB 3.5Å; D244-A247 PolarHBondContact O-N 3.28Å
245	S	89.9	Confident	89.4	Confident	33 Å²	33	41.6 Å²	41.6	23%	0.231	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-10.3	175	60.3	0	0	0	0	114.8	F57 Y243	F57-S245 VanDerWaalsContact C-OG 3.3Å; F57-S245 WeakPolarHBondContact O-CB 3.39Å; F57-S245 PolarHBondContact O-N 3.14Å; F57-S245 PolarHBondContact O-OG 2.76Å; Y243-S245 PolarHBondContact O-N 3.49Å
246	K	88.9	Confident	89.8	Confident	126 Å²	126	39 Å²	39	55%	0.548	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-13.8	167.6	-73.8	-67.4	-172.4	178.4	0	114	R58 D244	R58-K246 HydrophobicContact CG-CG 3.88Å; D244-K246 PolarHBondContact O-N 2.9Å; D244-K246 VanDerWaalsContact O-N 3.11Å; D244-K246 PolarHBondContact OD1-N 3.19Å; D244-K246 VanDerWaalsContact OD1-N 3.14Å; D244-K246 WeakPolarHBondContact OD2-CB 3.36Å
247	A	87	Confident	90	Very high	10 Å²	10	46.5 Å²	46.5	8%	0.083	23%	0.233	C	C	.	.	S	Bend	trans	-71.9	132.3	175.9	0	0	0	0	0	111	D244 N249 A250 S251	D244-A247 HydrophobicContact CB-CB 4.25Å; D244-A247 VanDerWaalsContact O-CB 3.25Å; D244-A247 WeakPolarHBondContact O-CB 3.5Å; D244-A247 PolarHBondContact O-N 3.28Å; A247-N249 WeakPolarHBondContact CB-OD1 3.4Å; A247-N249 PolarHBondContact O-N 3.06Å; A247-N249 VanDerWaalsContact O-N 3.17Å; A247-A250 CarbonylContact O-C 3.44Å; A247-A250 PolarHBondContact O-N 2.89Å; A247-A250 VanDerWaalsContact O-N 3.08Å; A247-S251 PolarHBondContact O-N 2.96Å
248	P	77.4	Confident	90.1	Very high	53 Å²	53	45.3 Å²	45.3	34%	0.344	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.6	-174	-24.9	35	0	0	0	115.4	S251 Q279	P248-S251 PolarHBondContact O-OG 2.99Å; P248-Q279 HydrophobicContact CB-CG 4.19Å
249	N	82.1	Confident	90.1	Very high	61 Å²	61	46.7 Å²	46.7	33%	0.326	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.4	178.5	56.2	-44.3	0	0	0	113.5	S213 A247 R338	S213-N249 PolarHBondContact OG-ND2 3.05Å; A247-N249 WeakPolarHBondContact CB-OD1 3.4Å; A247-N249 PolarHBondContact O-N 3.06Å; A247-N249 VanDerWaalsContact O-N 3.17Å; N249-R338 PolarHBondContact O-NE 3.36Å
250	A	81.1	Confident	89.9	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.008	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	20.8	-178.8	0	0	0	0	0	113.3	Y243 A247	Y243-A250 VanDerWaalsContact CB-CB 3.49Å; Y243-A250 HydrophobicContact CD1-CB 4.09Å; Y243-A250 HydrophobicContact CG-CB 4.07Å; A247-A250 CarbonylContact O-C 3.44Å; A247-A250 PolarHBondContact O-N 2.89Å; A247-A250 VanDerWaalsContact O-N 3.08Å
251	S	82.7	Confident	89.9	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.063	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-58	140.2	167	53.6	0	0	0	0	110.2	A247 P248 L253 K277 R338	A247-S251 PolarHBondContact O-N 2.96Å; P248-S251 PolarHBondContact O-OG 2.99Å; S251-L253 PolarHBondContact O-N 2.78Å; S251-K277 PolarHBondContact OG-O 3.01Å; S251-R338 PolarHBondContact O-NH2 2.88Å
252	N	85.3	Confident	89.8	Confident	87 Å²	87	55 Å²	55	47%	0.465	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-68.1	128.2	174.2	-171.3	9	0	0	0	109.4
253	L	90.9	Very high	89.7	Confident	4 Å²	4	55 Å²	55	2%	0.021	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-79.3	130.5	-179.4	-61.7	-178.1	0	0	0	110.5	S251 V278 I283 L336 R338 E343 S345	S251-L253 PolarHBondContact O-N 2.78Å; L253-V278 HydrophobicContact CD2-CG1 4.05Å; L253-I283 HydrophobicContact CD2-CD1 4.08Å; L253-L336 HydrophobicContact CB-CB 4.31Å; L253-L336 HydrophobicContact CD1-CB 4.36Å; L253-R338 HydrophobicContact CD1-CB 4.1Å; L253-E343 HydrophobicContact CD1-CB 4.44Å; L253-E343 HydrophobicContact CD1-CG 4.36Å; L253-E343 WeakPolarHBondContact CD1-O 3.38Å; L253-S345 VanDerWaalsContact O-CA 3.25Å; L253-S345 WeakPolarHBondContact O-CA 3.45Å; L253-S345 WeakPolarHBondContact O-CB 3.2Å
254	K	92.6	Very high	89.6	Confident	92 Å²	92	53 Å²	53	40%	0.4	27%	0.27	S	S	.	.			trans	-150.4	130.3	179.8	-169	-174	178.9	-169.8	0	112.3	V256 C275 D276	K254-V256 PolarHBondContact O-N 3.27Å; K254-C275 VanDerWaalsContact O-CA 3.23Å; K254-C275 WeakPolarHBondContact O-CA 3.48Å; K254-C275 VanDerWaalsContact O-CB 3.3Å; K254-C275 WeakPolarHBondContact O-CB 3.39Å; K254-D276 HydrophobicContact CB-CB 4.1Å; K254-D276 WeakPolarHBondContact CB-OD2 3.33Å; K254-D276 VanDerWaalsContact CD-OD2 3.27Å; K254-D276 WeakPolarHBondContact CD-OD2 3.41Å; K254-D276 PolarHBondContact O-N 3.18Å
255	I	95.4	Very high	89.6	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.6	165.8	-57.7	174.3	0	0	0	107.9	M258 L273 V334 L336 K348	I255-M258 HydrophobicContact CG2-CG 3.9Å; I255-M258 HydrophobicContact CG2-SD 4.12Å; I255-L273 HydrophobicContact CD1-CD1 4.1Å; I255-L273 HydrophobicContact CG1-CD1 4.2Å; I255-L273 HydrophobicContact CG1-CD2 4.32Å; I255-L273 HydrophobicContact CG2-CD1 4.33Å; I255-L273 HydrophobicContact CG2-CD2 4.27Å; I255-L273 HydrophobicContact CG2-CG 4.02Å; I255-V334 HydrophobicContact CD1-CG1 4.22Å; I255-V334 WeakPolarHBondContact CD1-O 3.49Å; I255-L336 HydrophobicContact CD1-CG 4.44Å; I255-L336 HydrophobicContact CG1-CD1 3.98Å; I255-L336 HydrophobicContact CG1-CG 3.78Å; I255-K348 HydrophobicContact CB-CD 4.1Å; I255-K348 HydrophobicContact CB-CG 4.45Å; I255-K348 HydrophobicContact CG2-CD 3.8Å; I255-K348 WeakPolarHBondContact O-CE 3.39Å; I255-K348 PolarHBondContact O-NZ 3.48Å
256	V	94.7	Very high	89.6	Confident	71 Å²	71	52.8 Å²	52.8	43%	0.43	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-56.2	176.2	178.7	0	0	0	0	109.3	K254 L274 D276 K348	K254-V256 PolarHBondContact O-N 3.27Å; V256-L274 WeakPolarHBondContact CA-O 3.39Å; V256-L274 HydrophobicContact CB-CB 4.42Å; V256-L274 WeakPolarHBondContact CB-O 3.41Å; V256-L274 PolarHBondContact N-O 2.93Å; V256-D276 WeakPolarHBondContact CG2-OD1 3.23Å; V256-K348 PolarHBondContact O-NZ 3.04Å
257	R	92.9	Very high	89.7	Confident	181 Å²	181	47.4 Å²	47.4	68%	0.683	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-149.7	156.4	-178.8	-169.4	170.8	-177	168.4	2.5	110.6	L274	R257-L274 HydrophobicContact CB-CB 4.34Å; R257-L274 HydrophobicContact CB-CD1 4.36Å; R257-L274 PolarHBondContact N-O 3.27Å; R257-L274 PolarHBondContact O-N 2.9Å
258	M	94.1	Very high	89.9	Confident	16 Å²	16	49.2 Å²	49.2	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.7	165.2	-66.3	163.9	70.6	0	0	107.1	I255 V271 Y272 L273 F316 V334 F350	I255-M258 HydrophobicContact CG2-CG 3.9Å; I255-M258 HydrophobicContact CG2-SD 4.12Å; M258-V271 HydrophobicContact CE-CG1 3.99Å; M258-Y272 WeakPolarHBondContact CA-O 3.26Å; M258-L273 HydrophobicContact CG-CB 4.21Å; M258-L273 HydrophobicContact CG-CD1 4.19Å; M258-L273 HydrophobicContact CG-CG 3.93Å; M258-L273 HydrophobicContact SD-CD1 4.32Å; M258-F316 HydrophobicContact CE-CZ 4.43Å; M258-V334 HydrophobicContact CE-CG1 4.16Å; M258-V334 HydrophobicContact SD-CG1 4.44Å; M258-F350 HydrophobicContact CE-CD2 4.03Å
259	D	93.5	Very high	90.6	Very high	81 Å²	81	49.3 Å²	49.3	43%	0.433	26%	0.263	S	S	.	.	S	Bend	trans	-72.6	-40.3	171.8	68.2	-34.4	0	0	0	111.6	V271 Y272	D259-V271 WeakPolarHBondContact OD1-CA 3.23Å; D259-V271 WeakPolarHBondContact OD1-CG1 3.32Å; D259-Y272 PolarHBondContact N-O 3.07Å; D259-Y272 VanDerWaalsContact N-O 3.1Å; D259-Y272 PolarHBondContact OD1-N 3.3Å
260	R	92	Very high	91.2	Very high	129 Å²	129	50.8 Å²	50.8	49%	0.487	27%	0.268	S	S	.	.			trans	-117.1	127.2	179.2	-63.7	172.3	-171.9	-86.9	-6.1	110.6	E270 V271	R260-E270 WeakPolarHBondContact CD-O 3.44Å; R260-E270 PolarHBondContact NE-O 2.93Å; R260-V271 HydrophobicContact CB-CG2 4.22Å
261	T	93.2	Very high	91.9	Very high	87 Å²	87	50.8 Å²	50.8	53%	0.534	27%	0.268	S	S	.	.	S	Bend	trans	-112.1	15.1	171.3	57.7	0	0	0	0	112.3	F350 T351	T261-F350 CarbonylContact O-C 3.55Å; T261-F350 WeakPolarHBondContact O-CA 3.39Å; T261-T351 PolarHBondContact O-N 3.35Å
262	A	92.9	Very high	92.6	Very high	46 Å²	46	56.4 Å²	56.4	38%	0.38	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	159.1	174.4	0	0	0	0	0	110.3	T351	A262-T351 CarbonylContact C-O 3.56Å; A262-T351 WeakPolarHBondContact CA-O 3.45Å; A262-T351 VanDerWaalsContact CB-O 3.3Å; A262-T351 WeakPolarHBondContact CB-O 3.46Å
263	G	92	Very high	93.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	170.3	-178.6	0	0	0	0	0	114.5	E269 T351 Y352 H353	G263-E269 WeakPolarHBondContact CA-OE2 3.48Å; G263-T351 PolarHBondContact N-O 3.31Å; G263-Y352 CarbonylContact O-C 3.52Å; G263-Y352 VanDerWaalsContact O-CA 3.3Å; G263-Y352 WeakPolarHBondContact O-CA 3.45Å; G263-H353 VanDerWaalsContact C-NE2 3.34Å; G263-H353 PolarHBondContact O-CD2 3.22Å; G263-H353 VanDerWaalsContact O-CD2 3.25Å; G263-H353 PolarHBondContact O-N 3.43Å
264	C	90.9	Very high	93.5	Very high	11 Å²	11	56 Å²	56	7%	0.074	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	140.8	-176	-171.3	0	0	0	0	112.6	T266 G267 E269 H353	C264-T266 PolarHBondContact O-N 3.45Å; C264-T266 PolarHBondContact SG-OG1 2.91Å; C264-G267 PolarHBondContact O-N 3.26Å; C264-E269 WeakPolarHBondContact CB-OE1 3.33Å; C264-E269 VanDerWaalsContact N-CD 3.3Å; C264-E269 PolarHBondContact N-OE1 2.95Å; C264-E269 PolarHBondContact N-OE2 3.33Å; C264-H353 PolarHBondContact N-NE2 2.94Å
265	V	91.4	Very high	93.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-21.4	174	-73.7	0	0	0	0	115	G267 Y321 Q324 L326 Y352 H353 Q355	V265-G267 PolarHBondContact O-N 2.83Å; V265-Y321 HydrophobicContact CG1-CD1 4.05Å; V265-Y321 HydrophobicContact CG1-CG 4.39Å; V265-Y321 PolarHBondContact O-N 3.42Å; V265-Q324 WeakPolarHBondContact CG2-O 3.26Å; V265-L326 HydrophobicContact CG1-CB 3.89Å; V265-L326 HydrophobicContact CG1-CD2 3.59Å; V265-L326 HydrophobicContact CG1-CG 4.33Å; V265-Y352 HydrophobicContact CG1-CD1 4.42Å; V265-Y352 HydrophobicContact CG1-CG 4.49Å; V265-H353 WeakPolarHBondContact CG1-O 3.42Å; V265-H353 PolarHBondContact N-O 3.48Å; V265-H353 VanDerWaalsContact N-O 3.08Å; V265-Q355 HydrophobicContact CG2-CB 4.34Å
266	T	90	Very high	93.4	Very high	38 Å²	38	54.7 Å²	54.7	23%	0.233	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-12.6	175.3	54.9	0	0	0	0	114.3	C264 K320 Q355	C264-T266 PolarHBondContact O-N 3.45Å; C264-T266 PolarHBondContact SG-OG1 2.91Å; T266-K320 VanDerWaalsContact O-CE 3.27Å; T266-K320 WeakPolarHBondContact O-CE 3.49Å; T266-K320 WeakPolarHBondContact O-CG 3.29Å; T266-Q355 HydrophobicContact CG2-CB 4.4Å; T266-Q355 HydrophobicContact CG2-CG 4.18Å
267	G	90.9	Very high	93.2	Very high	12 Å²	12	55.2 Å²	55.2	12%	0.124	28%	0.281	C	S	.	.			trans	60.5	-168.4	-173.8	0	0	0	0	0	113.6	C264 V265 T318 P319	C264-G267 PolarHBondContact O-N 3.26Å; V265-G267 PolarHBondContact O-N 2.83Å; G267-T318 CarbonylContact C-O 3.49Å; G267-T318 WeakPolarHBondContact CA-O 3.46Å; G267-T318 WeakPolarHBondContact CA-OG1 3.33Å; G267-P319 WeakPolarHBondContact CA-O 3.47Å
268	G	91.3	Very high	93.2	Very high	48 Å²	48	46.7 Å²	46.7	50%	0.495	25%	0.249	S	C	.	.			trans	85.9	1.8	176.3	0	0	0	0	0	115.3	T318	G268-T318 PolarHBondContact N-O 2.95Å; G268-T318 PolarHBondContact N-OG1 3.36Å
269	E	92.4	Very high	93.1	Very high	55 Å²	55	49.1 Å²	49.1	26%	0.257	26%	0.26	S	S	.	.			trans	-82.8	136.2	179	-63.8	165.9	166.7	0	0	110.5	G263 C264 K317 T318	G263-E269 WeakPolarHBondContact CA-OE2 3.48Å; C264-E269 WeakPolarHBondContact CB-OE1 3.33Å; C264-E269 VanDerWaalsContact N-CD 3.3Å; C264-E269 PolarHBondContact N-OE1 2.95Å; C264-E269 PolarHBondContact N-OE2 3.33Å; E269-K317 CarbonylContact O-C 3.55Å; E269-K317 VanDerWaalsContact O-CA 3.29Å; E269-K317 WeakPolarHBondContact O-CA 3.36Å; E269-T318 HydrophobicContact CB-CG2 4.49Å; E269-T318 PolarHBondContact N-OG1 2.99Å; E269-T318 VanDerWaalsContact N-OG1 3.13Å; E269-T318 PolarHBondContact O-N 2.77Å
270	E	95.9	Very high	93	Very high	93 Å²	93	50.2 Å²	50.2	44%	0.435	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.4	-179.9	-72.9	169.5	-173.8	0	0	111.6	R260 F316 K317	R260-E270 WeakPolarHBondContact CD-O 3.44Å; R260-E270 PolarHBondContact NE-O 2.93Å; E270-F316 WeakPolarHBondContact CA-O 3.28Å; E270-K317 HydrophobicContact CG-CD 4.19Å; E270-K317 HydrophobicContact CG-CG 3.89Å; E270-K317 WeakPolarHBondContact OE1-CE 3.39Å; E270-K317 IonicContact OE1-NZ 3.96Å; E270-K317 PolarHBondContact OE1-NZ 3.39Å
271	V	95.9	Very high	93	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.6	-177	178.7	0	0	0	0	109.1	M258 D259 R260 V315 F316 T318	M258-V271 HydrophobicContact CE-CG1 3.99Å; D259-V271 WeakPolarHBondContact OD1-CA 3.23Å; D259-V271 WeakPolarHBondContact OD1-CG1 3.32Å; R260-V271 HydrophobicContact CB-CG2 4.22Å; V271-V315 WeakPolarHBondContact O-CA 3.42Å; V271-F316 HydrophobicContact CB-CD1 4.33Å; V271-F316 HydrophobicContact CB-CE1 3.78Å; V271-F316 HydrophobicContact CB-CE2 4.21Å; V271-F316 HydrophobicContact CB-CZ 3.7Å; V271-F316 HydrophobicContact CG1-CE1 3.66Å; V271-F316 HydrophobicContact CG1-CZ 3.69Å; V271-F316 HydrophobicContact CG2-CZ 4.27Å; V271-F316 PolarHBondContact N-O 2.55Å; V271-F316 PolarHBondContact O-N 2.93Å; V271-T318 HydrophobicContact CG2-CG2 3.62Å
272	Y	96.8	Very high	93	Very high	127 Å²	127	46 Å²	46	50%	0.498	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	105.3	177.8	-71.4	-107	0	0	0	109.3	M258 D259 V315	M258-Y272 WeakPolarHBondContact CA-O 3.26Å; D259-Y272 PolarHBondContact N-O 3.07Å; D259-Y272 VanDerWaalsContact N-O 3.1Å; D259-Y272 PolarHBondContact OD1-N 3.3Å; Y272-V315 HydrophobicContact CD1-CG2 3.65Å; Y272-V315 HydrophobicContact CE1-CG1 4.29Å; Y272-V315 HydrophobicContact CE1-CG2 3.54Å; Y272-V315 HydrophobicContact CE2-CG1 4.17Å; Y272-V315 HydrophobicContact CG-CG2 4.34Å
273	L	97.1	Very high	93.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.9	-179	-175.8	161	0	0	0	109.9	I255 M258 C275 V285 A313 I314 F316 L336	I255-L273 HydrophobicContact CD1-CD1 4.1Å; I255-L273 HydrophobicContact CG1-CD1 4.2Å; I255-L273 HydrophobicContact CG1-CD2 4.32Å; I255-L273 HydrophobicContact CG2-CD1 4.33Å; I255-L273 HydrophobicContact CG2-CD2 4.27Å; I255-L273 HydrophobicContact CG2-CG 4.02Å; M258-L273 HydrophobicContact CG-CB 4.21Å; M258-L273 HydrophobicContact CG-CD1 4.19Å; M258-L273 HydrophobicContact CG-CG 3.93Å; M258-L273 HydrophobicContact SD-CD1 4.32Å; L273-C275 HydrophobicContact CD2-CB 3.77Å; L273-V285 HydrophobicContact CD1-CG1 4.2Å; L273-V285 HydrophobicContact CD1-CG2 4.36Å; L273-A313 CarbonylContact O-C 3.54Å; L273-A313 VanDerWaalsContact O-CA 3.22Å; L273-A313 WeakPolarHBondContact O-CA 3.31Å; L273-I314 PolarHBondContact N-O 3.19Å; L273-I314 PolarHBondContact O-N 2.85Å; L273-F316 HydrophobicContact CB-CD1 4.35Å; L273-F316 HydrophobicContact CB-CE1 3.93Å; L273-F316 HydrophobicContact CD1-CE1 3.94Å; L273-L336 HydrophobicContact CD1-CD2 4.38Å; L273-L336 HydrophobicContact CD2-CD1 4.43Å; L273-L336 HydrophobicContact CD2-CD2 4.03Å
274	L	96.7	Very high	93.3	Very high	84 Å²	84	46.5 Å²	46.5	44%	0.44	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	133.4	171.9	-56.5	-175.6	0	0	0	109.8	V256 R257 A313	V256-L274 WeakPolarHBondContact CA-O 3.39Å; V256-L274 HydrophobicContact CB-CB 4.42Å; V256-L274 WeakPolarHBondContact CB-O 3.41Å; V256-L274 PolarHBondContact N-O 2.93Å; R257-L274 HydrophobicContact CB-CB 4.34Å; R257-L274 HydrophobicContact CB-CD1 4.36Å; R257-L274 PolarHBondContact N-O 3.27Å; R257-L274 PolarHBondContact O-N 2.9Å; L274-A313 HydrophobicContact CD2-CB 3.71Å
275	C	94.6	Very high	93.6	Very high	5 Å²	5	46 Å²	46	3%	0.034	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	161.9	-172.6	52.4	0	0	0	0	113.6	K254 L273 F312 L336	K254-C275 VanDerWaalsContact O-CA 3.23Å; K254-C275 WeakPolarHBondContact O-CA 3.48Å; K254-C275 VanDerWaalsContact O-CB 3.3Å; K254-C275 WeakPolarHBondContact O-CB 3.39Å; L273-C275 HydrophobicContact CD2-CB 3.77Å; C275-F312 PolarHBondContact N-O 2.98Å; C275-L336 HydrophobicContact CB-CD1 3.64Å
276	D	92.3	Very high	93.8	Very high	64 Å²	64	47.3 Å²	47.3	34%	0.342	24%	0.24	S	C	.	.	S	Bend	trans	-67.9	165.6	163.4	-70.8	-10.1	0	0	0	109.8	K254 V256 V278	K254-D276 HydrophobicContact CB-CB 4.1Å; K254-D276 WeakPolarHBondContact CB-OD2 3.33Å; K254-D276 VanDerWaalsContact CD-OD2 3.27Å; K254-D276 WeakPolarHBondContact CD-OD2 3.41Å; K254-D276 PolarHBondContact O-N 3.18Å; V256-D276 WeakPolarHBondContact CG2-OD1 3.23Å; D276-V278 PolarHBondContact O-N 3.4Å
277	K	90.7	Very high	94.1	Very high	82 Å²	82	45.5 Å²	45.5	36%	0.357	23%	0.229	S	C	.	.	S	Bend	trans	-56.7	115.3	-163.8	-165.9	179.8	-176.5	179	0	114.6	S251 Q311 F312	S251-K277 PolarHBondContact OG-O 3.01Å; K277-Q311 WeakPolarHBondContact CA-O 3.29Å; K277-Q311 HydrophobicContact CG-CB 4.02Å; K277-F312 HydrophobicContact CB-CD1 4.39Å; K277-F312 HydrophobicContact CB-CE1 3.69Å; K277-F312 HydrophobicContact CB-CZ 4.16Å; K277-F312 HydrophobicContact CD-CZ 4.37Å; K277-F312 HydrophobicContact CG-CE1 4.12Å; K277-F312 HydrophobicContact CG-CZ 4.11Å
278	V	92.2	Very high	94.3	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	23%	0.226	C	C	.	.			trans	-112.7	160	177.6	-67.2	0	0	0	0	113.9	L253 D276 I283 V308 Q311 I314 L336	L253-V278 HydrophobicContact CD2-CG1 4.05Å; D276-V278 PolarHBondContact O-N 3.4Å; V278-I283 HydrophobicContact CB-CB 4.32Å; V278-I283 HydrophobicContact CB-CD1 4.13Å; V278-I283 HydrophobicContact CB-CG1 4.01Å; V278-I283 HydrophobicContact CG1-CD1 3.61Å; V278-I283 HydrophobicContact CG1-CG1 3.88Å; V278-I283 HydrophobicContact CG2-CG1 4.44Å; V278-V308 HydrophobicContact CG2-CG1 3.85Å; V278-Q311 WeakPolarHBondContact CG2-O 3.29Å; V278-Q311 PolarHBondContact N-O 2.89Å; V278-Q311 VanDerWaalsContact O-CB 3.25Å; V278-Q311 WeakPolarHBondContact O-CB 3.09Å; V278-Q311 WeakPolarHBondContact O-CG 3.45Å; V278-Q311 PolarHBondContact O-NE2 2.72Å; V278-I314 HydrophobicContact CG2-CD1 4.46Å; V278-L336 HydrophobicContact CG1-CD1 4.47Å
279	Q	91.6	Very high	94.4	Very high	66 Å²	66	44.3 Å²	44.3	31%	0.308	21%	0.207	S	C	.	.			trans	-98.5	124.5	169.8	-69.7	-180	-52.3	0	0	110	P248 D281 D282 I283	P248-Q279 HydrophobicContact CB-CG 4.19Å; Q279-D281 VanDerWaalsContact C-N 3.26Å; Q279-D281 PolarHBondContact O-N 3.24Å; Q279-D282 HydrophobicContact CB-CB 4.19Å; Q279-D282 CarbonylContact O-C 3.58Å; Q279-D282 PolarHBondContact O-N 3.32Å; Q279-D282 VanDerWaalsContact O-N 3.11Å; Q279-I283 WeakPolarHBondContact O-CB 3.45Å; Q279-I283 WeakPolarHBondContact O-CG2 3.18Å; Q279-I283 PolarHBondContact O-N 3.16Å
280	K	92	Very high	94.2	Very high	105 Å²	105	46.7 Å²	46.7	46%	0.457	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-35.6	-171.9	69.7	176.8	-168.4	166.8	0	114.2	P305 V308	K280-P305 HydrophobicContact CB-CB 4.21Å; K280-P305 HydrophobicContact CD-CB 4.2Å; K280-P305 HydrophobicContact CG-CB 4.09Å; K280-V308 HydrophobicContact CB-CB 3.71Å; K280-V308 HydrophobicContact CB-CG1 3.96Å; K280-V308 HydrophobicContact CB-CG2 4.09Å
281	D	92.3	Very high	93.6	Very high	100 Å²	100	46.4 Å²	46.4	54%	0.535	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-19.1	-175.1	-51.1	-68.9	0	0	0	111.8	Q279 K339	Q279-D281 VanDerWaalsContact C-N 3.26Å; Q279-D281 PolarHBondContact O-N 3.24Å; D281-K339 WeakPolarHBondContact O-CE 3.45Å; D281-K339 PolarHBondContact O-NZ 3.41Å
282	D	93.1	Very high	92.6	Very high	27 Å²	27	55.3 Å²	55.3	14%	0.144	27%	0.267	C	S	.	.	S	Bend	trans	-116.2	22.8	-172	-165.3	16.3	0	0	0	113.1	Q279 R338 K339 S340	Q279-D282 HydrophobicContact CB-CB 4.19Å; Q279-D282 CarbonylContact O-C 3.58Å; Q279-D282 PolarHBondContact O-N 3.32Å; Q279-D282 VanDerWaalsContact O-N 3.11Å; D282-R338 HydrophobicContact CB-CG 4.44Å; D282-R338 VanDerWaalsContact CG-CG 3.44Å; D282-R338 VanDerWaalsContact O-CA 3.27Å; D282-R338 WeakPolarHBondContact O-CA 3.34Å; D282-R338 WeakPolarHBondContact O-CG 3.45Å; D282-R338 VanDerWaalsContact OD2-CD 3.31Å; D282-R338 WeakPolarHBondContact OD2-CD 3.47Å; D282-R338 WeakPolarHBondContact OD2-CG 3.28Å; D282-K339 PolarHBondContact O-N 3.28Å; D282-K339 VanDerWaalsContact O-N 3.1Å; D282-K339 VanDerWaalsContact OD1-CA 3.29Å; D282-K339 WeakPolarHBondContact OD1-CA 3.28Å; D282-K339 WeakPolarHBondContact OD1-CB 3.41Å; D282-K339 PolarHBondContact OD1-N 3.21Å; D282-S340 PolarHBondContact OD1-N 2.66Å; D282-S340 PolarHBondContact OD1-OG 3.44Å; D282-S340 VanDerWaalsContact OD2-CB 3.3Å; D282-S340 WeakPolarHBondContact OD2-CB 3.38Å; D282-S340 PolarHBondContact OD2-OG 2.98Å
283	I	95.6	Very high	91.5	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.015	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.6	-179.2	-163.2	64.4	0	0	0	112.6	L253 V278 Q279 F303 V308 I314 L336 K339	L253-I283 HydrophobicContact CD2-CD1 4.08Å; V278-I283 HydrophobicContact CB-CB 4.32Å; V278-I283 HydrophobicContact CB-CD1 4.13Å; V278-I283 HydrophobicContact CB-CG1 4.01Å; V278-I283 HydrophobicContact CG1-CD1 3.61Å; V278-I283 HydrophobicContact CG1-CG1 3.88Å; V278-I283 HydrophobicContact CG2-CG1 4.44Å; Q279-I283 WeakPolarHBondContact O-CB 3.45Å; Q279-I283 WeakPolarHBondContact O-CG2 3.18Å; Q279-I283 PolarHBondContact O-N 3.16Å; I283-F303 HydrophobicContact CG2-CE2 4Å; I283-F303 HydrophobicContact CG2-CZ 4.1Å; I283-F303 WeakPolarHBondContact O-CZ 3.23Å; I283-V308 HydrophobicContact CG2-CG2 4.03Å; I283-I314 HydrophobicContact CG1-CD1 3.86Å; I283-I314 HydrophobicContact CG2-CD1 4.15Å; I283-L336 HydrophobicContact CD1-CB 4.23Å; I283-L336 HydrophobicContact CD1-CD2 4.33Å; I283-L336 HydrophobicContact CG1-CD2 4.3Å; I283-K339 WeakPolarHBondContact O-CE 3.47Å
284	Q	95.8	Very high	90.6	Very high	54 Å²	54	56.1 Å²	56.1	25%	0.252	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.4	171.8	-69.5	178.8	-26.7	0	0	110	L300 K337 K339	Q284-L300 HydrophobicContact CB-CD2 4.4Å; Q284-K337 PolarHBondContact N-O 2.99Å; Q284-K337 PolarHBondContact O-N 2.93Å; Q284-K339 HydrophobicContact CG-CD 4.24Å; Q284-K339 HydrophobicContact CG-CG 3.85Å
285	V	96.9	Very high	89.8	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	114.5	167.7	-174.3	0	0	0	0	107.2	L273 F287 L300 G301 F303 I314 F316 V334 L336	L273-V285 HydrophobicContact CD1-CG1 4.2Å; L273-V285 HydrophobicContact CD1-CG2 4.36Å; V285-F287 HydrophobicContact CG1-CD2 4.27Å; V285-F287 HydrophobicContact CG1-CE2 3.8Å; V285-L300 CarbonylContact O-C 3.54Å; V285-L300 WeakPolarHBondContact O-CA 3.09Å; V285-G301 PolarHBondContact O-N 3.19Å; V285-F303 HydrophobicContact CB-CE1 4.42Å; V285-F303 HydrophobicContact CG2-CE1 3.93Å; V285-F303 HydrophobicContact CG2-CZ 4.42Å; V285-I314 HydrophobicContact CG2-CD1 4.26Å; V285-I314 HydrophobicContact CG2-CG2 4.38Å; V285-F316 HydrophobicContact CG1-CE1 4.11Å; V285-F316 HydrophobicContact CG1-CE2 4.25Å; V285-F316 HydrophobicContact CG1-CZ 3.96Å; V285-F316 HydrophobicContact CG2-CD1 4.04Å; V285-F316 HydrophobicContact CG2-CE1 4.32Å; V285-F316 HydrophobicContact CG2-CG 4.3Å; V285-V334 HydrophobicContact CG1-CG1 3.64Å; V285-L336 HydrophobicContact CG2-CD2 4.17Å
286	R	96.1	Very high	89.3	Confident	28 Å²	28	58.2 Å²	58.2	11%	0.106	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.2	-178.7	-179.6	-177.4	-178.5	-111.3	5.3	110	Y288 L295 E298 L300 V334 Q335	R286-Y288 HydrophobicContact CG-CD1 4.45Å; R286-Y288 VanDerWaalsContact NH1-CG 3.32Å; R286-L295 VanDerWaalsContact NH2-CD1 3.28Å; R286-L295 VanDerWaalsContact NH2-CD2 3.29Å; R286-E298 IonicContact CZ-OE2 3.68Å; R286-E298 IonicContact NE-OE2 3.76Å; R286-E298 PolarHBondContact NE-OE2 3.37Å; R286-E298 IonicContact NH2-OE2 3.51Å; R286-E298 PolarHBondContact NH2-OE2 2.92Å; R286-L300 HydrophobicContact CB-CD2 4.16Å; R286-L300 HydrophobicContact CG-CD2 4.46Å; R286-V334 WeakPolarHBondContact O-CA 3.41Å; R286-Q335 HydrophobicContact CB-CG 4.15Å; R286-Q335 PolarHBondContact N-O 2.94Å; R286-Q335 PolarHBondContact O-N 3.28Å
287	F	96.1	Very high	89.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.1	167.1	-74.8	-116	0	0	0	108.1	V285 W297 E298 A299 F316 T318 P319 V332 F333 V334 F350 Y352	V285-F287 HydrophobicContact CG1-CD2 4.27Å; V285-F287 HydrophobicContact CG1-CE2 3.8Å; F287-W297 HydrophobicContact CB-CH2 3.75Å; F287-W297 HydrophobicContact CB-CZ3 3.82Å; F287-E298 CarbonylContact O-C 3.55Å; F287-E298 VanDerWaalsContact O-CA 3.29Å; F287-E298 WeakPolarHBondContact O-CA 3.32Å; F287-A299 PolarHBondContact N-O 3.48Å; F287-A299 PolarHBondContact O-N 3.14Å; F287-A299 VanDerWaalsContact O-O 3.1Å; F287-F316 HydrophobicContact CE2-CD2 4.41Å; F287-F316 AromaticContact CE2-CE2 3.41Å; F287-F316 HydrophobicContact CE2-CE2 3.41Å; F287-F316 VanDerWaalsContact CE2-CE2 3.41Å; F287-F316 AromaticContact CE2-CZ 3.78Å; F287-F316 HydrophobicContact CE2-CZ 3.78Å; F287-F316 AromaticContact CZ-CE2 3.56Å; F287-F316 HydrophobicContact CZ-CE2 3.56Å; F287-F316 AromaticContact CZ-CZ 3.76Å; F287-F316 HydrophobicContact CZ-CZ 3.76Å; F287-T318 HydrophobicContact CZ-CG2 4.38Å; F287-P319 HydrophobicContact CB-CG 3.84Å; F287-P319 HydrophobicContact CD1-CG 4.02Å; F287-P319 HydrophobicContact CD2-CG 3.66Å; F287-P319 HydrophobicContact CE2-CG 4.25Å; F287-P319 HydrophobicContact CG-CG 3.56Å; F287-V332 HydrophobicContact CD1-CG2 4.25Å; F287-F333 CarbonylContact C-O 3.56Å; F287-F333 VanDerWaalsContact CA-O 3.29Å; F287-F333 WeakPolarHBondContact CA-O 3.4Å; F287-V334 HydrophobicContact CD1-CG2 3.56Å; F287-V334 HydrophobicContact CD2-CG1 4.37Å; F287-V334 HydrophobicContact CD2-CG2 4.2Å; F287-V334 HydrophobicContact CE1-CG2 3.41Å; F287-V334 VanDerWaalsContact CE1-CG2 3.41Å; F287-V334 HydrophobicContact CE2-CG1 4.01Å; F287-V334 HydrophobicContact CE2-CG2 4.05Å; F287-V334 HydrophobicContact CG-CG2 3.95Å; F287-V334 HydrophobicContact CZ-CG1 4.22Å; F287-V334 HydrophobicContact CZ-CG2 3.66Å; F287-F350 HydrophobicContact CD1-CD1 4.45Å; F287-F350 HydrophobicContact CE1-CB 4.44Å; F287-F350 AromaticContact CE1-CD1 3.82Å; F287-F350 HydrophobicContact CE1-CD1 3.82Å; F287-F350 HydrophobicContact CE1-CD2 4.21Å; F287-F350 HydrophobicContact CE1-CE1 4.09Å; F287-F350 HydrophobicContact CE1-CE2 4.45Å; F287-F350 AromaticContact CE1-CG 3.91Å; F287-F350 HydrophobicContact CE1-CG 3.91Å; F287-F350 HydrophobicContact CE1-CZ 4.4Å; F287-Y352 HydrophobicContact CD1-CE2 4.1Å
288	Y	94.7	Very high	89.4	Confident	14 Å²	14	57.9 Å²	57.9	6%	0.055	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	156.3	179.8	71.8	-78.9	0	0	0	114	R286 E290 L295 W297 V332 F333 Q335 P347	R286-Y288 HydrophobicContact CG-CD1 4.45Å; R286-Y288 VanDerWaalsContact NH1-CG 3.32Å; Y288-E290 HydrophobicContact CD2-CG 3.99Å; Y288-E290 VanDerWaalsContact CE2-CD 3.42Å; Y288-E290 HydrophobicContact CE2-CG 4.09Å; Y288-E290 VanDerWaalsContact CE2-OE1 3.31Å; Y288-E290 WeakPolarHBondContact CE2-OE1 3.47Å; Y288-L295 HydrophobicContact CD2-CD1 3.9Å; Y288-L295 HydrophobicContact CG-CD1 4.32Å; Y288-W297 CarbonylContact C-O 3.51Å; Y288-W297 WeakPolarHBondContact CA-O 3.42Å; Y288-W297 WeakPolarHBondContact CB-O 3.49Å; Y288-V332 WeakPolarHBondContact O-CB 3.46Å; Y288-F333 HydrophobicContact CD1-CB 3.94Å; Y288-F333 HydrophobicContact CD2-CB 4.48Å; Y288-F333 HydrophobicContact CE1-CB 3.45Å; Y288-F333 VanDerWaalsContact CE1-CB 3.45Å; Y288-F333 HydrophobicContact CE2-CB 4.06Å; Y288-F333 HydrophobicContact CE2-CD2 4.35Å; Y288-F333 HydrophobicContact CG-CB 4.43Å; Y288-F333 PolarHBondContact N-O 3.27Å; Y288-F333 PolarHBondContact O-N 3.15Å; Y288-Q335 HydrophobicContact CD1-CG 4.35Å; Y288-Q335 HydrophobicContact CE1-CB 4.42Å; Y288-Q335 VanDerWaalsContact CE1-CD 3.47Å; Y288-Q335 HydrophobicContact CE1-CG 3.88Å; Y288-Q335 VanDerWaalsContact CE1-OE1 3.29Å; Y288-Q335 PolarHBondContact OH-OE1 3.29Å; Y288-P347 HydrophobicContact CE1-CB 4.33Å; Y288-P347 WeakPolarHBondContact OH-CB 3.48Å
289	E	92.7	Very high	89.6	Confident	21 Å²	21	58.9 Å²	58.9	10%	0.098	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.9	174.1	-165.2	179.9	-129.8	0	0	108.9	T296 W297 Y321 R322 T330 V332	E289-T296 PolarHBondContact O-N 3.49Å; E289-T296 PolarHBondContact O-OG1 3.26Å; E289-W297 HydrophobicContact CB-CB 4.07Å; E289-W297 HydrophobicContact CB-CE3 4.38Å; E289-W297 PolarHBondContact N-O 3.37Å; E289-W297 PolarHBondContact O-N 2.88Å; E289-Y321 PolarHBondContact OE1-OH 2.68Å; E289-Y321 PolarHBondContact OE2-OH 3.09Å; E289-R322 IonicContact OE1-NH2 3.23Å; E289-R322 IonicContact OE2-CZ 2.7Å; E289-R322 IonicContact OE2-NH1 2.78Å; E289-R322 PolarHBondContact OE2-NH1 3.46Å; E289-R322 IonicContact OE2-NH2 3.16Å; E289-R322 PolarHBondContact OE2-NH2 3.03Å; E289-T330 WeakPolarHBondContact OE1-CG2 3.46Å; E289-V332 HydrophobicContact CB-CG1 4.29Å
290	E	89.5	Confident	89.8	Confident	106 Å²	106	59.8 Å²	59.8	50%	0.495	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.7	179.4	-86.7	167.5	-166.7	0	0	109	Y288 G294 L295	Y288-E290 HydrophobicContact CD2-CG 3.99Å; Y288-E290 VanDerWaalsContact CE2-CD 3.42Å; Y288-E290 HydrophobicContact CE2-CG 4.09Å; Y288-E290 VanDerWaalsContact CE2-OE1 3.31Å; Y288-E290 WeakPolarHBondContact CE2-OE1 3.47Å; E290-G294 WeakPolarHBondContact CA-O 3.37Å; E290-L295 HydrophobicContact CG-CB 4.26Å; E290-L295 HydrophobicContact CG-CD1 3.98Å
291	D	82.8	Confident	89.9	Confident	86 Å²	86	55.2 Å²	55.2	46%	0.46	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	178.2	176.1	-69.6	-74.6	0	0	0	110	S293 G294 T296	D291-S293 PolarHBondContact O-N 3.5Å; D291-G294 PolarHBondContact N-O 3.39Å; D291-G294 PolarHBondContact O-N 3.03Å; D291-T296 HydrophobicContact CB-CG2 3.82Å; D291-T296 VanDerWaalsContact OD2-CB 3.27Å; D291-T296 WeakPolarHBondContact OD2-CB 3.43Å; D291-T296 WeakPolarHBondContact OD2-CG2 3.42Å; D291-T296 PolarHBondContact OD2-OG1 3.28Å
292	D	75.1	Confident	90.1	Very high	187 Å²	187	56 Å²	56	100%	1	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-11.6	178.7	-68.5	-37.7	0	0	0	115
293	S	73.9	Confident	90.3	Very high	111 Å²	111	56.6 Å²	56.6	78%	0.776	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-2.4	176	59.4	0	0	0	0	114.5	D291	D291-S293 PolarHBondContact O-N 3.5Å
294	G	77	Confident	90.2	Very high	34 Å²	34	58.8 Å²	58.8	35%	0.351	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	114.6	-156.6	-178.7	0	0	0	0	0	113.7	E290 D291 T296	E290-G294 WeakPolarHBondContact CA-O 3.37Å; D291-G294 PolarHBondContact N-O 3.39Å; D291-G294 PolarHBondContact O-N 3.03Å; G294-T296 PolarHBondContact O-N 3.41Å
295	L	81.6	Confident	90.1	Very high	82 Å²	82	58.6 Å²	58.6	43%	0.429	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	114.5	-179	-176.3	74.4	0	0	0	111.5	R286 Y288 E290 E298	R286-L295 VanDerWaalsContact NH2-CD1 3.28Å; R286-L295 VanDerWaalsContact NH2-CD2 3.29Å; Y288-L295 HydrophobicContact CD2-CD1 3.9Å; Y288-L295 HydrophobicContact CG-CD1 4.32Å; E290-L295 HydrophobicContact CG-CB 4.26Å; E290-L295 HydrophobicContact CG-CD1 3.98Å; L295-E298 HydrophobicContact CD2-CG 4.38Å
296	T	83.8	Confident	90	Very high	50 Å²	50	63.9 Å²	63.9	31%	0.307	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-14.2	-177.1	58.1	0	0	0	0	114.2	E289 D291 G294 R322	E289-T296 PolarHBondContact O-N 3.49Å; E289-T296 PolarHBondContact O-OG1 3.26Å; D291-T296 HydrophobicContact CB-CG2 3.82Å; D291-T296 VanDerWaalsContact OD2-CB 3.27Å; D291-T296 WeakPolarHBondContact OD2-CB 3.43Å; D291-T296 WeakPolarHBondContact OD2-CG2 3.42Å; D291-T296 PolarHBondContact OD2-OG1 3.28Å; G294-T296 PolarHBondContact O-N 3.41Å; T296-R322 PolarHBondContact O-NH1 2.85Å
297	W	91.8	Very high	90	Very high	29 Å²	29	65.3 Å²	65.3	11%	0.11	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	145.2	167.5	175.7	67.1	0	0	0	111.4	F287 Y288 E289 A299 P319 K320 Y321 R322 V332 Y352	F287-W297 HydrophobicContact CB-CH2 3.75Å; F287-W297 HydrophobicContact CB-CZ3 3.82Å; Y288-W297 CarbonylContact C-O 3.51Å; Y288-W297 WeakPolarHBondContact CA-O 3.42Å; Y288-W297 WeakPolarHBondContact CB-O 3.49Å; E289-W297 HydrophobicContact CB-CB 4.07Å; E289-W297 HydrophobicContact CB-CE3 4.38Å; E289-W297 PolarHBondContact N-O 3.37Å; E289-W297 PolarHBondContact O-N 2.88Å; W297-A299 HydrophobicContact CH2-CB 4Å; W297-A299 HydrophobicContact CZ2-CB 3.38Å; W297-P319 HydrophobicContact CH2-CG 4.33Å; W297-K320 WeakPolarHBondContact CZ2-O 3.32Å; W297-Y321 HydrophobicContact CD2-CD2 4.26Å; W297-Y321 HydrophobicContact CD2-CE2 4.22Å; W297-Y321 HydrophobicContact CE3-CD2 4.08Å; W297-Y321 AromaticContact CE3-CE2 3.99Å; W297-Y321 HydrophobicContact CE3-CE2 3.99Å; W297-Y321 HydrophobicContact CH2-CD2 4.04Å; W297-Y321 HydrophobicContact CZ2-CD2 4.2Å; W297-Y321 AromaticContact CZ3-CD2 3.98Å; W297-Y321 HydrophobicContact CZ3-CD2 3.98Å; W297-Y321 HydrophobicContact CZ3-CE2 4.28Å; W297-R322 HydrophobicContact CG-CB 4.39Å; W297-V332 HydrophobicContact CE3-CG1 4.12Å; W297-V332 HydrophobicContact CZ3-CB 4.17Å; W297-V332 HydrophobicContact CZ3-CG1 3.91Å; W297-V332 HydrophobicContact CZ3-CG2 4.21Å; W297-Y352 AromaticContact CH2-CE2 3.71Å; W297-Y352 HydrophobicContact CH2-CE2 3.71Å; W297-Y352 HydrophobicContact CZ3-CE2 4.02Å
298	E	93.6	Very high	90	Very high	110 Å²	110	65.9 Å²	65.9	51%	0.514	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.3	160.5	65.3	170.9	-167.2	0	0	111.9	R286 F287 L295	R286-E298 IonicContact CZ-OE2 3.68Å; R286-E298 IonicContact NE-OE2 3.76Å; R286-E298 PolarHBondContact NE-OE2 3.37Å; R286-E298 IonicContact NH2-OE2 3.51Å; R286-E298 PolarHBondContact NH2-OE2 2.92Å; F287-E298 CarbonylContact O-C 3.55Å; F287-E298 VanDerWaalsContact O-CA 3.29Å; F287-E298 WeakPolarHBondContact O-CA 3.32Å; L295-E298 HydrophobicContact CD2-CG 4.38Å
299	A	95.1	Very high	89.9	Confident	24 Å²	24	70.7 Å²	70.7	20%	0.198	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	165.1	171.5	0	0	0	0	0	110.7	F287 W297 P319	F287-A299 PolarHBondContact N-O 3.48Å; F287-A299 PolarHBondContact O-N 3.14Å; F287-A299 VanDerWaalsContact O-O 3.1Å; W297-A299 HydrophobicContact CH2-CB 4Å; W297-A299 HydrophobicContact CZ2-CB 3.38Å; A299-P319 HydrophobicContact CB-CB 3.55Å; A299-P319 HydrophobicContact CB-CG 3.84Å
300	L	95.9	Very high	90	Very high	85 Å²	85	79.3 Å²	79.3	45%	0.445	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.2	176.3	-59	-179.4	0	0	0	110.4	Q284 V285 R286	Q284-L300 HydrophobicContact CB-CD2 4.4Å; V285-L300 CarbonylContact O-C 3.54Å; V285-L300 WeakPolarHBondContact O-CA 3.09Å; R286-L300 HydrophobicContact CB-CD2 4.16Å; R286-L300 HydrophobicContact CG-CD2 4.46Å
301	G	95.1	Very high	90	Very high	8 Å²	8	77.5 Å²	77.5	8%	0.082	42%	0.42	C	S	.	.			trans	-65.7	139.9	166.1	0	0	0	0	0	110.8	V285 F303 K317	V285-G301 PolarHBondContact O-N 3.19Å; G301-F303 WeakPolarHBondContact O-CD1 3.3Å; G301-K317 WeakPolarHBondContact CA-O 3.47Å
302	D	95.9	Very high	90.6	Very high	117 Å²	117	78.8 Å²	78.8	63%	0.626	42%	0.421	S	S	*	.	B	Isolated β-bridge	trans	-91.6	118	-174.8	-177.2	31.5	0	0	0	110.8	F316 K317	D302-F316 WeakPolarHBondContact O-CA 3.47Å; D302-K317 HydrophobicContact CB-CB 4.35Å; D302-K317 PolarHBondContact N-O 2.92Å; D302-K317 PolarHBondContact O-N 3.37Å
303	F	96.6	Very high	91.6	Very high	40 Å²	40	70.8 Å²	70.8	18%	0.175	38%	0.381	C	S	.	.			trans	-162.5	156.8	177.9	67.2	-78.1	0	0	0	112.2	I283 V285 G301 D307 V308 I314 V315 F316	I283-F303 HydrophobicContact CG2-CE2 4Å; I283-F303 HydrophobicContact CG2-CZ 4.1Å; I283-F303 WeakPolarHBondContact O-CZ 3.23Å; V285-F303 HydrophobicContact CB-CE1 4.42Å; V285-F303 HydrophobicContact CG2-CE1 3.93Å; V285-F303 HydrophobicContact CG2-CZ 4.42Å; G301-F303 WeakPolarHBondContact O-CD1 3.3Å; F303-D307 HydrophobicContact CB-CB 4.32Å; F303-V308 HydrophobicContact CD2-CG2 3.96Å; F303-V308 HydrophobicContact CE2-CG2 3.67Å; F303-I314 HydrophobicContact CD1-CG2 4.3Å; F303-I314 HydrophobicContact CD2-CG2 3.74Å; F303-I314 HydrophobicContact CE1-CG2 4.36Å; F303-I314 HydrophobicContact CE2-CG2 3.81Å; F303-I314 HydrophobicContact CG-CG2 4Å; F303-I314 HydrophobicContact CZ-CG2 4.12Å; F303-V315 WeakPolarHBondContact CB-O 3.2Å; F303-F316 HydrophobicContact CB-CB 3.74Å; F303-F316 HydrophobicContact CD1-CB 3.74Å; F303-F316 HydrophobicContact CG-CB 3.99Å
304	S	94.6	Very high	92.7	Very high	48 Å²	48	65.5 Å²	65.5	34%	0.336	34%	0.344	S	S	.	.			trans	-96.8	155.5	174.1	165.1	0	0	0	0	111.2	T306 D307	S304-T306 WeakPolarHBondContact CB-OG1 3.39Å; S304-T306 PolarHBondContact O-N 3.04Å; S304-T306 PolarHBondContact OG-N 3.19Å; S304-T306 PolarHBondContact OG-OG1 3.04Å; S304-D307 WeakPolarHBondContact CB-OD2 3.21Å; S304-D307 PolarHBondContact N-OD2 3.47Å; S304-D307 WeakPolarHBondContact O-CB 3.43Å; S304-D307 PolarHBondContact O-N 2.91Å
305	P	94.1	Very high	93.7	Very high	50 Å²	50	65.7 Å²	65.7	33%	0.325	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-13.3	169.7	-25.1	35.4	0	0	0	114.9	K280 D307	K280-P305 HydrophobicContact CB-CB 4.21Å; K280-P305 HydrophobicContact CD-CB 4.2Å; K280-P305 HydrophobicContact CG-CB 4.09Å; P305-D307 VanDerWaalsContact C-N 3.29Å
306	T	94.5	Very high	94.4	Very high	111 Å²	111	61.9 Å²	61.9	68%	0.681	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.1	169	44.3	0	0	0	0	113.3	S304 V308	S304-T306 WeakPolarHBondContact CB-OG1 3.39Å; S304-T306 PolarHBondContact O-N 3.04Å; S304-T306 PolarHBondContact OG-N 3.19Å; S304-T306 PolarHBondContact OG-OG1 3.04Å; T306-V308 VanDerWaalsContact C-N 3.32Å
307	D	95.9	Very high	95	Very high	59 Å²	59	63.4 Å²	63.4	32%	0.316	32%	0.321	S	S	.	.	S	Bend	trans	-93.4	-3.1	-165.7	-42.1	-22.9	0	0	0	111.2	F303 S304 P305 H309 V315	F303-D307 HydrophobicContact CB-CB 4.32Å; S304-D307 WeakPolarHBondContact CB-OD2 3.21Å; S304-D307 PolarHBondContact N-OD2 3.47Å; S304-D307 WeakPolarHBondContact O-CB 3.43Å; S304-D307 PolarHBondContact O-N 2.91Å; P305-D307 VanDerWaalsContact C-N 3.29Å; D307-H309 PolarHBondContact O-N 3.1Å; D307-V315 HydrophobicContact CB-CB 4.48Å; D307-V315 WeakPolarHBondContact CB-O 3.49Å; D307-V315 PolarHBondContact O-N 3.01Å
308	V	95.8	Very high	95.2	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	32%	0.317	C	S	.	.	S	Bend	trans	-84.8	81.2	172.1	-175.6	0	0	0	0	109.4	V278 K280 I283 F303 T306 R310 A313 I314	V278-V308 HydrophobicContact CG2-CG1 3.85Å; K280-V308 HydrophobicContact CB-CB 3.71Å; K280-V308 HydrophobicContact CB-CG1 3.96Å; K280-V308 HydrophobicContact CB-CG2 4.09Å; I283-V308 HydrophobicContact CG2-CG2 4.03Å; F303-V308 HydrophobicContact CD2-CG2 3.96Å; F303-V308 HydrophobicContact CE2-CG2 3.67Å; T306-V308 VanDerWaalsContact C-N 3.32Å; V308-R310 PolarHBondContact O-N 3.45Å; V308-A313 CarbonylContact C-O 3.26Å; V308-A313 VanDerWaalsContact C-O 3.31Å; V308-A313 VanDerWaalsContact CA-O 3.3Å; V308-A313 WeakPolarHBondContact CA-O 3.25Å; V308-I314 HydrophobicContact CG1-CG1 4.29Å; V308-I314 HydrophobicContact CG2-CG1 4.28Å; V308-I314 HydrophobicContact CG2-CG2 4.35Å
309	H	93.9	Very high	95.3	Very high	115 Å²	115	57.7 Å²	57.7	53%	0.532	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-63.7	115.6	-176.6	-172.3	94.8	0	0	0	112.4	D307 Q311 F312 A313	D307-H309 PolarHBondContact O-N 3.1Å; H309-Q311 PolarHBondContact O-N 3.37Å; H309-F312 PolarHBondContact O-N 2.93Å; H309-F312 VanDerWaalsContact O-N 3.11Å; H309-A313 HydrophobicContact CB-CB 4.33Å; H309-A313 PolarHBondContact N-O 3.06Å; H309-A313 PolarHBondContact O-N 3.38Å
310	R	92.8	Very high	95.3	Very high	203 Å²	203	63 Å²	63	77%	0.766	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	48	30.8	171.6	-65.7	-175.3	175.1	-168.8	0.3	115.6	V308 F312	V308-R310 PolarHBondContact O-N 3.45Å; R310-F312 VanDerWaalsContact C-N 3.26Å; R310-F312 WeakPolarHBondContact O-CD2 3.19Å; R310-F312 PolarHBondContact O-N 2.88Å
311	Q	91.1	Very high	95.1	Very high	68 Å²	68	59.2 Å²	59.2	32%	0.318	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	69	2.9	-178.1	-49.5	-162.8	-95.6	0	0	117	K277 V278 H309	K277-Q311 WeakPolarHBondContact CA-O 3.29Å; K277-Q311 HydrophobicContact CG-CB 4.02Å; V278-Q311 WeakPolarHBondContact CG2-O 3.29Å; V278-Q311 PolarHBondContact N-O 2.89Å; V278-Q311 VanDerWaalsContact O-CB 3.25Å; V278-Q311 WeakPolarHBondContact O-CB 3.09Å; V278-Q311 WeakPolarHBondContact O-CG 3.45Å; V278-Q311 PolarHBondContact O-NE2 2.72Å; H309-Q311 PolarHBondContact O-N 3.37Å
312	F	94.9	Very high	94.7	Very high	113 Å²	113	64 Å²	64	50%	0.496	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-5.8	-173.7	-64.7	-71.9	0	0	0	114.7	C275 K277 H309 R310	C275-F312 PolarHBondContact N-O 2.98Å; K277-F312 HydrophobicContact CB-CD1 4.39Å; K277-F312 HydrophobicContact CB-CE1 3.69Å; K277-F312 HydrophobicContact CB-CZ 4.16Å; K277-F312 HydrophobicContact CD-CZ 4.37Å; K277-F312 HydrophobicContact CG-CE1 4.12Å; K277-F312 HydrophobicContact CG-CZ 4.11Å; H309-F312 PolarHBondContact O-N 2.93Å; H309-F312 VanDerWaalsContact O-N 3.11Å; R310-F312 VanDerWaalsContact C-N 3.26Å; R310-F312 WeakPolarHBondContact O-CD2 3.19Å; R310-F312 PolarHBondContact O-N 2.88Å
313	A	95.9	Very high	94.2	Very high	18 Å²	18	62.2 Å²	62.2	15%	0.149	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	153.8	169.2	0	0	0	0	0	110.8	L273 L274 V308 H309	L273-A313 CarbonylContact O-C 3.54Å; L273-A313 VanDerWaalsContact O-CA 3.22Å; L273-A313 WeakPolarHBondContact O-CA 3.31Å; L274-A313 HydrophobicContact CD2-CB 3.71Å; V308-A313 CarbonylContact C-O 3.26Å; V308-A313 VanDerWaalsContact C-O 3.31Å; V308-A313 VanDerWaalsContact CA-O 3.3Å; V308-A313 WeakPolarHBondContact CA-O 3.25Å; H309-A313 HydrophobicContact CB-CB 4.33Å; H309-A313 PolarHBondContact N-O 3.06Å; H309-A313 PolarHBondContact O-N 3.38Å
314	I	97.3	Very high	93.6	Very high	1 Å²	1	65 Å²	65	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122	172.5	-52	178.9	0	0	0	106.9	L273 V278 I283 V285 F303 V308 F316 L336	L273-I314 PolarHBondContact N-O 3.19Å; L273-I314 PolarHBondContact O-N 2.85Å; V278-I314 HydrophobicContact CG2-CD1 4.46Å; I283-I314 HydrophobicContact CG1-CD1 3.86Å; I283-I314 HydrophobicContact CG2-CD1 4.15Å; V285-I314 HydrophobicContact CG2-CD1 4.26Å; V285-I314 HydrophobicContact CG2-CG2 4.38Å; F303-I314 HydrophobicContact CD1-CG2 4.3Å; F303-I314 HydrophobicContact CD2-CG2 3.74Å; F303-I314 HydrophobicContact CE1-CG2 4.36Å; F303-I314 HydrophobicContact CE2-CG2 3.81Å; F303-I314 HydrophobicContact CG-CG2 4Å; F303-I314 HydrophobicContact CZ-CG2 4.12Å; V308-I314 HydrophobicContact CG1-CG1 4.29Å; V308-I314 HydrophobicContact CG2-CG1 4.28Å; V308-I314 HydrophobicContact CG2-CG2 4.35Å; I314-F316 HydrophobicContact CG2-CB 4.3Å; I314-F316 HydrophobicContact CG2-CD1 4.44Å; I314-L336 HydrophobicContact CD1-CD2 3.74Å
315	V	97.4	Very high	93	Very high	37 Å²	37	69.8 Å²	69.8	22%	0.224	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.9	163.7	-171.1	0	0	0	0	107.2	V271 Y272 F303 D307	V271-V315 WeakPolarHBondContact O-CA 3.42Å; Y272-V315 HydrophobicContact CD1-CG2 3.65Å; Y272-V315 HydrophobicContact CE1-CG1 4.29Å; Y272-V315 HydrophobicContact CE1-CG2 3.54Å; Y272-V315 HydrophobicContact CE2-CG1 4.17Å; Y272-V315 HydrophobicContact CG-CG2 4.34Å; F303-V315 WeakPolarHBondContact CB-O 3.2Å; D307-V315 HydrophobicContact CB-CB 4.48Å; D307-V315 WeakPolarHBondContact CB-O 3.49Å; D307-V315 PolarHBondContact O-N 3.01Å
316	F	97.1	Very high	92.4	Very high	3 Å²	3	68.6 Å²	68.6	1%	0.013	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	164.4	-179.8	75.4	-86.7	0	0	0	111.8	M258 E270 V271 L273 V285 F287 D302 F303 I314	M258-F316 HydrophobicContact CE-CZ 4.43Å; E270-F316 WeakPolarHBondContact CA-O 3.28Å; V271-F316 HydrophobicContact CB-CD1 4.33Å; V271-F316 HydrophobicContact CB-CE1 3.78Å; V271-F316 HydrophobicContact CB-CE2 4.21Å; V271-F316 HydrophobicContact CB-CZ 3.7Å; V271-F316 HydrophobicContact CG1-CE1 3.66Å; V271-F316 HydrophobicContact CG1-CZ 3.69Å; V271-F316 HydrophobicContact CG2-CZ 4.27Å; V271-F316 PolarHBondContact N-O 2.55Å; V271-F316 PolarHBondContact O-N 2.93Å; L273-F316 HydrophobicContact CB-CD1 4.35Å; L273-F316 HydrophobicContact CB-CE1 3.93Å; L273-F316 HydrophobicContact CD1-CE1 3.94Å; V285-F316 HydrophobicContact CG1-CE1 4.11Å; V285-F316 HydrophobicContact CG1-CE2 4.25Å; V285-F316 HydrophobicContact CG1-CZ 3.96Å; V285-F316 HydrophobicContact CG2-CD1 4.04Å; V285-F316 HydrophobicContact CG2-CE1 4.32Å; V285-F316 HydrophobicContact CG2-CG 4.3Å; F287-F316 HydrophobicContact CE2-CD2 4.41Å; F287-F316 AromaticContact CE2-CE2 3.41Å; F287-F316 HydrophobicContact CE2-CE2 3.41Å; F287-F316 VanDerWaalsContact CE2-CE2 3.41Å; F287-F316 AromaticContact CE2-CZ 3.78Å; F287-F316 HydrophobicContact CE2-CZ 3.78Å; F287-F316 AromaticContact CZ-CE2 3.56Å; F287-F316 HydrophobicContact CZ-CE2 3.56Å; F287-F316 AromaticContact CZ-CZ 3.76Å; F287-F316 HydrophobicContact CZ-CZ 3.76Å; D302-F316 WeakPolarHBondContact O-CA 3.47Å; F303-F316 HydrophobicContact CB-CB 3.74Å; F303-F316 HydrophobicContact CD1-CB 3.74Å; F303-F316 HydrophobicContact CG-CB 3.99Å; I314-F316 HydrophobicContact CG2-CB 4.3Å; I314-F316 HydrophobicContact CG2-CD1 4.44Å
317	K	96.4	Very high	91.7	Very high	82 Å²	82	71.3 Å²	71.3	36%	0.357	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.4	177	-56.7	-169.3	-175.8	-146.8	0	111.7	E269 E270 G301 D302	E269-K317 CarbonylContact O-C 3.55Å; E269-K317 VanDerWaalsContact O-CA 3.29Å; E269-K317 WeakPolarHBondContact O-CA 3.36Å; E270-K317 HydrophobicContact CG-CD 4.19Å; E270-K317 HydrophobicContact CG-CG 3.89Å; E270-K317 WeakPolarHBondContact OE1-CE 3.39Å; E270-K317 IonicContact OE1-NZ 3.96Å; E270-K317 PolarHBondContact OE1-NZ 3.39Å; G301-K317 WeakPolarHBondContact CA-O 3.47Å; D302-K317 HydrophobicContact CB-CB 4.35Å; D302-K317 PolarHBondContact N-O 2.92Å; D302-K317 PolarHBondContact O-N 3.37Å
318	T	96.1	Very high	91.1	Very high	5 Å²	5	76.5 Å²	76.5	3%	0.031	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-59.3	136.5	-178.8	49.6	0	0	0	0	111.6	G267 G268 E269 V271 F287 F350	G267-T318 CarbonylContact C-O 3.49Å; G267-T318 WeakPolarHBondContact CA-O 3.46Å; G267-T318 WeakPolarHBondContact CA-OG1 3.33Å; G268-T318 PolarHBondContact N-O 2.95Å; G268-T318 PolarHBondContact N-OG1 3.36Å; E269-T318 HydrophobicContact CB-CG2 4.49Å; E269-T318 PolarHBondContact N-OG1 2.99Å; E269-T318 VanDerWaalsContact N-OG1 3.13Å; E269-T318 PolarHBondContact O-N 2.77Å; V271-T318 HydrophobicContact CG2-CG2 3.62Å; F287-T318 HydrophobicContact CZ-CG2 4.38Å; T318-F350 HydrophobicContact CG2-CE1 4.46Å; T318-F350 HydrophobicContact CG2-CE2 4.37Å; T318-F350 HydrophobicContact CG2-CZ 3.78Å
319	P	96	Very high	90.8	Very high	14 Å²	14	80.1 Å²	80.1	9%	0.091	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-67.1	162.9	173.2	21.4	-23.9	0	0	0	111.4	G267 F287 W297 A299 Y352	G267-P319 WeakPolarHBondContact CA-O 3.47Å; F287-P319 HydrophobicContact CB-CG 3.84Å; F287-P319 HydrophobicContact CD1-CG 4.02Å; F287-P319 HydrophobicContact CD2-CG 3.66Å; F287-P319 HydrophobicContact CE2-CG 4.25Å; F287-P319 HydrophobicContact CG-CG 3.56Å; W297-P319 HydrophobicContact CH2-CG 4.33Å; A299-P319 HydrophobicContact CB-CB 3.55Å; A299-P319 HydrophobicContact CB-CG 3.84Å; P319-Y352 WeakPolarHBondContact CD-OH 3.45Å; P319-Y352 WeakPolarHBondContact CG-OH 3.34Å; P319-Y352 PolarHBondContact O-OH 3.4Å
320	K	94.1	Very high	90.6	Very high	136 Å²	136	76.2 Å²	76.2	59%	0.591	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-71	128.4	167.8	-82.2	161.9	-175.8	173.4	0	109.6	T266 W297	T266-K320 VanDerWaalsContact O-CE 3.27Å; T266-K320 WeakPolarHBondContact O-CE 3.49Å; T266-K320 WeakPolarHBondContact O-CG 3.29Å; W297-K320 WeakPolarHBondContact CZ2-O 3.32Å
321	Y	92.4	Very high	90.6	Very high	4 Å²	4	70.3 Å²	70.3	2%	0.016	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-69.2	153.1	170.5	-173	-113.5	0	0	0	110.5	V265 E289 W297 D323 L326 V332 Y352	V265-Y321 HydrophobicContact CG1-CD1 4.05Å; V265-Y321 HydrophobicContact CG1-CG 4.39Å; V265-Y321 PolarHBondContact O-N 3.42Å; E289-Y321 PolarHBondContact OE1-OH 2.68Å; E289-Y321 PolarHBondContact OE2-OH 3.09Å; W297-Y321 HydrophobicContact CD2-CD2 4.26Å; W297-Y321 HydrophobicContact CD2-CE2 4.22Å; W297-Y321 HydrophobicContact CE3-CD2 4.08Å; W297-Y321 AromaticContact CE3-CE2 3.99Å; W297-Y321 HydrophobicContact CE3-CE2 3.99Å; W297-Y321 HydrophobicContact CH2-CD2 4.04Å; W297-Y321 HydrophobicContact CZ2-CD2 4.2Å; W297-Y321 AromaticContact CZ3-CD2 3.98Å; W297-Y321 HydrophobicContact CZ3-CD2 3.98Å; W297-Y321 HydrophobicContact CZ3-CE2 4.28Å; Y321-D323 VanDerWaalsContact C-N 3.32Å; Y321-D323 HydrophobicContact CD1-CB 4.2Å; Y321-D323 HydrophobicContact CE1-CB 3.93Å; Y321-D323 PolarHBondContact O-N 2.78Å; Y321-L326 HydrophobicContact CD1-CD1 4.34Å; Y321-L326 HydrophobicContact CE1-CD1 3.87Å; Y321-V332 HydrophobicContact CD2-CG1 4.33Å; Y321-V332 HydrophobicContact CE2-CG1 3.89Å; Y321-Y352 AromaticContact CD2-CD2 3.7Å; Y321-Y352 HydrophobicContact CD2-CD2 3.7Å; Y321-Y352 HydrophobicContact CD2-CE2 4Å; Y321-Y352 HydrophobicContact CD2-CG 4.3Å; Y321-Y352 HydrophobicContact CG-CD2 4.03Å; Y321-Y352 HydrophobicContact CG-CE2 4.45Å; Y321-Y352 HydrophobicContact CG-CG 4.17Å
322	R	86.8	Confident	90.7	Very high	110 Å²	110	67.1 Å²	67.1	42%	0.415	34%	0.335	S	S	.	.	S	Bend	trans	-60.5	-41	-174.7	81.6	-177.9	178.5	-133.3	-22.2	112.4	E289 T296 W297	E289-R322 IonicContact OE1-NH2 3.23Å; E289-R322 IonicContact OE2-CZ 2.7Å; E289-R322 IonicContact OE2-NH1 2.78Å; E289-R322 PolarHBondContact OE2-NH1 3.46Å; E289-R322 IonicContact OE2-NH2 3.16Å; E289-R322 PolarHBondContact OE2-NH2 3.03Å; T296-R322 PolarHBondContact O-NH1 2.85Å; W297-R322 HydrophobicContact CG-CB 4.39Å
323	D	85.4	Confident	90.8	Very high	78 Å²	78	65.8 Å²	65.8	42%	0.417	33%	0.329	S	S	.	.			trans	-107.5	88.9	-175.7	-64.3	-56.1	0	0	0	110.9	Y321 N325 L326	Y321-D323 VanDerWaalsContact C-N 3.32Å; Y321-D323 HydrophobicContact CD1-CB 4.2Å; Y321-D323 HydrophobicContact CE1-CB 3.93Å; Y321-D323 PolarHBondContact O-N 2.78Å; D323-N325 PolarHBondContact O-N 3.13Å; D323-L326 HydrophobicContact CB-CD1 4.29Å; D323-L326 PolarHBondContact O-N 2.89Å
324	Q	82.9	Confident	90.8	Very high	99 Å²	99	64.9 Å²	64.9	46%	0.463	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.8	179.5	-69.5	171.5	42.8	0	0	113.6	V265 L326	V265-Q324 WeakPolarHBondContact CG2-O 3.26Å; Q324-L326 VanDerWaalsContact C-N 3.27Å; Q324-L326 PolarHBondContact O-N 3.28Å
325	N	82.4	Confident	90.7	Very high	148 Å²	148	65.5 Å²	65.5	79%	0.791	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	30.9	178.3	-66.4	-47.9	0	0	0	113.2	D323 Q327	D323-N325 PolarHBondContact O-N 3.13Å; N325-Q327 PolarHBondContact O-NE2 3.05Å
326	L	81.8	Confident	90.7	Very high	26 Å²	26	63.8 Å²	63.8	14%	0.136	31%	0.314	C	S	.	.			trans	-56.3	147.6	-177	-151.6	70.6	0	0	0	112.2	V265 Y321 D323 Q324 K328 P354	V265-L326 HydrophobicContact CG1-CB 3.89Å; V265-L326 HydrophobicContact CG1-CD2 3.59Å; V265-L326 HydrophobicContact CG1-CG 4.33Å; Y321-L326 HydrophobicContact CD1-CD1 4.34Å; Y321-L326 HydrophobicContact CE1-CD1 3.87Å; D323-L326 HydrophobicContact CB-CD1 4.29Å; D323-L326 PolarHBondContact O-N 2.89Å; Q324-L326 VanDerWaalsContact C-N 3.27Å; Q324-L326 PolarHBondContact O-N 3.28Å; L326-K328 WeakPolarHBondContact CD2-O 3.48Å; L326-K328 WeakPolarHBondContact CG-O 3.46Å; L326-P354 HydrophobicContact CB-CB 4.36Å; L326-P354 VanDerWaalsContact O-CB 3.29Å; L326-P354 WeakPolarHBondContact O-CB 3.15Å
327	Q	78.6	Confident	90.5	Very high	168 Å²	168	65.8 Å²	65.8	79%	0.785	32%	0.323	S	S	*	.	S	Bend	trans	-118.1	-15.2	-177.3	-64.7	-63.1	-50.3	0	0	113.9	N325	N325-Q327 PolarHBondContact O-NE2 3.05Å
328	K	84.4	Confident	90.3	Very high	168 Å²	168	62.2 Å²	62.2	73%	0.73	31%	0.307	S	S	*	.	S	Bend	trans	-141.7	150.7	176.2	-65.7	-175.1	178.6	-177	0	107.9	L326	L326-K328 WeakPolarHBondContact CD2-O 3.48Å; L326-K328 WeakPolarHBondContact CG-O 3.46Å
329	P	89.7	Confident	90.1	Very high	87 Å²	87	66.2 Å²	66.2	57%	0.565	32%	0.324	S	S	*	.			trans	-61	138.8	175.1	-20.9	32.8	0	0	0	111.9	T351 Y352	P329-T351 HydrophobicContact CB-CG2 3.6Å; P329-Y352 CarbonylContact C-O 3.58Å; P329-Y352 WeakPolarHBondContact CA-O 3.49Å
330	T	89.8	Confident	89.7	Confident	32 Å²	32	69.3 Å²	69.3	20%	0.196	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.9	177.7	-67.4	0	0	0	0	109.5	E289 V332 T351 Y352	E289-T330 WeakPolarHBondContact OE1-CG2 3.46Å; T330-V332 HydrophobicContact CG2-CG1 4.43Å; T330-T351 CarbonylContact O-C 3.55Å; T330-T351 WeakPolarHBondContact O-CA 3.47Å; T330-Y352 PolarHBondContact N-O 2.95Å; T330-Y352 PolarHBondContact O-N 3.41Å
331	S	91.6	Very high	89.2	Confident	79 Å²	79	65.5 Å²	65.5	55%	0.552	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.5	174.7	-66.3	0	0	0	0	110.7	T351	S331-T351 PolarHBondContact OG-OG1 3.12Å
332	V	94.3	Very high	89	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	171.6	172.5	-58.7	0	0	0	0	109.6	F287 Y288 E289 W297 Y321 T330 P349 F350 Y352	F287-V332 HydrophobicContact CD1-CG2 4.25Å; Y288-V332 WeakPolarHBondContact O-CB 3.46Å; E289-V332 HydrophobicContact CB-CG1 4.29Å; W297-V332 HydrophobicContact CE3-CG1 4.12Å; W297-V332 HydrophobicContact CZ3-CB 4.17Å; W297-V332 HydrophobicContact CZ3-CG1 3.91Å; W297-V332 HydrophobicContact CZ3-CG2 4.21Å; Y321-V332 HydrophobicContact CD2-CG1 4.33Å; Y321-V332 HydrophobicContact CE2-CG1 3.89Å; T330-V332 HydrophobicContact CG2-CG1 4.43Å; V332-P349 CarbonylContact O-C 3.5Å; V332-P349 WeakPolarHBondContact O-CA 3.39Å; V332-F350 HydrophobicContact CG2-CB 4.26Å; V332-F350 HydrophobicContact CG2-CD1 4.36Å; V332-F350 WeakPolarHBondContact CG2-O 3.3Å; V332-F350 PolarHBondContact N-O 3.21Å; V332-F350 PolarHBondContact O-N 3.39Å; V332-Y352 HydrophobicContact CG1-CD2 4.11Å; V332-Y352 HydrophobicContact CG2-CD2 3.75Å; V332-Y352 HydrophobicContact CG2-CE2 3.76Å
333	F	95.8	Very high	89	Confident	85 Å²	85	66.1 Å²	66.1	37%	0.373	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	147.2	174.6	-68.5	-71	0	0	0	112.3	F287 Y288 P347 K348	F287-F333 CarbonylContact C-O 3.56Å; F287-F333 VanDerWaalsContact CA-O 3.29Å; F287-F333 WeakPolarHBondContact CA-O 3.4Å; Y288-F333 HydrophobicContact CD1-CB 3.94Å; Y288-F333 HydrophobicContact CD2-CB 4.48Å; Y288-F333 HydrophobicContact CE1-CB 3.45Å; Y288-F333 VanDerWaalsContact CE1-CB 3.45Å; Y288-F333 HydrophobicContact CE2-CB 4.06Å; Y288-F333 HydrophobicContact CE2-CD2 4.35Å; Y288-F333 HydrophobicContact CG-CB 4.43Å; Y288-F333 PolarHBondContact N-O 3.27Å; Y288-F333 PolarHBondContact O-N 3.15Å; F333-P347 HydrophobicContact CB-CB 4.11Å; F333-P347 HydrophobicContact CD1-CB 4.11Å; F333-P347 HydrophobicContact CG-CB 4.35Å; F333-K348 CarbonylContact C-O 3.59Å; F333-K348 WeakPolarHBondContact CA-O 3.42Å
334	V	96.3	Very high	89.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.5	176.2	-178.3	0	0	0	0	108.8	I255 M258 V285 R286 F287 P347 K348 F350	I255-V334 HydrophobicContact CD1-CG1 4.22Å; I255-V334 WeakPolarHBondContact CD1-O 3.49Å; M258-V334 HydrophobicContact CE-CG1 4.16Å; M258-V334 HydrophobicContact SD-CG1 4.44Å; V285-V334 HydrophobicContact CG1-CG1 3.64Å; R286-V334 WeakPolarHBondContact O-CA 3.41Å; F287-V334 HydrophobicContact CD1-CG2 3.56Å; F287-V334 HydrophobicContact CD2-CG1 4.37Å; F287-V334 HydrophobicContact CD2-CG2 4.2Å; F287-V334 HydrophobicContact CE1-CG2 3.41Å; F287-V334 VanDerWaalsContact CE1-CG2 3.41Å; F287-V334 HydrophobicContact CE2-CG1 4.01Å; F287-V334 HydrophobicContact CE2-CG2 4.05Å; F287-V334 HydrophobicContact CG-CG2 3.95Å; F287-V334 HydrophobicContact CZ-CG1 4.22Å; F287-V334 HydrophobicContact CZ-CG2 3.66Å; V334-P347 WeakPolarHBondContact O-CA 3.36Å; V334-K348 PolarHBondContact N-O 2.97Å; V334-K348 PolarHBondContact O-N 2.86Å; V334-F350 HydrophobicContact CG2-CB 3.49Å; V334-F350 VanDerWaalsContact CG2-CB 3.49Å; V334-F350 HydrophobicContact CG2-CD2 4.46Å; V334-F350 HydrophobicContact CG2-CG 4.1Å
335	Q	95.8	Very high	89.9	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.065	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151.8	175.8	68.2	-170.6	19.9	0	0	111.1	R286 Y288 T344 P347	R286-Q335 HydrophobicContact CB-CG 4.15Å; R286-Q335 PolarHBondContact N-O 2.94Å; R286-Q335 PolarHBondContact O-N 3.28Å; Y288-Q335 HydrophobicContact CD1-CG 4.35Å; Y288-Q335 HydrophobicContact CE1-CB 4.42Å; Y288-Q335 VanDerWaalsContact CE1-CD 3.47Å; Y288-Q335 HydrophobicContact CE1-CG 3.88Å; Y288-Q335 VanDerWaalsContact CE1-OE1 3.29Å; Y288-Q335 PolarHBondContact OH-OE1 3.29Å; Q335-T344 VanDerWaalsContact NE2-CG2 3.28Å; Q335-P347 HydrophobicContact CB-CB 4.42Å
336	L	96.3	Very high	90.3	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	146.5	165	-66.4	169.4	0	0	0	109.1	L253 I255 L273 C275 V278 I283 V285 I314 T344 S345	L253-L336 HydrophobicContact CB-CB 4.31Å; L253-L336 HydrophobicContact CD1-CB 4.36Å; I255-L336 HydrophobicContact CD1-CG 4.44Å; I255-L336 HydrophobicContact CG1-CD1 3.98Å; I255-L336 HydrophobicContact CG1-CG 3.78Å; L273-L336 HydrophobicContact CD1-CD2 4.38Å; L273-L336 HydrophobicContact CD2-CD1 4.43Å; L273-L336 HydrophobicContact CD2-CD2 4.03Å; C275-L336 HydrophobicContact CB-CD1 3.64Å; V278-L336 HydrophobicContact CG1-CD1 4.47Å; I283-L336 HydrophobicContact CD1-CB 4.23Å; I283-L336 HydrophobicContact CD1-CD2 4.33Å; I283-L336 HydrophobicContact CG1-CD2 4.3Å; V285-L336 HydrophobicContact CG2-CD2 4.17Å; I314-L336 HydrophobicContact CD1-CD2 3.74Å; L336-T344 CarbonylContact O-C 3.56Å; L336-T344 WeakPolarHBondContact O-CA 3.09Å; L336-S345 PolarHBondContact N-OG 3.37Å; L336-S345 PolarHBondContact O-N 2.57Å
337	K	94.3	Very high	90.9	Very high	46 Å²	46	62.8 Å²	62.8	20%	0.2	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	128.7	173.8	-173.9	178.3	178.1	-170.2	0	110.7	Q284 N342 E343 T344	Q284-K337 PolarHBondContact N-O 2.99Å; Q284-K337 PolarHBondContact O-N 2.93Å; K337-N342 WeakPolarHBondContact CE-OD1 3.44Å; K337-N342 PolarHBondContact NZ-OD1 3.32Å; K337-E343 CarbonylContact C-O 3.54Å; K337-E343 VanDerWaalsContact CA-O 3.29Å; K337-E343 WeakPolarHBondContact CA-O 2.93Å; K337-T344 HydrophobicContact CB-CG2 4.19Å; K337-T344 HydrophobicContact CD-CG2 4.34Å; K337-T344 HydrophobicContact CG-CG2 3.94Å
338	R	92.6	Very high	91.6	Very high	6 Å²	6	58 Å²	58	2%	0.023	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	142.4	171.3	-172.6	-178.6	-62.3	104.3	-1.6	109.6	R55 N249 S251 L253 D282 S340 D341 N342 E343	R55-R338 VanDerWaalsContact NH1-NH1 3.17Å; N249-R338 PolarHBondContact O-NE 3.36Å; S251-R338 PolarHBondContact O-NH2 2.88Å; L253-R338 HydrophobicContact CD1-CB 4.1Å; D282-R338 HydrophobicContact CB-CG 4.44Å; D282-R338 VanDerWaalsContact CG-CG 3.44Å; D282-R338 VanDerWaalsContact O-CA 3.27Å; D282-R338 WeakPolarHBondContact O-CA 3.34Å; D282-R338 WeakPolarHBondContact O-CG 3.45Å; D282-R338 VanDerWaalsContact OD2-CD 3.31Å; D282-R338 WeakPolarHBondContact OD2-CD 3.47Å; D282-R338 WeakPolarHBondContact OD2-CG 3.28Å; R338-S340 VanDerWaalsContact CD-OG 3.22Å; R338-S340 WeakPolarHBondContact CD-OG 3.47Å; R338-S340 WeakPolarHBondContact CG-OG 3.27Å; R338-D341 WeakPolarHBondContact CB-OD1 3.44Å; R338-D341 WeakPolarHBondContact CD-OD1 3.03Å; R338-D341 IonicContact CZ-OD2 3.2Å; R338-D341 IonicContact NH1-OD1 3.99Å; R338-D341 PolarHBondContact NH1-OD1 2.88Å; R338-D341 IonicContact NH1-OD2 2.7Å; R338-D341 PolarHBondContact NH1-OD2 3.35Å; R338-N342 VanDerWaalsContact O-CA 3.28Å; R338-N342 WeakPolarHBondContact O-CA 3.5Å; R338-N342 PolarHBondContact O-N 2.86Å; R338-E343 IonicContact CZ-OE2 3.17Å; R338-E343 PolarHBondContact N-O 3.05Å; R338-E343 IonicContact NH1-OE2 2.73Å; R338-E343 PolarHBondContact NH1-OE2 3.29Å; R338-E343 IonicContact NH2-OE2 2.76Å
339	K	90.8	Very high	92.2	Very high	90 Å²	90	53.8 Å²	53.8	39%	0.391	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-36.5	-175.3	-51.5	172.9	-169.6	164.8	0	111.9	D281 D282 I283 Q284	D281-K339 WeakPolarHBondContact O-CE 3.45Å; D281-K339 PolarHBondContact O-NZ 3.41Å; D282-K339 PolarHBondContact O-N 3.28Å; D282-K339 VanDerWaalsContact O-N 3.1Å; D282-K339 VanDerWaalsContact OD1-CA 3.29Å; D282-K339 WeakPolarHBondContact OD1-CA 3.28Å; D282-K339 WeakPolarHBondContact OD1-CB 3.41Å; D282-K339 PolarHBondContact OD1-N 3.21Å; I283-K339 WeakPolarHBondContact O-CE 3.47Å; Q284-K339 HydrophobicContact CG-CD 4.24Å; Q284-K339 HydrophobicContact CG-CG 3.85Å
340	S	87.6	Confident	92.4	Very high	79 Å²	79	49.6 Å²	49.6	55%	0.552	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-50	-174.7	56.2	0	0	0	0	114.1	D282 R338	D282-S340 PolarHBondContact OD1-N 2.66Å; D282-S340 PolarHBondContact OD1-OG 3.44Å; D282-S340 VanDerWaalsContact OD2-CB 3.3Å; D282-S340 WeakPolarHBondContact OD2-CB 3.38Å; D282-S340 PolarHBondContact OD2-OG 2.98Å; R338-S340 VanDerWaalsContact CD-OG 3.22Å; R338-S340 WeakPolarHBondContact CD-OG 3.47Å; R338-S340 WeakPolarHBondContact CG-OG 3.27Å
341	D	83.7	Confident	92.7	Very high	55 Å²	55	50.1 Å²	50.1	29%	0.294	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-2.1	-176.3	64.6	10.7	0	0	0	114.5	R55 R338 E343	R55-D341 IonicContact CZ-OD2 3.05Å; R55-D341 IonicContact NH1-OD2 2.72Å; R55-D341 PolarHBondContact NH1-OD2 3.48Å; R55-D341 IonicContact NH2-OD2 2.73Å; R55-D341 PolarHBondContact NH2-OD2 2.86Å; R338-D341 WeakPolarHBondContact CB-OD1 3.44Å; R338-D341 WeakPolarHBondContact CD-OD1 3.03Å; R338-D341 IonicContact CZ-OD2 3.2Å; R338-D341 IonicContact NH1-OD1 3.99Å; R338-D341 PolarHBondContact NH1-OD1 2.88Å; R338-D341 IonicContact NH1-OD2 2.7Å; R338-D341 PolarHBondContact NH1-OD2 3.35Å; D341-E343 PolarHBondContact O-N 3.16Å; D341-E343 VanDerWaalsContact OD1-CB 3.29Å; D341-E343 WeakPolarHBondContact OD1-CB 3.49Å; D341-E343 PolarHBondContact OD1-N 2.92Å
342	N	88.3	Confident	92.8	Very high	92 Å²	92	46.4 Å²	46.4	49%	0.492	25%	0.246	S	C	.	.			trans	60.2	15.9	-175	-66.1	-99.7	0	0	0	115	K337 R338	K337-N342 WeakPolarHBondContact CE-OD1 3.44Å; K337-N342 PolarHBondContact NZ-OD1 3.32Å; R338-N342 VanDerWaalsContact O-CA 3.28Å; R338-N342 WeakPolarHBondContact O-CA 3.5Å; R338-N342 PolarHBondContact O-N 2.86Å
343	E	87.5	Confident	92.6	Very high	36 Å²	36	49.8 Å²	49.8	17%	0.168	26%	0.261	C	S	.	.			trans	-59.4	145.4	173.4	-178.2	169.9	-134.8	0	0	110.9	R55 L253 K337 R338 D341	R55-E343 WeakPolarHBondContact CD-OE1 3.08Å; R55-E343 IonicContact CZ-OE2 3.42Å; R55-E343 IonicContact NE-OE1 2.92Å; R55-E343 IonicContact NH1-OE1 3.86Å; R55-E343 IonicContact NH1-OE2 2.73Å; R55-E343 PolarHBondContact NH1-OE2 2.75Å; L253-E343 HydrophobicContact CD1-CB 4.44Å; L253-E343 HydrophobicContact CD1-CG 4.36Å; L253-E343 WeakPolarHBondContact CD1-O 3.38Å; K337-E343 CarbonylContact C-O 3.54Å; K337-E343 VanDerWaalsContact CA-O 3.29Å; K337-E343 WeakPolarHBondContact CA-O 2.93Å; R338-E343 IonicContact CZ-OE2 3.17Å; R338-E343 PolarHBondContact N-O 3.05Å; R338-E343 IonicContact NH1-OE2 2.73Å; R338-E343 PolarHBondContact NH1-OE2 3.29Å; R338-E343 IonicContact NH2-OE2 2.76Å; D341-E343 PolarHBondContact O-N 3.16Å; D341-E343 VanDerWaalsContact OD1-CB 3.29Å; D341-E343 WeakPolarHBondContact OD1-CB 3.49Å; D341-E343 PolarHBondContact OD1-N 2.92Å
344	T	91.4	Very high	92.2	Very high	62 Å²	62	47.4 Å²	47.4	38%	0.38	25%	0.254	S	S	.	.	B	Isolated β-bridge	trans	-128.4	147.2	-176.4	53.9	0	0	0	0	112.2	Q335 L336 K337	Q335-T344 VanDerWaalsContact NE2-CG2 3.28Å; L336-T344 CarbonylContact O-C 3.56Å; L336-T344 WeakPolarHBondContact O-CA 3.09Å; K337-T344 HydrophobicContact CB-CG2 4.19Å; K337-T344 HydrophobicContact CD-CG2 4.34Å; K337-T344 HydrophobicContact CG-CG2 3.94Å
345	S	94.1	Very high	91.2	Very high	4 Å²	4	52 Å²	52	3%	0.028	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-72.9	167.7	171.2	70.6	0	0	0	0	112.8	L253 L336	L253-S345 VanDerWaalsContact O-CA 3.25Å; L253-S345 WeakPolarHBondContact O-CA 3.45Å; L253-S345 WeakPolarHBondContact O-CB 3.2Å; L336-S345 PolarHBondContact N-OG 3.37Å; L336-S345 PolarHBondContact O-N 2.57Å
346	E	91	Very high	89.7	Confident	152 Å²	152	58.8 Å²	58.8	71%	0.71	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-51.4	133.9	156.3	-66.7	177.7	157.9	0	0	109.3
347	P	94.3	Very high	88	Confident	62 Å²	62	63.8 Å²	63.8	40%	0.403	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-78.8	151.8	-179	30.8	-35	0	0	0	112.1	Y288 F333 V334 Q335	Y288-P347 HydrophobicContact CE1-CB 4.33Å; Y288-P347 WeakPolarHBondContact OH-CB 3.48Å; F333-P347 HydrophobicContact CB-CB 4.11Å; F333-P347 HydrophobicContact CD1-CB 4.11Å; F333-P347 HydrophobicContact CG-CB 4.35Å; V334-P347 WeakPolarHBondContact O-CA 3.36Å; Q335-P347 HydrophobicContact CB-CB 4.42Å
348	K	94.9	Very high	86.1	Confident	67 Å²	67	65.8 Å²	65.8	29%	0.291	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.4	171.5	-67.6	-159.8	178.3	-176.8	0	111.6	I255 V256 F333 V334	I255-K348 HydrophobicContact CB-CD 4.1Å; I255-K348 HydrophobicContact CB-CG 4.45Å; I255-K348 HydrophobicContact CG2-CD 3.8Å; I255-K348 WeakPolarHBondContact O-CE 3.39Å; I255-K348 PolarHBondContact O-NZ 3.48Å; V256-K348 PolarHBondContact O-NZ 3.04Å; F333-K348 CarbonylContact C-O 3.59Å; F333-K348 WeakPolarHBondContact CA-O 3.42Å; V334-K348 PolarHBondContact N-O 2.97Å; V334-K348 PolarHBondContact O-N 2.86Å
349	P	95.3	Very high	84.5	Confident	80 Å²	80	72.5 Å²	72.5	52%	0.519	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.3	176	30	-35	0	0	0	111.5	V332	V332-P349 CarbonylContact O-C 3.5Å; V332-P349 WeakPolarHBondContact O-CA 3.39Å
350	F	95.8	Very high	82.9	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	133.7	171.6	-176.1	-82.3	0	0	0	109.2	M258 T261 F287 T318 V332 V334 Y352	M258-F350 HydrophobicContact CE-CD2 4.03Å; T261-F350 CarbonylContact O-C 3.55Å; T261-F350 WeakPolarHBondContact O-CA 3.39Å; F287-F350 HydrophobicContact CD1-CD1 4.45Å; F287-F350 HydrophobicContact CE1-CB 4.44Å; F287-F350 AromaticContact CE1-CD1 3.82Å; F287-F350 HydrophobicContact CE1-CD1 3.82Å; F287-F350 HydrophobicContact CE1-CD2 4.21Å; F287-F350 HydrophobicContact CE1-CE1 4.09Å; F287-F350 HydrophobicContact CE1-CE2 4.45Å; F287-F350 AromaticContact CE1-CG 3.91Å; F287-F350 HydrophobicContact CE1-CG 3.91Å; F287-F350 HydrophobicContact CE1-CZ 4.4Å; T318-F350 HydrophobicContact CG2-CE1 4.46Å; T318-F350 HydrophobicContact CG2-CE2 4.37Å; T318-F350 HydrophobicContact CG2-CZ 3.78Å; V332-F350 HydrophobicContact CG2-CB 4.26Å; V332-F350 HydrophobicContact CG2-CD1 4.36Å; V332-F350 WeakPolarHBondContact CG2-O 3.3Å; V332-F350 PolarHBondContact N-O 3.21Å; V332-F350 PolarHBondContact O-N 3.39Å; V334-F350 HydrophobicContact CG2-CB 3.49Å; V334-F350 VanDerWaalsContact CG2-CB 3.49Å; V334-F350 HydrophobicContact CG2-CD2 4.46Å; V334-F350 HydrophobicContact CG2-CG 4.1Å; F350-Y352 HydrophobicContact CD1-CD2 4.4Å; F350-Y352 HydrophobicContact CD1-CE2 4.36Å; F350-Y352 HydrophobicContact CE1-CD1 4.33Å; F350-Y352 HydrophobicContact CE1-CE1 4.24Å; F350-Y352 HydrophobicContact CE1-CE2 4.45Å
351	T	94.3	Very high	81.5	Confident	43 Å²	43	74.6 Å²	74.6	26%	0.264	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.3	-174.7	-55.8	0	0	0	0	112.4	T261 A262 G263 P329 T330 S331	T261-T351 PolarHBondContact O-N 3.35Å; A262-T351 CarbonylContact C-O 3.56Å; A262-T351 WeakPolarHBondContact CA-O 3.45Å; A262-T351 VanDerWaalsContact CB-O 3.3Å; A262-T351 WeakPolarHBondContact CB-O 3.46Å; G263-T351 PolarHBondContact N-O 3.31Å; P329-T351 HydrophobicContact CB-CG2 3.6Å; T330-T351 CarbonylContact O-C 3.55Å; T330-T351 WeakPolarHBondContact O-CA 3.47Å; S331-T351 PolarHBondContact OG-OG1 3.12Å
352	Y	94.1	Very high	80.2	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	126	168.6	-83.1	-70.6	0	0	0	111	G263 V265 F287 W297 P319 Y321 P329 T330 V332 F350	G263-Y352 CarbonylContact O-C 3.52Å; G263-Y352 VanDerWaalsContact O-CA 3.3Å; G263-Y352 WeakPolarHBondContact O-CA 3.45Å; V265-Y352 HydrophobicContact CG1-CD1 4.42Å; V265-Y352 HydrophobicContact CG1-CG 4.49Å; F287-Y352 HydrophobicContact CD1-CE2 4.1Å; W297-Y352 AromaticContact CH2-CE2 3.71Å; W297-Y352 HydrophobicContact CH2-CE2 3.71Å; W297-Y352 HydrophobicContact CZ3-CE2 4.02Å; P319-Y352 WeakPolarHBondContact CD-OH 3.45Å; P319-Y352 WeakPolarHBondContact CG-OH 3.34Å; P319-Y352 PolarHBondContact O-OH 3.4Å; Y321-Y352 AromaticContact CD2-CD2 3.7Å; Y321-Y352 HydrophobicContact CD2-CD2 3.7Å; Y321-Y352 HydrophobicContact CD2-CE2 4Å; Y321-Y352 HydrophobicContact CD2-CG 4.3Å; Y321-Y352 HydrophobicContact CG-CD2 4.03Å; Y321-Y352 HydrophobicContact CG-CE2 4.45Å; Y321-Y352 HydrophobicContact CG-CG 4.17Å; P329-Y352 CarbonylContact C-O 3.58Å; P329-Y352 WeakPolarHBondContact CA-O 3.49Å; T330-Y352 PolarHBondContact N-O 2.95Å; T330-Y352 PolarHBondContact O-N 3.41Å; V332-Y352 HydrophobicContact CG1-CD2 4.11Å; V332-Y352 HydrophobicContact CG2-CD2 3.75Å; V332-Y352 HydrophobicContact CG2-CE2 3.76Å; F350-Y352 HydrophobicContact CD1-CD2 4.4Å; F350-Y352 HydrophobicContact CD1-CE2 4.36Å; F350-Y352 HydrophobicContact CE1-CD1 4.33Å; F350-Y352 HydrophobicContact CE1-CE1 4.24Å; F350-Y352 HydrophobicContact CE1-CE2 4.45Å
353	H	90.2	Very high	78.8	Confident	72 Å²	72	77 Å²	77	33%	0.333	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	149.6	175.8	68.3	72.1	0	0	0	112	G263 C264 V265	G263-H353 VanDerWaalsContact C-NE2 3.34Å; G263-H353 PolarHBondContact O-CD2 3.22Å; G263-H353 VanDerWaalsContact O-CD2 3.25Å; G263-H353 PolarHBondContact O-N 3.43Å; C264-H353 PolarHBondContact N-NE2 2.94Å; V265-H353 WeakPolarHBondContact CG1-O 3.42Å; V265-H353 PolarHBondContact N-O 3.48Å; V265-H353 VanDerWaalsContact N-O 3.08Å
354	P	87.8	Confident	77.6	Confident	35 Å²	35	82.8 Å²	82.8	23%	0.227	41%	0.413	C	S	.	.			trans	-61.9	155.2	178	28	-37.3	0	0	0	112.3	L326 I356	L326-P354 HydrophobicContact CB-CB 4.36Å; L326-P354 VanDerWaalsContact O-CB 3.29Å; L326-P354 WeakPolarHBondContact O-CB 3.15Å; P354-I356 PolarHBondContact O-N 2.95Å
355	Q	74.5	Confident	76	Confident	98 Å²	98	86.9 Å²	86.9	46%	0.458	43%	0.426	S	S	.	.			trans	-77.2	109.9	177.5	-169.2	-176.2	16.9	0	0	110.4	V265 T266 I357	V265-Q355 HydrophobicContact CG2-CB 4.34Å; T266-Q355 HydrophobicContact CG2-CB 4.4Å; T266-Q355 HydrophobicContact CG2-CG 4.18Å; Q355-I357 VanDerWaalsContact C-N 3.34Å; Q355-I357 HydrophobicContact CB-CG1 4.4Å; Q355-I357 HydrophobicContact CG-CG1 3.83Å; Q355-I357 PolarHBondContact O-N 3.49Å
356	I	65.9	Low	74.3	Confident	156 Å²	156	97 Å²	97	80%	0.8	46%	0.463	S	S	*	.			trans	-75.6	87	173.6	-54	177.8	0	0	0	108.7	P354 D358	P354-I356 PolarHBondContact O-N 2.95Å; I356-D358 PolarHBondContact O-N 2.81Å; I356-D358 VanDerWaalsContact O-N 3.11Å
357	I	60.2	Low	72.6	Confident	105 Å²	105	96.9 Å²	96.9	54%	0.538	46%	0.463	S	S	.	.			trans	-79.6	90.6	174.5	-54.6	177.1	0	0	0	108.7	Q355 K359	Q355-I357 VanDerWaalsContact C-N 3.34Å; Q355-I357 HydrophobicContact CB-CG1 4.4Å; Q355-I357 HydrophobicContact CG-CG1 3.83Å; Q355-I357 PolarHBondContact O-N 3.49Å; I357-K359 HydrophobicContact CG2-CG 4.17Å; I357-K359 PolarHBondContact O-N 2.89Å
358	D	54.8	Low	70.6	Confident	87 Å²	87	103.1 Å²	103.1	47%	0.465	48%	0.484	S	S	.	.			trans	-63.7	105.6	166.3	-175.4	-17.5	0	0	0	109.6	I356 E360 E361 V362	I356-D358 PolarHBondContact O-N 2.81Å; I356-D358 VanDerWaalsContact O-N 3.11Å; D358-E360 VanDerWaalsContact C-N 3.34Å; D358-E360 WeakPolarHBondContact OD1-CA 3.5Å; D358-E360 WeakPolarHBondContact OD1-CB 3.43Å; D358-E360 PolarHBondContact OD1-N 3Å; D358-E361 PolarHBondContact OD1-N 3.33Å; D358-E361 WeakPolarHBondContact OD2-CB 3.3Å; D358-V362 WeakPolarHBondContact O-CG2 3.08Å
359	K	58.3	Low	68.3	Low	147 Å²	147	106.3 Å²	106.3	64%	0.639	51%	0.509	S	S	*	.	H	α-helix	trans	-83.2	-13.1	178.6	-67.9	174.9	-175.4	170	0	112.6	I357 Q363	I357-K359 HydrophobicContact CG2-CG 4.17Å; I357-K359 PolarHBondContact O-N 2.89Å; K359-Q363 VanDerWaalsContact O-CG 3.23Å; K359-Q363 WeakPolarHBondContact O-CG 3.27Å; K359-Q363 PolarHBondContact O-N 3.25Å; K359-Q363 PolarHBondContact O-NE2 2.86Å
360	E	57.7	Low	65.7	Low	160 Å²	160	110.2 Å²	110.2	75%	0.748	53%	0.525	S	S	*	.	H	α-helix	trans	-89.9	-46.1	-172.6	-159.9	161.7	-177	0	0	110.3	D358 V362 Q363 R364	D358-E360 VanDerWaalsContact C-N 3.34Å; D358-E360 WeakPolarHBondContact OD1-CA 3.5Å; D358-E360 WeakPolarHBondContact OD1-CB 3.43Å; D358-E360 PolarHBondContact OD1-N 3Å; E360-V362 VanDerWaalsContact C-N 3.29Å; E360-V362 PolarHBondContact O-N 3.34Å; E360-Q363 PolarHBondContact O-N 2.92Å; E360-Q363 VanDerWaalsContact O-N 3.12Å; E360-R364 WeakPolarHBondContact O-CB 3.29Å; E360-R364 PolarHBondContact O-N 2.76Å
361	E	56.6	Low	63.2	Low	54 Å²	54	115.8 Å²	115.8	25%	0.252	56%	0.561	S	S	.	*	H	α-helix	trans	-58.6	-39.3	170.6	-177.6	64.8	-97.3	0	0	111.9	D358 R364 K365	D358-E361 PolarHBondContact OD1-N 3.33Å; D358-E361 WeakPolarHBondContact OD2-CB 3.3Å; E361-R364 PolarHBondContact O-N 3.11Å; E361-R364 IonicContact OE1-CZ 3.69Å; E361-R364 IonicContact OE1-NE 2.93Å; E361-R364 PolarHBondContact OE1-NE 3.06Å; E361-R364 IonicContact OE1-NH2 3.42Å; E361-R364 PolarHBondContact OE1-NH2 2.81Å; E361-R364 IonicContact OE2-CZ 2.69Å; E361-R364 IonicContact OE2-NE 2.72Å; E361-R364 IonicContact OE2-NH2 3.44Å; E361-R364 PolarHBondContact OE2-NH2 3.12Å; E361-K365 HydrophobicContact CG-CD 4.33Å; E361-K365 WeakPolarHBondContact O-CB 3.45Å; E361-K365 WeakPolarHBondContact O-CG 3.45Å; E361-K365 PolarHBondContact O-N 3.3Å; E361-K365 VanDerWaalsContact OE1-CE 3.32Å; E361-K365 WeakPolarHBondContact OE1-CE 3.37Å; E361-K365 IonicContact OE1-NZ 2.72Å
362	V	57.5	Low	60.4	Low	81 Å²	81	120.5 Å²	120.5	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-67.9	-35.7	176.7	176	0	0	0	0	112	D358 E360 R366	D358-V362 WeakPolarHBondContact O-CG2 3.08Å; E360-V362 VanDerWaalsContact C-N 3.29Å; E360-V362 PolarHBondContact O-N 3.34Å; V362-R366 WeakPolarHBondContact O-CG 3.25Å; V362-R366 PolarHBondContact O-N 2.96Å
363	Q	58.3	Low	57.4	Low	115 Å²	115	130.1 Å²	130.1	54%	0.537	63%	0.627	S	S	.	*	H	α-helix	trans	-72.2	-41.5	174.1	-77.8	173.3	63.1	0	0	111.5	K359 E360 K365 R366 Q367	K359-Q363 VanDerWaalsContact O-CG 3.23Å; K359-Q363 WeakPolarHBondContact O-CG 3.27Å; K359-Q363 PolarHBondContact O-N 3.25Å; K359-Q363 PolarHBondContact O-NE2 2.86Å; E360-Q363 PolarHBondContact O-N 2.92Å; E360-Q363 VanDerWaalsContact O-N 3.12Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 2.94Å; Q363-R366 CarbonylContact O-C 3.6Å; Q363-R366 WeakPolarHBondContact O-CA 3.19Å; Q363-R366 PolarHBondContact O-N 3.34Å; Q363-Q367 PolarHBondContact O-N 3.34Å
364	R	62.4	Low	54.8	Low	158 Å²	158	134.6 Å²	134.6	60%	0.596	65%	0.648	S	S	*	*	H	α-helix	trans	-57.3	-43.9	174.7	-168.1	175.9	76.1	145.8	-4.9	111.8	E360 E361 R366 Q367	E360-R364 WeakPolarHBondContact O-CB 3.29Å; E360-R364 PolarHBondContact O-N 2.76Å; E361-R364 PolarHBondContact O-N 3.11Å; E361-R364 IonicContact OE1-CZ 3.69Å; E361-R364 IonicContact OE1-NE 2.93Å; E361-R364 PolarHBondContact OE1-NE 3.06Å; E361-R364 IonicContact OE1-NH2 3.42Å; E361-R364 PolarHBondContact OE1-NH2 2.81Å; E361-R364 IonicContact OE2-CZ 2.69Å; E361-R364 IonicContact OE2-NE 2.72Å; E361-R364 IonicContact OE2-NH2 3.44Å; E361-R364 PolarHBondContact OE2-NH2 3.12Å; R364-R366 VanDerWaalsContact C-N 3.3Å; R364-R366 PolarHBondContact O-N 2.94Å; R364-Q367 PolarHBondContact O-N 3.34Å
365	K	57.8	Low	52.3	Low	149 Å²	149	140.1 Å²	140.1	65%	0.648	68%	0.676	S	S	*	*	H	α-helix	trans	-66.5	-27.4	174.2	-74.2	172.4	-179	168.2	0	113.4	E361 Q363	E361-K365 HydrophobicContact CG-CD 4.33Å; E361-K365 WeakPolarHBondContact O-CB 3.45Å; E361-K365 WeakPolarHBondContact O-CG 3.45Å; E361-K365 PolarHBondContact O-N 3.3Å; E361-K365 VanDerWaalsContact OE1-CE 3.32Å; E361-K365 WeakPolarHBondContact OE1-CE 3.37Å; E361-K365 IonicContact OE1-NZ 2.72Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 2.94Å
366	R	58.9	Low	50.1	Low	215 Å²	215	145 Å²	145	81%	0.811	70%	0.696	S	S	*	*	H	α-helix	trans	-83.2	-14.9	172.8	-75.5	-178.7	169.8	-158	-3.2	114.5	V362 Q363 R364	V362-R366 WeakPolarHBondContact O-CG 3.25Å; V362-R366 PolarHBondContact O-N 2.96Å; Q363-R366 CarbonylContact O-C 3.6Å; Q363-R366 WeakPolarHBondContact O-CA 3.19Å; Q363-R366 PolarHBondContact O-N 3.34Å; R364-R366 VanDerWaalsContact C-N 3.3Å; R364-R366 PolarHBondContact O-N 2.94Å
367	Q	55.9	Low	48.4	Very low	150 Å²	150	143.4 Å²	143.4	70%	0.701	70%	0.698	S	S	*	*	H	α-helix	trans	-94.4	-6.3	-178.4	-81.7	-176.6	-20.3	0	0	115	Q363 R364 T369	Q363-Q367 PolarHBondContact O-N 3.34Å; R364-Q367 PolarHBondContact O-N 3.34Å; Q367-T369 PolarHBondContact O-N 2.89Å
368	K	51.7	Low	47	Very low	193 Å²	193	141 Å²	141	84%	0.839	70%	0.7	S	S	*	*			trans	-71.2	89.7	170.2	-84.1	-167.6	172.4	-175.2	0	111.1
369	T	45.4	Very low	46	Very low	134 Å²	134	146.8 Å²	146.8	82%	0.822	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-66.1	146.5	162.1	41.6	0	0	0	0	110.7	Q367	Q367-T369 PolarHBondContact O-N 2.89Å
370	L	41.9	Very low	44.6	Very low	162 Å²	162	143.6 Å²	143.6	85%	0.848	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-71.2	148.3	178.9	-77.4	153.7	0	0	0	111.4
371	P	42.1	Very low	43.3	Very low	118 Å²	118	140 Å²	140	77%	0.766	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-62.2	135.2	173.8	-21.2	33.4	0	0	0	111.9	F373	P371-F373 PolarHBondContact O-N 3.06Å
372	N	35.8	Very low	42.1	Very low	142 Å²	142	141.6 Å²	141.6	76%	0.759	77%	0.769	S	S	*	*			trans	-85.4	99.6	-174.7	-166.9	84.3	0	0	0	111.1	Q374	N372-Q374 PolarHBondContact O-N 3.17Å
373	F	32.3	Very low	40.8	Very low	201 Å²	201	141.6 Å²	141.6	88%	0.882	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67	128.5	172.1	-114.5	-93.5	0	0	0	110.2	P371	P371-F373 PolarHBondContact O-N 3.06Å
374	Q	34.9	Very low	39.7	Very low	166 Å²	166	142.4 Å²	142.4	78%	0.776	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-102.2	142.6	174.4	-79.3	-170.6	-45.2	0	0	111.9	N372	N372-Q374 PolarHBondContact O-N 3.17Å
375	D	34.4	Very low	38.3	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-54.6	153.6	-165.3	-51.2	-75.7	0	0	0	116.9
376	F	28.4	Very low	37.1	Very low	201 Å²	201	135.5 Å²	135.5	88%	0.882	82%	0.824	S	S	*	*			trans	-136.9	96.2	158.1	-130.6	-84.6	0	0	0	111.3
377	S	31.8	Very low	35.8	Very low	121 Å²	121	129.1 Å²	129.1	85%	0.846	83%	0.825	S	S	*	*			trans	63.7	149.2	176	74.4	0	0	0	0	117.3
378	G	29.8	Very low	34.7	Very low	56 Å²	56	126 Å²	126	58%	0.577	83%	0.833	S	S	*	*			cis	163.3	150.9	-8.2	0	0	0	0	0	112.7
379	H	34.5	Very low	33.8	Very low	208 Å²	208	120.6 Å²	120.6	96%	0.963	83%	0.833	S	S	*	*			trans	72	152.7	-175	-46.1	86.8	0	0	0	115.7
380	G	28.7	Very low	33.1	Very low	80 Å²	80	118.4 Å²	118.4	83%	0.825	84%	0.837	S	S	*	*			trans	162.9	-55.1	166.7	0	0	0	0	0	116.5
381	G	30.6	Very low	32.6	Very low	85 Å²	85	114.3 Å²	114.3	88%	0.876	83%	0.833	S	S	*	*			trans	73.8	164.5	174.2	0	0	0	0	0	117.3
382	G	30.9	Very low	32.2	Very low	87 Å²	87	115.2 Å²	115.2	90%	0.897	83%	0.831	S	S	*	*			trans	110.2	80.2	152.4	0	0	0	0	0	119.6
383	G	30.5	Very low	32	Very low	80 Å²	80	118.2 Å²	118.2	83%	0.825	83%	0.833	S	S	*	*			trans	110.6	154.5	135.4	0	0	0	0	0	119.8
384	S	33.9	Very low	32	Very low	132 Å²	132	120.8 Å²	120.8	92%	0.923	84%	0.837	S	S	*	*			trans	-52.1	157.9	177.4	-47.5	0	0	0	0	115.3
385	G	33.3	Very low	31.7	Very low	76 Å²	76	116.6 Å²	116.6	78%	0.784	84%	0.838	S	S	*	*			cis	140.3	132.7	-0.8	0	0	0	0	0	112.5
386	G	32.6	Very low	31.5	Very low	86 Å²	86	113.6 Å²	113.6	89%	0.887	84%	0.843	S	S	*	*			trans	77.6	158.6	-173.6	0	0	0	0	0	113.8
387	G	32.6	Very low	31.5	Very low	81 Å²	81	107.9 Å²	107.9	84%	0.835	84%	0.841	S	S	*	*			cis	157.5	113.7	-11.3	0	0	0	0	0	114.8
388	G	32.3	Very low	31.4	Very low	84 Å²	84	105.7 Å²	105.7	87%	0.866	84%	0.837	S	S	*	*			trans	83.1	142.8	156.2	0	0	0	0	0	119.2
389	G	32.6	Very low	32	Very low	81 Å²	81	109 Å²	109	84%	0.835	85%	0.849	S	S	*	*			trans	77.6	139.8	167.1	0	0	0	0	0	115.8
390	G	31.4	Very low	31.9	Very low	88 Å²	88	103 Å²	103	91%	0.907	84%	0.835	S	S	*	*			cis	101.5	100.2	0.2	0	0	0	0	0	113.3
391	G	31.8	Very low	32.1	Very low	75 Å²	75	105.3 Å²	105.3	77%	0.773	84%	0.839	S	S	*	*			trans	179.4	55	-172.3	0	0	0	0	0	119
392	L	32.2	Very low	32	Very low	138 Å²	138	105.1 Å²	105.1	72%	0.723	84%	0.837	S	S	*	*			trans	23.6	129.4	136.1	-62.9	171.8	0	0	0	122.9
393	Y	32.7	Very low	31.9	Very low	205 Å²	205	108.6 Å²	108.6	80%	0.804	84%	0.84	S	S	*	*			trans	79.2	137.1	143	-60	-47.5	0	0	0	124.1
394	R	31.3	Very low	31.8	Very low	254 Å²	254	108.6 Å²	108.6	96%	0.958	84%	0.841	S	S	*	*			trans	62.2	143.4	155.9	-72	179.3	171.7	-173.8	-3.1	118.7
395	G	29.7	Very low	31.5	Very low	78 Å²	78	105.8 Å²	105.8	80%	0.804	83%	0.832	S	S	*	*			cis	145.2	128.3	-13.6	0	0	0	0	0	115.2
396	G	30.2	Very low	31.9	Very low	89 Å²	89	108.9 Å²	108.9	92%	0.918	84%	0.839	S	S	*	*			trans	88.4	135.6	165.6	0	0	0	0	0	116.2
397	G	28.3	Very low	31.6	Very low	82 Å²	82	108.7 Å²	108.7	85%	0.845	84%	0.837	S	S	*	*			trans	151.3	92.3	171.3	0	0	0	0	0	115.5
398	G	29.1	Very low	31.4	Very low	74 Å²	74	111.1 Å²	111.1	76%	0.763	84%	0.841	S	S	*	*			trans	-90.4	-170.7	145.3	0	0	0	0	0	110
399	P	43.6	Very low	31.2	Very low	125 Å²	125	111.7 Å²	111.7	81%	0.812	84%	0.837	S	S	*	*			cis	-142.2	-171	19.1	43.4	-24.8	0	0	0	116.2
400	A	31.5	Very low	30.8	Very low	83 Å²	83	111.6 Å²	111.6	69%	0.686	84%	0.837	S	S	*	*			trans	74.8	108.8	145.1	0	0	0	0	0	121.8
401	S	33	Very low	30.6	Very low	129 Å²	129	111.6 Å²	111.6	90%	0.902	84%	0.837	S	S	*	*				63.2	112.9	123.2	-53	0	0	0	0	121.6
402	G	28.3	Very low	30.3	Very low	81 Å²	81	111 Å²	111	84%	0.835	83%	0.831	S	S	*	*			trans	-144.6	128.8	153.8	0	0	0	0	0	110
403	V	30	Very low	29.9	Very low	159 Å²	159	115.3 Å²	115.3	96%	0.964	84%	0.839	S	S	*	*			trans	-96.7	134.4	-176.9	176.7	0	0	0	0	110
404	G	27.2	Very low	29.6	Very low	81 Å²	81	115.8 Å²	115.8	84%	0.835	84%	0.841	S	S	*	*			trans	-172	109.9	176.3	0	0	0	0	0	114.8
405	G	27.2	Very low	29.4	Very low	72 Å²	72	111.4 Å²	111.4	74%	0.742	83%	0.832	S	S	*	*			trans	-147.7	179.7	158	0	0	0	0	0	108.2
406	P	42.6	Very low	29.1	Very low	141 Å²	141	111 Å²	111	92%	0.916	83%	0.828	S	S	*	*			cis	-115.9	178.3	3.4	40.9	-30	0	0	0	113
407	G	25.8	Very low	28.8	Very low	83 Å²	83	117 Å²	117	86%	0.856	83%	0.828	S	S	*	*			trans	-165	120.2	168.3	0	0	0	0	0	111.6
408	S	29.3	Very low	28.6	Very low	131 Å²	131	117.4 Å²	117.4	92%	0.916	82%	0.819	S	S	*	*			trans	-115.5	124.2	177.6	-175.7	0	0	0	0	110
409	A	27.2	Very low	28.4	Very low	96 Å²	96	119.6 Å²	119.6	79%	0.793	82%	0.822	S	S	*	*			trans	-157	158	172.1	0	0	0	0	0	109.3
410	G	25.2	Very low	27.5	Very low	80 Å²	80	124.1 Å²	124.1	83%	0.825	83%	0.825	S	S	*	*			trans	-64.4	160.9	178.8	0	0	0	0	0	113.2
411	G	27.1	Very low	27.1	Very low	88 Å²	88	126 Å²	126	91%	0.907	83%	0.833	S	S	*	*			cis	98.7	86.9	17.9	0	0	0	0	0	109.8
412	G	25.1	Very low	26.7	Very low	63 Å²	63	130.8 Å²	130.8	65%	0.649	83%	0.833	S	S	*	*			trans	-162.7	121.8	-176.7	0	0	0	0	0	112.6
413	Y	24.6	Very low	26.5	Very low	228 Å²	228	129.9 Å²	129.9	89%	0.894	82%	0.823	S	S	*	*			trans	30.4	114.7	151.4	-53.6	-84.7	0	0	0	119.6
414	Y	24.5	Very low	26.3	Very low	215 Å²	215	126.1 Å²	126.1	84%	0.843	82%	0.817	S	S	*	*				-150.3	163.9	107.8	-127.9	-89.5	0	0	0	111.9
415	Q	27.2	Very low	26.2	Very low	162 Å²	162	127.2 Å²	127.2	76%	0.757	82%	0.818	S	S	*	*			trans	-68.9	157.8	179.5	-64.9	150	-45.7	0	0	111.7
416	G	23.4	Very low	26.1	Very low	70 Å²	70	128.5 Å²	128.5	72%	0.722	82%	0.822	S	S	*	*			cis	110.4	71	7.6	0	0	0	0	0	112.2
417	F	24.9	Very low	25.2	Very low	213 Å²	213	125.9 Å²	125.9	93%	0.934	82%	0.82	S	S	*	*			trans	-115	119.7	167.9	-101	-81.8	0	0	0	109.5
418	S	24.5	Very low	25.1	Very low	92 Å²	92	125 Å²	125	64%	0.643	81%	0.811	S	S	*	*			trans	-91.5	136.6	170.8	-61.9	0	0	0	0	109.9
419	S	24.6	Very low	24.8	Very low	120 Å²	120	129.3 Å²	129.3	84%	0.839	81%	0.814	S	S	*	*			trans	-113.8	143.1	151.2	49.1	0	0	0	0	107.4
420	Y	25.3	Very low	24.6	Very low	219 Å²	219	130.5 Å²	130.5	86%	0.859	82%	0.817	S	S	*	*			trans	-92.8	143.5	-155.2	-64	-99	0	0	0	112.1
421	S	22.6	Very low	24.5	Very low	122 Å²	122	131.8 Å²	131.8	85%	0.853	81%	0.813	S	S	*	*			trans	-133.6	129.8	166.2	-179.1	0	0	0	0	107.7
422	Y	24.1	Very low	24.5	Very low	230 Å²	230	132.2 Å²	132.2	90%	0.902	81%	0.808	S	S	*	*			trans	-119.1	111.5	-174.9	-148.3	-82.3	0	0	0	109.4
423	G	24.1	Very low	24.5	Very low	62 Å²	62	138.2 Å²	138.2	64%	0.639	81%	0.812	S	S	*	*			trans	-93.7	163.7	160	0	0	0	0	0	109.9
424	G	25.8	Very low	24.6	Very low	81 Å²	81	133.4 Å²	133.4	84%	0.835	81%	0.812	S	S	*	*			cis	139.5	107.8	1	0	0	0	0	0	111.5
425	A	25	Very low	24.6	Very low	104 Å²	104	128.4 Å²	128.4	86%	0.86	82%	0.815	S	S	*	*			trans	-166.6	168.1	176.8	0	0	0	0	0	109.6
426	A	24.9	Very low	24.5	Very low	98 Å²	98	124.1 Å²	124.1	81%	0.81	82%	0.815	S	S	*	*			cis	-166.1	137.4	-40.5	0	0	0	0	0	108.6
427	G	24.2	Very low	24.7	Very low	86 Å²	86	129.3 Å²	129.3	89%	0.887	83%	0.825	S	S	*	*			trans	81.7	151.5	175.6	0	0	0	0	0	115.3
428	G	23.7	Very low	24.7	Very low	65 Å²	65	122.8 Å²	122.8	67%	0.67	82%	0.818	S	S	*	*			cis	140.8	73.8	-17.6	0	0	0	0	0	116.5
429	F	22.1	Very low	24.7	Very low	221 Å²	221	122.2 Å²	122.2	97%	0.969	83%	0.826	S	S	*	*			trans	-134.6	160.3	157.3	-84.7	-71.4	0	0	0	111.1
430	S	24.4	Very low	24.7	Very low	122 Å²	122	120.6 Å²	120.6	85%	0.853	83%	0.829	S	S	*	*			trans	-110.5	143	-171.9	-56	0	0	0	0	111.1
431	S	23.3	Very low	24.7	Very low	107 Å²	107	114 Å²	114	75%	0.748	83%	0.827	S	S	*	*			trans	-143.3	149.4	140.7	-169	0	0	0	0	109
432	A	26.5	Very low	24.8	Very low	96 Å²	96	112 Å²	112	79%	0.793	83%	0.826	S	S	*	*			trans	-144.9	126	-179	0	0	0	0	0	109.3
433	Y	25.1	Very low	25	Very low	190 Å²	190	108 Å²	108	75%	0.745	83%	0.826	S	S	*	*			trans	-140.2	137.1	164.3	36.2	-92.2	0	0	0	109.9
434	S	25.9	Very low	25.2	Very low	126 Å²	126	114.5 Å²	114.5	88%	0.881	84%	0.837	S	S	*	*			trans	-107.8	120.8	172.2	-62.5	0	0	0	0	108.2
435	A	25.1	Very low	25.1	Very low	110 Å²	110	120.1 Å²	120.1	91%	0.909	84%	0.84	S	S	*	*			trans	-88.4	120.6	164.3	0	0	0	0	0	108.4
436	G	25.9	Very low	25.1	Very low	73 Å²	73	119.9 Å²	119.9	75%	0.753	84%	0.838	S	S	*	*			trans	-113.8	119.1	-170.5	0	0	0	0	0	114.2
437	L	26.4	Very low	25.2	Very low	178 Å²	178	123.5 Å²	123.5	93%	0.932	84%	0.843	S	S	*	*			trans	-138	138.4	156	-67.4	170.6	0	0	0	105.1
438	G	24.7	Very low	25.2	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	84%	0.844	S	S	*	*			cis	94.5	104.1	26	0	0	0	0	0	109
439	G	25	Very low	25.3	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	85%	0.852	S	S	*	*			cis	175.2	169.9	-4.4	0	0	0	0	0	111.5
440	G	24.4	Very low	25.6	Very low	87 Å²	87	130 Å²	130	90%	0.897	85%	0.849	S	S	*	*			trans	84.7	156.1	-179.7	0	0	0	0	0	114.2
441	G	25.9	Very low	25.8	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	85%	0.847	S	S	*	*			cis	-154	149.8	-5.5	0	0	0	0	0	110.8
442	G	25.5	Very low	26.1	Very low	82 Å²	82	127.7 Å²	127.7	85%	0.845	84%	0.844	S	S	*	*			trans	-110.3	120.9	-178.9	0	0	0	0	0	112.2
443	T	26.6	Very low	26.3	Very low	146 Å²	146	130.9 Å²	130.9	90%	0.896	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-91.8	123.4	178	-15	0	0	0	0	110.7
444	K	28.2	Very low	26.4	Very low	198 Å²	198	129.3 Å²	129.3	86%	0.861	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-96.7	144.6	168.1	-77.7	-177.4	173.2	-179.3	0	110.1
445	H	24.6	Very low	27	Very low	198 Å²	198	128.5 Å²	128.5	92%	0.917	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-65.9	140.6	161.8	-71.7	-99.8	0	0	0	110.5
446	A	24.9	Very low	27.2	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	84%	0.84	S	S	*	*			trans	-142.3	151.7	161.3	0	0	0	0	0	108.4
447	L	27	Very low	27.6	Very low	174 Å²	174	130.6 Å²	130.6	91%	0.911	84%	0.843	S	S	*	*			trans	-98.7	167.9	-174.9	-77	163.7	0	0	0	112.2
448	Q	24.1	Very low	27.8	Very low	194 Å²	194	129.1 Å²	129.1	91%	0.907	84%	0.836	S	S	*	*			trans	-67.4	149.2	-175	-63.3	163	-54.8	0	0	114.1
449	S	26.3	Very low	28.2	Very low	120 Å²	120	130.1 Å²	130.1	84%	0.839	83%	0.831	S	S	*	*			trans	-151.7	145	147.4	58.6	0	0	0	0	109
450	E	27.3	Very low	28.3	Very low	195 Å²	195	133.6 Å²	133.6	91%	0.911	83%	0.831	S	S	*	*			trans	-87	152	-170.9	-54.4	174.8	121	0	0	113.7
451	A	28.8	Very low	29.9	Very low	96 Å²	96	134.2 Å²	134.2	79%	0.793	82%	0.819	S	S	*	*				154.6	145.5	116.2	0	0	0	0	0	115.5
452	A	30.6	Very low	30.1	Very low	85 Å²	85	137 Å²	137	70%	0.702	82%	0.816	S	S	*	*			trans	67.7	109.8	153.3	0	0	0	0	0	122.2
453	D	29.9	Very low	30.4	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	81%	0.811	S	S	*	*				35.8	123.7	123.6	-44.6	-15.9	0	0	0	121.8
454	D	28.4	Very low	30.4	Very low	157 Å²	157	139.5 Å²	139.5	84%	0.84	80%	0.804	S	S	*	*				-169.7	-164.3	94.1	-154.5	-13.5	0	0	0	110.8
455	S	36.8	Very low	31.3	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	80%	0.797	S	S	*	*			trans	-138.5	170.1	-145.9	57.7	0	0	0	0	118.2
456	G	30.6	Very low	31.4	Very low	74 Å²	74	130 Å²	130	76%	0.763	79%	0.788	S	S	*	*			trans	103.7	120.2	173.7	0	0	0	0	0	114.6
457	D	33.9	Very low	31.8	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	79%	0.79	S	S	*	*			cis	109	156.3	11.9	-152.5	13.4	0	0	0	115.1
458	D	31.5	Very low	31.7	Very low	146 Å²	146	126.5 Å²	126.5	78%	0.781	78%	0.783	S	S	*	*			trans	67.7	151.5	-175.7	-70.2	-49.6	0	0	0	118.7
459	S	32.9	Very low	31.9	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	78%	0.777	S	S	*	*			cis	-174.2	130.8	-42.6	-116.9	0	0	0	0	112.8
460	D	26.1	Very low	31.8	Very low	153 Å²	153	122.3 Å²	122.3	82%	0.818	78%	0.775	S	S	*	*			trans	23.8	167.4	138.4	-82.4	-8.5	0	0	0	124.5
461	P	57.7	Low	31.7	Very low	100 Å²	100	119.9 Å²	119.9	65%	0.649	77%	0.767	S	S	*	*			cis	-143	-141.2	-32.8	41.7	-20.6	0	0	0	112.9
462	D	31.4	Very low	31.5	Very low	138 Å²	138	126 Å²	126	74%	0.738	77%	0.77	S	S	*	*			trans	79.9	138.8	159.1	-79.6	-5.2	0	0	0	120.6
463	N	30.9	Very low	31.1	Very low	138 Å²	138	126 Å²	126	74%	0.738	78%	0.778	S	S	*	*			cis	-158.5	168.6	-15.8	-144.8	-54.5	0	0	0	112.4
464	D	26.7	Very low	30.9	Very low	142 Å²	142	123.4 Å²	123.4	76%	0.759	77%	0.773	S	S	*	*			trans	-88.1	-156.4	176.9	-133.7	-10.5	0	0	0	110.1
465	P	46.9	Very low	30.6	Very low	111 Å²	111	120.6 Å²	120.6	72%	0.721	77%	0.771	S	S	*	*			cis	-116.5	-153.8	-8.3	45.3	-29.4	0	0	0	110.8
466	A	27.1	Very low	30.1	Very low	86 Å²	86	124.5 Å²	124.5	71%	0.711	78%	0.777	S	S	*	*			cis	-166.3	173.4	9.5	0	0	0	0	0	106.8
467	S	32	Very low	30.2	Very low	124 Å²	124	126.9 Å²	126.9	87%	0.867	78%	0.782	S	S	*	*			cis	-176.8	178.1	-17.5	-91	0	0	0	0	105
468	G	26.8	Very low	29.7	Very low	74 Å²	74	123.3 Å²	123.3	76%	0.763	78%	0.782	S	S	*	*			cis	159.7	169.2	7.2	0	0	0	0	0	107.1
469	A	26.8	Very low	29.3	Very low	94 Å²	94	119.8 Å²	119.8	78%	0.777	78%	0.78	S	S	*	*			cis	-167.5	-164.6	-0.4	0	0	0	0	0	110.5
470	V	25.3	Very low	29.1	Very low	133 Å²	133	121.6 Å²	121.6	81%	0.806	79%	0.793	S	S	*	*			trans	93.6	123.1	162.4	-172.9	0	0	0	0	116.8
471	L	24.3	Very low	29.2	Very low	143 Å²	143	117.4 Å²	117.4	75%	0.749	78%	0.779	S	S	*	*			cis	-156	124.2	-23.2	-116.6	-175.9	0	0	0	112.1
472	R	25	Very low	28	Very low	225 Å²	225	122.3 Å²	122.3	85%	0.849	79%	0.793	S	S	*	*			trans	19.6	128.5	148.6	-67.1	178.8	170.8	-177.2	-3.9	122.7
473	G	23.3	Very low	27.7	Very low	85 Å²	85	120.2 Å²	120.2	88%	0.876	79%	0.789	S	S	*	*				-140.9	123.8	129.9	0	0	0	0	0	108.3
474	S	24.7	Very low	27.8	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	79%	0.793	S	S	*	*			trans	-131.6	129.3	-153.4	57.4	0	0	0	0	116.4
475	A	22.6	Very low	27.9	Very low	97 Å²	97	118.5 Å²	118.5	80%	0.802	79%	0.793	S	S	*	*			trans	-153.1	110.2	155.6	0	0	0	0	0	112.4
476	Q	26	Very low	27.5	Very low	193 Å²	193	118.1 Å²	118.1	90%	0.902	79%	0.79	S	S	*	*			trans	28.4	130.6	150.3	-69.5	170.3	-35.8	0	0	122.7
477	S	32.9	Very low	28.4	Very low	124 Å²	124	119.4 Å²	119.4	87%	0.867	80%	0.795	S	S	*	*			trans	-69	148.7	153.4	52.8	0	0	0	0	112.7
478	G	22.5	Very low	29.2	Very low	78 Å²	78	117.7 Å²	117.7	80%	0.804	78%	0.779	S	S	*	*			trans	-178.5	145.9	163.7	0	0	0	0	0	115.2
479	G	24.4	Very low	30.7	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	77%	0.772	S	S	*	*			trans	83.2	108.4	153.1	0	0	0	0	0	118.1	A481	G479-A481 PolarHBondContact O-N 2.82Å
480	S	28.6	Very low	32.4	Very low	136 Å²	136	120.1 Å²	120.1	95%	0.951	77%	0.767	S	S	*	*			trans	-71.5	77.2	142.7	56.6	0	0	0	0	109.1
481	A	26.7	Very low	34.5	Very low	64 Å²	64	119.6 Å²	119.6	53%	0.529	76%	0.759	S	S	.	*			trans	-107.7	145.9	171.8	0	0	0	0	0	107.1	G479	G479-A481 PolarHBondContact O-N 2.82Å
482	Q	33	Very low	37	Very low	204 Å²	204	119.3 Å²	119.3	95%	0.953	75%	0.754	S	S	*	*			cis	47.1	34	21.8	-72.5	-161	-9.7	0	0	113.8
483	S	24.6	Very low	39.2	Very low	94 Å²	94	111.2 Å²	111.2	66%	0.657	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-85	130.3	145.3	53.6	0	0	0	0	106.7	A485	S483-A485 PolarHBondContact O-N 3.47Å
484	D	34.4	Very low	42	Very low	151 Å²	151	112.3 Å²	112.3	81%	0.807	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-49.8	131.7	164.8	-60	-81.9	0	0	0	109.4	P486	D484-P486 WeakPolarHBondContact O-CD 3.41Å
485	A	27.6	Very low	44.7	Very low	93 Å²	93	113.6 Å²	113.6	77%	0.769	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-63.4	117.8	156.9	0	0	0	0	0	105.5	S483 S487	S483-A485 PolarHBondContact O-N 3.47Å; A485-S487 PolarHBondContact O-N 2.99Å
486	P	39.8	Very low	47.4	Very low	102 Å²	102	111.6 Å²	111.6	66%	0.662	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-58.7	138.1	177.1	25.8	-33.4	0	0	0	107.9	D484 V488	D484-P486 WeakPolarHBondContact O-CD 3.41Å; P486-V488 HydrophobicContact CG-CG2 4.36Å; P486-V488 PolarHBondContact O-N 3.32Å
487	S	45.7	Very low	49.9	Very low	114 Å²	114	104.5 Å²	104.5	80%	0.797	67%	0.665	S	S	*	*			trans	-66.9	84.2	166.9	54.7	0	0	0	0	107.8	A485 D489	A485-S487 PolarHBondContact O-N 2.99Å; S487-D489 PolarHBondContact O-N 2.93Å; S487-D489 VanDerWaalsContact O-N 3.08Å
488	V	48.8	Very low	52.2	Low	88 Å²	88	101.9 Å²	101.9	53%	0.533	64%	0.644	S	S	.	*			trans	-58	114.9	175.7	-179.9	0	0	0	0	106.8	P486 A493	P486-V488 HydrophobicContact CG-CG2 4.36Å; P486-V488 PolarHBondContact O-N 3.32Å; V488-A493 HydrophobicContact CG1-CB 4.21Å
489	D	57.3	Low	55.1	Low	115 Å²	115	105.8 Å²	105.8	62%	0.615	63%	0.634	S	S	*	*			trans	-57.5	131	179.2	-87.8	-51.7	0	0	0	108.7	S487 D491 E492 A493	S487-D489 PolarHBondContact O-N 2.93Å; S487-D489 VanDerWaalsContact O-N 3.08Å; D489-D491 PolarHBondContact O-N 3.5Å; D489-E492 PolarHBondContact O-N 3.25Å; D489-A493 PolarHBondContact O-N 3.1Å
490	P	63	Low	57.8	Low	104 Å²	104	109.4 Å²	109.4	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-54.3	-30.4	-175.1	-29.7	35.9	0	0	0	113.8	L494	P490-L494 WeakPolarHBondContact O-CB 3.45Å; P490-L494 PolarHBondContact O-N 3.12Å
491	D	70.2	Confident	60.5	Low	122 Å²	122	107.4 Å²	107.4	65%	0.652	60%	0.601	S	S	*	*	H	α-helix	trans	-67.7	-34.1	176.3	-70.1	-21.7	0	0	0	113	D489 L494 M495	D489-D491 PolarHBondContact O-N 3.5Å; D491-L494 PolarHBondContact O-N 3.11Å; D491-M495 VanDerWaalsContact O-CB 3.32Å; D491-M495 WeakPolarHBondContact O-CB 3.36Å; D491-M495 WeakPolarHBondContact O-CG 3.49Å; D491-M495 PolarHBondContact O-N 3.28Å
492	E	75.1	Confident	63.2	Low	137 Å²	137	110 Å²	110	64%	0.64	61%	0.606	S	S	*	*	H	α-helix	trans	-73.9	-39.1	178.2	-172.2	164.9	-143.2	0	0	111.3	D489 L494 M495 E496	D489-E492 PolarHBondContact O-N 3.25Å; E492-L494 VanDerWaalsContact C-N 3.33Å; E492-L494 PolarHBondContact O-N 3.09Å; E492-M495 PolarHBondContact O-N 2.87Å; E492-E496 PolarHBondContact O-N 3.46Å
493	A	72.9	Confident	65.6	Low	55 Å²	55	103.6 Å²	103.6	46%	0.455	58%	0.578	S	S	.	*	H	α-helix	trans	-61.8	-40.5	171.1	0	0	0	0	0	112	V488 D489 A497	V488-A493 HydrophobicContact CG1-CB 4.21Å; D489-A493 PolarHBondContact O-N 3.1Å; A493-A497 WeakPolarHBondContact O-CB 3.36Å; A493-A497 PolarHBondContact O-N 3.33Å
494	L	80.6	Confident	68.3	Low	107 Å²	107	99.5 Å²	99.5	56%	0.56	55%	0.55	S	S	*	.	H	α-helix	trans	-68	-39.1	176.3	-177.6	62.1	0	0	0	112.5	P490 D491 E492 T498	P490-L494 WeakPolarHBondContact O-CB 3.45Å; P490-L494 PolarHBondContact O-N 3.12Å; D491-L494 PolarHBondContact O-N 3.11Å; E492-L494 VanDerWaalsContact C-N 3.33Å; E492-L494 PolarHBondContact O-N 3.09Å; L494-T498 PolarHBondContact O-N 2.92Å; L494-T498 PolarHBondContact O-OG1 3.07Å
495	M	81.7	Confident	70.8	Confident	136 Å²	136	97.3 Å²	97.3	67%	0.67	54%	0.537	S	S	*	.	H	α-helix	trans	-63.8	-44.5	174.6	-77	-91.8	-79.1	0	0	111.9	D491 E492 T498 R499	D491-M495 VanDerWaalsContact O-CB 3.32Å; D491-M495 WeakPolarHBondContact O-CB 3.36Å; D491-M495 WeakPolarHBondContact O-CG 3.49Å; D491-M495 PolarHBondContact O-N 3.28Å; E492-M495 PolarHBondContact O-N 2.87Å; M495-T498 WeakPolarHBondContact CA-OG1 3.33Å; M495-T498 PolarHBondContact O-N 3.45Å; M495-T498 PolarHBondContact O-OG1 3.2Å; M495-T498 VanDerWaalsContact O-OG1 3.05Å; M495-R499 VanDerWaalsContact O-CB 3.31Å; M495-R499 WeakPolarHBondContact O-CB 3.32Å; M495-R499 PolarHBondContact O-N 3.47Å
496	E	79.4	Confident	73.6	Confident	54 Å²	54	99.2 Å²	99.2	25%	0.252	53%	0.529	S	S	.	.	H	α-helix	trans	-69.5	-37.2	177.4	174.5	59.5	-175.4	0	0	112.2	E492 R499 R500	E492-E496 PolarHBondContact O-N 3.46Å; E496-R499 VanDerWaalsContact CD-NH2 3.34Å; E496-R499 PolarHBondContact O-N 3.37Å; E496-R499 IonicContact OE1-NH2 3.16Å; E496-R499 PolarHBondContact OE1-NH2 3.02Å; E496-R499 VanDerWaalsContact OE1-NH2 3.16Å; E496-R499 IonicContact OE2-CZ 2.75Å; E496-R499 IonicContact OE2-NE 2.62Å; E496-R499 PolarHBondContact OE2-NE 3.02Å; E496-R499 IonicContact OE2-NH2 2.73Å; E496-R499 PolarHBondContact OE2-NH2 3.38Å; E496-R500 VanDerWaalsContact CG-NH2 3.28Å; E496-R500 WeakPolarHBondContact O-CG 3.46Å; E496-R500 PolarHBondContact O-N 2.95Å; E496-R500 IonicContact OE1-CZ 3.16Å; E496-R500 IonicContact OE1-NE 3.2Å; E496-R500 PolarHBondContact OE1-NE 2.58Å; E496-R500 IonicContact OE1-NH2 2.74Å; E496-R500 PolarHBondContact OE1-NH2 3.46Å
497	A	78.2	Confident	75.6	Confident	45 Å²	45	100.1 Å²	100.1	37%	0.372	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-47.8	173.1	0	0	0	0	0	112	A493 R499 R500 Q501	A493-A497 WeakPolarHBondContact O-CB 3.36Å; A493-A497 PolarHBondContact O-N 3.33Å; A497-R499 VanDerWaalsContact C-N 3.33Å; A497-R499 PolarHBondContact O-N 2.97Å; A497-R500 PolarHBondContact O-N 3.05Å; A497-Q501 PolarHBondContact O-N 3.29Å
498	T	81.9	Confident	77.4	Confident	69 Å²	69	99.1 Å²	99.1	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-65.7	-34	176.8	47.1	0	0	0	0	112.6	L494 M495 Q501 L502	L494-T498 PolarHBondContact O-N 2.92Å; L494-T498 PolarHBondContact O-OG1 3.07Å; M495-T498 WeakPolarHBondContact CA-OG1 3.33Å; M495-T498 PolarHBondContact O-N 3.45Å; M495-T498 PolarHBondContact O-OG1 3.2Å; M495-T498 VanDerWaalsContact O-OG1 3.05Å; T498-Q501 PolarHBondContact O-N 3.1Å; T498-L502 WeakPolarHBondContact O-CG 3.37Å; T498-L502 PolarHBondContact O-N 2.76Å
499	R	83.6	Confident	79.3	Confident	160 Å²	160	99.2 Å²	99.2	60%	0.604	50%	0.503	S	S	*	.	H	α-helix	trans	-62.1	-41.6	172.7	-166.6	175.9	72.5	102.4	2.9	112.3	M495 E496 A497 L502 D503	M495-R499 VanDerWaalsContact O-CB 3.31Å; M495-R499 WeakPolarHBondContact O-CB 3.32Å; M495-R499 PolarHBondContact O-N 3.47Å; E496-R499 VanDerWaalsContact CD-NH2 3.34Å; E496-R499 PolarHBondContact O-N 3.37Å; E496-R499 IonicContact OE1-NH2 3.16Å; E496-R499 PolarHBondContact OE1-NH2 3.02Å; E496-R499 VanDerWaalsContact OE1-NH2 3.16Å; E496-R499 IonicContact OE2-CZ 2.75Å; E496-R499 IonicContact OE2-NE 2.62Å; E496-R499 PolarHBondContact OE2-NE 3.02Å; E496-R499 IonicContact OE2-NH2 2.73Å; E496-R499 PolarHBondContact OE2-NH2 3.38Å; A497-R499 VanDerWaalsContact C-N 3.33Å; A497-R499 PolarHBondContact O-N 2.97Å; R499-L502 PolarHBondContact O-N 3.13Å; R499-D503 PolarHBondContact O-N 3.32Å
500	R	80.8	Confident	80.8	Confident	147 Å²	147	98.7 Å²	98.7	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-65.4	-42.3	174.5	-68.6	168.5	-169.7	178.4	4.8	112	E496 A497 L502 D503 A504	E496-R500 VanDerWaalsContact CG-NH2 3.28Å; E496-R500 WeakPolarHBondContact O-CG 3.46Å; E496-R500 PolarHBondContact O-N 2.95Å; E496-R500 IonicContact OE1-CZ 3.16Å; E496-R500 IonicContact OE1-NE 3.2Å; E496-R500 PolarHBondContact OE1-NE 2.58Å; E496-R500 IonicContact OE1-NH2 2.74Å; E496-R500 PolarHBondContact OE1-NH2 3.46Å; A497-R500 PolarHBondContact O-N 3.05Å; R500-L502 VanDerWaalsContact C-N 3.31Å; R500-L502 PolarHBondContact O-N 3.23Å; R500-D503 PolarHBondContact O-N 3.5Å; R500-A504 WeakPolarHBondContact O-CB 3.37Å; R500-A504 PolarHBondContact O-N 3.39Å
501	Q	84.4	Confident	81.7	Confident	94 Å²	94	97.3 Å²	97.3	44%	0.439	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-40.3	174.7	-124.5	72.4	-4.6	0	0	112.2	A497 T498 L505	A497-Q501 PolarHBondContact O-N 3.29Å; T498-Q501 PolarHBondContact O-N 3.1Å; Q501-L505 WeakPolarHBondContact O-CB 3.45Å; Q501-L505 PolarHBondContact O-N 3.45Å
502	L	83.8	Confident	82.1	Confident	120 Å²	120	94.2 Å²	94.2	63%	0.628	49%	0.49	S	S	*	.	H	α-helix	trans	-71.2	-41	178.5	-75.2	166.3	0	0	0	112.9	T498 R499 R500 L505 F506	T498-L502 WeakPolarHBondContact O-CG 3.37Å; T498-L502 PolarHBondContact O-N 2.76Å; R499-L502 PolarHBondContact O-N 3.13Å; R500-L502 VanDerWaalsContact C-N 3.31Å; R500-L502 PolarHBondContact O-N 3.23Å; L502-L505 PolarHBondContact O-N 2.86Å; L502-F506 WeakPolarHBondContact O-CB 3.45Å; L502-F506 PolarHBondContact O-N 3.03Å
503	D	83.3	Confident	82.3	Confident	69 Å²	69	90.8 Å²	90.8	37%	0.369	48%	0.476	S	S	.	.	H	α-helix	trans	-65	-39.8	175.4	-172.5	56.8	0	0	0	111.6	R499 R500 F506 R507	R499-D503 PolarHBondContact O-N 3.32Å; R500-D503 PolarHBondContact O-N 3.5Å; D503-F506 PolarHBondContact O-N 3.4Å; D503-R507 VanDerWaalsContact O-CG 3.32Å; D503-R507 WeakPolarHBondContact O-CG 3.37Å; D503-R507 PolarHBondContact O-N 3.49Å; D503-R507 IonicContact OD1-NE 3.76Å; D503-R507 IonicContact OD2-CZ 3.17Å; D503-R507 IonicContact OD2-NE 2.8Å; D503-R507 PolarHBondContact OD2-NE 2.88Å; D503-R507 IonicContact OD2-NH2 2.71Å; D503-R507 PolarHBondContact OD2-NH2 3.18Å
504	A	82.5	Confident	82.4	Confident	8 Å²	8	91.6 Å²	91.6	7%	0.066	48%	0.478	C	S	.	.	H	α-helix	trans	-58.6	-47.8	170.6	0	0	0	0	0	112.9	R500 F506 R507 Y508 Y516 P520	R500-A504 WeakPolarHBondContact O-CB 3.37Å; R500-A504 PolarHBondContact O-N 3.39Å; A504-F506 VanDerWaalsContact C-N 3.31Å; A504-F506 PolarHBondContact O-N 2.76Å; A504-R507 PolarHBondContact O-N 3.3Å; A504-Y508 WeakPolarHBondContact O-CB 3.43Å; A504-Y508 PolarHBondContact O-N 2.72Å; A504-Y516 WeakPolarHBondContact CB-O 3.25Å; A504-P520 HydrophobicContact CB-CG 3.37Å
505	L	86.3	Confident	81.9	Confident	105 Å²	105	86.7 Å²	86.7	55%	0.55	45%	0.453	S	S	.	.	H	α-helix	trans	-64.2	-36.3	177.3	-141.9	91.4	0	0	0	112.1	Q501 L502 S509 L517	Q501-L505 WeakPolarHBondContact O-CB 3.45Å; Q501-L505 PolarHBondContact O-N 3.45Å; L502-L505 PolarHBondContact O-N 2.86Å; L505-S509 PolarHBondContact O-N 2.79Å; L505-S509 PolarHBondContact O-OG 3.47Å; L505-L517 HydrophobicContact CD1-CD2 3.78Å; L505-L517 HydrophobicContact CG-CD2 4.41Å
506	F	86.3	Confident	81.6	Confident	133 Å²	133	83.4 Å²	83.4	58%	0.583	43%	0.434	S	S	*	.	H	α-helix	trans	-66.6	-50.3	175.9	179	-105.1	0	0	0	111.1	L502 D503 A504 Y508 S509 V510	L502-F506 WeakPolarHBondContact O-CB 3.45Å; L502-F506 PolarHBondContact O-N 3.03Å; D503-F506 PolarHBondContact O-N 3.4Å; A504-F506 VanDerWaalsContact C-N 3.31Å; A504-F506 PolarHBondContact O-N 2.76Å; F506-Y508 VanDerWaalsContact C-N 3.32Å; F506-Y508 PolarHBondContact O-N 2.72Å; F506-S509 PolarHBondContact O-N 2.71Å; F506-S509 VanDerWaalsContact O-N 3.1Å; F506-S509 PolarHBondContact O-OG 2.81Å; F506-V510 HydrophobicContact CE1-CG2 4.32Å; F506-V510 HydrophobicContact CE2-CG2 4.27Å; F506-V510 HydrophobicContact CZ-CG2 4.08Å; F506-V510 WeakPolarHBondContact O-CG2 3.3Å; F506-V510 PolarHBondContact O-N 3.1Å; F506-V510 VanDerWaalsContact O-N 3.12Å
507	R	81.2	Confident	81.4	Confident	120 Å²	120	83.5 Å²	83.5	45%	0.453	44%	0.436	S	S	.	.	H	α-helix	trans	-57.9	-43	175.3	-69.3	176.6	-162.8	-139.4	9.7	112	D503 A504 S509 V510 T511 Y516	D503-R507 VanDerWaalsContact O-CG 3.32Å; D503-R507 WeakPolarHBondContact O-CG 3.37Å; D503-R507 PolarHBondContact O-N 3.49Å; D503-R507 IonicContact OD1-NE 3.76Å; D503-R507 IonicContact OD2-CZ 3.17Å; D503-R507 IonicContact OD2-NE 2.8Å; D503-R507 PolarHBondContact OD2-NE 2.88Å; D503-R507 IonicContact OD2-NH2 2.71Å; D503-R507 PolarHBondContact OD2-NH2 3.18Å; A504-R507 PolarHBondContact O-N 3.3Å; R507-S509 PolarHBondContact O-N 2.82Å; R507-V510 PolarHBondContact O-N 2.76Å; R507-T511 WeakPolarHBondContact O-CB 3.23Å; R507-T511 WeakPolarHBondContact O-CG2 3.46Å; R507-T511 PolarHBondContact O-N 3.15Å; R507-T511 PolarHBondContact O-OG1 2.94Å; R507-Y516 HydrophobicContact CB-CD1 3.68Å; R507-Y516 HydrophobicContact CB-CE1 4.28Å; R507-Y516 HydrophobicContact CB-CG 3.82Å; R507-Y516 HydrophobicContact CG-CD1 4.25Å
508	Y	84.9	Confident	81.1	Confident	94 Å²	94	84.3 Å²	84.3	37%	0.369	43%	0.433	S	S	.	.	H	α-helix	trans	-58.2	-46.2	173.5	172.4	-110.6	0	0	0	112.3	A504 F506 V510 T511 G512 D513 L517	A504-Y508 WeakPolarHBondContact O-CB 3.43Å; A504-Y508 PolarHBondContact O-N 2.72Å; F506-Y508 VanDerWaalsContact C-N 3.32Å; F506-Y508 PolarHBondContact O-N 2.72Å; Y508-V510 PolarHBondContact O-N 3.34Å; Y508-T511 PolarHBondContact O-N 2.95Å; Y508-G512 WeakPolarHBondContact O-CA 3.46Å; Y508-G512 PolarHBondContact O-N 3.01Å; Y508-D513 WeakPolarHBondContact CD2-O 3.18Å; Y508-L517 HydrophobicContact CD1-CD1 3.83Å; Y508-L517 HydrophobicContact CD1-CD2 3.83Å; Y508-L517 HydrophobicContact CD1-CG 4.03Å; Y508-L517 HydrophobicContact CD2-CD1 3.89Å; Y508-L517 HydrophobicContact CD2-CD2 4.45Å; Y508-L517 HydrophobicContact CD2-CG 3.88Å; Y508-L517 HydrophobicContact CE1-CD1 3.93Å; Y508-L517 HydrophobicContact CE2-CD1 4Å; Y508-L517 HydrophobicContact CE2-CG 4.48Å; Y508-L517 HydrophobicContact CG-CD1 3.8Å; Y508-L517 HydrophobicContact CG-CD2 3.68Å; Y508-L517 HydrophobicContact CG-CG 3.62Å
509	S	88.2	Confident	80.5	Confident	90 Å²	90	82.7 Å²	82.7	63%	0.629	43%	0.427	S	S	*	.	H	α-helix	trans	-69.5	-15.4	179.9	63.4	0	0	0	0	114.6	L505 F506 R507	L505-S509 PolarHBondContact O-N 2.79Å; L505-S509 PolarHBondContact O-OG 3.47Å; F506-S509 PolarHBondContact O-N 2.71Å; F506-S509 VanDerWaalsContact O-N 3.1Å; F506-S509 PolarHBondContact O-OG 2.81Å; R507-S509 PolarHBondContact O-N 2.82Å
510	V	87.6	Confident	80	Confident	104 Å²	104	76.8 Å²	76.8	63%	0.63	41%	0.41	S	S	*	.	H	α-helix	trans	-93.8	-35	173.6	174.1	0	0	0	0	113	F506 R507 Y508	F506-V510 HydrophobicContact CE1-CG2 4.32Å; F506-V510 HydrophobicContact CE2-CG2 4.27Å; F506-V510 HydrophobicContact CZ-CG2 4.08Å; F506-V510 WeakPolarHBondContact O-CG2 3.3Å; F506-V510 PolarHBondContact O-N 3.1Å; F506-V510 VanDerWaalsContact O-N 3.12Å; R507-V510 PolarHBondContact O-N 2.76Å; Y508-V510 PolarHBondContact O-N 3.34Å
511	T	82.1	Confident	79.7	Confident	75 Å²	75	74 Å²	74	46%	0.46	40%	0.403	S	S	.	.	H	α-helix	trans	-99.3	-28	-174.2	57.6	0	0	0	0	114.3	R507 Y508 D513 Y516	R507-T511 WeakPolarHBondContact O-CB 3.23Å; R507-T511 WeakPolarHBondContact O-CG2 3.46Å; R507-T511 PolarHBondContact O-N 3.15Å; R507-T511 PolarHBondContact O-OG1 2.94Å; Y508-T511 PolarHBondContact O-N 2.95Å; T511-D513 PolarHBondContact O-N 2.96Å; T511-D513 PolarHBondContact OG1-N 3.26Å; T511-Y516 HydrophobicContact CG2-CD2 4.48Å; T511-Y516 HydrophobicContact CG2-CE2 4.06Å
512	G	80.2	Confident	79	Confident	56 Å²	56	73 Å²	73	58%	0.577	40%	0.395	S	S	*	.			trans	73.8	-1.5	-168.2	0	0	0	0	0	114.8	Y508	Y508-G512 WeakPolarHBondContact O-CA 3.46Å; Y508-G512 PolarHBondContact O-N 3.01Å
513	D	77.4	Confident	78.6	Confident	66 Å²	66	71.9 Å²	71.9	35%	0.353	40%	0.395	S	S	.	.			trans	-87.9	114	-174.3	174.4	9.2	0	0	0	111.4	Y508 T511 A515 Y516	Y508-D513 WeakPolarHBondContact CD2-O 3.18Å; T511-D513 PolarHBondContact O-N 2.96Å; T511-D513 PolarHBondContact OG1-N 3.26Å; D513-A515 PolarHBondContact O-N 3.4Å; D513-A515 VanDerWaalsContact OD1-CB 3.28Å; D513-A515 WeakPolarHBondContact OD1-CB 3.27Å; D513-A515 PolarHBondContact OD1-N 2.98Å; D513-Y516 HydrophobicContact CB-CD2 3.93Å; D513-Y516 HydrophobicContact CB-CE2 4.11Å; D513-Y516 PolarHBondContact O-N 3Å
514	S	75.4	Confident	78.3	Confident	72 Å²	72	74.6 Å²	74.6	50%	0.503	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.2	-177.8	53.1	0	0	0	0	114	Y516 L517	S514-Y516 PolarHBondContact O-N 3.45Å; S514-L517 WeakPolarHBondContact O-CB 3.44Å; S514-L517 PolarHBondContact O-N 2.85Å; S514-L517 VanDerWaalsContact O-N 3.08Å
515	A	70.4	Confident	78	Confident	4 Å²	4	75.5 Å²	75.5	3%	0.033	41%	0.412	C	S	.	.	H	α-helix	trans	-56.3	-38.3	173.6	0	0	0	0	0	111.7	D513 L517 L518 A519 A557 L558	D513-A515 PolarHBondContact O-N 3.4Å; D513-A515 VanDerWaalsContact OD1-CB 3.28Å; D513-A515 WeakPolarHBondContact OD1-CB 3.27Å; D513-A515 PolarHBondContact OD1-N 2.98Å; A515-L517 PolarHBondContact O-N 2.82Å; A515-L518 CarbonylContact O-C 3.59Å; A515-L518 PolarHBondContact O-N 2.78Å; A515-A519 PolarHBondContact O-N 2.84Å; A515-A557 HydrophobicContact CB-CB 3.68Å; A515-L558 HydrophobicContact CB-CD1 4.45Å; A515-L558 HydrophobicContact CB-CD2 4.39Å; A515-L558 HydrophobicContact CB-CG 4.3Å; A515-L558 WeakPolarHBondContact O-CD1 3.1Å
516	Y	76.4	Confident	77.8	Confident	67 Å²	67	72 Å²	72	26%	0.263	40%	0.398	S	S	.	.	H	α-helix	trans	-61.6	-29	178.6	-71.4	-78.3	0	0	0	113.6	A504 R507 T511 D513 S514 L518 P520	A504-Y516 WeakPolarHBondContact CB-O 3.25Å; R507-Y516 HydrophobicContact CB-CD1 3.68Å; R507-Y516 HydrophobicContact CB-CE1 4.28Å; R507-Y516 HydrophobicContact CB-CG 3.82Å; R507-Y516 HydrophobicContact CG-CD1 4.25Å; T511-Y516 HydrophobicContact CG2-CD2 4.48Å; T511-Y516 HydrophobicContact CG2-CE2 4.06Å; D513-Y516 HydrophobicContact CB-CD2 3.93Å; D513-Y516 HydrophobicContact CB-CE2 4.11Å; D513-Y516 PolarHBondContact O-N 3Å; S514-Y516 PolarHBondContact O-N 3.45Å; Y516-L518 VanDerWaalsContact C-N 3.3Å; Y516-P520 WeakPolarHBondContact O-CD 3.47Å
517	L	74.9	Confident	77.8	Confident	55 Å²	55	68.1 Å²	68.1	29%	0.288	39%	0.39	S	S	.	.	H	α-helix	trans	-72.8	-24.3	175	-62.1	179.6	0	0	0	113	L505 Y508 S514 A515	L505-L517 HydrophobicContact CD1-CD2 3.78Å; L505-L517 HydrophobicContact CG-CD2 4.41Å; Y508-L517 HydrophobicContact CD1-CD1 3.83Å; Y508-L517 HydrophobicContact CD1-CD2 3.83Å; Y508-L517 HydrophobicContact CD1-CG 4.03Å; Y508-L517 HydrophobicContact CD2-CD1 3.89Å; Y508-L517 HydrophobicContact CD2-CD2 4.45Å; Y508-L517 HydrophobicContact CD2-CG 3.88Å; Y508-L517 HydrophobicContact CE1-CD1 3.93Å; Y508-L517 HydrophobicContact CE2-CD1 4Å; Y508-L517 HydrophobicContact CE2-CG 4.48Å; Y508-L517 HydrophobicContact CG-CD1 3.8Å; Y508-L517 HydrophobicContact CG-CD2 3.68Å; Y508-L517 HydrophobicContact CG-CG 3.62Å; S514-L517 WeakPolarHBondContact O-CB 3.44Å; S514-L517 PolarHBondContact O-N 2.85Å; S514-L517 VanDerWaalsContact O-N 3.08Å; A515-L517 PolarHBondContact O-N 2.82Å
518	L	71.9	Confident	78.1	Confident	62 Å²	62	66.9 Å²	66.9	33%	0.325	39%	0.39	S	S	.	.	H	α-helix	trans	-94.1	-15.6	-179.9	-63.2	171.3	0	0	0	112.1	A515 Y516 Q521 R522 V554	A515-L518 CarbonylContact O-C 3.59Å; A515-L518 PolarHBondContact O-N 2.78Å; Y516-L518 VanDerWaalsContact C-N 3.3Å; L518-Q521 CarbonylContact O-C 3.42Å; L518-Q521 VanDerWaalsContact O-CA 3.31Å; L518-Q521 WeakPolarHBondContact O-CA 3.42Å; L518-Q521 WeakPolarHBondContact O-CB 3.2Å; L518-Q521 PolarHBondContact O-N 2.94Å; L518-R522 PolarHBondContact O-N 2.83Å; L518-V554 HydrophobicContact CB-CG1 3.76Å; L518-V554 HydrophobicContact CD1-CB 4.44Å; L518-V554 HydrophobicContact CD1-CG1 4.08Å; L518-V554 HydrophobicContact CD1-CG2 3.52Å
519	A	69.6	Low	78.4	Confident	35 Å²	35	65.3 Å²	65.3	29%	0.289	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-55.4	-41.3	176	0	0	0	0	0	114.9	A515 Q521 R522 L558	A515-A519 PolarHBondContact O-N 2.84Å; A519-Q521 PolarHBondContact O-N 3.08Å; A519-R522 WeakPolarHBondContact O-CB 3.29Å; A519-R522 PolarHBondContact O-N 3.18Å; A519-L558 HydrophobicContact CB-CD1 3.75Å; A519-L558 HydrophobicContact CB-CD2 3.77Å; A519-L558 HydrophobicContact CB-CG 4.38Å
520	P	73.2	Confident	78.5	Confident	37 Å²	37	69.8 Å²	69.8	24%	0.24	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-68	-17.6	172.2	-18.4	32.5	0	0	0	113.7	A504 Y516 P523	A504-P520 HydrophobicContact CB-CG 3.37Å; Y516-P520 WeakPolarHBondContact O-CD 3.47Å; P520-P523 WeakPolarHBondContact O-CD 3.47Å
521	Q	72.8	Confident	78.5	Confident	87 Å²	87	70.4 Å²	70.4	41%	0.407	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-91	0.4	178.5	-55.1	-174.3	7	0	0	113	L518 A519 P523 L524 M525	L518-Q521 CarbonylContact O-C 3.42Å; L518-Q521 VanDerWaalsContact O-CA 3.31Å; L518-Q521 WeakPolarHBondContact O-CA 3.42Å; L518-Q521 WeakPolarHBondContact O-CB 3.2Å; L518-Q521 PolarHBondContact O-N 2.94Å; A519-Q521 PolarHBondContact O-N 3.08Å; Q521-P523 VanDerWaalsContact O-N 3.1Å; Q521-L524 HydrophobicContact CB-CD1 4.37Å; Q521-L524 WeakPolarHBondContact O-CA 3.29Å; Q521-L524 WeakPolarHBondContact O-CB 3.39Å; Q521-L524 PolarHBondContact O-N 3Å; Q521-M525 PolarHBondContact O-N 2.72Å
522	R	71.6	Confident	78.8	Confident	75 Å²	75	66.8 Å²	66.8	28%	0.283	38%	0.377	S	S	.	.	H	α-helix	trans	-45.4	-38.6	174	179.3	173.2	171.8	154.5	-5.8	114.2	L518 A519 L524 M525 A526 L558 T559 E562	L518-R522 PolarHBondContact O-N 2.83Å; A519-R522 WeakPolarHBondContact O-CB 3.29Å; A519-R522 PolarHBondContact O-N 3.18Å; R522-L524 VanDerWaalsContact C-N 3.26Å; R522-L524 PolarHBondContact O-N 3.26Å; R522-M525 WeakPolarHBondContact O-CB 3.41Å; R522-M525 PolarHBondContact O-N 3.27Å; R522-M525 VanDerWaalsContact O-N 3.1Å; R522-A526 PolarHBondContact O-N 2.65Å; R522-L558 PolarHBondContact NH1-O 3.49Å; R522-T559 PolarHBondContact NH1-O 3.48Å; R522-T559 PolarHBondContact NH2-O 2.95Å; R522-E562 IonicContact CZ-OE2 3.71Å; R522-E562 IonicContact NH2-OE2 2.7Å; R522-E562 PolarHBondContact NH2-OE2 3.29Å
523	P	75	Confident	79.3	Confident	95 Å²	95	64.8 Å²	64.8	62%	0.617	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-29	174.9	-25.2	36.2	0	0	0	114.7	P520 Q521 A526 A527	P520-P523 WeakPolarHBondContact O-CD 3.47Å; Q521-P523 VanDerWaalsContact O-N 3.1Å; P523-A526 PolarHBondContact O-N 2.81Å; P523-A527 PolarHBondContact O-N 3.35Å
524	L	77.1	Confident	79.9	Confident	126 Å²	126	61.6 Å²	61.6	66%	0.66	34%	0.336	S	S	*	.	H	α-helix	trans	-76.7	-26.4	175.9	-59.3	176.2	0	0	0	112.2	Q521 R522 A526 A527	Q521-L524 HydrophobicContact CB-CD1 4.37Å; Q521-L524 WeakPolarHBondContact O-CA 3.29Å; Q521-L524 WeakPolarHBondContact O-CB 3.39Å; Q521-L524 PolarHBondContact O-N 3Å; R522-L524 VanDerWaalsContact C-N 3.26Å; R522-L524 PolarHBondContact O-N 3.26Å; L524-A526 VanDerWaalsContact C-N 3.29Å; L524-A527 WeakPolarHBondContact O-CB 3.44Å; L524-A527 PolarHBondContact O-N 3.41Å
525	M	75.9	Confident	80.5	Confident	27 Å²	27	59.8 Å²	59.8	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-72.5	-28.2	173.9	-54.4	-179.7	74.3	0	0	111.7	Q521 R522 L551 V554 V555 V563	Q521-M525 PolarHBondContact O-N 2.72Å; R522-M525 WeakPolarHBondContact O-CB 3.41Å; R522-M525 PolarHBondContact O-N 3.27Å; R522-M525 VanDerWaalsContact O-N 3.1Å; M525-L551 HydrophobicContact CE-CB 4.39Å; M525-L551 HydrophobicContact CE-CD2 3.97Å; M525-V554 HydrophobicContact CE-CB 4.44Å; M525-V554 HydrophobicContact CE-CG1 4.14Å; M525-V554 HydrophobicContact SD-CG1 4.11Å; M525-V555 HydrophobicContact CE-CG2 3.55Å; M525-V563 HydrophobicContact CB-CG1 4.15Å; M525-V563 WeakPolarHBondContact O-CG1 3.42Å
526	A	82.3	Confident	81.4	Confident	32 Å²	32	59.8 Å²	59.8	26%	0.264	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	1	174.6	0	0	0	0	0	113.6	R522 P523 L524 V563 M566	R522-A526 PolarHBondContact O-N 2.65Å; P523-A526 PolarHBondContact O-N 2.81Å; L524-A526 VanDerWaalsContact C-N 3.29Å; A526-V563 HydrophobicContact CB-CG2 4.34Å; A526-M566 HydrophobicContact CB-CE 3.91Å; A526-M566 HydrophobicContact CB-SD 3.94Å
527	A	85.2	Confident	82.1	Confident	51 Å²	51	56.6 Å²	56.6	42%	0.421	32%	0.315	S	S	.	.			trans	-69.8	139.5	173.2	0	0	0	0	0	110.1	P523 L524 T534	P523-A527 PolarHBondContact O-N 3.35Å; L524-A527 WeakPolarHBondContact O-CB 3.44Å; L524-A527 PolarHBondContact O-N 3.41Å; A527-T534 WeakPolarHBondContact O-CA 3.03Å
528	Q	89	Confident	82.9	Confident	94 Å²	94	56.8 Å²	56.8	44%	0.439	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-115.2	150.1	177.8	-65.9	-178.4	-77.1	0	0	109.5	G532 D533 T534 R567	Q528-G532 PolarHBondContact NE2-O 3.24Å; Q528-D533 WeakPolarHBondContact CA-O 3.37Å; Q528-T534 HydrophobicContact CG-CG2 3.84Å; Q528-R567 PolarHBondContact NE2-O 2.87Å; Q528-R567 VanDerWaalsContact NE2-O 3.12Å
529	D	89.9	Confident	83.8	Confident	62 Å²	62	54.2 Å²	54.2	33%	0.332	30%	0.304	S	S	.	.			trans	-88.6	-169.1	169.8	65.7	18.4	0	0	0	112.7	D531 G532 D533	D529-D531 PolarHBondContact O-N 2.88Å; D529-D531 PolarHBondContact OD1-N 2.63Å; D529-G532 PolarHBondContact O-N 2.94Å; D529-G532 PolarHBondContact OD1-N 2.85Å; D529-G532 VanDerWaalsContact OD1-N 3.15Å; D529-D533 PolarHBondContact N-O 2.99Å; D529-D533 VanDerWaalsContact N-O 3.1Å; D529-D533 PolarHBondContact OD1-N 3.44Å
530	E	91.6	Very high	84.9	Confident	183 Å²	183	52.5 Å²	52.5	86%	0.855	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.5	-178.2	-55.6	-73.2	143	0	0	113.8
531	D	86.8	Confident	85.8	Confident	117 Å²	117	54.9 Å²	54.9	63%	0.626	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-2.5	174.7	-75.2	-64.3	0	0	0	112	D529 H569	D529-D531 PolarHBondContact O-N 2.88Å; D529-D531 PolarHBondContact OD1-N 2.63Å; D531-H569 VanDerWaalsContact O-CB 3.25Å; D531-H569 WeakPolarHBondContact O-CB 3.49Å; D531-H569 VanDerWaalsContact O-CG 3.23Å; D531-H569 PolarHBondContact O-N 3.3Å
532	G	88.4	Confident	86.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.			trans	84.7	7.7	-176.8	0	0	0	0	0	114.1	Q528 D529 N568	Q528-G532 PolarHBondContact NE2-O 3.24Å; D529-G532 PolarHBondContact O-N 2.94Å; D529-G532 PolarHBondContact OD1-N 2.85Å; D529-G532 VanDerWaalsContact OD1-N 3.15Å; G532-N568 WeakPolarHBondContact O-CA 3.4Å; G532-N568 WeakPolarHBondContact O-CB 3.46Å
533	D	90.1	Very high	87.5	Confident	13 Å²	13	55.4 Å²	55.4	7%	0.07	31%	0.312	C	S	.	.			trans	-77.7	131	-177.3	-90.7	-3.3	0	0	0	110.5	Q528 D529 H537 L538 N568	Q528-D533 WeakPolarHBondContact CA-O 3.37Å; D529-D533 PolarHBondContact N-O 2.99Å; D529-D533 VanDerWaalsContact N-O 3.1Å; D529-D533 PolarHBondContact OD1-N 3.44Å; D533-H537 HydrophobicContact CB-CB 3.61Å; D533-H537 WeakPolarHBondContact OD1-CB 3.42Å; D533-H537 IonicContact OD1-CD2 3.24Å; D533-H537 PolarHBondContact OD1-CD2 2.93Å; D533-H537 IonicContact OD1-CG 3Å; D533-L538 HydrophobicContact CB-CD2 4.19Å; D533-L538 HydrophobicContact CB-CG 4.35Å; D533-N568 WeakPolarHBondContact OD1-CB 3.09Å; D533-N568 PolarHBondContact OD1-ND2 2.93Å
534	T	90.1	Very high	88.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-85.2	169.6	173.4	70.4	0	0	0	0	111.2	A527 Q528 L536 H537 L538 M566	A527-T534 WeakPolarHBondContact O-CA 3.03Å; Q528-T534 HydrophobicContact CG-CG2 3.84Å; T534-L536 PolarHBondContact O-N 3.4Å; T534-L536 PolarHBondContact OG1-N 3.01Å; T534-H537 PolarHBondContact N-ND1 2.92Å; T534-H537 VanDerWaalsContact N-ND1 3.18Å; T534-H537 WeakPolarHBondContact O-CA 3.45Å; T534-H537 WeakPolarHBondContact O-CB 3.36Å; T534-H537 PolarHBondContact O-N 3.46Å; T534-H537 PolarHBondContact OG1-ND1 3.03Å; T534-L538 PolarHBondContact O-N 3.42Å; T534-M566 HydrophobicContact CG2-CB 3.96Å; T534-M566 HydrophobicContact CG2-SD 3.77Å
535	G	87.6	Confident	88.7	Confident	34 Å²	34	54.3 Å²	54.3	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-53.8	-24.3	173.9	0	0	0	0	0	114.9	A539	G535-A539 VanDerWaalsContact O-CB 3.29Å; G535-A539 WeakPolarHBondContact O-CB 3.29Å; G535-A539 PolarHBondContact O-N 3.12Å; G535-A539 VanDerWaalsContact O-N 3.09Å
536	L	89.4	Confident	89.2	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-76.2	-39.2	171.4	-69.5	174.4	0	0	0	112.8	T534 A539 V540 L548 L551 V563 L564 P574	T534-L536 PolarHBondContact O-N 3.4Å; T534-L536 PolarHBondContact OG1-N 3.01Å; L536-A539 PolarHBondContact O-N 3.13Å; L536-V540 WeakPolarHBondContact O-CG2 3.03Å; L536-V540 PolarHBondContact O-N 3.43Å; L536-V540 VanDerWaalsContact O-N 3.13Å; L536-L548 HydrophobicContact CD2-CD1 3.98Å; L536-L551 HydrophobicContact CD2-CB 3.69Å; L536-L551 HydrophobicContact CD2-CD1 4.18Å; L536-V563 HydrophobicContact CD1-CG1 4.13Å; L536-L564 HydrophobicContact CD1-CD2 3.99Å; L536-P574 HydrophobicContact CB-CB 4.05Å; L536-P574 HydrophobicContact CB-CG 3.64Å; L536-P574 HydrophobicContact CD1-CG 4.44Å
537	H	91.8	Very high	89.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-48.6	174.5	-65.7	78.2	0	0	0	109.8	D533 T534 A539 V540 L541 M566 Q572 P574 L577	D533-H537 HydrophobicContact CB-CB 3.61Å; D533-H537 WeakPolarHBondContact OD1-CB 3.42Å; D533-H537 IonicContact OD1-CD2 3.24Å; D533-H537 PolarHBondContact OD1-CD2 2.93Å; D533-H537 IonicContact OD1-CG 3Å; T534-H537 PolarHBondContact N-ND1 2.92Å; T534-H537 VanDerWaalsContact N-ND1 3.18Å; T534-H537 WeakPolarHBondContact O-CA 3.45Å; T534-H537 WeakPolarHBondContact O-CB 3.36Å; T534-H537 PolarHBondContact O-N 3.46Å; T534-H537 PolarHBondContact OG1-ND1 3.03Å; H537-A539 PolarHBondContact O-N 3Å; H537-V540 PolarHBondContact O-N 3.37Å; H537-L541 WeakPolarHBondContact O-CB 3.36Å; H537-L541 PolarHBondContact O-N 3.5Å; H537-M566 PolarHBondContact CE1-O 3.07Å; H537-Q572 PolarHBondContact NE2-O 3.05Å; H537-Q572 VanDerWaalsContact NE2-O 3.14Å; H537-P574 VanDerWaalsContact CE1-CD 3.45Å; H537-P574 WeakPolarHBondContact CE1-CD 3.27Å; H537-L577 HydrophobicContact CB-CD1 3.78Å
538	L	91	Very high	89.5	Confident	59 Å²	59	59 Å²	59	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-62.9	-37.9	177.5	-63.6	177.2	0	0	0	112.9	D533 T534 V540 L541 H542	D533-L538 HydrophobicContact CB-CD2 4.19Å; D533-L538 HydrophobicContact CB-CG 4.35Å; T534-L538 PolarHBondContact O-N 3.42Å; L538-V540 VanDerWaalsContact C-N 3.32Å; L538-V540 PolarHBondContact O-N 2.88Å; L538-L541 PolarHBondContact O-N 2.87Å; L538-H542 WeakPolarHBondContact O-CB 3.27Å; L538-H542 PolarHBondContact O-CD2 3.31Å; L538-H542 VanDerWaalsContact O-CD2 3.31Å; L538-H542 PolarHBondContact O-N 3.42Å
539	A	91.4	Very high	89.4	Confident	7 Å²	7	56.8 Å²	56.8	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-38.5	174.9	0	0	0	0	0	112.2	G535 L536 H537 S543 Q544 L548 L551	G535-A539 VanDerWaalsContact O-CB 3.29Å; G535-A539 WeakPolarHBondContact O-CB 3.29Å; G535-A539 PolarHBondContact O-N 3.12Å; G535-A539 VanDerWaalsContact O-N 3.09Å; L536-A539 PolarHBondContact O-N 3.13Å; H537-A539 PolarHBondContact O-N 3Å; A539-S543 PolarHBondContact O-N 3.17Å; A539-Q544 PolarHBondContact O-N 2.87Å; A539-L548 HydrophobicContact CB-CB 4.21Å; A539-L548 HydrophobicContact CB-CD1 4.3Å; A539-L551 HydrophobicContact CB-CD1 4.35Å
540	V	93.1	Very high	89	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-71.1	-50.2	172.9	174.6	0	0	0	0	111	L536 H537 L538 H542 S543 L548 P574 L577 A578 Q583 L590	L536-V540 WeakPolarHBondContact O-CG2 3.03Å; L536-V540 PolarHBondContact O-N 3.43Å; L536-V540 VanDerWaalsContact O-N 3.13Å; H537-V540 PolarHBondContact O-N 3.37Å; L538-V540 VanDerWaalsContact C-N 3.32Å; L538-V540 PolarHBondContact O-N 2.88Å; V540-H542 PolarHBondContact O-N 3.37Å; V540-S543 PolarHBondContact O-N 3.19Å; V540-L548 HydrophobicContact CG2-CD1 3.9Å; V540-L548 HydrophobicContact CG2-CD2 3.98Å; V540-P574 HydrophobicContact CG2-CB 4.44Å; V540-L577 HydrophobicContact CG1-CB 3.92Å; V540-A578 HydrophobicContact CG1-CB 3.99Å; V540-Q583 PolarHBondContact O-NE2 3.49Å; V540-Q583 PolarHBondContact O-OE1 3.33Å; V540-L590 HydrophobicContact CG2-CD1 4.18Å
541	L	91.1	Very high	88.6	Confident	87 Å²	87	50.9 Å²	50.9	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-33.1	-176.6	-171	148.6	0	0	0	112.5	H537 L538	H537-L541 WeakPolarHBondContact O-CB 3.36Å; H537-L541 PolarHBondContact O-N 3.5Å; L538-L541 PolarHBondContact O-N 2.87Å
542	H	90.5	Very high	88.4	Confident	113 Å²	113	45.6 Å²	45.6	52%	0.523	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	9.9	174.4	-61.1	-48.1	0	0	0	114.8	L538 V540 Q544	L538-H542 WeakPolarHBondContact O-CB 3.27Å; L538-H542 PolarHBondContact O-CD2 3.31Å; L538-H542 VanDerWaalsContact O-CD2 3.31Å; L538-H542 PolarHBondContact O-N 3.42Å; V540-H542 PolarHBondContact O-N 3.37Å; H542-Q544 VanDerWaalsContact C-N 3.25Å; H542-Q544 HydrophobicContact CB-CG 3.92Å; H542-Q544 PolarHBondContact O-N 2.81Å; H542-Q544 PolarHBondContact O-NE2 3.27Å
543	S	90.2	Very high	88	Confident	60 Å²	60	52.1 Å²	52.1	42%	0.42	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	33.9	178	-156.8	0	0	0	0	114.5	A539 V540 Q545	A539-S543 PolarHBondContact O-N 3.17Å; V540-S543 PolarHBondContact O-N 3.19Å; S543-Q545 PolarHBondContact O-N 3.23Å; S543-Q545 VanDerWaalsContact O-N 3.1Å
544	Q	90.9	Very high	87.4	Confident	110 Å²	110	52.1 Å²	52.1	51%	0.514	29%	0.285	S	S	.	.			trans	-87.3	72.6	-175.4	-61.9	-57.5	-55.1	0	0	111.2	A539 H542 E546 A547 L548	A539-Q544 PolarHBondContact O-N 2.87Å; H542-Q544 VanDerWaalsContact C-N 3.25Å; H542-Q544 HydrophobicContact CB-CG 3.92Å; H542-Q544 PolarHBondContact O-N 2.81Å; H542-Q544 PolarHBondContact O-NE2 3.27Å; Q544-E546 VanDerWaalsContact C-N 3.32Å; Q544-E546 PolarHBondContact O-N 2.88Å; Q544-A547 HydrophobicContact CB-CB 3.89Å; Q544-A547 PolarHBondContact O-N 3.08Å; Q544-A547 VanDerWaalsContact O-N 3.1Å; Q544-L548 PolarHBondContact O-N 2.93Å
545	Q	87.2	Confident	86.9	Confident	88 Å²	88	52.5 Å²	52.5	41%	0.411	29%	0.287	S	S	.	.	H	α-helix	trans	-57.8	-37.7	-173.3	-60.5	-174	6.8	0	0	114	S543 L548 T549	S543-Q545 PolarHBondContact O-N 3.23Å; S543-Q545 VanDerWaalsContact O-N 3.1Å; Q545-L548 PolarHBondContact O-N 2.87Å; Q545-T549 WeakPolarHBondContact O-CB 3.31Å; Q545-T549 WeakPolarHBondContact O-CG2 3.38Å; Q545-T549 PolarHBondContact O-N 3.16Å; Q545-T549 PolarHBondContact O-OG1 3.3Å
546	E	85.8	Confident	86.3	Confident	164 Å²	164	54.2 Å²	54.2	77%	0.766	29%	0.294	S	S	*	.	H	α-helix	trans	-67.8	-38.7	176.4	-64.2	-172.6	170.8	0	0	112.6	Q544 T549 S550	Q544-E546 VanDerWaalsContact C-N 3.32Å; Q544-E546 PolarHBondContact O-N 2.88Å; E546-T549 WeakPolarHBondContact CA-OG1 3.2Å; E546-T549 PolarHBondContact O-OG1 2.9Å; E546-T549 VanDerWaalsContact O-OG1 3.07Å; E546-S550 VanDerWaalsContact O-CB 3.29Å; E546-S550 WeakPolarHBondContact O-CB 3.29Å; E546-S550 PolarHBondContact O-N 3.08Å; E546-S550 VanDerWaalsContact O-N 3.08Å; E546-S550 PolarHBondContact O-OG 3.14Å
547	A	85.4	Confident	85.4	Confident	42 Å²	42	56.4 Å²	56.4	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-68.5	-44.2	174.2	0	0	0	0	0	110.9	Q544 S550 L551	Q544-A547 HydrophobicContact CB-CB 3.89Å; Q544-A547 PolarHBondContact O-N 3.08Å; Q544-A547 VanDerWaalsContact O-N 3.1Å; A547-S550 PolarHBondContact O-N 3.02Å; A547-L551 WeakPolarHBondContact O-CB 3.41Å; A547-L551 VanDerWaalsContact O-CG 3.22Å; A547-L551 WeakPolarHBondContact O-CG 3.35Å; A547-L551 PolarHBondContact O-N 3.28Å
548	L	88.3	Confident	84.2	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-59.5	-50.9	178.3	-177.1	66.1	0	0	0	111.4	L536 A539 V540 Q544 Q545 S550 L551 T552 A586 L590	L536-L548 HydrophobicContact CD2-CD1 3.98Å; A539-L548 HydrophobicContact CB-CB 4.21Å; A539-L548 HydrophobicContact CB-CD1 4.3Å; V540-L548 HydrophobicContact CG2-CD1 3.9Å; V540-L548 HydrophobicContact CG2-CD2 3.98Å; Q544-L548 PolarHBondContact O-N 2.93Å; Q545-L548 PolarHBondContact O-N 2.87Å; L548-S550 PolarHBondContact O-N 3.36Å; L548-L551 PolarHBondContact O-N 3.5Å; L548-T552 WeakPolarHBondContact O-CB 3.19Å; L548-T552 PolarHBondContact O-N 2.95Å; L548-T552 PolarHBondContact O-OG1 3.26Å; L548-A586 HydrophobicContact CD2-CB 3.42Å; L548-A586 VanDerWaalsContact CD2-CB 3.42Å; L548-L590 HydrophobicContact CD1-CD2 4.16Å; L548-L590 HydrophobicContact CD1-CG 4.42Å
549	T	86.1	Confident	82.8	Confident	47 Å²	47	60.5 Å²	60.5	29%	0.288	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-44.3	177.3	45	0	0	0	0	112.1	Q545 E546 T552 Q553 V589	Q545-T549 WeakPolarHBondContact O-CB 3.31Å; Q545-T549 WeakPolarHBondContact O-CG2 3.38Å; Q545-T549 PolarHBondContact O-N 3.16Å; Q545-T549 PolarHBondContact O-OG1 3.3Å; E546-T549 WeakPolarHBondContact CA-OG1 3.2Å; E546-T549 PolarHBondContact O-OG1 2.9Å; E546-T549 VanDerWaalsContact O-OG1 3.07Å; T549-T552 PolarHBondContact O-N 3.05Å; T549-Q553 WeakPolarHBondContact O-CB 3.35Å; T549-Q553 VanDerWaalsContact O-CG 3.28Å; T549-Q553 WeakPolarHBondContact O-CG 3.42Å; T549-Q553 PolarHBondContact O-N 2.78Å; T549-V589 HydrophobicContact CG2-CB 4.48Å; T549-V589 HydrophobicContact CG2-CG1 3.9Å; T549-V589 HydrophobicContact CG2-CG2 3.78Å
550	S	82.9	Confident	81.4	Confident	67 Å²	67	60.4 Å²	60.4	47%	0.469	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-49.8	177.6	-59.2	0	0	0	0	112.3	E546 A547 L548 T552 Q553 V554	E546-S550 VanDerWaalsContact O-CB 3.29Å; E546-S550 WeakPolarHBondContact O-CB 3.29Å; E546-S550 PolarHBondContact O-N 3.08Å; E546-S550 VanDerWaalsContact O-N 3.08Å; E546-S550 PolarHBondContact O-OG 3.14Å; A547-S550 PolarHBondContact O-N 3.02Å; L548-S550 PolarHBondContact O-N 3.36Å; S550-T552 VanDerWaalsContact C-N 3.31Å; S550-T552 PolarHBondContact O-N 2.74Å; S550-Q553 PolarHBondContact O-N 3.01Å; S550-V554 VanDerWaalsContact O-CG2 3.28Å; S550-V554 WeakPolarHBondContact O-CG2 3.4Å; S550-V554 PolarHBondContact O-N 3.41Å
551	L	82.8	Confident	79.9	Confident	55 Å²	55	66.7 Å²	66.7	29%	0.288	37%	0.368	S	S	.	.	H	α-helix	trans	-60.9	-41.6	177	-69.7	167.5	0	0	0	111.3	M525 L536 A539 A547 L548 V554 V555	M525-L551 HydrophobicContact CE-CB 4.39Å; M525-L551 HydrophobicContact CE-CD2 3.97Å; L536-L551 HydrophobicContact CD2-CB 3.69Å; L536-L551 HydrophobicContact CD2-CD1 4.18Å; A539-L551 HydrophobicContact CB-CD1 4.35Å; A547-L551 WeakPolarHBondContact O-CB 3.41Å; A547-L551 VanDerWaalsContact O-CG 3.22Å; A547-L551 WeakPolarHBondContact O-CG 3.35Å; A547-L551 PolarHBondContact O-N 3.28Å; L548-L551 PolarHBondContact O-N 3.5Å; L551-V554 PolarHBondContact O-N 3.45Å; L551-V555 WeakPolarHBondContact O-CG2 3.49Å; L551-V555 PolarHBondContact O-N 3.01Å
552	T	82.9	Confident	79	Confident	5 Å²	5	69 Å²	69	3%	0.031	38%	0.376	C	S	.	.	H	α-helix	trans	-69	-39.1	-177.2	-60.5	0	0	0	0	112.4	L548 T549 S550 V554 V555 S556 V589 A593	L548-T552 WeakPolarHBondContact O-CB 3.19Å; L548-T552 PolarHBondContact O-N 2.95Å; L548-T552 PolarHBondContact O-OG1 3.26Å; T549-T552 PolarHBondContact O-N 3.05Å; S550-T552 VanDerWaalsContact C-N 3.31Å; S550-T552 PolarHBondContact O-N 2.74Å; T552-V554 VanDerWaalsContact C-N 3.32Å; T552-V554 PolarHBondContact O-N 3.18Å; T552-V555 PolarHBondContact O-N 3.23Å; T552-S556 PolarHBondContact O-N 3.21Å; T552-S556 PolarHBondContact O-OG 3.17Å; T552-V589 HydrophobicContact CG2-CG1 3.94Å; T552-A593 HydrophobicContact CG2-CB 3.17Å
553	Q	79.8	Confident	78.6	Confident	137 Å²	137	63.9 Å²	63.9	64%	0.64	35%	0.353	S	S	*	.	H	α-helix	trans	-60.4	-42.4	171.5	-74.8	170.8	10	0	0	111.4	T549 S550 S556 A557	T549-Q553 WeakPolarHBondContact O-CB 3.35Å; T549-Q553 VanDerWaalsContact O-CG 3.28Å; T549-Q553 WeakPolarHBondContact O-CG 3.42Å; T549-Q553 PolarHBondContact O-N 2.78Å; S550-Q553 PolarHBondContact O-N 3.01Å; Q553-S556 WeakPolarHBondContact O-CB 3.36Å; Q553-S556 PolarHBondContact O-N 2.75Å; Q553-A557 WeakPolarHBondContact O-CB 3.5Å; Q553-A557 PolarHBondContact O-N 2.96Å
554	V	77.7	Confident	78.4	Confident	14 Å²	14	61 Å²	61	9%	0.085	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-39.8	178.8	172.2	0	0	0	0	111.8	L518 M525 S550 L551 T552 A557 L558	L518-V554 HydrophobicContact CB-CG1 3.76Å; L518-V554 HydrophobicContact CD1-CB 4.44Å; L518-V554 HydrophobicContact CD1-CG1 4.08Å; L518-V554 HydrophobicContact CD1-CG2 3.52Å; M525-V554 HydrophobicContact CE-CB 4.44Å; M525-V554 HydrophobicContact CE-CG1 4.14Å; M525-V554 HydrophobicContact SD-CG1 4.11Å; S550-V554 VanDerWaalsContact O-CG2 3.28Å; S550-V554 WeakPolarHBondContact O-CG2 3.4Å; S550-V554 PolarHBondContact O-N 3.41Å; L551-V554 PolarHBondContact O-N 3.45Å; T552-V554 VanDerWaalsContact C-N 3.32Å; T552-V554 PolarHBondContact O-N 3.18Å; V554-A557 PolarHBondContact O-N 3.48Å; V554-L558 HydrophobicContact CG1-CD1 3.73Å; V554-L558 WeakPolarHBondContact O-CB 3.42Å; V554-L558 WeakPolarHBondContact O-CD1 3.38Å; V554-L558 VanDerWaalsContact O-CG 3.26Å; V554-L558 WeakPolarHBondContact O-CG 3.35Å; V554-L558 PolarHBondContact O-N 2.79Å
555	V	78.1	Confident	78.3	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-43.8	172.9	175.5	0	0	0	0	111.6	M525 L551 T552 A557 L558 G560 L564	M525-V555 HydrophobicContact CE-CG2 3.55Å; L551-V555 WeakPolarHBondContact O-CG2 3.49Å; L551-V555 PolarHBondContact O-N 3.01Å; T552-V555 PolarHBondContact O-N 3.23Å; V555-A557 VanDerWaalsContact C-N 3.34Å; V555-A557 PolarHBondContact O-N 3.18Å; V555-L558 PolarHBondContact O-N 2.8Å; V555-G560 VanDerWaalsContact CG1-C 3.48Å; V555-G560 VanDerWaalsContact CG1-O 3.27Å; V555-G560 WeakPolarHBondContact CG1-O 3.2Å; V555-G560 PolarHBondContact O-N 3.35Å; V555-L564 HydrophobicContact CG1-CD1 3.96Å; V555-L564 HydrophobicContact CG1-CG 3.9Å
556	S	75.2	Confident	78.3	Confident	70 Å²	70	56 Å²	56	49%	0.49	31%	0.311	S	S	.	.	H	α-helix	trans	-62.9	-38.6	-179.8	-54.5	0	0	0	0	112.3	T552 Q553 L558 A593	T552-S556 PolarHBondContact O-N 3.21Å; T552-S556 PolarHBondContact O-OG 3.17Å; Q553-S556 WeakPolarHBondContact O-CB 3.36Å; Q553-S556 PolarHBondContact O-N 2.75Å; S556-L558 VanDerWaalsContact C-N 3.28Å; S556-L558 PolarHBondContact O-N 3.23Å; S556-A593 WeakPolarHBondContact OG-CB 3.37Å
557	A	71.1	Confident	78.7	Confident	50 Å²	50	53.1 Å²	53.1	41%	0.413	29%	0.294	S	S	.	.	H	α-helix	trans	-72.7	-16.5	178.8	0	0	0	0	0	114.2	A515 Q553 V554 V555	A515-A557 HydrophobicContact CB-CB 3.68Å; Q553-A557 WeakPolarHBondContact O-CB 3.5Å; Q553-A557 PolarHBondContact O-N 2.96Å; V554-A557 PolarHBondContact O-N 3.48Å; V555-A557 VanDerWaalsContact C-N 3.34Å; V555-A557 PolarHBondContact O-N 3.18Å
558	L	65.9	Low	79	Confident	26 Å²	26	51.7 Å²	51.7	14%	0.136	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	27	-164.6	-60.7	175.5	0	0	0	114.4	A515 A519 R522 V554 V555 S556 G560	A515-L558 HydrophobicContact CB-CD1 4.45Å; A515-L558 HydrophobicContact CB-CD2 4.39Å; A515-L558 HydrophobicContact CB-CG 4.3Å; A515-L558 WeakPolarHBondContact O-CD1 3.1Å; A519-L558 HydrophobicContact CB-CD1 3.75Å; A519-L558 HydrophobicContact CB-CD2 3.77Å; A519-L558 HydrophobicContact CB-CG 4.38Å; R522-L558 PolarHBondContact NH1-O 3.49Å; V554-L558 HydrophobicContact CG1-CD1 3.73Å; V554-L558 WeakPolarHBondContact O-CB 3.42Å; V554-L558 WeakPolarHBondContact O-CD1 3.38Å; V554-L558 VanDerWaalsContact O-CG 3.26Å; V554-L558 WeakPolarHBondContact O-CG 3.35Å; V554-L558 PolarHBondContact O-N 2.79Å; V555-L558 PolarHBondContact O-N 2.8Å; S556-L558 VanDerWaalsContact C-N 3.28Å; S556-L558 PolarHBondContact O-N 3.23Å; L558-G560 VanDerWaalsContact C-N 3.29Å; L558-G560 PolarHBondContact O-N 3.36Å
559	T	61.8	Low	79.2	Confident	120 Å²	120	57.5 Å²	57.5	74%	0.736	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	51	176.2	55.4	0	0	0	0	112.5	R522	R522-T559 PolarHBondContact NH1-O 3.48Å; R522-T559 PolarHBondContact NH2-O 2.95Å
560	G	61.5	Low	79.3	Confident	4 Å²	4	58.9 Å²	58.9	4%	0.041	31%	0.312	C	S	.	.			trans	-110.8	24.3	-167.8	0	0	0	0	0	116.2	V555 L558 E562 V563	V555-G560 VanDerWaalsContact CG1-C 3.48Å; V555-G560 VanDerWaalsContact CG1-O 3.27Å; V555-G560 WeakPolarHBondContact CG1-O 3.2Å; V555-G560 PolarHBondContact O-N 3.35Å; L558-G560 VanDerWaalsContact C-N 3.29Å; L558-G560 PolarHBondContact O-N 3.36Å; G560-E562 PolarHBondContact O-N 3.11Å; G560-V563 PolarHBondContact O-N 3.01Å
561	E	63.1	Low	79.8	Confident	132 Å²	132	62 Å²	62	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-47	-34	-174.1	-65.7	166.6	-162.2	0	0	114.3	V563 L564 N565	E561-V563 PolarHBondContact O-N 3.43Å; E561-V563 VanDerWaalsContact O-N 3.13Å; E561-L564 PolarHBondContact O-N 2.71Å; E561-N565 PolarHBondContact O-N 3.29Å; E561-N565 PolarHBondContact O-ND2 2.92Å
562	E	70.9	Confident	80.3	Confident	136 Å²	136	60.7 Å²	60.7	64%	0.636	31%	0.307	S	S	*	.	H	α-helix	trans	-46.9	-40.3	173.3	-60	170.4	140.3	0	0	113.2	R522 G560 N565 M566	R522-E562 IonicContact CZ-OE2 3.71Å; R522-E562 IonicContact NH2-OE2 2.7Å; R522-E562 PolarHBondContact NH2-OE2 3.29Å; G560-E562 PolarHBondContact O-N 3.11Å; E562-N565 CarbonylContact O-C 3.31Å; E562-N565 PolarHBondContact O-N 2.76Å; E562-M566 WeakPolarHBondContact O-CG 3.17Å; E562-M566 PolarHBondContact O-N 2.92Å
563	V	82.4	Confident	80.8	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-79.4	-30.1	-172.6	-174.3	0	0	0	0	112.4	M525 A526 L536 G560 E561 N565	M525-V563 HydrophobicContact CB-CG1 4.15Å; M525-V563 WeakPolarHBondContact O-CG1 3.42Å; A526-V563 HydrophobicContact CB-CG2 4.34Å; L536-V563 HydrophobicContact CD1-CG1 4.13Å; G560-V563 PolarHBondContact O-N 3.01Å; E561-V563 PolarHBondContact O-N 3.43Å; E561-V563 VanDerWaalsContact O-N 3.13Å; V563-N565 PolarHBondContact O-N 3.07Å
564	L	85.6	Confident	81.4	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.7	-29.8	172.3	-67.7	165.8	0	0	0	111.5	L536 V555 E561 P574 L590 A593 A595	L536-L564 HydrophobicContact CD1-CD2 3.99Å; V555-L564 HydrophobicContact CG1-CD1 3.96Å; V555-L564 HydrophobicContact CG1-CG 3.9Å; E561-L564 PolarHBondContact O-N 2.71Å; L564-P574 WeakPolarHBondContact O-CD 3.28Å; L564-L590 HydrophobicContact CD2-CD2 3.89Å; L564-A593 HydrophobicContact CD1-CB 4.09Å; L564-A593 WeakPolarHBondContact CD1-O 3.45Å; L564-A593 HydrophobicContact CD2-CB 4.49Å; L564-A595 HydrophobicContact CB-CB 4.21Å
565	N	89.8	Confident	82.2	Confident	38 Å²	38	53.3 Å²	53.3	20%	0.203	27%	0.271	C	S	.	.	S	Bend	trans	-106.5	4.7	-171.4	-65.8	-25.7	0	0	0	113.1	E561 E562 V563 D596 L599	E561-N565 PolarHBondContact O-N 3.29Å; E561-N565 PolarHBondContact O-ND2 2.92Å; E562-N565 CarbonylContact O-C 3.31Å; E562-N565 PolarHBondContact O-N 2.76Å; V563-N565 PolarHBondContact O-N 3.07Å; N565-D596 WeakPolarHBondContact OD1-CB 3.49Å; N565-D596 PolarHBondContact OD1-N 3.27Å; N565-L599 HydrophobicContact CB-CD1 3.76Å
566	M	88.1	Confident	83	Confident	54 Å²	54	53 Å²	53	27%	0.266	27%	0.269	S	S	.	.			trans	-59.2	147	167.7	-87.9	-175.9	140.7	0	0	110.8	A526 T534 H537 E562	A526-M566 HydrophobicContact CB-CE 3.91Å; A526-M566 HydrophobicContact CB-SD 3.94Å; T534-M566 HydrophobicContact CG2-CB 3.96Å; T534-M566 HydrophobicContact CG2-SD 3.77Å; H537-M566 PolarHBondContact CE1-O 3.07Å; E562-M566 WeakPolarHBondContact O-CG 3.17Å; E562-M566 PolarHBondContact O-N 2.92Å
567	R	92.3	Very high	83.9	Confident	104 Å²	104	50.4 Å²	50.4	39%	0.392	25%	0.25	S	C	.	.			trans	-123	136.3	-175.9	-75.7	-180	-72.7	-177	-1.2	111.7	Q528 Y571 Q572 T573	Q528-R567 PolarHBondContact NE2-O 2.87Å; Q528-R567 VanDerWaalsContact NE2-O 3.12Å; R567-Y571 WeakPolarHBondContact CD-O 3.47Å; R567-Y571 WeakPolarHBondContact CG-O 3.39Å; R567-Q572 VanDerWaalsContact CA-O 3.23Å; R567-Q572 WeakPolarHBondContact CA-O 3.3Å; R567-T573 HydrophobicContact CG-CG2 3.61Å
568	N	92.1	Very high	85	Confident	11 Å²	11	48 Å²	48	6%	0.059	23%	0.23	C	C	.	.			trans	-76.8	-176.7	174	73.4	8.4	0	0	0	112.5	G532 D533 L570 Y571 Q572	G532-N568 WeakPolarHBondContact O-CA 3.4Å; G532-N568 WeakPolarHBondContact O-CB 3.46Å; D533-N568 WeakPolarHBondContact OD1-CB 3.09Å; D533-N568 PolarHBondContact OD1-ND2 2.93Å; N568-L570 PolarHBondContact O-N 2.87Å; N568-L570 VanDerWaalsContact O-N 3.15Å; N568-L570 WeakPolarHBondContact OD1-CA 3.36Å; N568-L570 WeakPolarHBondContact OD1-CB 3.1Å; N568-L570 PolarHBondContact OD1-N 2.98Å; N568-Y571 WeakPolarHBondContact O-CA 3.39Å; N568-Y571 PolarHBondContact O-N 3.13Å; N568-Y571 PolarHBondContact OD1-N 2.92Å; N568-Q572 PolarHBondContact N-O 3.17Å; N568-Q572 PolarHBondContact OD1-N 2.75Å; N568-Q572 PolarHBondContact OD1-O 2.63Å
569	H	92.1	Very high	86.3	Confident	125 Å²	125	46.8 Å²	46.8	58%	0.579	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.6	-178.1	-65.5	-2	0	0	0	114.1	D531 Y571	D531-H569 VanDerWaalsContact O-CB 3.25Å; D531-H569 WeakPolarHBondContact O-CB 3.49Å; D531-H569 VanDerWaalsContact O-CG 3.23Å; D531-H569 PolarHBondContact O-N 3.3Å; H569-Y571 VanDerWaalsContact C-N 3.34Å
570	L	89.6	Confident	87.8	Confident	75 Å²	75	43.5 Å²	43.5	39%	0.393	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	6.3	169.6	-60.6	177.4	0	0	0	113.3	N568 Q572 R602	N568-L570 PolarHBondContact O-N 2.87Å; N568-L570 VanDerWaalsContact O-N 3.15Å; N568-L570 WeakPolarHBondContact OD1-CA 3.36Å; N568-L570 WeakPolarHBondContact OD1-CB 3.1Å; N568-L570 PolarHBondContact OD1-N 2.98Å; L570-Q572 HydrophobicContact CB-CG 4.1Å; L570-Q572 PolarHBondContact O-N 3.12Å; L570-R602 WeakPolarHBondContact O-CB 3.4Å; L570-R602 WeakPolarHBondContact O-CG 3.31Å; L570-R602 PolarHBondContact O-N 3Å
571	Y	92.2	Very high	89.3	Confident	133 Å²	133	46.1 Å²	46.1	52%	0.522	22%	0.216	S	C	.	.	S	Bend	trans	62.3	15.4	-173.3	-78.3	-117.5	0	0	0	114	R567 N568 H569	R567-Y571 WeakPolarHBondContact CD-O 3.47Å; R567-Y571 WeakPolarHBondContact CG-O 3.39Å; N568-Y571 WeakPolarHBondContact O-CA 3.39Å; N568-Y571 PolarHBondContact O-N 3.13Å; N568-Y571 PolarHBondContact OD1-N 2.92Å; H569-Y571 VanDerWaalsContact C-N 3.34Å
572	Q	93.8	Very high	90.6	Very high	28 Å²	28	42.1 Å²	42.1	13%	0.131	20%	0.198	C	C	.	.			trans	-83.6	146.1	177.7	-66.5	167.6	-17.9	0	0	110	H537 R567 N568 L570 H576 D601	H537-Q572 PolarHBondContact NE2-O 3.05Å; H537-Q572 VanDerWaalsContact NE2-O 3.14Å; R567-Q572 VanDerWaalsContact CA-O 3.23Å; R567-Q572 WeakPolarHBondContact CA-O 3.3Å; N568-Q572 PolarHBondContact N-O 3.17Å; N568-Q572 PolarHBondContact OD1-N 2.75Å; N568-Q572 PolarHBondContact OD1-O 2.63Å; L570-Q572 HydrophobicContact CB-CG 4.1Å; L570-Q572 PolarHBondContact O-N 3.12Å; Q572-H576 HydrophobicContact CB-CB 3.92Å; Q572-H576 HydrophobicContact CG-CB 4.23Å; Q572-D601 HydrophobicContact CG-CB 4.13Å
573	T	93.9	Very high	91.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.172	C	C	.	.			trans	-98.1	170.3	168.9	70.3	0	0	0	0	110.3	R567 L575 H576 L577 L599	R567-T573 HydrophobicContact CG-CG2 3.61Å; T573-L575 PolarHBondContact O-N 2.92Å; T573-L575 VanDerWaalsContact O-N 3.11Å; T573-L575 PolarHBondContact OG1-N 3.09Å; T573-H576 PolarHBondContact N-ND1 2.98Å; T573-H576 WeakPolarHBondContact O-CB 3.22Å; T573-H576 PolarHBondContact O-N 3.32Å; T573-H576 PolarHBondContact OG1-ND1 3.37Å; T573-L577 PolarHBondContact O-N 3.24Å; T573-L577 VanDerWaalsContact O-N 3.15Å; T573-L599 HydrophobicContact CG2-CB 4.46Å; T573-L599 HydrophobicContact CG2-CD1 3.95Å
574	P	93.1	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.1	-30.8	174.7	-23.8	34.3	0	0	0	113	L536 H537 V540 L564 L577 A578 L590	L536-P574 HydrophobicContact CB-CB 4.05Å; L536-P574 HydrophobicContact CB-CG 3.64Å; L536-P574 HydrophobicContact CD1-CG 4.44Å; H537-P574 VanDerWaalsContact CE1-CD 3.45Å; H537-P574 WeakPolarHBondContact CE1-CD 3.27Å; V540-P574 HydrophobicContact CG2-CB 4.44Å; L564-P574 WeakPolarHBondContact O-CD 3.28Å; P574-L577 PolarHBondContact O-N 2.87Å; P574-A578 WeakPolarHBondContact O-CB 3.08Å; P574-A578 PolarHBondContact O-N 2.61Å; P574-L590 HydrophobicContact CB-CD1 3.98Å; P574-L590 HydrophobicContact CB-CD2 4.31Å
575	L	94.4	Very high	92.3	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-70.7	-35.3	176.4	-174.4	65.4	0	0	0	112.4	T573 A578 V579 A587 L590 L591 A595 P597 V607	T573-L575 PolarHBondContact O-N 2.92Å; T573-L575 VanDerWaalsContact O-N 3.11Å; T573-L575 PolarHBondContact OG1-N 3.09Å; L575-A578 PolarHBondContact O-N 3.37Å; L575-V579 PolarHBondContact O-N 3.15Å; L575-V579 VanDerWaalsContact O-N 3.16Å; L575-A587 HydrophobicContact CD1-CB 4.06Å; L575-L590 HydrophobicContact CB-CD1 4.35Å; L575-L590 HydrophobicContact CD1-CB 4.03Å; L575-L590 HydrophobicContact CD1-CD1 4.44Å; L575-L591 HydrophobicContact CD1-CD1 4.29Å; L575-L591 HydrophobicContact CD1-CD2 4.44Å; L575-L591 HydrophobicContact CD1-CG 3.9Å; L575-L591 HydrophobicContact CD2-CD2 3.7Å; L575-L591 HydrophobicContact CD2-CG 4.09Å; L575-A595 HydrophobicContact CB-CB 4.49Å; L575-A595 HydrophobicContact CD2-CB 4.34Å; L575-P597 HydrophobicContact CD2-CB 4.3Å; L575-V607 HydrophobicContact CB-CG1 4.44Å; L575-V607 HydrophobicContact CD2-CG1 4.04Å; L575-V607 HydrophobicContact CD2-CG2 4.23Å; L575-V607 HydrophobicContact CG-CG1 3.96Å
576	H	94.6	Very high	92.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-45.2	171.7	-69.2	72.5	0	0	0	110.2	Q572 T573 A578 V579 I580 L599 D601 N605 L610	Q572-H576 HydrophobicContact CB-CB 3.92Å; Q572-H576 HydrophobicContact CG-CB 4.23Å; T573-H576 PolarHBondContact N-ND1 2.98Å; T573-H576 WeakPolarHBondContact O-CB 3.22Å; T573-H576 PolarHBondContact O-N 3.32Å; T573-H576 PolarHBondContact OG1-ND1 3.37Å; H576-A578 VanDerWaalsContact C-N 3.34Å; H576-A578 PolarHBondContact O-N 2.81Å; H576-V579 PolarHBondContact O-N 2.68Å; H576-I580 WeakPolarHBondContact O-CD1 3.46Å; H576-I580 VanDerWaalsContact O-CG1 3.27Å; H576-I580 WeakPolarHBondContact O-CG1 3.18Å; H576-I580 PolarHBondContact O-N 2.8Å; H576-L599 PolarHBondContact CE1-O 3.44Å; H576-L599 VanDerWaalsContact CE1-O 3.24Å; H576-L599 PolarHBondContact NE2-O 2.88Å; H576-D601 PolarHBondContact NE2-N 2.93Å; H576-N605 PolarHBondContact NE2-O 3.23Å; H576-L610 HydrophobicContact CB-CD1 4.09Å
577	L	93.4	Very high	92.6	Very high	15 Å²	15	40.8 Å²	40.8	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-37	175.5	-66.6	-174.5	0	0	0	112.7	H537 V540 T573 P574 V579 I580 T581	H537-L577 HydrophobicContact CB-CD1 3.78Å; V540-L577 HydrophobicContact CG1-CB 3.92Å; T573-L577 PolarHBondContact O-N 3.24Å; T573-L577 VanDerWaalsContact O-N 3.15Å; P574-L577 PolarHBondContact O-N 2.87Å; L577-V579 VanDerWaalsContact C-N 3.31Å; L577-V579 PolarHBondContact O-N 2.84Å; L577-I580 HydrophobicContact CD2-CD1 4.42Å; L577-I580 PolarHBondContact O-N 2.86Å; L577-T581 WeakPolarHBondContact O-CB 3.37Å; L577-T581 WeakPolarHBondContact O-CG2 3.35Å; L577-T581 PolarHBondContact O-N 3.36Å; L577-T581 PolarHBondContact O-OG1 3.06Å
578	A	94.1	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-35.9	178.1	0	0	0	0	0	112.1	V540 P574 L575 H576 T581 Q582 Q583 A586 A587 L590	V540-A578 HydrophobicContact CG1-CB 3.99Å; P574-A578 WeakPolarHBondContact O-CB 3.08Å; P574-A578 PolarHBondContact O-N 2.61Å; L575-A578 PolarHBondContact O-N 3.37Å; H576-A578 VanDerWaalsContact C-N 3.34Å; H576-A578 PolarHBondContact O-N 2.81Å; A578-T581 PolarHBondContact O-OG1 2.85Å; A578-Q582 PolarHBondContact O-N 2.84Å; A578-Q583 PolarHBondContact O-N 2.91Å; A578-A586 HydrophobicContact CB-CB 4.01Å; A578-A587 HydrophobicContact CB-CB 4.15Å; A578-L590 HydrophobicContact CB-CD1 4.18Å
579	V	94.1	Very high	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-73.8	-44.1	173.2	172.4	0	0	0	0	111.8	L575 H576 L577 T581 Q582 V607 L610 A611 M619 L623	L575-V579 PolarHBondContact O-N 3.15Å; L575-V579 VanDerWaalsContact O-N 3.16Å; H576-V579 PolarHBondContact O-N 2.68Å; L577-V579 VanDerWaalsContact C-N 3.31Å; L577-V579 PolarHBondContact O-N 2.84Å; V579-T581 VanDerWaalsContact C-N 3.28Å; V579-T581 PolarHBondContact O-N 3.37Å; V579-Q582 PolarHBondContact O-N 2.99Å; V579-Q582 VanDerWaalsContact O-N 3.1Å; V579-Q582 PolarHBondContact O-NE2 3.45Å; V579-V607 HydrophobicContact CG2-CB 4.26Å; V579-L610 HydrophobicContact CG1-CB 3.98Å; V579-A611 HydrophobicContact CG1-CB 3.68Å; V579-M619 HydrophobicContact CG1-CG 4.41Å; V579-M619 HydrophobicContact CG2-SD 4.32Å; V579-L623 HydrophobicContact CG2-CD1 4.31Å
580	I	92.9	Very high	92.4	Very high	52 Å²	52	35.1 Å²	35.1	27%	0.267	17%	0.168	S	C	.	.	H	α-helix	trans	-59.5	-41.4	177.4	-68.9	162.5	0	0	0	110.9	H576 L577 Q582 L610	H576-I580 WeakPolarHBondContact O-CD1 3.46Å; H576-I580 VanDerWaalsContact O-CG1 3.27Å; H576-I580 WeakPolarHBondContact O-CG1 3.18Å; H576-I580 PolarHBondContact O-N 2.8Å; L577-I580 HydrophobicContact CD2-CD1 4.42Å; L577-I580 PolarHBondContact O-N 2.86Å; I580-Q582 VanDerWaalsContact C-N 3.3Å; I580-Q582 PolarHBondContact O-N 3.32Å; I580-L610 HydrophobicContact CD1-CD1 3.98Å; I580-L610 HydrophobicContact CG1-CD1 3.98Å
581	T	91.9	Very high	92.4	Very high	59 Å²	59	32 Å²	32	36%	0.362	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	5.1	178.7	59.3	0	0	0	0	114.2	L577 A578 V579 Q583	L577-T581 WeakPolarHBondContact O-CB 3.37Å; L577-T581 WeakPolarHBondContact O-CG2 3.35Å; L577-T581 PolarHBondContact O-N 3.36Å; L577-T581 PolarHBondContact O-OG1 3.06Å; A578-T581 PolarHBondContact O-OG1 2.85Å; V579-T581 VanDerWaalsContact C-N 3.28Å; V579-T581 PolarHBondContact O-N 3.37Å; T581-Q583 PolarHBondContact O-N 3.3Å; T581-Q583 PolarHBondContact OG1-NE2 2.9Å; T581-Q583 VanDerWaalsContact OG1-NE2 3.14Å
582	Q	91.3	Very high	92.3	Very high	48 Å²	48	31.4 Å²	31.4	22%	0.224	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	24.1	179.3	-67.9	-61.1	-44.1	0	0	115.8	A578 V579 I580 K584 M619	A578-Q582 PolarHBondContact O-N 2.84Å; V579-Q582 PolarHBondContact O-N 2.99Å; V579-Q582 VanDerWaalsContact O-N 3.1Å; V579-Q582 PolarHBondContact O-NE2 3.45Å; I580-Q582 VanDerWaalsContact C-N 3.3Å; I580-Q582 PolarHBondContact O-N 3.32Å; Q582-K584 PolarHBondContact O-N 3.35Å; Q582-M619 VanDerWaalsContact C-CE 3.47Å; Q582-M619 VanDerWaalsContact OE1-CB 3.31Å
583	Q	91.7	Very high	91.9	Very high	22 Å²	22	31 Å²	31	10%	0.103	16%	0.158	C	C	.	.			trans	-82.9	81.7	-179.1	-66.8	-179.5	41	0	0	111.6	V540 A578 T581 Q585 A586 A587	V540-Q583 PolarHBondContact O-NE2 3.49Å; V540-Q583 PolarHBondContact O-OE1 3.33Å; A578-Q583 PolarHBondContact O-N 2.91Å; T581-Q583 PolarHBondContact O-N 3.3Å; T581-Q583 PolarHBondContact OG1-NE2 2.9Å; T581-Q583 VanDerWaalsContact OG1-NE2 3.14Å; Q583-Q585 VanDerWaalsContact C-N 3.33Å; Q583-Q585 PolarHBondContact O-N 3.24Å; Q583-A586 HydrophobicContact CB-CB 3.65Å; Q583-A586 WeakPolarHBondContact O-CB 2.99Å; Q583-A586 PolarHBondContact O-N 3.17Å; Q583-A587 PolarHBondContact O-N 3.45Å
584	K	91.6	Very high	91.5	Very high	74 Å²	74	33.1 Å²	33.1	32%	0.322	18%	0.18	S	C	.	.	H	α-helix	trans	-48.2	-48.3	-179.5	-71.7	-178	-177.8	178.2	0	113.6	Q582 A586 A587 E588 D617 M619 L622	Q582-K584 PolarHBondContact O-N 3.35Å; K584-A586 PolarHBondContact O-N 3.36Å; K584-A587 PolarHBondContact O-N 3.35Å; K584-E588 PolarHBondContact O-N 3.23Å; K584-D617 WeakPolarHBondContact CE-O 3.5Å; K584-D617 PolarHBondContact NZ-O 2.87Å; K584-M619 HydrophobicContact CG-CE 3.85Å; K584-M619 HydrophobicContact CG-SD 4.33Å; K584-L622 HydrophobicContact CB-CD1 3.71Å; K584-L622 HydrophobicContact CG-CD1 4.13Å
585	Q	91.1	Very high	91.3	Very high	108 Å²	108	33.3 Å²	33.3	51%	0.505	18%	0.182	S	C	.	.	H	α-helix	trans	-66.5	-35.9	179.2	-69.3	75.1	12.6	0	0	112.4	Q583 E588 V589	Q583-Q585 VanDerWaalsContact C-N 3.33Å; Q583-Q585 PolarHBondContact O-N 3.24Å; Q585-E588 PolarHBondContact O-N 3.05Å; Q585-V589 WeakPolarHBondContact O-CB 3.5Å; Q585-V589 VanDerWaalsContact O-CG2 3.23Å; Q585-V589 WeakPolarHBondContact O-CG2 3.33Å; Q585-V589 PolarHBondContact O-N 3.48Å
586	A	91.4	Very high	91.1	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-67.3	-43.5	176.5	0	0	0	0	0	111.3	L548 A578 Q583 K584 V589 L590	L548-A586 HydrophobicContact CD2-CB 3.42Å; L548-A586 VanDerWaalsContact CD2-CB 3.42Å; A578-A586 HydrophobicContact CB-CB 4.01Å; Q583-A586 HydrophobicContact CB-CB 3.65Å; Q583-A586 WeakPolarHBondContact O-CB 2.99Å; Q583-A586 PolarHBondContact O-N 3.17Å; K584-A586 PolarHBondContact O-N 3.36Å; A586-V589 PolarHBondContact O-N 2.92Å; A586-L590 WeakPolarHBondContact O-CB 3.19Å; A586-L590 WeakPolarHBondContact O-CG 3.42Å; A586-L590 PolarHBondContact O-N 3.41Å
587	A	92.6	Very high	90.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-42.9	175.3	0	0	0	0	0	111.9	L575 A578 Q583 K584 L591 M619	L575-A587 HydrophobicContact CD1-CB 4.06Å; A578-A587 HydrophobicContact CB-CB 4.15Å; Q583-A587 PolarHBondContact O-N 3.45Å; K584-A587 PolarHBondContact O-N 3.35Å; A587-L591 WeakPolarHBondContact O-CB 3.46Å; A587-L591 WeakPolarHBondContact O-CD1 3.34Å; A587-L591 VanDerWaalsContact O-CG 3.31Å; A587-L591 WeakPolarHBondContact O-CG 3.26Å; A587-L591 PolarHBondContact O-N 2.9Å; A587-M619 HydrophobicContact CB-SD 4.42Å
588	E	91.4	Very high	90.7	Very high	88 Å²	88	38.6 Å²	38.6	41%	0.411	21%	0.213	S	C	.	.	H	α-helix	trans	-63.1	-43.7	176.4	-176	167	-145.9	0	0	112.5	K584 Q585 L591 L592 L622	K584-E588 PolarHBondContact O-N 3.23Å; Q585-E588 PolarHBondContact O-N 3.05Å; E588-L591 PolarHBondContact O-N 3.5Å; E588-L592 HydrophobicContact CG-CD1 4.21Å; E588-L592 WeakPolarHBondContact O-CB 3.4Å; E588-L592 VanDerWaalsContact O-CG 3.29Å; E588-L592 WeakPolarHBondContact O-CG 3.49Å; E588-L592 PolarHBondContact O-N 2.94Å; E588-L622 HydrophobicContact CB-CD2 4.46Å
589	V	91	Very high	90.6	Very high	33 Å²	33	40.2 Å²	40.2	20%	0.2	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-44.6	177.5	165.2	0	0	0	0	112	T549 T552 Q585 A586 L592 A593	T549-V589 HydrophobicContact CG2-CB 4.48Å; T549-V589 HydrophobicContact CG2-CG1 3.9Å; T549-V589 HydrophobicContact CG2-CG2 3.78Å; T552-V589 HydrophobicContact CG2-CG1 3.94Å; Q585-V589 WeakPolarHBondContact O-CB 3.5Å; Q585-V589 VanDerWaalsContact O-CG2 3.23Å; Q585-V589 WeakPolarHBondContact O-CG2 3.33Å; Q585-V589 PolarHBondContact O-N 3.48Å; A586-V589 PolarHBondContact O-N 2.92Å; V589-L592 PolarHBondContact O-N 3.05Å; V589-A593 PolarHBondContact O-N 3.44Å
590	L	90.8	Very high	90.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-41.7	177.5	-74	167.6	0	0	0	111.8	V540 L548 L564 P574 L575 A578 A586 A593 G594 A595	V540-L590 HydrophobicContact CG2-CD1 4.18Å; L548-L590 HydrophobicContact CD1-CD2 4.16Å; L548-L590 HydrophobicContact CD1-CG 4.42Å; L564-L590 HydrophobicContact CD2-CD2 3.89Å; P574-L590 HydrophobicContact CB-CD1 3.98Å; P574-L590 HydrophobicContact CB-CD2 4.31Å; L575-L590 HydrophobicContact CB-CD1 4.35Å; L575-L590 HydrophobicContact CD1-CB 4.03Å; L575-L590 HydrophobicContact CD1-CD1 4.44Å; A578-L590 HydrophobicContact CB-CD1 4.18Å; A586-L590 WeakPolarHBondContact O-CB 3.19Å; A586-L590 WeakPolarHBondContact O-CG 3.42Å; A586-L590 PolarHBondContact O-N 3.41Å; L590-A593 PolarHBondContact O-N 3.21Å; L590-G594 PolarHBondContact O-N 2.73Å; L590-A595 HydrophobicContact CB-CB 4.07Å; L590-A595 VanDerWaalsContact O-CB 3.26Å; L590-A595 WeakPolarHBondContact O-CB 3.45Å; L590-A595 PolarHBondContact O-N 3.09Å; L590-A595 VanDerWaalsContact O-N 3.14Å
591	L	89.8	Confident	90.5	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-70.8	-27	175.7	-72.7	166.6	0	0	0	113.5	L575 A587 E588 A593 P597 L623 R626	L575-L591 HydrophobicContact CD1-CD1 4.29Å; L575-L591 HydrophobicContact CD1-CD2 4.44Å; L575-L591 HydrophobicContact CD1-CG 3.9Å; L575-L591 HydrophobicContact CD2-CD2 3.7Å; L575-L591 HydrophobicContact CD2-CG 4.09Å; A587-L591 WeakPolarHBondContact O-CB 3.46Å; A587-L591 WeakPolarHBondContact O-CD1 3.34Å; A587-L591 VanDerWaalsContact O-CG 3.31Å; A587-L591 WeakPolarHBondContact O-CG 3.26Å; A587-L591 PolarHBondContact O-N 2.9Å; E588-L591 PolarHBondContact O-N 3.5Å; L591-A593 PolarHBondContact O-N 3.12Å; L591-P597 HydrophobicContact CD2-CB 4.35Å; L591-P597 HydrophobicContact CD2-CG 4.49Å; L591-L623 HydrophobicContact CD1-CD2 3.63Å; L591-R626 PolarHBondContact O-NH1 3.05Å
592	L	88.3	Confident	90.5	Very high	121 Å²	121	44.9 Å²	44.9	63%	0.634	24%	0.236	S	C	*	.	H	α-helix	trans	-67.7	-21.4	171.1	-80.6	169.5	0	0	0	112.9	E588 V589 R626	E588-L592 HydrophobicContact CG-CD1 4.21Å; E588-L592 WeakPolarHBondContact O-CB 3.4Å; E588-L592 VanDerWaalsContact O-CG 3.29Å; E588-L592 WeakPolarHBondContact O-CG 3.49Å; E588-L592 PolarHBondContact O-N 2.94Å; V589-L592 PolarHBondContact O-N 3.05Å; L592-R626 VanDerWaalsContact CD2-NH2 3.29Å; L592-R626 VanDerWaalsContact CG-NH2 3.34Å
593	A	85.6	Confident	90.5	Very high	18 Å²	18	47.2 Å²	47.2	15%	0.149	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	1.8	-176.3	0	0	0	0	0	114.9	T552 S556 L564 V589 L590 L591	T552-A593 HydrophobicContact CG2-CB 3.17Å; S556-A593 WeakPolarHBondContact OG-CB 3.37Å; L564-A593 HydrophobicContact CD1-CB 4.09Å; L564-A593 WeakPolarHBondContact CD1-O 3.45Å; L564-A593 HydrophobicContact CD2-CB 4.49Å; V589-A593 PolarHBondContact O-N 3.44Å; L590-A593 PolarHBondContact O-N 3.21Å; L591-A593 PolarHBondContact O-N 3.12Å
594	G	86.6	Confident	90.5	Very high	45 Å²	45	46.8 Å²	46.8	46%	0.464	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	25.6	180	0	0	0	0	0	115.2	L590 D596	L590-G594 PolarHBondContact O-N 2.73Å; G594-D596 PolarHBondContact O-N 2.93Å
595	A	89.4	Confident	90.6	Very high	5 Å²	5	43.9 Å²	43.9	4%	0.041	24%	0.236	C	C	.	.			trans	-62.2	128.6	164.5	0	0	0	0	0	109.9	L564 L575 L590 P597	L564-A595 HydrophobicContact CB-CB 4.21Å; L575-A595 HydrophobicContact CB-CB 4.49Å; L575-A595 HydrophobicContact CD2-CB 4.34Å; L590-A595 HydrophobicContact CB-CB 4.07Å; L590-A595 VanDerWaalsContact O-CB 3.26Å; L590-A595 WeakPolarHBondContact O-CB 3.45Å; L590-A595 PolarHBondContact O-N 3.09Å; L590-A595 VanDerWaalsContact O-N 3.14Å; A595-P597 WeakPolarHBondContact O-CD 3.22Å
596	D	88.7	Confident	90.7	Very high	48 Å²	48	38.8 Å²	38.8	26%	0.257	21%	0.212	S	C	.	.			trans	-79.7	114.9	-173	179.6	-2.7	0	0	0	111.1	N565 G594 T598 L599	N565-D596 WeakPolarHBondContact OD1-CB 3.49Å; N565-D596 PolarHBondContact OD1-N 3.27Å; G594-D596 PolarHBondContact O-N 2.93Å; D596-T598 VanDerWaalsContact C-N 3.34Å; D596-T598 WeakPolarHBondContact OD1-CA 3.35Å; D596-T598 VanDerWaalsContact OD1-CB 3.24Å; D596-T598 WeakPolarHBondContact OD1-CB 3.29Å; D596-T598 VanDerWaalsContact OD1-CG2 3.31Å; D596-T598 WeakPolarHBondContact OD1-CG2 3.36Å; D596-T598 PolarHBondContact OD1-N 3.18Å; D596-T598 PolarHBondContact OD1-OG1 2.92Å; D596-T598 PolarHBondContact OD2-OG1 3.41Å; D596-L599 HydrophobicContact CB-CD1 3.93Å; D596-L599 HydrophobicContact CB-CG 4.05Å
597	P	89.6	Confident	90.7	Very high	9 Å²	9	38.7 Å²	38.7	6%	0.058	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.5	179.6	35.1	-35.5	0	0	0	113.8	L575 L591 A595 L599 V607 E628 M629 L632	L575-P597 HydrophobicContact CD2-CB 4.3Å; L591-P597 HydrophobicContact CD2-CB 4.35Å; L591-P597 HydrophobicContact CD2-CG 4.49Å; A595-P597 WeakPolarHBondContact O-CD 3.22Å; P597-L599 VanDerWaalsContact C-N 3.29Å; P597-V607 HydrophobicContact CB-CG2 3.89Å; P597-E628 HydrophobicContact CG-CB 4.44Å; P597-M629 HydrophobicContact CB-CE 4.28Å; P597-M629 HydrophobicContact CB-SD 3.3Å; P597-M629 WeakPolarHBondContact CB-SD 3.43Å; P597-M629 HydrophobicContact CG-SD 3.73Å; P597-L632 HydrophobicContact CB-CD1 3.9Å; P597-L632 HydrophobicContact CG-CD1 4.05Å; P597-L632 VanDerWaalsContact O-CD1 3.29Å; P597-L632 WeakPolarHBondContact O-CD1 3.48Å
598	T	90.4	Very high	90.8	Very high	69 Å²	69	38.7 Å²	38.7	42%	0.423	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-21.6	-180	77.7	0	0	0	0	112.1	D596 L632	D596-T598 VanDerWaalsContact C-N 3.34Å; D596-T598 WeakPolarHBondContact OD1-CA 3.35Å; D596-T598 VanDerWaalsContact OD1-CB 3.24Å; D596-T598 WeakPolarHBondContact OD1-CB 3.29Å; D596-T598 VanDerWaalsContact OD1-CG2 3.31Å; D596-T598 WeakPolarHBondContact OD1-CG2 3.36Å; D596-T598 PolarHBondContact OD1-N 3.18Å; D596-T598 PolarHBondContact OD1-OG1 2.92Å; D596-T598 PolarHBondContact OD2-OG1 3.41Å; T598-L632 HydrophobicContact CG2-CD1 4.5Å; T598-L632 HydrophobicContact CG2-CD2 4.06Å
599	L	91.3	Very high	90.9	Very high	35 Å²	35	34.5 Å²	34.5	18%	0.183	19%	0.192	C	C	.	.			trans	-60.7	147	173.8	-62.7	175	0	0	0	111.3	N565 T573 H576 D596 P597	N565-L599 HydrophobicContact CB-CD1 3.76Å; T573-L599 HydrophobicContact CG2-CB 4.46Å; T573-L599 HydrophobicContact CG2-CD1 3.95Å; H576-L599 PolarHBondContact CE1-O 3.44Å; H576-L599 VanDerWaalsContact CE1-O 3.24Å; H576-L599 PolarHBondContact NE2-O 2.88Å; D596-L599 HydrophobicContact CB-CD1 3.93Å; D596-L599 HydrophobicContact CB-CG 4.05Å; P597-L599 VanDerWaalsContact C-N 3.29Å
600	T	93	Very high	91	Very high	49 Å²	49	33.3 Å²	33.3	30%	0.301	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-121.7	149.9	-177.2	60.5	0	0	0	0	112.9	G604 N605 T606	T600-G604 WeakPolarHBondContact CG2-O 3.35Å; T600-N605 VanDerWaalsContact CA-O 3.28Å; T600-N605 WeakPolarHBondContact CA-O 3.46Å; T600-T606 HydrophobicContact CG2-CG2 3.79Å
601	D	92.5	Very high	91.2	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.043	19%	0.185	C	C	.	.			trans	-67.7	-179.4	168.4	79.6	-2.8	0	0	0	113.1	Q572 H576 H603 G604 N605	Q572-D601 HydrophobicContact CG-CB 4.13Å; H576-D601 PolarHBondContact NE2-N 2.93Å; D601-H603 PolarHBondContact O-N 3.13Å; D601-H603 VanDerWaalsContact OD1-C 3.27Å; D601-H603 VanDerWaalsContact OD1-CA 3.25Å; D601-H603 WeakPolarHBondContact OD1-CA 3.28Å; D601-H603 WeakPolarHBondContact OD1-CB 3.37Å; D601-H603 PolarHBondContact OD1-N 3.38Å; D601-H603 IonicContact OD2-CD2 3.19Å; D601-G604 PolarHBondContact O-N 3.46Å; D601-G604 PolarHBondContact OD1-N 2.61Å; D601-N605 PolarHBondContact N-O 3.16Å; D601-N605 WeakPolarHBondContact OD1-CB 3.33Å; D601-N605 PolarHBondContact OD1-N 3.12Å; D601-N605 PolarHBondContact OD1-ND2 3.16Å; D601-N605 PolarHBondContact OD2-ND2 2.94Å
602	R	92.3	Very high	91.3	Very high	151 Å²	151	32.9 Å²	32.9	57%	0.57	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-9.6	176.1	66.7	-178.2	-60.3	-167.4	3.5	115.6	L570	L570-R602 WeakPolarHBondContact O-CB 3.4Å; L570-R602 WeakPolarHBondContact O-CG 3.31Å; L570-R602 PolarHBondContact O-N 3Å
603	H	90.3	Very high	91.5	Very high	98 Å²	98	31.2 Å²	31.2	45%	0.454	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	5.9	177.4	-56	-72.9	0	0	0	111.8	D601 N605 T638	D601-H603 PolarHBondContact O-N 3.13Å; D601-H603 VanDerWaalsContact OD1-C 3.27Å; D601-H603 VanDerWaalsContact OD1-CA 3.25Å; D601-H603 WeakPolarHBondContact OD1-CA 3.28Å; D601-H603 WeakPolarHBondContact OD1-CB 3.37Å; D601-H603 PolarHBondContact OD1-N 3.38Å; D601-H603 IonicContact OD2-CD2 3.19Å; H603-N605 WeakPolarHBondContact CB-ND2 3.47Å; H603-N605 PolarHBondContact O-N 3.26Å; H603-T638 WeakPolarHBondContact O-CG2 3.44Å; H603-T638 PolarHBondContact O-N 3.43Å; H603-T638 PolarHBondContact O-OG1 2.97Å
604	G	91.8	Very high	91.7	Very high	12 Å²	12	33.1 Å²	33.1	12%	0.124	18%	0.177	C	C	.	.	S	Bend	trans	74.5	8.5	-176.3	0	0	0	0	0	113.9	T600 D601 T606 N637	T600-G604 WeakPolarHBondContact CG2-O 3.35Å; D601-G604 PolarHBondContact O-N 3.46Å; D601-G604 PolarHBondContact OD1-N 2.61Å; G604-T606 PolarHBondContact O-N 3.39Å; G604-N637 WeakPolarHBondContact O-CA 3.27Å; G604-N637 WeakPolarHBondContact O-CB 3.28Å
605	N	93.8	Very high	91.5	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.07	19%	0.189	C	C	.	.			trans	-73.1	125	176.2	-59.2	-47.2	0	0	0	108.9	H576 T600 D601 H603 H609 L610 N637	H576-N605 PolarHBondContact NE2-O 3.23Å; T600-N605 VanDerWaalsContact CA-O 3.28Å; T600-N605 WeakPolarHBondContact CA-O 3.46Å; D601-N605 PolarHBondContact N-O 3.16Å; D601-N605 WeakPolarHBondContact OD1-CB 3.33Å; D601-N605 PolarHBondContact OD1-N 3.12Å; D601-N605 PolarHBondContact OD1-ND2 3.16Å; D601-N605 PolarHBondContact OD2-ND2 2.94Å; H603-N605 WeakPolarHBondContact CB-ND2 3.47Å; H603-N605 PolarHBondContact O-N 3.26Å; N605-H609 HydrophobicContact CB-CB 3.72Å; N605-L610 HydrophobicContact CB-CD2 3.92Å; N605-L610 HydrophobicContact CB-CG 4.09Å; N605-N637 WeakPolarHBondContact OD1-CB 3.4Å; N605-N637 PolarHBondContact OD1-ND2 3.31Å
606	T	93.3	Very high	90.7	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-74.1	169.8	161	66.7	0	0	0	0	110	T600 G604 L608 H609 L610	T600-T606 HydrophobicContact CG2-CG2 3.79Å; G604-T606 PolarHBondContact O-N 3.39Å; T606-L608 PolarHBondContact O-N 3.2Å; T606-L608 VanDerWaalsContact O-N 3.08Å; T606-H609 PolarHBondContact N-ND1 2.75Å; T606-H609 WeakPolarHBondContact O-CB 3.33Å; T606-H609 PolarHBondContact O-N 3.14Å; T606-H609 PolarHBondContact OG1-ND1 3.32Å; T606-L610 PolarHBondContact O-N 3.47Å
607	V	93.3	Very high	90.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-25.6	177.2	-55.8	0	0	0	0	113.4	L575 V579 P597 A611 M629	L575-V607 HydrophobicContact CB-CG1 4.44Å; L575-V607 HydrophobicContact CD2-CG1 4.04Å; L575-V607 HydrophobicContact CD2-CG2 4.23Å; L575-V607 HydrophobicContact CG-CG1 3.96Å; V579-V607 HydrophobicContact CG2-CB 4.26Å; P597-V607 HydrophobicContact CB-CG2 3.89Å; V607-A611 WeakPolarHBondContact O-CB 3.44Å; V607-A611 PolarHBondContact O-N 2.81Å; V607-M629 HydrophobicContact CG2-CE 3.68Å; V607-M629 HydrophobicContact CG2-SD 4.21Å
608	L	93.4	Very high	89.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-74.4	-34.8	174.9	-167.5	63.2	0	0	0	113	T606 L610 A611 A612 V620 L623 L624 M629 L633 A643 L659	T606-L608 PolarHBondContact O-N 3.2Å; T606-L608 VanDerWaalsContact O-N 3.08Å; L608-L610 VanDerWaalsContact C-N 3.34Å; L608-A611 PolarHBondContact O-N 2.98Å; L608-A612 WeakPolarHBondContact O-CB 3.39Å; L608-A612 PolarHBondContact O-N 2.76Å; L608-V620 HydrophobicContact CD1-CG1 4.24Å; L608-L623 HydrophobicContact CD1-CB 4.45Å; L608-L623 HydrophobicContact CD1-CD1 4.25Å; L608-L624 HydrophobicContact CD1-CD2 4.27Å; L608-L624 HydrophobicContact CD1-CG 4.37Å; L608-L624 HydrophobicContact CD2-CD2 4.33Å; L608-M629 HydrophobicContact CB-CE 3.78Å; L608-M629 HydrophobicContact CD1-CE 4.3Å; L608-M629 HydrophobicContact CG-CE 4.44Å; L608-L633 HydrophobicContact CD2-CD2 3.78Å; L608-L633 HydrophobicContact CD2-CG 4.09Å; L608-A643 HydrophobicContact CD2-CB 4.32Å; L608-A643 HydrophobicContact CG-CB 4.05Å; L608-L659 HydrophobicContact CD1-CD2 4.18Å; L608-L659 HydrophobicContact CD2-CD2 4.36Å; L608-L659 HydrophobicContact CG-CD2 4.26Å
609	H	94.3	Very high	89.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-42.1	173.8	-72.8	80.6	0	0	0	110.9	N605 T606 A612 Q613 F635 N637 L641 L646	N605-H609 HydrophobicContact CB-CB 3.72Å; T606-H609 PolarHBondContact N-ND1 2.75Å; T606-H609 WeakPolarHBondContact O-CB 3.33Å; T606-H609 PolarHBondContact O-N 3.14Å; T606-H609 PolarHBondContact OG1-ND1 3.32Å; H609-A612 PolarHBondContact O-N 3.11Å; H609-Q613 PolarHBondContact O-N 2.84Å; H609-F635 PolarHBondContact CE1-O 2.98Å; H609-F635 PolarHBondContact NE2-O 2.96Å; H609-F635 VanDerWaalsContact NE2-O 3.1Å; H609-N637 PolarHBondContact NE2-N 3.18Å; H609-L641 PolarHBondContact CD2-O 3.34Å; H609-L641 PolarHBondContact NE2-O 3.1Å; H609-L641 VanDerWaalsContact NE2-O 3.09Å; H609-L646 HydrophobicContact CB-CD1 3.61Å
610	L	93.4	Very high	89.9	Confident	8 Å²	8	37.8 Å²	37.8	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-45.9	175.3	-62.1	179.9	0	0	0	111.2	H576 V579 I580 N605 T606 L608 A612 Q613 Q614	H576-L610 HydrophobicContact CB-CD1 4.09Å; V579-L610 HydrophobicContact CG1-CB 3.98Å; I580-L610 HydrophobicContact CD1-CD1 3.98Å; I580-L610 HydrophobicContact CG1-CD1 3.98Å; N605-L610 HydrophobicContact CB-CD2 3.92Å; N605-L610 HydrophobicContact CB-CG 4.09Å; T606-L610 PolarHBondContact O-N 3.47Å; L608-L610 VanDerWaalsContact C-N 3.34Å; L610-A612 PolarHBondContact O-N 2.95Å; L610-Q613 PolarHBondContact O-N 2.9Å; L610-Q614 WeakPolarHBondContact O-CG 3.18Å; L610-Q614 PolarHBondContact O-N 3.01Å
611	A	93.7	Very high	89.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-58.6	-36.7	178.2	0	0	0	0	0	112.6	V579 V607 L608 Q613 M619 V620 L623	V579-A611 HydrophobicContact CG1-CB 3.68Å; V607-A611 WeakPolarHBondContact O-CB 3.44Å; V607-A611 PolarHBondContact O-N 2.81Å; L608-A611 PolarHBondContact O-N 2.98Å; A611-Q613 VanDerWaalsContact C-N 3.28Å; A611-Q613 PolarHBondContact O-N 3.19Å; A611-M619 HydrophobicContact CB-CG 4.07Å; A611-V620 HydrophobicContact CB-CG2 3.61Å; A611-L623 HydrophobicContact CB-CD1 3.61Å
612	A	93.1	Very high	89.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-20.4	176.5	0	0	0	0	0	114.6	L608 H609 L610 A643 L646 A647 R652 L659	L608-A612 WeakPolarHBondContact O-CB 3.39Å; L608-A612 PolarHBondContact O-N 2.76Å; H609-A612 PolarHBondContact O-N 3.11Å; L610-A612 PolarHBondContact O-N 2.95Å; A612-A643 HydrophobicContact CB-CB 4.27Å; A612-A643 WeakPolarHBondContact CB-O 3.21Å; A612-L646 HydrophobicContact CB-CB 4.49Å; A612-A647 HydrophobicContact CB-CB 4.21Å; A612-A647 WeakPolarHBondContact O-CA 3.46Å; A612-R652 WeakPolarHBondContact O-CG 3.25Å; A612-L659 HydrophobicContact CB-CD1 4.1Å
613	Q	92.2	Very high	89.6	Confident	86 Å²	86	33.3 Å²	33.3	40%	0.402	17%	0.174	S	C	.	.	H	α-helix	trans	-92.7	-32.6	-176.7	-170	179.1	16.3	0	0	113.3	H609 L610 A611 A650 R652	H609-Q613 PolarHBondContact O-N 2.84Å; L610-Q613 PolarHBondContact O-N 2.9Å; A611-Q613 VanDerWaalsContact C-N 3.28Å; A611-Q613 PolarHBondContact O-N 3.19Å; Q613-A650 HydrophobicContact CG-CB 4.09Å; Q613-R652 PolarHBondContact O-NE 2.99Å; Q613-R652 PolarHBondContact O-NH2 3.22Å
614	Q	90.1	Very high	89.5	Confident	58 Å²	58	29 Å²	29	27%	0.271	15%	0.154	S	C	.	.	S	Bend	trans	-77.2	168.4	-170.6	-64.5	-61.7	-17.6	0	0	113.9	L610 G616 R652	L610-Q614 WeakPolarHBondContact O-CG 3.18Å; L610-Q614 PolarHBondContact O-N 3.01Å; Q614-G616 VanDerWaalsContact C-N 3.33Å; Q614-G616 PolarHBondContact O-N 2.69Å; Q614-R652 PolarHBondContact O-NE 2.94Å
615	E	81	Confident	89.4	Confident	152 Å²	152	36.2 Å²	36.2	71%	0.71	18%	0.178	S	C	*	.	S	Bend	trans	-91.2	25.6	-172.2	-40.6	-140.5	114.8	0	0	114.1	R652	E615-R652 IonicContact OE1-CZ 2.78Å; E615-R652 IonicContact OE1-NH1 2.68Å; E615-R652 PolarHBondContact OE1-NH1 2.94Å; E615-R652 IonicContact OE1-NH2 3.31Å; E615-R652 PolarHBondContact OE1-NH2 2.73Å
616	G	74.1	Confident	89	Confident	23 Å²	23	38.7 Å²	38.7	24%	0.237	19%	0.186	C	C	.	.			trans	-114.6	110.2	-173.1	0	0	0	0	0	114.7	Q614	Q614-G616 VanDerWaalsContact C-N 3.33Å; Q614-G616 PolarHBondContact O-N 2.69Å
617	D	75.3	Confident	88.4	Confident	118 Å²	118	47.6 Å²	47.6	63%	0.631	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	140	173.7	-60.5	-37.2	0	0	0	111.8	K584 M619	K584-D617 WeakPolarHBondContact CE-O 3.5Å; K584-D617 PolarHBondContact NZ-O 2.87Å; D617-M619 PolarHBondContact O-N 3.41Å; D617-M619 VanDerWaalsContact O-N 3.16Å
618	G	84.3	Confident	87.9	Confident	14 Å²	14	52.6 Å²	52.6	14%	0.144	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	8.3	170.7	0	0	0	0	0	116.2	L622 E658	G618-L622 WeakPolarHBondContact O-CB 3.34Å; G618-L622 PolarHBondContact O-N 2.62Å; G618-E658 WeakPolarHBondContact CA-OE1 3.33Å; G618-E658 VanDerWaalsContact CA-OE2 3.22Å; G618-E658 WeakPolarHBondContact CA-OE2 3.32Å; G618-E658 PolarHBondContact N-OE1 3Å; G618-E658 PolarHBondContact N-OE2 3.03Å
619	M	90.8	Very high	87.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.3	-39.9	167.8	177.9	61.3	82.7	0	0	110.7	V579 Q582 K584 A587 A611 D617 L622 L623	V579-M619 HydrophobicContact CG1-CG 4.41Å; V579-M619 HydrophobicContact CG2-SD 4.32Å; Q582-M619 VanDerWaalsContact C-CE 3.47Å; Q582-M619 VanDerWaalsContact OE1-CB 3.31Å; K584-M619 HydrophobicContact CG-CE 3.85Å; K584-M619 HydrophobicContact CG-SD 4.33Å; A587-M619 HydrophobicContact CB-SD 4.42Å; A611-M619 HydrophobicContact CB-CG 4.07Å; D617-M619 PolarHBondContact O-N 3.41Å; D617-M619 VanDerWaalsContact O-N 3.16Å; M619-L622 PolarHBondContact O-N 2.85Å; M619-L623 WeakPolarHBondContact O-CG 3.42Å; M619-L623 PolarHBondContact O-N 2.7Å
620	V	91.6	Very high	87	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-42.5	176.8	170.5	0	0	0	0	110.2	L608 A611 L622 L623 L624 A655 E658 L659	L608-V620 HydrophobicContact CD1-CG1 4.24Å; A611-V620 HydrophobicContact CB-CG2 3.61Å; V620-L622 PolarHBondContact O-N 3.32Å; V620-L623 PolarHBondContact O-N 2.71Å; V620-L624 HydrophobicContact CG1-CD1 3.47Å; V620-L624 VanDerWaalsContact CG1-CD1 3.47Å; V620-L624 HydrophobicContact CG1-CG 4.24Å; V620-L624 WeakPolarHBondContact O-CB 3.27Å; V620-L624 VanDerWaalsContact O-CG 3.25Å; V620-L624 WeakPolarHBondContact O-CG 3.45Å; V620-L624 PolarHBondContact O-N 2.89Å; V620-A655 HydrophobicContact CG2-CB 4.21Å; V620-E658 HydrophobicContact CB-CB 3.99Å; V620-E658 WeakPolarHBondContact CB-OE2 3.36Å; V620-E658 HydrophobicContact CG1-CB 3.73Å; V620-E658 PolarHBondContact N-OE2 2.76Å; V620-L659 HydrophobicContact CG1-CD2 3.72Å; V620-L659 HydrophobicContact CG1-CG 3.9Å
621	E	91.3	Very high	86.6	Confident	89 Å²	89	63.6 Å²	63.6	42%	0.416	29%	0.289	S	S	.	.	H	α-helix	trans	-56.9	-46.2	173.6	-160.2	-120.2	121.4	0	0	112	L623 L624 R625 E658	E621-L623 VanDerWaalsContact C-N 3.34Å; E621-L623 PolarHBondContact O-N 2.8Å; E621-L624 PolarHBondContact O-N 3.18Å; E621-R625 WeakPolarHBondContact O-CG 3.43Å; E621-R625 PolarHBondContact O-N 2.99Å; E621-R625 IonicContact OE1-CZ 2.69Å; E621-R625 IonicContact OE1-NE 3.59Å; E621-R625 PolarHBondContact OE1-NE 3.31Å; E621-R625 IonicContact OE1-NH2 2.77Å; E621-R625 PolarHBondContact OE1-NH2 2.77Å; E621-R625 IonicContact OE2-NH2 3.14Å; E621-R625 PolarHBondContact OE2-NH2 2.88Å; E621-E658 HydrophobicContact CB-CG 4.18Å; E621-E658 WeakPolarHBondContact CB-OE2 3.31Å; E621-E658 PolarHBondContact N-OE2 3.38Å
622	L	89.7	Confident	86.3	Confident	25 Å²	25	63.8 Å²	63.8	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-43.4	177.8	-178.7	152.7	0	0	0	112.2	K584 E588 G618 M619 V620	K584-L622 HydrophobicContact CB-CD1 3.71Å; K584-L622 HydrophobicContact CG-CD1 4.13Å; E588-L622 HydrophobicContact CB-CD2 4.46Å; G618-L622 WeakPolarHBondContact O-CB 3.34Å; G618-L622 PolarHBondContact O-N 2.62Å; M619-L622 PolarHBondContact O-N 2.85Å; V620-L622 PolarHBondContact O-N 3.32Å
623	L	90.6	Very high	86	Confident	0 Å²	0	64 Å²	64	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-48.4	176.6	-66.5	173.3	0	0	0	111.1	V579 L591 L608 A611 M619 V620 E621 R625 R626 M629	V579-L623 HydrophobicContact CG2-CD1 4.31Å; L591-L623 HydrophobicContact CD1-CD2 3.63Å; L608-L623 HydrophobicContact CD1-CB 4.45Å; L608-L623 HydrophobicContact CD1-CD1 4.25Å; A611-L623 HydrophobicContact CB-CD1 3.61Å; M619-L623 WeakPolarHBondContact O-CG 3.42Å; M619-L623 PolarHBondContact O-N 2.7Å; V620-L623 PolarHBondContact O-N 2.71Å; E621-L623 VanDerWaalsContact C-N 3.34Å; E621-L623 PolarHBondContact O-N 2.8Å; L623-R625 PolarHBondContact O-N 2.83Å; L623-R625 VanDerWaalsContact O-N 3.1Å; L623-R626 PolarHBondContact O-N 2.91Å; L623-M629 HydrophobicContact CB-CE 4.16Å; L623-M629 HydrophobicContact CB-CG 4.14Å; L623-M629 HydrophobicContact CD1-CE 4.35Å; L623-M629 HydrophobicContact CD2-CE 4.47Å; L623-M629 VanDerWaalsContact O-CB 3.3Å; L623-M629 WeakPolarHBondContact O-CB 3.46Å; L623-M629 WeakPolarHBondContact O-CG 3.32Å
624	L	89.6	Confident	85.7	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.037	29%	0.291	C	S	.	.	H	α-helix	trans	-70.2	-5.5	-175.1	-66.2	168.6	0	0	0	115	L608 V620 E621 R630 L633 E658 L659	L608-L624 HydrophobicContact CD1-CD2 4.27Å; L608-L624 HydrophobicContact CD1-CG 4.37Å; L608-L624 HydrophobicContact CD2-CD2 4.33Å; V620-L624 HydrophobicContact CG1-CD1 3.47Å; V620-L624 VanDerWaalsContact CG1-CD1 3.47Å; V620-L624 HydrophobicContact CG1-CG 4.24Å; V620-L624 WeakPolarHBondContact O-CB 3.27Å; V620-L624 VanDerWaalsContact O-CG 3.25Å; V620-L624 WeakPolarHBondContact O-CG 3.45Å; V620-L624 PolarHBondContact O-N 2.89Å; E621-L624 PolarHBondContact O-N 3.18Å; L624-R630 HydrophobicContact CD2-CG 4.33Å; L624-R630 PolarHBondContact O-NE 2.83Å; L624-R630 PolarHBondContact O-NH2 3.04Å; L624-L633 HydrophobicContact CD2-CD1 4.13Å; L624-L633 HydrophobicContact CD2-CD2 3.97Å; L624-L633 HydrophobicContact CD2-CG 4.11Å; L624-E658 VanDerWaalsContact CD1-O 3.29Å; L624-E658 WeakPolarHBondContact CD1-O 3.42Å; L624-L659 HydrophobicContact CD1-CD2 4.4Å
625	R	88.1	Confident	85.7	Confident	165 Å²	165	66.3 Å²	66.3	62%	0.623	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.4	164.7	-71.4	170.2	-175.8	-167.1	2.7	112.5	E621 L623	E621-R625 WeakPolarHBondContact O-CG 3.43Å; E621-R625 PolarHBondContact O-N 2.99Å; E621-R625 IonicContact OE1-CZ 2.69Å; E621-R625 IonicContact OE1-NE 3.59Å; E621-R625 PolarHBondContact OE1-NE 3.31Å; E621-R625 IonicContact OE1-NH2 2.77Å; E621-R625 PolarHBondContact OE1-NH2 2.77Å; E621-R625 IonicContact OE2-NH2 3.14Å; E621-R625 PolarHBondContact OE2-NH2 2.88Å; L623-R625 PolarHBondContact O-N 2.83Å; L623-R625 VanDerWaalsContact O-N 3.1Å
626	R	85.3	Confident	86.3	Confident	65 Å²	65	60.1 Å²	60.1	25%	0.245	27%	0.274	C	S	.	.	S	Bend	trans	-87.8	145.7	173.9	-66.4	-172.6	-176.9	-97.5	-7.1	111.5	L591 L592 L623 M629	L591-R626 PolarHBondContact O-NH1 3.05Å; L592-R626 VanDerWaalsContact CD2-NH2 3.29Å; L592-R626 VanDerWaalsContact CG-NH2 3.34Å; L623-R626 PolarHBondContact O-N 2.91Å; R626-M629 HydrophobicContact CB-CG 4.13Å
627	R	82.4	Confident	87.2	Confident	187 Å²	187	59.9 Å²	59.9	71%	0.706	27%	0.267	S	S	*	.	S	Bend	trans	-68.4	-45.5	179.8	-179.3	-179.5	164.5	165.6	-1.4	111.6	M629 R630 E631	R627-M629 PolarHBondContact O-N 3.2Å; R627-R630 WeakPolarHBondContact O-CB 3.49Å; R627-R630 PolarHBondContact O-N 2.84Å; R627-E631 IonicContact CZ-OE1 2.78Å; R627-E631 IonicContact NE-OE1 3.78Å; R627-E631 PolarHBondContact NE-OE1 2.88Å; R627-E631 IonicContact NH2-OE1 2.79Å; R627-E631 PolarHBondContact NH2-OE1 2.9Å
628	E	82.1	Confident	88	Confident	105 Å²	105	59.7 Å²	59.7	49%	0.491	27%	0.27	S	S	.	.	H	α-helix	trans	-52.7	-40.9	-179.8	-59.2	98.4	-135.7	0	0	111.8	P597 R630 E631	P597-E628 HydrophobicContact CG-CB 4.44Å; E628-R630 PolarHBondContact O-N 2.88Å; E628-E631 PolarHBondContact O-N 2.77Å
629	M	84.2	Confident	88.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-23.6	180	-66	-52.8	-50.6	0	0	114.3	P597 V607 L608 L623 R626 R627 L632	P597-M629 HydrophobicContact CB-CE 4.28Å; P597-M629 HydrophobicContact CB-SD 3.3Å; P597-M629 WeakPolarHBondContact CB-SD 3.43Å; P597-M629 HydrophobicContact CG-SD 3.73Å; V607-M629 HydrophobicContact CG2-CE 3.68Å; V607-M629 HydrophobicContact CG2-SD 4.21Å; L608-M629 HydrophobicContact CB-CE 3.78Å; L608-M629 HydrophobicContact CD1-CE 4.3Å; L608-M629 HydrophobicContact CG-CE 4.44Å; L623-M629 HydrophobicContact CB-CE 4.16Å; L623-M629 HydrophobicContact CB-CG 4.14Å; L623-M629 HydrophobicContact CD1-CE 4.35Å; L623-M629 HydrophobicContact CD2-CE 4.47Å; L623-M629 VanDerWaalsContact O-CB 3.3Å; L623-M629 WeakPolarHBondContact O-CB 3.46Å; L623-M629 WeakPolarHBondContact O-CG 3.32Å; R626-M629 HydrophobicContact CB-CG 4.13Å; R627-M629 PolarHBondContact O-N 3.2Å; M629-L632 HydrophobicContact CE-CD1 4.09Å; M629-L632 HydrophobicContact SD-CD1 4.16Å
630	R	84.5	Confident	88.4	Confident	127 Å²	127	62 Å²	62	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-79.7	-30.7	178.3	-59.9	-176.1	-176.6	-146.8	-5.7	112.2	L624 R627 E628 L632 L633	L624-R630 HydrophobicContact CD2-CG 4.33Å; L624-R630 PolarHBondContact O-NE 2.83Å; L624-R630 PolarHBondContact O-NH2 3.04Å; R627-R630 WeakPolarHBondContact O-CB 3.49Å; R627-R630 PolarHBondContact O-N 2.84Å; E628-R630 PolarHBondContact O-N 2.88Å; R630-L632 PolarHBondContact O-N 2.72Å; R630-L633 HydrophobicContact CB-CD1 4.16Å; R630-L633 WeakPolarHBondContact O-CB 3.44Å; R630-L633 WeakPolarHBondContact O-CD1 3.44Å; R630-L633 PolarHBondContact O-N 3.44Å
631	E	84.8	Confident	88.6	Confident	113 Å²	113	63.3 Å²	63.3	53%	0.528	30%	0.295	S	S	.	.	H	α-helix	trans	-70.5	-19.2	176.7	-60.6	177.3	-168.8	0	0	110.3	R627 E628	R627-E631 IonicContact CZ-OE1 2.78Å; R627-E631 IonicContact NE-OE1 3.78Å; R627-E631 PolarHBondContact NE-OE1 2.88Å; R627-E631 IonicContact NH2-OE1 2.79Å; R627-E631 PolarHBondContact NH2-OE1 2.9Å; E628-E631 PolarHBondContact O-N 2.77Å
632	L	87.1	Confident	88.7	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.7	173	-62.2	177.9	0	0	0	115.8	P597 T598 M629 R630 Q634 F635	P597-L632 HydrophobicContact CB-CD1 3.9Å; P597-L632 HydrophobicContact CG-CD1 4.05Å; P597-L632 VanDerWaalsContact O-CD1 3.29Å; P597-L632 WeakPolarHBondContact O-CD1 3.48Å; T598-L632 HydrophobicContact CG2-CD1 4.5Å; T598-L632 HydrophobicContact CG2-CD2 4.06Å; M629-L632 HydrophobicContact CE-CD1 4.09Å; M629-L632 HydrophobicContact SD-CD1 4.16Å; R630-L632 PolarHBondContact O-N 2.72Å; L632-Q634 PolarHBondContact O-N 2.7Å; L632-F635 HydrophobicContact CD2-CD1 4.36Å; L632-F635 HydrophobicContact CD2-CD2 3.44Å; L632-F635 VanDerWaalsContact CD2-CD2 3.44Å; L632-F635 HydrophobicContact CD2-CE1 4.33Å; L632-F635 HydrophobicContact CD2-CE2 3.41Å; L632-F635 VanDerWaalsContact CD2-CE2 3.41Å; L632-F635 HydrophobicContact CD2-CG 3.95Å; L632-F635 HydrophobicContact CD2-CZ 3.89Å; L632-F635 PolarHBondContact O-N 2.78Å
633	L	87.3	Confident	88.9	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.031	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.5	-178.5	-80.5	162.9	0	0	0	113.3	L608 L624 R630 L659 A664	L608-L633 HydrophobicContact CD2-CD2 3.78Å; L608-L633 HydrophobicContact CD2-CG 4.09Å; L624-L633 HydrophobicContact CD2-CD1 4.13Å; L624-L633 HydrophobicContact CD2-CD2 3.97Å; L624-L633 HydrophobicContact CD2-CG 4.11Å; R630-L633 HydrophobicContact CB-CD1 4.16Å; R630-L633 WeakPolarHBondContact O-CB 3.44Å; R630-L633 WeakPolarHBondContact O-CD1 3.44Å; R630-L633 PolarHBondContact O-N 3.44Å; L633-L659 HydrophobicContact CD2-CD2 3.68Å; L633-A664 HydrophobicContact CD2-CB 4.05Å
634	Q	86.8	Confident	89.1	Confident	88 Å²	88	58.5 Å²	58.5	41%	0.411	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.4	-177.1	-49.8	-58.8	-12	0	0	113.4	L632 D665	L632-Q634 PolarHBondContact O-N 2.7Å; Q634-D665 VanDerWaalsContact NE2-N 3.15Å
635	F	89.8	Confident	89.4	Confident	104 Å²	104	58.1 Å²	58.1	46%	0.456	27%	0.271	S	S	.	.			trans	-76.8	143	175.4	-78.5	30	0	0	0	108.5	H609 L632 C642	H609-F635 PolarHBondContact CE1-O 2.98Å; H609-F635 PolarHBondContact NE2-O 2.96Å; H609-F635 VanDerWaalsContact NE2-O 3.1Å; L632-F635 HydrophobicContact CD2-CD1 4.36Å; L632-F635 HydrophobicContact CD2-CD2 3.44Å; L632-F635 VanDerWaalsContact CD2-CD2 3.44Å; L632-F635 HydrophobicContact CD2-CE1 4.33Å; L632-F635 HydrophobicContact CD2-CE2 3.41Å; L632-F635 VanDerWaalsContact CD2-CE2 3.41Å; L632-F635 HydrophobicContact CD2-CG 3.95Å; L632-F635 HydrophobicContact CD2-CZ 3.89Å; L632-F635 PolarHBondContact O-N 2.78Å; F635-C642 WeakPolarHBondContact O-CA 3.33Å
636	S	92.1	Very high	89.7	Confident	22 Å²	22	51.1 Å²	51.1	15%	0.154	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-115.4	139.6	179.6	66.6	0	0	0	0	111	L641 R671	S636-L641 CarbonylContact C-O 3.49Å; S636-L641 VanDerWaalsContact CA-O 3.31Å; S636-L641 WeakPolarHBondContact CA-O 3.32Å; S636-R671 PolarHBondContact OG-NE 3.19Å; S636-R671 PolarHBondContact OG-NH2 2.78Å
637	N	93.3	Very high	90.1	Very high	17 Å²	17	48 Å²	48	9%	0.091	23%	0.234	C	C	.	.			trans	-70.9	-174.6	174.6	73.3	6.4	0	0	0	113.4	G604 N605 H609 A639 G640 L641	G604-N637 WeakPolarHBondContact O-CA 3.27Å; G604-N637 WeakPolarHBondContact O-CB 3.28Å; N605-N637 WeakPolarHBondContact OD1-CB 3.4Å; N605-N637 PolarHBondContact OD1-ND2 3.31Å; H609-N637 PolarHBondContact NE2-N 3.18Å; N637-A639 PolarHBondContact O-N 3.41Å; N637-A639 WeakPolarHBondContact OD1-CA 3.45Å; N637-A639 WeakPolarHBondContact OD1-CB 3.42Å; N637-A639 PolarHBondContact OD1-N 3.35Å; N637-G640 PolarHBondContact O-N 2.84Å; N637-G640 PolarHBondContact OD1-N 3.35Å; N637-L641 PolarHBondContact N-O 3.44Å; N637-L641 PolarHBondContact OD1-N 2.97Å; N637-L641 VanDerWaalsContact OD1-N 3.14Å; N637-L641 PolarHBondContact OD1-O 3.42Å
638	T	93.1	Very high	90.7	Very high	115 Å²	115	39.1 Å²	39.1	71%	0.706	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.3	-178.5	60.6	0	0	0	0	114.1	H603 G640	H603-T638 WeakPolarHBondContact O-CG2 3.44Å; H603-T638 PolarHBondContact O-N 3.43Å; H603-T638 PolarHBondContact O-OG1 2.97Å; T638-G640 VanDerWaalsContact C-N 3.27Å
639	A	91.2	Very high	91.3	Very high	58 Å²	58	38 Å²	38	48%	0.479	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.3	172.1	0	0	0	0	0	113	N637 L641	N637-A639 PolarHBondContact O-N 3.41Å; N637-A639 WeakPolarHBondContact OD1-CA 3.45Å; N637-A639 WeakPolarHBondContact OD1-CB 3.42Å; N637-A639 PolarHBondContact OD1-N 3.35Å; A639-L641 VanDerWaalsContact C-N 3.3Å; A639-L641 HydrophobicContact CB-CD1 4.08Å; A639-L641 HydrophobicContact CB-CG 4.18Å; A639-L641 PolarHBondContact O-N 3.41Å
640	G	92.8	Very high	91.7	Very high	5 Å²	5	39 Å²	39	5%	0.052	21%	0.206	C	C	.	.	S	Bend	trans	78	11	-177.9	0	0	0	0	0	114.4	N637 T638 E670 R671	N637-G640 PolarHBondContact O-N 2.84Å; N637-G640 PolarHBondContact OD1-N 3.35Å; T638-G640 VanDerWaalsContact C-N 3.27Å; G640-E670 VanDerWaalsContact O-CA 3.25Å; G640-E670 WeakPolarHBondContact O-CA 3.45Å; G640-E670 VanDerWaalsContact O-CB 3.3Å; G640-E670 WeakPolarHBondContact O-CB 3.45Å; G640-R671 PolarHBondContact O-N 3.31Å
641	L	94.5	Very high	92.1	Very high	28 Å²	28	37.8 Å²	37.8	15%	0.147	21%	0.209	C	C	.	.			trans	-93.8	133.4	-178.5	-58.8	169.8	0	0	0	110.4	H609 S636 N637 A639 H645 L646 L649 E670	H609-L641 PolarHBondContact CD2-O 3.34Å; H609-L641 PolarHBondContact NE2-O 3.1Å; H609-L641 VanDerWaalsContact NE2-O 3.09Å; S636-L641 CarbonylContact C-O 3.49Å; S636-L641 VanDerWaalsContact CA-O 3.31Å; S636-L641 WeakPolarHBondContact CA-O 3.32Å; N637-L641 PolarHBondContact N-O 3.44Å; N637-L641 PolarHBondContact OD1-N 2.97Å; N637-L641 VanDerWaalsContact OD1-N 3.14Å; N637-L641 PolarHBondContact OD1-O 3.42Å; A639-L641 VanDerWaalsContact C-N 3.3Å; A639-L641 HydrophobicContact CB-CD1 4.08Å; A639-L641 HydrophobicContact CB-CG 4.18Å; A639-L641 PolarHBondContact O-N 3.41Å; L641-H645 HydrophobicContact CB-CB 4.14Å; L641-H645 HydrophobicContact CD2-CB 3.96Å; L641-L646 HydrophobicContact CB-CD2 4.27Å; L641-L646 HydrophobicContact CD1-CD2 3.85Å; L641-L649 HydrophobicContact CD1-CD1 3.9Å; L641-L649 HydrophobicContact CD2-CD1 4.29Å; L641-E670 HydrophobicContact CD2-CB 3.81Å; L641-E670 HydrophobicContact CD2-CG 4.04Å
642	C	94.1	Very high	92.4	Very high	7 Å²	7	35.5 Å²	35.5	5%	0.047	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-86.3	169.5	169.9	-56.5	0	0	0	0	111	F635 I644 H645 L646	F635-C642 WeakPolarHBondContact O-CA 3.33Å; C642-I644 VanDerWaalsContact C-N 3.27Å; C642-I644 HydrophobicContact CB-CG2 4.46Å; C642-I644 PolarHBondContact O-N 2.98Å; C642-H645 WeakPolarHBondContact O-CB 3.25Å; C642-H645 PolarHBondContact O-N 3.33Å; C642-L646 PolarHBondContact O-N 3.03Å
643	A	93.8	Very high	92.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-54.2	-38.2	-179	0	0	0	0	0	113.9	L608 A612 H645 L646 A647 L659	L608-A643 HydrophobicContact CD2-CB 4.32Å; L608-A643 HydrophobicContact CG-CB 4.05Å; A612-A643 HydrophobicContact CB-CB 4.27Å; A612-A643 WeakPolarHBondContact CB-O 3.21Å; A643-H645 VanDerWaalsContact C-N 3.31Å; A643-H645 PolarHBondContact O-N 3.2Å; A643-L646 PolarHBondContact O-N 3.34Å; A643-A647 PolarHBondContact O-N 2.69Å; A643-L659 HydrophobicContact CB-CD1 4.22Å; A643-L659 HydrophobicContact CB-CD2 4.13Å
644	I	94.4	Very high	92.9	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-33.9	177.1	-167.9	171.8	0	0	0	112.9	C642 A647 V648 L656 L659 L660 A664 A677 L693	C642-I644 VanDerWaalsContact C-N 3.27Å; C642-I644 HydrophobicContact CB-CG2 4.46Å; C642-I644 PolarHBondContact O-N 2.98Å; I644-A647 PolarHBondContact O-N 3.45Å; I644-V648 WeakPolarHBondContact O-CG2 3.45Å; I644-V648 PolarHBondContact O-N 3.42Å; I644-L656 HydrophobicContact CD1-CD1 4.02Å; I644-L656 HydrophobicContact CG1-CD1 3.62Å; I644-L659 HydrophobicContact CB-CD1 4.29Å; I644-L660 HydrophobicContact CD1-CD2 4Å; I644-A664 HydrophobicContact CB-CB 4.46Å; I644-A664 HydrophobicContact CD1-CB 4.12Å; I644-A677 HydrophobicContact CD1-CB 4.11Å; I644-A677 HydrophobicContact CG1-CB 4.04Å; I644-L693 HydrophobicContact CD1-CD2 4.38Å
645	H	95.3	Very high	93.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.8	-37	176.1	-60.9	157.3	0	0	0	111.7	L641 C642 A643 V648 L649 A668 A677 L680	L641-H645 HydrophobicContact CB-CB 4.14Å; L641-H645 HydrophobicContact CD2-CB 3.96Å; C642-H645 WeakPolarHBondContact O-CB 3.25Å; C642-H645 PolarHBondContact O-N 3.33Å; A643-H645 VanDerWaalsContact C-N 3.31Å; A643-H645 PolarHBondContact O-N 3.2Å; H645-V648 PolarHBondContact O-N 2.93Å; H645-L649 WeakPolarHBondContact O-CB 3.36Å; H645-L649 VanDerWaalsContact O-CG 3.28Å; H645-L649 WeakPolarHBondContact O-CG 3.21Å; H645-L649 PolarHBondContact O-N 3.44Å; H645-A668 PolarHBondContact CE1-O 3.08Å; H645-A668 PolarHBondContact NE2-O 3.17Å; H645-A677 PolarHBondContact NE2-N 3.21Å; H645-L680 HydrophobicContact CB-CD1 3.59Å
646	L	94.1	Very high	93.3	Very high	17 Å²	17	30.5 Å²	30.5	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-68.6	-38.6	174.3	-63.9	-177.1	0	0	0	112.4	H609 A612 L641 C642 A643 V648 L649 A650	H609-L646 HydrophobicContact CB-CD1 3.61Å; A612-L646 HydrophobicContact CB-CB 4.49Å; L641-L646 HydrophobicContact CB-CD2 4.27Å; L641-L646 HydrophobicContact CD1-CD2 3.85Å; C642-L646 PolarHBondContact O-N 3.03Å; A643-L646 PolarHBondContact O-N 3.34Å; L646-V648 VanDerWaalsContact C-N 3.31Å; L646-V648 PolarHBondContact O-N 2.94Å; L646-L649 PolarHBondContact O-N 3.47Å; L646-A650 WeakPolarHBondContact O-CB 3.33Å; L646-A650 PolarHBondContact O-N 3.08Å
647	A	94.4	Very high	93.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.8	-40.7	174.2	0	0	0	0	0	112.3	A612 A643 I644 N651 R652 A655 L656 L659	A612-A647 HydrophobicContact CB-CB 4.21Å; A612-A647 WeakPolarHBondContact O-CA 3.46Å; A643-A647 PolarHBondContact O-N 2.69Å; I644-A647 PolarHBondContact O-N 3.45Å; A647-N651 PolarHBondContact O-N 3.43Å; A647-R652 PolarHBondContact O-N 2.91Å; A647-A655 HydrophobicContact CB-CB 4.47Å; A647-L656 HydrophobicContact CB-CB 4.22Å; A647-L659 HydrophobicContact CB-CD1 3.85Å
648	V	95.2	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-67.8	-50.4	175.6	172.6	0	0	0	0	111.4	I644 H645 L646 A650 N651 L656 A677 L680 A681 L689 L693	I644-V648 WeakPolarHBondContact O-CG2 3.45Å; I644-V648 PolarHBondContact O-N 3.42Å; H645-V648 PolarHBondContact O-N 2.93Å; L646-V648 VanDerWaalsContact C-N 3.31Å; L646-V648 PolarHBondContact O-N 2.94Å; V648-A650 VanDerWaalsContact C-N 3.28Å; V648-A650 PolarHBondContact O-N 3.02Å; V648-N651 PolarHBondContact O-N 3.03Å; V648-L656 HydrophobicContact CG2-CD1 4.33Å; V648-L656 HydrophobicContact CG2-CD2 4.21Å; V648-A677 HydrophobicContact CG2-CB 4.24Å; V648-L680 HydrophobicContact CG1-CB 3.82Å; V648-A681 HydrophobicContact CG1-CB 3.94Å; V648-L689 HydrophobicContact CG1-CD1 4.16Å; V648-L693 HydrophobicContact CG2-CD1 4.21Å
649	L	94.2	Very high	93.3	Very high	80 Å²	80	29.6 Å²	29.6	42%	0.419	16%	0.164	S	C	.	.	H	α-helix	trans	-65.1	-28.6	-178.8	-70.7	169.5	0	0	0	113.5	L641 H645 L646 N651 L680 T684	L641-L649 HydrophobicContact CD1-CD1 3.9Å; L641-L649 HydrophobicContact CD2-CD1 4.29Å; H645-L649 WeakPolarHBondContact O-CB 3.36Å; H645-L649 VanDerWaalsContact O-CG 3.28Å; H645-L649 WeakPolarHBondContact O-CG 3.21Å; H645-L649 PolarHBondContact O-N 3.44Å; L646-L649 PolarHBondContact O-N 3.47Å; L649-N651 VanDerWaalsContact C-N 3.34Å; L649-L680 HydrophobicContact CD1-CD1 4.3Å; L649-L680 HydrophobicContact CD2-CB 4.47Å; L649-L680 HydrophobicContact CD2-CD2 4.45Å; L649-L680 HydrophobicContact CG-CD1 4.3Å; L649-T684 HydrophobicContact CD2-CG2 4.47Å
650	A	92.6	Very high	93.3	Very high	23 Å²	23	28.1 Å²	28.1	19%	0.19	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	5.6	174.4	0	0	0	0	0	113.8	Q613 L646 V648 R652	Q613-A650 HydrophobicContact CG-CB 4.09Å; L646-A650 WeakPolarHBondContact O-CB 3.33Å; L646-A650 PolarHBondContact O-N 3.08Å; V648-A650 VanDerWaalsContact C-N 3.28Å; V648-A650 PolarHBondContact O-N 3.02Å; A650-R652 VanDerWaalsContact C-N 3.35Å; A650-R652 HydrophobicContact CB-CG 3.85Å; A650-R652 WeakPolarHBondContact O-CD 3.37Å; A650-R652 PolarHBondContact O-N 3.27Å; A650-R652 PolarHBondContact O-NE 3.15Å
651	N	93.5	Very high	93.2	Very high	100 Å²	100	34.1 Å²	34.1	54%	0.535	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	40.4	-179	-166.3	17.1	0	0	0	114.5	A647 V648 L649 L653 N686	A647-N651 PolarHBondContact O-N 3.43Å; V648-N651 PolarHBondContact O-N 3.03Å; L649-N651 VanDerWaalsContact C-N 3.34Å; N651-L653 PolarHBondContact O-N 2.71Å; N651-N686 PolarHBondContact OD1-ND2 3.07Å
652	R	92.1	Very high	92.9	Very high	65 Å²	65	33.2 Å²	33.2	25%	0.245	18%	0.18	C	C	.	.			trans	-100.6	79.4	-176.3	-54.4	-56.6	175.8	-157	-9	111.8	A612 Q613 Q614 E615 A647 A650 A654 A655 L656	A612-R652 WeakPolarHBondContact O-CG 3.25Å; Q613-R652 PolarHBondContact O-NE 2.99Å; Q613-R652 PolarHBondContact O-NH2 3.22Å; Q614-R652 PolarHBondContact O-NE 2.94Å; E615-R652 IonicContact OE1-CZ 2.78Å; E615-R652 IonicContact OE1-NH1 2.68Å; E615-R652 PolarHBondContact OE1-NH1 2.94Å; E615-R652 IonicContact OE1-NH2 3.31Å; E615-R652 PolarHBondContact OE1-NH2 2.73Å; A647-R652 PolarHBondContact O-N 2.91Å; A650-R652 VanDerWaalsContact C-N 3.35Å; A650-R652 HydrophobicContact CB-CG 3.85Å; A650-R652 WeakPolarHBondContact O-CD 3.37Å; A650-R652 PolarHBondContact O-N 3.27Å; A650-R652 PolarHBondContact O-NE 3.15Å; R652-A654 VanDerWaalsContact C-N 3.26Å; R652-A654 PolarHBondContact O-N 3.16Å; R652-A655 HydrophobicContact CB-CB 3.73Å; R652-A655 PolarHBondContact O-N 2.91Å; R652-L656 VanDerWaalsContact O-CB 3.29Å; R652-L656 WeakPolarHBondContact O-CB 3.43Å; R652-L656 PolarHBondContact O-N 3.24Å
653	L	91.6	Very high	92.7	Very high	48 Å²	48	35.3 Å²	35.3	25%	0.251	20%	0.203	S	C	.	.	H	α-helix	trans	-58.4	-35.1	177.7	-179.7	61.7	0	0	0	113	N651 R657 L689 C692	N651-L653 PolarHBondContact O-N 2.71Å; L653-R657 WeakPolarHBondContact O-CG 3.42Å; L653-R657 PolarHBondContact O-N 2.84Å; L653-R657 VanDerWaalsContact O-N 3.15Å; L653-L689 HydrophobicContact CB-CD2 4Å; L653-L689 HydrophobicContact CD1-CD2 4.08Å; L653-C692 HydrophobicContact CD1-CB 3.6Å
654	A	91.4	Very high	92.6	Very high	39 Å²	39	35.9 Å²	35.9	32%	0.322	21%	0.208	S	C	.	.	H	α-helix	trans	-66.3	-56.4	175.2	0	0	0	0	0	111.7	R652 L656 R657 E658	R652-A654 VanDerWaalsContact C-N 3.26Å; R652-A654 PolarHBondContact O-N 3.16Å; A654-L656 VanDerWaalsContact C-N 3.26Å; A654-L656 PolarHBondContact O-N 3.34Å; A654-R657 WeakPolarHBondContact O-CB 3.38Å; A654-R657 PolarHBondContact O-N 3.24Å; A654-E658 PolarHBondContact O-N 3.28Å
655	A	91.8	Very high	92.4	Very high	10 Å²	10	39.2 Å²	39.2	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-36.1	177.7	0	0	0	0	0	112.5	V620 A647 R652 E658 L659	V620-A655 HydrophobicContact CG2-CB 4.21Å; A647-A655 HydrophobicContact CB-CB 4.47Å; R652-A655 HydrophobicContact CB-CB 3.73Å; R652-A655 PolarHBondContact O-N 2.91Å; A655-E658 PolarHBondContact O-N 2.75Å; A655-L659 VanDerWaalsContact O-CG 3.28Å; A655-L659 WeakPolarHBondContact O-CG 3.37Å; A655-L659 PolarHBondContact O-N 2.82Å
656	L	93.8	Very high	92.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-48.7	172.9	175.3	59	0	0	0	111.5	I644 A647 V648 R652 A654 E658 L659 L660 L689 C692 L693	I644-L656 HydrophobicContact CD1-CD1 4.02Å; I644-L656 HydrophobicContact CG1-CD1 3.62Å; A647-L656 HydrophobicContact CB-CB 4.22Å; V648-L656 HydrophobicContact CG2-CD1 4.33Å; V648-L656 HydrophobicContact CG2-CD2 4.21Å; R652-L656 VanDerWaalsContact O-CB 3.29Å; R652-L656 WeakPolarHBondContact O-CB 3.43Å; R652-L656 PolarHBondContact O-N 3.24Å; A654-L656 VanDerWaalsContact C-N 3.26Å; A654-L656 PolarHBondContact O-N 3.34Å; L656-E658 PolarHBondContact O-N 2.95Å; L656-L659 PolarHBondContact O-N 2.97Å; L656-L660 HydrophobicContact CD1-CD1 4.28Å; L656-L660 HydrophobicContact CD1-CG 4.22Å; L656-L660 HydrophobicContact CG-CD1 4.21Å; L656-L660 VanDerWaalsContact O-CG 3.3Å; L656-L660 WeakPolarHBondContact O-CG 3.44Å; L656-L660 PolarHBondContact O-N 3.14Å; L656-L689 HydrophobicContact CD2-CB 4.46Å; L656-L689 HydrophobicContact CD2-CD2 3.74Å; L656-C692 HydrophobicContact CD2-CB 4.39Å; L656-L693 HydrophobicContact CD1-CD2 3.91Å; L656-L693 HydrophobicContact CD2-CD2 4.2Å; L656-L693 HydrophobicContact CD2-CG 4.13Å
657	R	92.9	Very high	92.3	Very high	101 Å²	101	40.5 Å²	40.5	38%	0.381	23%	0.232	S	C	.	.	H	α-helix	trans	-61.5	-41.7	175.4	-75.3	178.8	169.9	133.3	1.2	112.4	L653 A654 L659 L660 V661 E696	L653-R657 WeakPolarHBondContact O-CG 3.42Å; L653-R657 PolarHBondContact O-N 2.84Å; L653-R657 VanDerWaalsContact O-N 3.15Å; A654-R657 WeakPolarHBondContact O-CB 3.38Å; A654-R657 PolarHBondContact O-N 3.24Å; R657-L659 VanDerWaalsContact C-N 3.33Å; R657-L659 PolarHBondContact O-N 2.93Å; R657-L660 PolarHBondContact O-N 3.11Å; R657-V661 WeakPolarHBondContact O-CB 3.48Å; R657-V661 WeakPolarHBondContact O-CG2 3.22Å; R657-V661 PolarHBondContact O-N 2.88Å; R657-E696 WeakPolarHBondContact CD-OE2 3.42Å; R657-E696 WeakPolarHBondContact CG-OE2 3.43Å; R657-E696 IonicContact CZ-OE1 3.79Å; R657-E696 VanDerWaalsContact CZ-OE1 3.31Å; R657-E696 IonicContact CZ-OE2 3.61Å; R657-E696 VanDerWaalsContact NE-CD 3.34Å; R657-E696 IonicContact NE-OE1 3.19Å; R657-E696 PolarHBondContact NE-OE1 3.39Å; R657-E696 VanDerWaalsContact NE-OE1 3.09Å; R657-E696 IonicContact NE-OE2 2.71Å; R657-E696 PolarHBondContact NE-OE2 3.45Å; R657-E696 IonicContact NH2-OE1 3.92Å; R657-E696 PolarHBondContact NH2-OE1 3.01Å; R657-E696 IonicContact NH2-OE2 3.6Å
658	E	92.4	Very high	92.2	Very high	34 Å²	34	41 Å²	41	16%	0.159	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-39.7	176.3	-68.3	173.6	-142.9	0	0	111.7	G618 V620 E621 L624 A654 A655 L656 G662	G618-E658 WeakPolarHBondContact CA-OE1 3.33Å; G618-E658 VanDerWaalsContact CA-OE2 3.22Å; G618-E658 WeakPolarHBondContact CA-OE2 3.32Å; G618-E658 PolarHBondContact N-OE1 3Å; G618-E658 PolarHBondContact N-OE2 3.03Å; V620-E658 HydrophobicContact CB-CB 3.99Å; V620-E658 WeakPolarHBondContact CB-OE2 3.36Å; V620-E658 HydrophobicContact CG1-CB 3.73Å; V620-E658 PolarHBondContact N-OE2 2.76Å; E621-E658 HydrophobicContact CB-CG 4.18Å; E621-E658 WeakPolarHBondContact CB-OE2 3.31Å; E621-E658 PolarHBondContact N-OE2 3.38Å; L624-E658 VanDerWaalsContact CD1-O 3.29Å; L624-E658 WeakPolarHBondContact CD1-O 3.42Å; A654-E658 PolarHBondContact O-N 3.28Å; A655-E658 PolarHBondContact O-N 2.75Å; L656-E658 PolarHBondContact O-N 2.95Å; E658-G662 PolarHBondContact O-N 2.9Å
659	L	93	Very high	92.1	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-43.9	173.4	-70.4	172.2	0	0	0	112.6	L608 A612 V620 L624 L633 A643 I644 A647 A655 L656 R657 G662 G663 A664	L608-L659 HydrophobicContact CD1-CD2 4.18Å; L608-L659 HydrophobicContact CD2-CD2 4.36Å; L608-L659 HydrophobicContact CG-CD2 4.26Å; A612-L659 HydrophobicContact CB-CD1 4.1Å; V620-L659 HydrophobicContact CG1-CD2 3.72Å; V620-L659 HydrophobicContact CG1-CG 3.9Å; L624-L659 HydrophobicContact CD1-CD2 4.4Å; L633-L659 HydrophobicContact CD2-CD2 3.68Å; A643-L659 HydrophobicContact CB-CD1 4.22Å; A643-L659 HydrophobicContact CB-CD2 4.13Å; I644-L659 HydrophobicContact CB-CD1 4.29Å; A647-L659 HydrophobicContact CB-CD1 3.85Å; A655-L659 VanDerWaalsContact O-CG 3.28Å; A655-L659 WeakPolarHBondContact O-CG 3.37Å; A655-L659 PolarHBondContact O-N 2.82Å; L656-L659 PolarHBondContact O-N 2.97Å; R657-L659 VanDerWaalsContact C-N 3.33Å; R657-L659 PolarHBondContact O-N 2.93Å; L659-G662 CarbonylContact O-C 3.5Å; L659-G662 WeakPolarHBondContact O-CA 3.31Å; L659-G662 PolarHBondContact O-N 2.96Å; L659-G662 VanDerWaalsContact O-N 3.11Å; L659-G663 PolarHBondContact O-N 3.35Å; L659-A664 HydrophobicContact CB-CB 4.07Å; L659-A664 VanDerWaalsContact O-CB 3.27Å; L659-A664 WeakPolarHBondContact O-CB 3.33Å; L659-A664 PolarHBondContact O-N 3.03Å
660	L	92.1	Very high	92.1	Very high	27 Å²	27	41.4 Å²	41.4	14%	0.141	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-48.3	177.4	-69.9	174.3	0	0	0	111.2	I644 L656 R657 G662 G663 V666	I644-L660 HydrophobicContact CD1-CD2 4Å; L656-L660 HydrophobicContact CD1-CD1 4.28Å; L656-L660 HydrophobicContact CD1-CG 4.22Å; L656-L660 HydrophobicContact CG-CD1 4.21Å; L656-L660 VanDerWaalsContact O-CG 3.3Å; L656-L660 WeakPolarHBondContact O-CG 3.44Å; L656-L660 PolarHBondContact O-N 3.14Å; R657-L660 PolarHBondContact O-N 3.11Å; L660-G662 PolarHBondContact O-N 2.9Å; L660-G663 PolarHBondContact O-N 2.82Å; L660-V666 HydrophobicContact CD2-CG2 3.38Å
661	V	91	Very high	92.1	Very high	132 Å²	132	49.1 Å²	49.1	80%	0.8	26%	0.26	S	S	*	.	H	α-helix	trans	-64.1	-27.6	174.1	174	0	0	0	0	112	R657 G663	R657-V661 WeakPolarHBondContact O-CB 3.48Å; R657-V661 WeakPolarHBondContact O-CG2 3.22Å; R657-V661 PolarHBondContact O-N 2.88Å; V661-G663 VanDerWaalsContact C-N 3.25Å; V661-G663 PolarHBondContact O-N 2.71Å
662	G	87.6	Confident	91.9	Very high	8 Å²	8	48.1 Å²	48.1	8%	0.082	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-19.3	170.9	0	0	0	0	0	115.5	E658 L659 L660	E658-G662 PolarHBondContact O-N 2.9Å; L659-G662 CarbonylContact O-C 3.5Å; L659-G662 WeakPolarHBondContact O-CA 3.31Å; L659-G662 PolarHBondContact O-N 2.96Å; L659-G662 VanDerWaalsContact O-N 3.11Å; L660-G662 PolarHBondContact O-N 2.9Å
663	G	88.6	Confident	91.6	Very high	51 Å²	51	45.9 Å²	45.9	53%	0.526	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	31.2	-172.5	0	0	0	0	0	114.2	L659 L660 V661	L659-G663 PolarHBondContact O-N 3.35Å; L660-G663 PolarHBondContact O-N 2.82Å; V661-G663 VanDerWaalsContact C-N 3.25Å; V661-G663 PolarHBondContact O-N 2.71Å
664	A	91.8	Very high	91.6	Very high	13 Å²	13	43.6 Å²	43.6	11%	0.107	25%	0.246	C	C	.	.			trans	-58.1	142.3	166	0	0	0	0	0	110.6	L633 I644 L659	L633-A664 HydrophobicContact CD2-CB 4.05Å; I644-A664 HydrophobicContact CB-CB 4.46Å; I644-A664 HydrophobicContact CD1-CB 4.12Å; L659-A664 HydrophobicContact CB-CB 4.07Å; L659-A664 VanDerWaalsContact O-CB 3.27Å; L659-A664 WeakPolarHBondContact O-CB 3.33Å; L659-A664 PolarHBondContact O-N 3.03Å
665	D	91.5	Very high	91.7	Very high	75 Å²	75	46.3 Å²	46.3	40%	0.401	25%	0.247	S	C	.	.			trans	-81.2	126	170.2	-173.8	4.7	0	0	0	109	Q634 E667 A668	Q634-D665 VanDerWaalsContact NE2-N 3.15Å; D665-E667 VanDerWaalsContact C-N 3.34Å; D665-E667 WeakPolarHBondContact OD1-CB 3.19Å; D665-E667 PolarHBondContact OD1-N 2.9Å; D665-A668 HydrophobicContact CB-CB 4.25Å; D665-A668 WeakPolarHBondContact O-CB 3.4Å
666	V	92.9	Very high	91.9	Very high	11 Å²	11	45.9 Å²	45.9	7%	0.067	24%	0.244	C	C	.	.	S	Bend	trans	-82.4	-22.5	-179	-160.7	0	0	0	0	111	L660 A668 L693 G697 A699	L660-V666 HydrophobicContact CD2-CG2 3.38Å; V666-A668 VanDerWaalsContact C-N 3.33Å; V666-L693 HydrophobicContact CG1-CB 4.5Å; V666-L693 HydrophobicContact CG1-CD2 3.65Å; V666-G697 WeakPolarHBondContact CG2-O 3.45Å; V666-A699 HydrophobicContact CG1-CB 3.75Å
667	E	93.3	Very high	92	Very high	33 Å²	33	45.9 Å²	45.9	15%	0.154	24%	0.244	C	C	.	.	S	Bend	trans	-91.1	4.2	174.6	-54	-54.8	136.1	0	0	112.6	D665 Q669 A699 K700 S703	D665-E667 VanDerWaalsContact C-N 3.34Å; D665-E667 WeakPolarHBondContact OD1-CB 3.19Å; D665-E667 PolarHBondContact OD1-N 2.9Å; E667-Q669 PolarHBondContact O-N 2.96Å; E667-A699 WeakPolarHBondContact OE1-CA 3.33Å; E667-K700 HydrophobicContact CG-CD 4.07Å; E667-K700 HydrophobicContact CG-CG 4.33Å; E667-K700 PolarHBondContact OE1-N 3.35Å; E667-S703 WeakPolarHBondContact OE2-CB 3.43Å; E667-S703 PolarHBondContact OE2-OG 3.32Å
668	A	92.8	Very high	92.1	Very high	9 Å²	9	41.1 Å²	41.1	7%	0.074	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-54.8	127.8	169.9	0	0	0	0	0	109.6	H645 D665 V666 T676	H645-A668 PolarHBondContact CE1-O 3.08Å; H645-A668 PolarHBondContact NE2-O 3.17Å; D665-A668 HydrophobicContact CB-CB 4.25Å; D665-A668 WeakPolarHBondContact O-CB 3.4Å; V666-A668 VanDerWaalsContact C-N 3.33Å; A668-T676 WeakPolarHBondContact O-CA 3.43Å
669	Q	93.5	Very high	92.2	Very high	87 Å²	87	39.7 Å²	39.7	41%	0.407	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-102	135.2	179.5	-70.3	-173.8	-41.1	0	0	110.5	E667 G674 R675 T676 C704	E667-Q669 PolarHBondContact O-N 2.96Å; Q669-G674 WeakPolarHBondContact CG-O 3.27Å; Q669-G674 PolarHBondContact NE2-O 3.46Å; Q669-G674 VanDerWaalsContact NE2-O 3.13Å; Q669-R675 WeakPolarHBondContact CA-O 3.39Å; Q669-T676 HydrophobicContact CG-CG2 3.98Å; Q669-C704 PolarHBondContact NE2-O 3.14Å
670	E	93.7	Very high	92.3	Very high	4 Å²	4	40 Å²	40	2%	0.019	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-72.5	148.9	170	60.9	66.2	-140.4	0	0	112.2	G640 L641 S672 G673 G674 R675	G640-E670 VanDerWaalsContact O-CA 3.25Å; G640-E670 WeakPolarHBondContact O-CA 3.45Å; G640-E670 VanDerWaalsContact O-CB 3.3Å; G640-E670 WeakPolarHBondContact O-CB 3.45Å; L641-E670 HydrophobicContact CD2-CB 3.81Å; L641-E670 HydrophobicContact CD2-CG 4.04Å; E670-S672 VanDerWaalsContact C-N 3.32Å; E670-S672 PolarHBondContact O-N 2.73Å; E670-S672 WeakPolarHBondContact OE2-CA 3.46Å; E670-S672 VanDerWaalsContact OE2-CB 3.29Å; E670-S672 WeakPolarHBondContact OE2-CB 3.01Å; E670-S672 PolarHBondContact OE2-N 3.42Å; E670-S672 PolarHBondContact OE2-OG 2.73Å; E670-G673 VanDerWaalsContact OE1-C 3.24Å; E670-G673 VanDerWaalsContact OE1-CA 3.23Å; E670-G673 WeakPolarHBondContact OE1-CA 3.48Å; E670-G673 PolarHBondContact OE1-N 2.95Å; E670-G673 PolarHBondContact OE2-N 2.81Å; E670-G673 VanDerWaalsContact OE2-N 3.16Å; E670-G674 WeakPolarHBondContact O-CA 3.41Å; E670-G674 PolarHBondContact O-N 2.93Å; E670-G674 PolarHBondContact OE1-N 2.8Å; E670-R675 HydrophobicContact CG-CB 3.85Å; E670-R675 WeakPolarHBondContact CG-O 3.29Å; E670-R675 PolarHBondContact N-O 3.11Å; E670-R675 WeakPolarHBondContact OE1-CB 3.34Å; E670-R675 WeakPolarHBondContact OE1-CG 3.28Å; E670-R675 PolarHBondContact OE1-N 2.83Å
671	R	91.9	Very high	92.5	Very high	185 Å²	185	38.7 Å²	38.7	70%	0.698	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.3	-164.8	-60.4	-174.4	176.7	175.7	3	115.7	S636 G640	S636-R671 PolarHBondContact OG-NE 3.19Å; S636-R671 PolarHBondContact OG-NH2 2.78Å; G640-R671 PolarHBondContact O-N 3.31Å
672	S	89.4	Confident	92.6	Very high	79 Å²	79	32.4 Å²	32.4	55%	0.552	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96	-37.9	-175.7	74.8	0	0	0	0	113.7	E670	E670-S672 VanDerWaalsContact C-N 3.32Å; E670-S672 PolarHBondContact O-N 2.73Å; E670-S672 WeakPolarHBondContact OE2-CA 3.46Å; E670-S672 VanDerWaalsContact OE2-CB 3.29Å; E670-S672 WeakPolarHBondContact OE2-CB 3.01Å; E670-S672 PolarHBondContact OE2-N 3.42Å; E670-S672 PolarHBondContact OE2-OG 2.73Å
673	G	87	Confident	92.9	Very high	18 Å²	18	34.6 Å²	34.6	19%	0.186	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.3	0.2	-178.5	0	0	0	0	0	115.3	E670 R675 T705 F706	E670-G673 VanDerWaalsContact OE1-C 3.24Å; E670-G673 VanDerWaalsContact OE1-CA 3.23Å; E670-G673 WeakPolarHBondContact OE1-CA 3.48Å; E670-G673 PolarHBondContact OE1-N 2.95Å; E670-G673 PolarHBondContact OE2-N 2.81Å; E670-G673 VanDerWaalsContact OE2-N 3.16Å; G673-R675 VanDerWaalsContact C-N 3.33Å; G673-T705 WeakPolarHBondContact O-CB 3.44Å; G673-F706 PolarHBondContact O-N 3.43Å
674	G	91.9	Very high	93	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.			trans	77.1	16.2	-179.6	0	0	0	0	0	114.1	Q669 E670 F706	Q669-G674 WeakPolarHBondContact CG-O 3.27Å; Q669-G674 PolarHBondContact NE2-O 3.46Å; Q669-G674 VanDerWaalsContact NE2-O 3.13Å; E670-G674 WeakPolarHBondContact O-CA 3.41Å; E670-G674 PolarHBondContact O-N 2.93Å; E670-G674 PolarHBondContact OE1-N 2.8Å; G674-F706 VanDerWaalsContact CA-CZ 3.49Å; G674-F706 VanDerWaalsContact N-CE2 3.29Å
675	R	93.8	Very high	93	Very high	95 Å²	95	38.7 Å²	38.7	36%	0.358	19%	0.194	S	C	.	.			trans	-71.9	133.5	-176.6	-62.6	166.9	174.5	-158.1	-7.2	110.5	Q669 E670 G673 H679 L680 E683 T705	Q669-R675 WeakPolarHBondContact CA-O 3.39Å; E670-R675 HydrophobicContact CG-CB 3.85Å; E670-R675 WeakPolarHBondContact CG-O 3.29Å; E670-R675 PolarHBondContact N-O 3.11Å; E670-R675 WeakPolarHBondContact OE1-CB 3.34Å; E670-R675 WeakPolarHBondContact OE1-CG 3.28Å; E670-R675 PolarHBondContact OE1-N 2.83Å; G673-R675 VanDerWaalsContact C-N 3.33Å; R675-H679 HydrophobicContact CB-CB 3.97Å; R675-H679 HydrophobicContact CG-CB 4.33Å; R675-L680 HydrophobicContact CB-CD2 4.23Å; R675-E683 IonicContact CZ-OE1 3.83Å; R675-E683 IonicContact CZ-OE2 2.98Å; R675-E683 IonicContact NH1-OE1 3.75Å; R675-E683 PolarHBondContact NH1-OE1 2.76Å; R675-E683 IonicContact NH1-OE2 3.86Å; R675-E683 PolarHBondContact NH1-OE2 2.73Å; R675-E683 IonicContact NH2-OE1 3.73Å; R675-E683 PolarHBondContact NH2-OE1 3.41Å; R675-T705 HydrophobicContact CB-CG2 4.44Å; R675-T705 HydrophobicContact CG-CG2 3.69Å
676	T	95	Very high	93.1	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	18%	0.182	C	C	.	.			trans	-86.9	169.2	169.1	64.7	0	0	0	0	111	A668 Q669 L678 H679 L680	A668-T676 WeakPolarHBondContact O-CA 3.43Å; Q669-T676 HydrophobicContact CG-CG2 3.98Å; T676-L678 PolarHBondContact O-N 2.91Å; T676-L678 VanDerWaalsContact O-N 3.13Å; T676-H679 PolarHBondContact N-ND1 3.31Å; T676-H679 WeakPolarHBondContact O-CB 2.9Å; T676-H679 PolarHBondContact O-N 2.94Å; T676-H679 PolarHBondContact OG1-ND1 3.2Å; T676-L680 PolarHBondContact O-N 2.92Å
677	A	95.1	Very high	93.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-51.2	-36.1	174.3	0	0	0	0	0	113.3	I644 H645 V648 L680 A681 L693	I644-A677 HydrophobicContact CD1-CB 4.11Å; I644-A677 HydrophobicContact CG1-CB 4.04Å; H645-A677 PolarHBondContact NE2-N 3.21Å; V648-A677 HydrophobicContact CG2-CB 4.24Å; A677-L680 PolarHBondContact O-N 3.1Å; A677-A681 PolarHBondContact O-N 2.91Å; A677-L693 HydrophobicContact CB-CD1 4.13Å; A677-L693 HydrophobicContact CB-CD2 3.74Å; A677-L693 WeakPolarHBondContact O-CD1 3.34Å
678	L	96.1	Very high	93.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-39.2	178.2	-176.5	58.1	0	0	0	112.5	T676 L680 A681 T682 A690 L693 L694 A699 P711 L727	T676-L678 PolarHBondContact O-N 2.91Å; T676-L678 VanDerWaalsContact O-N 3.13Å; L678-L680 VanDerWaalsContact C-N 3.35Å; L678-L680 PolarHBondContact O-N 2.85Å; L678-A681 PolarHBondContact O-N 2.9Å; L678-T682 WeakPolarHBondContact O-CG2 2.99Å; L678-T682 PolarHBondContact O-N 2.8Å; L678-T682 PolarHBondContact O-OG1 2.85Å; L678-A690 HydrophobicContact CD1-CB 4.03Å; L678-L693 HydrophobicContact CB-CD1 4.43Å; L678-L693 HydrophobicContact CD1-CB 4.35Å; L678-L693 HydrophobicContact CD1-CD1 4.47Å; L678-L694 HydrophobicContact CD1-CD1 4.37Å; L678-L694 HydrophobicContact CD1-CD2 4.43Å; L678-L694 HydrophobicContact CD1-CG 4.11Å; L678-L694 HydrophobicContact CD2-CD2 3.76Å; L678-L694 HydrophobicContact CD2-CG 4.33Å; L678-A699 HydrophobicContact CD2-CB 4.21Å; L678-P711 HydrophobicContact CB-CG 4.4Å; L678-P711 HydrophobicContact CD2-CB 4.34Å; L678-P711 HydrophobicContact CD2-CG 3.87Å; L678-P711 HydrophobicContact CG-CB 4.07Å; L678-P711 HydrophobicContact CG-CG 3.85Å; L678-L727 HydrophobicContact CD1-CD2 4.48Å; L678-L727 HydrophobicContact CD2-CD2 4.3Å
679	H	95.1	Very high	93.1	Very high	3 Å²	3	40 Å²	40	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-44.9	174.4	-69.6	86.2	0	0	0	111.3	R675 T676 A681 T682 E683 S703 S709 P711	R675-H679 HydrophobicContact CB-CB 3.97Å; R675-H679 HydrophobicContact CG-CB 4.33Å; T676-H679 PolarHBondContact N-ND1 3.31Å; T676-H679 WeakPolarHBondContact O-CB 2.9Å; T676-H679 PolarHBondContact O-N 2.94Å; T676-H679 PolarHBondContact OG1-ND1 3.2Å; H679-A681 VanDerWaalsContact C-N 3.33Å; H679-A681 PolarHBondContact O-N 3.09Å; H679-T682 WeakPolarHBondContact CA-OG1 3.39Å; H679-T682 PolarHBondContact O-N 2.8Å; H679-T682 PolarHBondContact O-OG1 2.98Å; H679-E683 WeakPolarHBondContact O-CB 3.48Å; H679-E683 PolarHBondContact O-N 3.25Å; H679-S703 PolarHBondContact CE1-O 2.91Å; H679-S703 PolarHBondContact NE2-O 2.93Å; H679-S709 PolarHBondContact NE2-O 3.46Å; H679-P711 VanDerWaalsContact NE2-CD 3.34Å; H679-P711 WeakPolarHBondContact NE2-CD 3.39Å
680	L	94.6	Very high	93.1	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-66.2	-35.2	179	-58.2	176.5	0	0	0	112	H645 V648 L649 R675 T676 A677 L678 E683 T684	H645-L680 HydrophobicContact CB-CD1 3.59Å; V648-L680 HydrophobicContact CG1-CB 3.82Å; L649-L680 HydrophobicContact CD1-CD1 4.3Å; L649-L680 HydrophobicContact CD2-CB 4.47Å; L649-L680 HydrophobicContact CD2-CD2 4.45Å; L649-L680 HydrophobicContact CG-CD1 4.3Å; R675-L680 HydrophobicContact CB-CD2 4.23Å; T676-L680 PolarHBondContact O-N 2.92Å; A677-L680 PolarHBondContact O-N 3.1Å; L678-L680 VanDerWaalsContact C-N 3.35Å; L678-L680 PolarHBondContact O-N 2.85Å; L680-E683 PolarHBondContact O-N 3.2Å; L680-T684 WeakPolarHBondContact O-CG2 3.27Å; L680-T684 PolarHBondContact O-N 2.76Å; L680-T684 VanDerWaalsContact O-N 3.1Å; L680-T684 PolarHBondContact O-OG1 3.16Å
681	A	95.4	Very high	93	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-37.3	172.9	0	0	0	0	0	112	V648 A677 L678 H679 T684 D685 N686 L689 A690 L693	V648-A681 HydrophobicContact CG1-CB 3.94Å; A677-A681 PolarHBondContact O-N 2.91Å; L678-A681 PolarHBondContact O-N 2.9Å; H679-A681 VanDerWaalsContact C-N 3.33Å; H679-A681 PolarHBondContact O-N 3.09Å; A681-T684 PolarHBondContact O-OG1 3.12Å; A681-D685 PolarHBondContact O-N 3.47Å; A681-N686 PolarHBondContact O-N 3.31Å; A681-L689 HydrophobicContact CB-CB 4Å; A681-A690 HydrophobicContact CB-CB 4.13Å; A681-L693 HydrophobicContact CB-CD1 3.75Å
682	T	94.4	Very high	93.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-72.6	-34.9	174.4	56.5	0	0	0	0	113.5	L678 H679 T684 D685 P711 L723 L727	L678-T682 WeakPolarHBondContact O-CG2 2.99Å; L678-T682 PolarHBondContact O-N 2.8Å; L678-T682 PolarHBondContact O-OG1 2.85Å; H679-T682 WeakPolarHBondContact CA-OG1 3.39Å; H679-T682 PolarHBondContact O-N 2.8Å; H679-T682 PolarHBondContact O-OG1 2.98Å; T682-T684 VanDerWaalsContact C-N 3.3Å; T682-T684 PolarHBondContact O-N 2.76Å; T682-D685 PolarHBondContact O-N 2.86Å; T682-P711 HydrophobicContact CG2-CB 3.93Å; T682-L723 HydrophobicContact CG2-CD1 4.24Å; T682-L723 HydrophobicContact CG2-CD2 4.41Å; T682-L727 HydrophobicContact CG2-CD1 3.99Å
683	E	92.6	Very high	93.3	Very high	54 Å²	54	23.7 Å²	23.7	25%	0.252	14%	0.135	S	C	.	.	H	α-helix	trans	-68.8	-30.3	177.1	-172.2	173.2	-142	0	0	112.2	R675 H679 L680 D685 V714 R718	R675-E683 IonicContact CZ-OE1 3.83Å; R675-E683 IonicContact CZ-OE2 2.98Å; R675-E683 IonicContact NH1-OE1 3.75Å; R675-E683 PolarHBondContact NH1-OE1 2.76Å; R675-E683 IonicContact NH1-OE2 3.86Å; R675-E683 PolarHBondContact NH1-OE2 2.73Å; R675-E683 IonicContact NH2-OE1 3.73Å; R675-E683 PolarHBondContact NH2-OE1 3.41Å; H679-E683 WeakPolarHBondContact O-CB 3.48Å; H679-E683 PolarHBondContact O-N 3.25Å; L680-E683 PolarHBondContact O-N 3.2Å; E683-D685 VanDerWaalsContact C-N 3.31Å; E683-V714 HydrophobicContact CB-CG1 4.23Å; E683-R718 PolarHBondContact O-NE 3.04Å; E683-R718 PolarHBondContact O-NH2 3.01Å
684	T	91.9	Very high	93.6	Very high	62 Å²	62	23.8 Å²	23.8	38%	0.38	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8.7	175.2	51.9	0	0	0	0	114	L649 L680 A681 T682 N686	L649-T684 HydrophobicContact CD2-CG2 4.47Å; L680-T684 WeakPolarHBondContact O-CG2 3.27Å; L680-T684 PolarHBondContact O-N 2.76Å; L680-T684 VanDerWaalsContact O-N 3.1Å; L680-T684 PolarHBondContact O-OG1 3.16Å; A681-T684 PolarHBondContact O-OG1 3.12Å; T682-T684 VanDerWaalsContact C-N 3.3Å; T682-T684 PolarHBondContact O-N 2.76Å; T684-N686 PolarHBondContact O-N 3.13Å; T684-N686 VanDerWaalsContact O-N 3.17Å
685	D	91.7	Very high	93.5	Very high	87 Å²	87	30.6 Å²	30.6	47%	0.465	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	24	-176.4	-158.8	45.9	0	0	0	114.7	A681 T682 E683 V687 S720	A681-D685 PolarHBondContact O-N 3.47Å; T682-D685 PolarHBondContact O-N 2.86Å; E683-D685 VanDerWaalsContact C-N 3.31Å; D685-V687 PolarHBondContact O-N 3.11Å; D685-S720 WeakPolarHBondContact OD1-CB 3.3Å; D685-S720 PolarHBondContact OD1-OG 3.28Å
686	N	92.4	Very high	93.3	Very high	26 Å²	26	30.9 Å²	30.9	14%	0.139	17%	0.172	C	C	.	.			trans	-96.1	86.7	-166	-162.4	-41.4	0	0	0	112.7	N651 A681 T684 S688 L689 A690	N651-N686 PolarHBondContact OD1-ND2 3.07Å; A681-N686 PolarHBondContact O-N 3.31Å; T684-N686 PolarHBondContact O-N 3.13Å; T684-N686 VanDerWaalsContact O-N 3.17Å; N686-S688 PolarHBondContact O-N 2.89Å; N686-S688 PolarHBondContact OD1-N 2.72Å; N686-L689 HydrophobicContact CB-CB 4.23Å; N686-L689 HydrophobicContact CB-CD1 3.93Å; N686-L689 HydrophobicContact CB-CG 4.24Å; N686-L689 VanDerWaalsContact CG-CD1 3.48Å; N686-L689 VanDerWaalsContact ND2-CD1 3.28Å; N686-L689 WeakPolarHBondContact ND2-CD1 3.36Å; N686-L689 PolarHBondContact O-N 3.07Å; N686-L689 WeakPolarHBondContact OD1-CG 3.41Å; N686-L689 PolarHBondContact OD1-N 3.26Å; N686-A690 WeakPolarHBondContact O-CB 3.46Å; N686-A690 PolarHBondContact O-N 2.93Å
687	V	92.7	Very high	92.9	Very high	50 Å²	50	31.6 Å²	31.6	30%	0.303	18%	0.179	S	C	.	.	H	α-helix	trans	-53.5	-36.1	177.9	-174	0	0	0	0	112.6	D685 G691 K722 L723 L726	D685-V687 PolarHBondContact O-N 3.11Å; V687-G691 PolarHBondContact O-N 3.48Å; V687-K722 HydrophobicContact CG2-CB 3.74Å; V687-K722 HydrophobicContact CG2-CD 4.3Å; V687-L723 HydrophobicContact CB-CD2 4.41Å; V687-L723 HydrophobicContact CG2-CD2 4.03Å; V687-L723 HydrophobicContact CG2-CG 4.14Å; V687-L726 HydrophobicContact CG1-CD2 4.27Å
688	S	93.3	Very high	92.6	Very high	80 Å²	80	38.2 Å²	38.2	56%	0.559	22%	0.215	S	C	*	.	H	α-helix	trans	-70.6	-41.6	-178.7	-58.8	0	0	0	0	112.6	N686 C692	N686-S688 PolarHBondContact O-N 2.89Å; N686-S688 PolarHBondContact OD1-N 2.72Å; S688-C692 WeakPolarHBondContact O-CB 3.48Å; S688-C692 PolarHBondContact O-N 3.11Å; S688-C692 VanDerWaalsContact O-N 3.09Å
689	L	93.9	Very high	92.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-71.2	-43.3	175	-63.5	172.9	0	0	0	111.1	V648 L653 L656 A681 N686 G691 C692 L693	V648-L689 HydrophobicContact CG1-CD1 4.16Å; L653-L689 HydrophobicContact CB-CD2 4Å; L653-L689 HydrophobicContact CD1-CD2 4.08Å; L656-L689 HydrophobicContact CD2-CB 4.46Å; L656-L689 HydrophobicContact CD2-CD2 3.74Å; A681-L689 HydrophobicContact CB-CB 4Å; N686-L689 HydrophobicContact CB-CB 4.23Å; N686-L689 HydrophobicContact CB-CD1 3.93Å; N686-L689 HydrophobicContact CB-CG 4.24Å; N686-L689 VanDerWaalsContact CG-CD1 3.48Å; N686-L689 VanDerWaalsContact ND2-CD1 3.28Å; N686-L689 WeakPolarHBondContact ND2-CD1 3.36Å; N686-L689 PolarHBondContact O-N 3.07Å; N686-L689 WeakPolarHBondContact OD1-CG 3.41Å; N686-L689 PolarHBondContact OD1-N 3.26Å; L689-G691 VanDerWaalsContact C-N 3.34Å; L689-G691 PolarHBondContact O-N 2.9Å; L689-C692 WeakPolarHBondContact O-CB 3.19Å; L689-C692 PolarHBondContact O-N 3.02Å; L689-L693 WeakPolarHBondContact O-CD1 3.43Å; L689-L693 VanDerWaalsContact O-CG 3.26Å; L689-L693 WeakPolarHBondContact O-CG 3.35Å; L689-L693 PolarHBondContact O-N 3.35Å
690	A	93.9	Very high	92.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-44.3	176.2	0	0	0	0	0	111.5	L678 A681 N686 C692 L693 L694 L723 L726	L678-A690 HydrophobicContact CD1-CB 4.03Å; A681-A690 HydrophobicContact CB-CB 4.13Å; N686-A690 WeakPolarHBondContact O-CB 3.46Å; N686-A690 PolarHBondContact O-N 2.93Å; A690-C692 PolarHBondContact O-N 2.9Å; A690-L693 PolarHBondContact O-N 2.97Å; A690-L694 WeakPolarHBondContact O-CB 3.33Å; A690-L694 WeakPolarHBondContact O-CD1 3.43Å; A690-L694 VanDerWaalsContact O-CG 3.28Å; A690-L694 WeakPolarHBondContact O-CG 3.24Å; A690-L694 PolarHBondContact O-N 3.26Å; A690-L723 HydrophobicContact CB-CD2 3.69Å; A690-L726 HydrophobicContact CB-CD2 3.74Å
691	G	91.8	Very high	92.2	Very high	10 Å²	10	45.1 Å²	45.1	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-40.6	175.4	0	0	0	0	0	113	V687 L689 L694 L695	V687-G691 PolarHBondContact O-N 3.48Å; L689-G691 VanDerWaalsContact C-N 3.34Å; L689-G691 PolarHBondContact O-N 2.9Å; G691-L694 PolarHBondContact O-N 3.12Å; G691-L695 VanDerWaalsContact O-CB 3.25Å; G691-L695 WeakPolarHBondContact O-CB 3.45Å; G691-L695 VanDerWaalsContact O-CG 3.31Å; G691-L695 WeakPolarHBondContact O-CG 3.21Å; G691-L695 PolarHBondContact O-N 3.08Å
692	C	92.9	Very high	92	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.014	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-46.8	173.8	-175.8	0	0	0	0	111.8	L653 L656 S688 L689 A690 L694 E696 G697	L653-C692 HydrophobicContact CD1-CB 3.6Å; L656-C692 HydrophobicContact CD2-CB 4.39Å; S688-C692 WeakPolarHBondContact O-CB 3.48Å; S688-C692 PolarHBondContact O-N 3.11Å; S688-C692 VanDerWaalsContact O-N 3.09Å; L689-C692 WeakPolarHBondContact O-CB 3.19Å; L689-C692 PolarHBondContact O-N 3.02Å; A690-C692 PolarHBondContact O-N 2.9Å; C692-L694 VanDerWaalsContact C-N 3.35Å; C692-L694 PolarHBondContact O-N 2.77Å; C692-E696 WeakPolarHBondContact O-CA 3.21Å; C692-E696 VanDerWaalsContact O-CB 3.32Å; C692-E696 WeakPolarHBondContact O-CB 3.47Å; C692-E696 PolarHBondContact O-N 3.46Å; C692-G697 PolarHBondContact O-N 2.97Å
693	L	94	Very high	91.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-40.5	178.7	-68.8	162.4	0	0	0	112.3	I644 V648 L656 V666 A677 L678 A681 L689 A690 G697 N698 A699	I644-L693 HydrophobicContact CD1-CD2 4.38Å; V648-L693 HydrophobicContact CG2-CD1 4.21Å; L656-L693 HydrophobicContact CD1-CD2 3.91Å; L656-L693 HydrophobicContact CD2-CD2 4.2Å; L656-L693 HydrophobicContact CD2-CG 4.13Å; V666-L693 HydrophobicContact CG1-CB 4.5Å; V666-L693 HydrophobicContact CG1-CD2 3.65Å; A677-L693 HydrophobicContact CB-CD1 4.13Å; A677-L693 HydrophobicContact CB-CD2 3.74Å; A677-L693 WeakPolarHBondContact O-CD1 3.34Å; L678-L693 HydrophobicContact CB-CD1 4.43Å; L678-L693 HydrophobicContact CD1-CB 4.35Å; L678-L693 HydrophobicContact CD1-CD1 4.47Å; A681-L693 HydrophobicContact CB-CD1 3.75Å; L689-L693 WeakPolarHBondContact O-CD1 3.43Å; L689-L693 VanDerWaalsContact O-CG 3.26Å; L689-L693 WeakPolarHBondContact O-CG 3.35Å; L689-L693 PolarHBondContact O-N 3.35Å; A690-L693 PolarHBondContact O-N 2.97Å; L693-G697 CarbonylContact O-C 3.57Å; L693-G697 VanDerWaalsContact O-CA 3.23Å; L693-G697 WeakPolarHBondContact O-CA 3.45Å; L693-G697 PolarHBondContact O-N 3.35Å; L693-N698 PolarHBondContact O-N 3.06Å; L693-A699 HydrophobicContact CB-CB 4.37Å; L693-A699 VanDerWaalsContact O-CB 3.26Å; L693-A699 WeakPolarHBondContact O-CB 3.21Å; L693-A699 PolarHBondContact O-N 3.03Å
694	L	92.6	Very high	91.8	Very high	20 Å²	20	46.5 Å²	46.5	11%	0.105	26%	0.26	C	S	.	.	H	α-helix	trans	-73.2	-45.9	179	-69.6	165	0	0	0	112.7	L678 A690 G691 C692 N698 V701 L726 L727 A730	L678-L694 HydrophobicContact CD1-CD1 4.37Å; L678-L694 HydrophobicContact CD1-CD2 4.43Å; L678-L694 HydrophobicContact CD1-CG 4.11Å; L678-L694 HydrophobicContact CD2-CD2 3.76Å; L678-L694 HydrophobicContact CD2-CG 4.33Å; A690-L694 WeakPolarHBondContact O-CB 3.33Å; A690-L694 WeakPolarHBondContact O-CD1 3.43Å; A690-L694 VanDerWaalsContact O-CG 3.28Å; A690-L694 WeakPolarHBondContact O-CG 3.24Å; A690-L694 PolarHBondContact O-N 3.26Å; G691-L694 PolarHBondContact O-N 3.12Å; C692-L694 VanDerWaalsContact C-N 3.35Å; C692-L694 PolarHBondContact O-N 2.77Å; L694-N698 WeakPolarHBondContact O-CA 3.41Å; L694-V701 HydrophobicContact CD2-CB 4.47Å; L694-V701 HydrophobicContact CD2-CG1 4.22Å; L694-V701 HydrophobicContact CD2-CG2 3.96Å; L694-L726 HydrophobicContact CD1-CD2 3.96Å; L694-L726 HydrophobicContact CD1-CG 3.94Å; L694-L727 HydrophobicContact CD1-CD2 4.23Å; L694-A730 HydrophobicContact CD1-CB 4.14Å; L694-A730 HydrophobicContact CD2-CB 4.04Å
695	L	90.3	Very high	91.9	Very high	143 Å²	143	44 Å²	44	75%	0.749	25%	0.245	S	C	*	.	H	α-helix	trans	-91.7	-34.3	-170.6	-61.1	173.2	0	0	0	114.2	G691	G691-L695 VanDerWaalsContact O-CB 3.25Å; G691-L695 WeakPolarHBondContact O-CB 3.45Å; G691-L695 VanDerWaalsContact O-CG 3.31Å; G691-L695 WeakPolarHBondContact O-CG 3.21Å; G691-L695 PolarHBondContact O-N 3.08Å
696	E	90.3	Very high	91.9	Very high	102 Å²	102	45.4 Å²	45.4	48%	0.477	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-37.8	-177.8	-58.2	174.3	-133.4	0	0	111.3	R657 C692	R657-E696 WeakPolarHBondContact CD-OE2 3.42Å; R657-E696 WeakPolarHBondContact CG-OE2 3.43Å; R657-E696 IonicContact CZ-OE1 3.79Å; R657-E696 VanDerWaalsContact CZ-OE1 3.31Å; R657-E696 IonicContact CZ-OE2 3.61Å; R657-E696 VanDerWaalsContact NE-CD 3.34Å; R657-E696 IonicContact NE-OE1 3.19Å; R657-E696 PolarHBondContact NE-OE1 3.39Å; R657-E696 VanDerWaalsContact NE-OE1 3.09Å; R657-E696 IonicContact NE-OE2 2.71Å; R657-E696 PolarHBondContact NE-OE2 3.45Å; R657-E696 IonicContact NH2-OE1 3.92Å; R657-E696 PolarHBondContact NH2-OE1 3.01Å; R657-E696 IonicContact NH2-OE2 3.6Å; C692-E696 WeakPolarHBondContact O-CA 3.21Å; C692-E696 VanDerWaalsContact O-CB 3.32Å; C692-E696 WeakPolarHBondContact O-CB 3.47Å; C692-E696 PolarHBondContact O-N 3.46Å
697	G	85.4	Confident	91.6	Very high	16 Å²	16	46.9 Å²	46.9	17%	0.165	26%	0.255	C	S	.	.	S	Bend	trans	-82.8	-12.3	173.9	0	0	0	0	0	114.8	V666 C692 L693 A699	V666-G697 WeakPolarHBondContact CG2-O 3.45Å; C692-G697 PolarHBondContact O-N 2.97Å; L693-G697 CarbonylContact O-C 3.57Å; L693-G697 VanDerWaalsContact O-CA 3.23Å; L693-G697 WeakPolarHBondContact O-CA 3.45Å; L693-G697 PolarHBondContact O-N 3.35Å; G697-A699 PolarHBondContact O-N 2.81Å
698	N	89	Confident	91.5	Very high	139 Å²	139	44.6 Å²	44.6	74%	0.743	24%	0.242	S	C	*	.			trans	55.8	32.8	-178.4	-149	119	0	0	0	113.7	L693 L694	L693-N698 PolarHBondContact O-N 3.06Å; L694-N698 WeakPolarHBondContact O-CA 3.41Å
699	A	92.1	Very high	91.4	Very high	8 Å²	8	41.2 Å²	41.2	7%	0.066	22%	0.218	C	C	.	.			trans	-57.6	146	-176.2	0	0	0	0	0	113.6	V666 E667 L678 L693 G697 V701	V666-A699 HydrophobicContact CG1-CB 3.75Å; E667-A699 WeakPolarHBondContact OE1-CA 3.33Å; L678-A699 HydrophobicContact CD2-CB 4.21Å; L693-A699 HydrophobicContact CB-CB 4.37Å; L693-A699 VanDerWaalsContact O-CB 3.26Å; L693-A699 WeakPolarHBondContact O-CB 3.21Å; L693-A699 PolarHBondContact O-N 3.03Å; G697-A699 PolarHBondContact O-N 2.81Å; A699-V701 PolarHBondContact O-N 3.28Å
700	K	92.9	Very high	91.4	Very high	128 Å²	128	41.2 Å²	41.2	56%	0.557	22%	0.218	S	C	*	.			trans	-74.9	117.6	172.9	-62.1	172.3	-166.9	151.8	0	109.6	E667 D702 S703	E667-K700 HydrophobicContact CG-CD 4.07Å; E667-K700 HydrophobicContact CG-CG 4.33Å; E667-K700 PolarHBondContact OE1-N 3.35Å; K700-D702 VanDerWaalsContact C-N 3.33Å; K700-D702 PolarHBondContact O-N 3.14Å; K700-S703 WeakPolarHBondContact CB-OG 3.3Å; K700-S703 PolarHBondContact O-N 3.38Å
701	V	92.3	Very high	91.5	Very high	20 Å²	20	41.2 Å²	41.2	12%	0.121	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-40.4	-174.7	-153.6	0	0	0	0	112	L694 A699 P711 L727 A730 A732	L694-V701 HydrophobicContact CD2-CB 4.47Å; L694-V701 HydrophobicContact CD2-CG1 4.22Å; L694-V701 HydrophobicContact CD2-CG2 3.96Å; A699-V701 PolarHBondContact O-N 3.28Å; V701-P711 WeakPolarHBondContact O-CD 3.44Å; V701-P711 WeakPolarHBondContact O-CG 3.41Å; V701-L727 HydrophobicContact CG1-CB 4.29Å; V701-L727 HydrophobicContact CG1-CD2 3.7Å; V701-A730 HydrophobicContact CG1-CB 4.09Å; V701-A730 HydrophobicContact CG2-CB 3.8Å; V701-A732 HydrophobicContact CB-CB 4.44Å; V701-A732 HydrophobicContact CG1-CB 3.64Å
702	D	91.8	Very high	91.6	Very high	33 Å²	33	40.8 Å²	40.8	18%	0.176	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	42.7	179.5	-50.3	-67.9	0	0	0	113.4	K700 T710 A732 D733 R736	K700-D702 VanDerWaalsContact C-N 3.33Å; K700-D702 PolarHBondContact O-N 3.14Å; D702-T710 HydrophobicContact CB-CG2 4.13Å; D702-A732 WeakPolarHBondContact OD1-CA 3.33Å; D702-D733 PolarHBondContact OD1-N 3.39Å; D702-D733 PolarHBondContact OD2-N 2.76Å; D702-R736 VanDerWaalsContact O-CZ 3.23Å; D702-R736 PolarHBondContact O-NH1 3.36Å; D702-R736 PolarHBondContact O-NH2 2.92Å
703	S	92.2	Very high	91.6	Very high	19 Å²	19	40.8 Å²	40.8	13%	0.133	21%	0.214	C	C	.	.			trans	-69.1	145.7	160.3	-88.4	0	0	0	0	110.1	E667 H679 K700 P711	E667-S703 WeakPolarHBondContact OE2-CB 3.43Å; E667-S703 PolarHBondContact OE2-OG 3.32Å; H679-S703 PolarHBondContact CE1-O 2.91Å; H679-S703 PolarHBondContact NE2-O 2.93Å; K700-S703 WeakPolarHBondContact CB-OG 3.3Å; K700-S703 PolarHBondContact O-N 3.38Å; S703-P711 WeakPolarHBondContact O-CD 3.36Å
704	C	91.6	Very high	91.5	Very high	31 Å²	31	42.5 Å²	42.5	21%	0.209	22%	0.224	C	C	.	.			trans	-109.5	145.1	-174.8	-71	0	0	0	0	112.7	Q669 G708 S709 R736	Q669-C704 PolarHBondContact NE2-O 3.14Å; C704-G708 PolarHBondContact SG-O 2.91Å; C704-S709 CarbonylContact C-O 3.59Å; C704-S709 WeakPolarHBondContact CA-O 3.26Å; C704-R736 PolarHBondContact SG-NH2 2.74Å
705	T	92.9	Very high	91.6	Very high	10 Å²	10	41.5 Å²	41.5	6%	0.061	22%	0.219	C	C	.	.			trans	-70.3	175.6	161.1	50.8	0	0	0	0	112.3	G673 R675 N707 G708 S709	G673-T705 WeakPolarHBondContact O-CB 3.44Å; R675-T705 HydrophobicContact CB-CG2 4.44Å; R675-T705 HydrophobicContact CG-CG2 3.69Å; T705-N707 WeakPolarHBondContact CB-OD1 3.24Å; T705-N707 PolarHBondContact O-N 3.26Å; T705-N707 PolarHBondContact OG1-OD1 3.37Å; T705-G708 PolarHBondContact O-N 2.93Å; T705-S709 PolarHBondContact N-O 3.08Å; T705-S709 WeakPolarHBondContact OG1-CB 3.39Å; T705-S709 PolarHBondContact OG1-N 3.08Å; T705-S709 VanDerWaalsContact OG1-N 3.12Å; T705-S709 PolarHBondContact OG1-O 3.12Å; T705-S709 VanDerWaalsContact OG1-O 3.07Å
706	F	91.1	Very high	91.7	Very high	116 Å²	116	34.7 Å²	34.7	51%	0.509	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.7	175.3	-60	-24.3	0	0	0	113.8	G673 G674 G708	G673-F706 PolarHBondContact O-N 3.43Å; G674-F706 VanDerWaalsContact CA-CZ 3.49Å; G674-F706 VanDerWaalsContact N-CE2 3.29Å; F706-G708 VanDerWaalsContact C-N 3.32Å
707	N	87.1	Confident	91.7	Very high	57 Å²	57	31.7 Å²	31.7	31%	0.305	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	19.2	169.5	71.7	-32.8	0	0	0	113.2	T705 S709 N738 F739 E740	T705-N707 WeakPolarHBondContact CB-OD1 3.24Å; T705-N707 PolarHBondContact O-N 3.26Å; T705-N707 PolarHBondContact OG1-OD1 3.37Å; N707-S709 PolarHBondContact ND2-OG 3.05Å; N707-S709 PolarHBondContact O-N 3.38Å; N707-S709 VanDerWaalsContact O-N 3.1Å; N707-N738 WeakPolarHBondContact O-CB 3.48Å; N707-F739 VanDerWaalsContact C-CD2 3.46Å; N707-F739 PolarHBondContact O-N 2.98Å; N707-E740 PolarHBondContact ND2-OE1 2.87Å
708	G	89.5	Confident	91.9	Very high	3 Å²	3	37.1 Å²	37.1	3%	0.031	20%	0.195	C	C	.	.	S	Bend	trans	75.7	-8.7	174.9	0	0	0	0	0	115.7	C704 T705 F706	C704-G708 PolarHBondContact SG-O 2.91Å; T705-G708 PolarHBondContact O-N 2.93Å; F706-G708 VanDerWaalsContact C-N 3.32Å
709	S	92.2	Very high	91.9	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.063	17%	0.168	C	C	.	.			trans	-68.7	141.5	-176.4	-62.7	0	0	0	0	111.8	H679 C704 T705 N707 N738	H679-S709 PolarHBondContact NE2-O 3.46Å; C704-S709 CarbonylContact C-O 3.59Å; C704-S709 WeakPolarHBondContact CA-O 3.26Å; T705-S709 PolarHBondContact N-O 3.08Å; T705-S709 WeakPolarHBondContact OG1-CB 3.39Å; T705-S709 PolarHBondContact OG1-N 3.08Å; T705-S709 VanDerWaalsContact OG1-N 3.12Å; T705-S709 PolarHBondContact OG1-O 3.12Å; T705-S709 VanDerWaalsContact OG1-O 3.07Å; N707-S709 PolarHBondContact ND2-OG 3.05Å; N707-S709 PolarHBondContact O-N 3.38Å; N707-S709 VanDerWaalsContact O-N 3.1Å; S709-N738 PolarHBondContact OG-ND2 2.82Å
710	T	93.9	Very high	91.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.			trans	-98.1	168.1	173.7	70	0	0	0	0	111	D702 L712 H713 V714	D702-T710 HydrophobicContact CB-CG2 4.13Å; T710-L712 PolarHBondContact O-N 3.28Å; T710-L712 VanDerWaalsContact O-N 3.14Å; T710-L712 PolarHBondContact OG1-N 2.96Å; T710-H713 PolarHBondContact N-ND1 2.87Å; T710-H713 WeakPolarHBondContact O-CB 3.46Å; T710-H713 PolarHBondContact O-N 3.05Å; T710-H713 PolarHBondContact OG1-ND1 3.42Å; T710-V714 PolarHBondContact O-N 3.46Å
711	P	94.9	Very high	91.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-27.8	172.8	-22.4	33.4	0	0	0	113.1	L678 H679 T682 V701 S703 V714 A715 L727	L678-P711 HydrophobicContact CB-CG 4.4Å; L678-P711 HydrophobicContact CD2-CB 4.34Å; L678-P711 HydrophobicContact CD2-CG 3.87Å; L678-P711 HydrophobicContact CG-CB 4.07Å; L678-P711 HydrophobicContact CG-CG 3.85Å; H679-P711 VanDerWaalsContact NE2-CD 3.34Å; H679-P711 WeakPolarHBondContact NE2-CD 3.39Å; T682-P711 HydrophobicContact CG2-CB 3.93Å; V701-P711 WeakPolarHBondContact O-CD 3.44Å; V701-P711 WeakPolarHBondContact O-CG 3.41Å; S703-P711 WeakPolarHBondContact O-CD 3.36Å; P711-V714 PolarHBondContact O-N 3.33Å; P711-A715 PolarHBondContact O-N 2.87Å; P711-L727 HydrophobicContact CB-CD1 4.19Å; P711-L727 HydrophobicContact CB-CD2 4.12Å
712	L	94.6	Very high	91.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.9	-35.1	175.9	-168.6	67.4	0	0	0	112.2	T710 V714 A715 A716 T724 L727 M728 A732 P734 P767 L780	T710-L712 PolarHBondContact O-N 3.28Å; T710-L712 VanDerWaalsContact O-N 3.14Å; T710-L712 PolarHBondContact OG1-N 2.96Å; L712-V714 VanDerWaalsContact C-N 3.32Å; L712-V714 PolarHBondContact O-N 3.33Å; L712-A715 PolarHBondContact O-N 3.04Å; L712-A716 WeakPolarHBondContact O-CB 3.32Å; L712-A716 PolarHBondContact O-N 3.31Å; L712-T724 HydrophobicContact CD1-CG2 4.12Å; L712-L727 HydrophobicContact CB-CD1 4.4Å; L712-L727 HydrophobicContact CD1-CB 3.85Å; L712-L727 HydrophobicContact CD1-CD1 4.15Å; L712-M728 HydrophobicContact CD1-CG 4.23Å; L712-M728 HydrophobicContact CD1-SD 4.32Å; L712-M728 HydrophobicContact CD2-SD 3.85Å; L712-A732 HydrophobicContact CB-CB 4.24Å; L712-A732 HydrophobicContact CD1-CB 4.4Å; L712-A732 HydrophobicContact CD2-CB 3.79Å; L712-A732 HydrophobicContact CG-CB 4.37Å; L712-P734 HydrophobicContact CD2-CB 4.26Å; L712-P767 HydrophobicContact CB-CB 4.45Å; L712-P767 HydrophobicContact CB-CG 4.22Å; L712-P767 HydrophobicContact CD2-CB 3.92Å; L712-P767 HydrophobicContact CD2-CG 3.94Å; L712-P767 HydrophobicContact CG-CB 3.86Å; L712-P767 HydrophobicContact CG-CG 4.07Å; L712-L780 HydrophobicContact CD1-CD2 3.94Å; L712-L780 HydrophobicContact CD2-CD2 3.77Å; L712-L780 HydrophobicContact CG-CD2 3.96Å
713	H	93.3	Very high	91.7	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-60.5	-44.2	170.6	-67.4	73.6	0	0	0	110.8	T710 A716 G717 R736 T765 M770	T710-H713 PolarHBondContact N-ND1 2.87Å; T710-H713 WeakPolarHBondContact O-CB 3.46Å; T710-H713 PolarHBondContact O-N 3.05Å; T710-H713 PolarHBondContact OG1-ND1 3.42Å; H713-A716 PolarHBondContact O-N 3.25Å; H713-G717 PolarHBondContact O-N 2.71Å; H713-R736 PolarHBondContact CE1-O 2.76Å; H713-R736 PolarHBondContact NE2-O 2.79Å; H713-T765 PolarHBondContact NE2-O 3.29Å; H713-T765 VanDerWaalsContact NE2-O 3.08Å; H713-M770 HydrophobicContact CB-SD 3.81Å
714	V	92.5	Very high	91.7	Very high	35 Å²	35	30.9 Å²	30.9	21%	0.212	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-43.1	180	-178.9	0	0	0	0	111.5	E683 T710 P711 L712 R718	E683-V714 HydrophobicContact CB-CG1 4.23Å; T710-V714 PolarHBondContact O-N 3.46Å; P711-V714 PolarHBondContact O-N 3.33Å; L712-V714 VanDerWaalsContact C-N 3.32Å; L712-V714 PolarHBondContact O-N 3.33Å; V714-R718 WeakPolarHBondContact O-CB 3.13Å; V714-R718 WeakPolarHBondContact O-CD 3.34Å; V714-R718 VanDerWaalsContact O-CG 3.28Å; V714-R718 WeakPolarHBondContact O-CG 3.41Å; V714-R718 PolarHBondContact O-N 3.2Å
715	A	93.8	Very high	91.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-42.7	175.9	0	0	0	0	0	112.2	P711 L712 R718 G719 S720 L723 L727	P711-A715 PolarHBondContact O-N 2.87Å; L712-A715 PolarHBondContact O-N 3.04Å; A715-R718 PolarHBondContact O-N 3.06Å; A715-G719 PolarHBondContact O-N 3.04Å; A715-G719 VanDerWaalsContact O-N 3.13Å; A715-S720 PolarHBondContact O-N 3.2Å; A715-L723 HydrophobicContact CB-CB 3.95Å; A715-L727 HydrophobicContact CB-CD1 3.86Å
716	A	92.7	Very high	91.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-48.5	180	0	0	0	0	0	112.3	L712 H713 R718 G719 P767 M770 A772 V776 L780	L712-A716 WeakPolarHBondContact O-CB 3.32Å; L712-A716 PolarHBondContact O-N 3.31Å; H713-A716 PolarHBondContact O-N 3.25Å; A716-R718 PolarHBondContact O-N 2.82Å; A716-G719 PolarHBondContact O-N 1.89Å; A716-P767 HydrophobicContact CB-CB 4.33Å; A716-P767 WeakPolarHBondContact CB-O 3.33Å; A716-M770 CarbonylContact C-O 3.59Å; A716-M770 HydrophobicContact CB-CB 4.4Å; A716-A772 WeakPolarHBondContact O-CB 3.43Å; A716-A772 PolarHBondContact O-N 3.08Å; A716-V776 HydrophobicContact CB-CG1 4.17Å; A716-L780 HydrophobicContact CB-CD1 4Å
717	G	89.1	Confident	91.8	Very high	38 Å²	38	26.3 Å²	26.3	39%	0.392	14%	0.143	S	C	.	.	H	α-helix	trans	-66.6	-17.8	177.5	0	0	0	0	0	114.8	H713 M770	H713-G717 PolarHBondContact O-N 2.71Å; G717-M770 VanDerWaalsContact CA-O 3.32Å; G717-M770 WeakPolarHBondContact CA-O 3.47Å; G717-M770 PolarHBondContact N-O 2.8Å
718	R	89.7	Confident	92	Very high	131 Å²	131	26 Å²	26	49%	0.494	14%	0.14	S	C	.	.	H	α-helix	trans	-92.8	-12.1	171.3	-72.8	172.7	121.5	69.3	-7.5	113.6	E683 V714 A715 A716 S720	E683-R718 PolarHBondContact O-NE 3.04Å; E683-R718 PolarHBondContact O-NH2 3.01Å; V714-R718 WeakPolarHBondContact O-CB 3.13Å; V714-R718 WeakPolarHBondContact O-CD 3.34Å; V714-R718 VanDerWaalsContact O-CG 3.28Å; V714-R718 WeakPolarHBondContact O-CG 3.41Å; V714-R718 PolarHBondContact O-N 3.2Å; A715-R718 PolarHBondContact O-N 3.06Å; A716-R718 PolarHBondContact O-N 2.82Å; R718-S720 VanDerWaalsContact C-N 3.3Å
719	G	89.6	Confident	92	Very high	18 Å²	18	30.3 Å²	30.3	19%	0.186	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	19.1	-174.5	0	0	0	0	0	113.9	A715 A716 I721	A715-G719 PolarHBondContact O-N 3.04Å; A715-G719 VanDerWaalsContact O-N 3.13Å; A716-G719 PolarHBondContact O-N 1.89Å; G719-I721 PolarHBondContact O-N 3.06Å
720	S	91.2	Very high	91.9	Very high	13 Å²	13	32 Å²	32	9%	0.091	19%	0.19	C	C	.	.			trans	-76.5	75.9	-172.3	-70.4	0	0	0	0	113	D685 A715 R718 K722 L723 T724	D685-S720 WeakPolarHBondContact OD1-CB 3.3Å; D685-S720 PolarHBondContact OD1-OG 3.28Å; A715-S720 PolarHBondContact O-N 3.2Å; R718-S720 VanDerWaalsContact C-N 3.3Å; S720-K722 VanDerWaalsContact C-N 3.27Å; S720-K722 PolarHBondContact O-N 2.71Å; S720-K722 VanDerWaalsContact O-N 3.08Å; S720-L723 PolarHBondContact O-N 3.26Å; S720-T724 PolarHBondContact O-N 2.99Å; S720-T724 PolarHBondContact O-OG1 3.19Å
721	I	91.1	Very high	91.6	Very high	49 Å²	49	34.6 Å²	34.6	25%	0.251	22%	0.216	S	C	.	.	H	α-helix	trans	-41.9	-49.2	-177.6	-54.5	160.1	0	0	0	112.8	G719 L723 T724 A725 E775 V776 L779 Y785	G719-I721 PolarHBondContact O-N 3.06Å; I721-L723 PolarHBondContact O-N 3Å; I721-T724 PolarHBondContact O-N 3.15Å; I721-A725 WeakPolarHBondContact O-CB 3.44Å; I721-A725 PolarHBondContact O-N 2.65Å; I721-E775 HydrophobicContact CD1-CB 4.11Å; I721-E775 WeakPolarHBondContact CD1-OE2 3.44Å; I721-E775 HydrophobicContact CG1-CB 4.22Å; I721-V776 HydrophobicContact CB-CG2 4.43Å; I721-V776 HydrophobicContact CG1-CG2 3.94Å; I721-L779 HydrophobicContact CG2-CD1 3.64Å; I721-Y785 HydrophobicContact CG2-CD2 3.98Å; I721-Y785 HydrophobicContact CG2-CE2 3.67Å
722	K	91.3	Very high	91.5	Very high	135 Å²	135	35 Å²	35	59%	0.587	22%	0.22	S	C	*	.	H	α-helix	trans	-65.5	-38.8	-177.8	-64.8	177.4	-178.1	172.4	0	113.1	V687 S720 L726	V687-K722 HydrophobicContact CG2-CB 3.74Å; V687-K722 HydrophobicContact CG2-CD 4.3Å; S720-K722 VanDerWaalsContact C-N 3.27Å; S720-K722 PolarHBondContact O-N 2.71Å; S720-K722 VanDerWaalsContact O-N 3.08Å; K722-L726 WeakPolarHBondContact O-CB 3.45Å; K722-L726 PolarHBondContact O-N 2.82Å
723	L	92.1	Very high	91.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-74.6	-39.7	176.7	-74.9	175.2	0	0	0	111.3	T682 V687 A690 A715 S720 I721 A725 L726 L727	T682-L723 HydrophobicContact CG2-CD1 4.24Å; T682-L723 HydrophobicContact CG2-CD2 4.41Å; V687-L723 HydrophobicContact CB-CD2 4.41Å; V687-L723 HydrophobicContact CG2-CD2 4.03Å; V687-L723 HydrophobicContact CG2-CG 4.14Å; A690-L723 HydrophobicContact CB-CD2 3.69Å; A715-L723 HydrophobicContact CB-CB 3.95Å; S720-L723 PolarHBondContact O-N 3.26Å; I721-L723 PolarHBondContact O-N 3Å; L723-A725 VanDerWaalsContact C-N 3.34Å; L723-A725 PolarHBondContact O-N 3.36Å; L723-L726 HydrophobicContact CD2-CD2 4.28Å; L723-L726 PolarHBondContact O-N 2.87Å; L723-L727 WeakPolarHBondContact O-CB 3.46Å; L723-L727 VanDerWaalsContact O-CG 3.25Å; L723-L727 WeakPolarHBondContact O-CG 3.3Å; L723-L727 PolarHBondContact O-N 2.92Å
724	T	92.4	Very high	91.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-49.7	172.9	-54.2	0	0	0	0	110.2	L712 S720 I721 L726 L727 M728 V776 L779 L780	L712-T724 HydrophobicContact CD1-CG2 4.12Å; S720-T724 PolarHBondContact O-N 2.99Å; S720-T724 PolarHBondContact O-OG1 3.19Å; I721-T724 PolarHBondContact O-N 3.15Å; T724-L726 PolarHBondContact O-N 2.94Å; T724-L727 PolarHBondContact O-N 2.88Å; T724-M728 HydrophobicContact CG2-CG 4.36Å; T724-M728 WeakPolarHBondContact O-CB 3.2Å; T724-M728 WeakPolarHBondContact O-CG 3.29Å; T724-M728 PolarHBondContact O-N 3.42Å; T724-V776 HydrophobicContact CG2-CG1 4.22Å; T724-L779 HydrophobicContact CG2-CB 4.24Å; T724-L779 HydrophobicContact CG2-CD1 4.46Å; T724-L780 HydrophobicContact CG2-CD2 3.87Å; T724-L780 HydrophobicContact CG2-CG 3.92Å
725	A	90.9	Very high	91.1	Very high	17 Å²	17	43.2 Å²	43.2	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-42.7	175.7	0	0	0	0	0	112.8	I721 L723 A729 L779 Y785	I721-A725 WeakPolarHBondContact O-CB 3.44Å; I721-A725 PolarHBondContact O-N 2.65Å; L723-A725 VanDerWaalsContact C-N 3.34Å; L723-A725 PolarHBondContact O-N 3.36Å; A725-A729 WeakPolarHBondContact O-CB 3.44Å; A725-A729 PolarHBondContact O-N 2.75Å; A725-L779 HydrophobicContact CB-CD1 4.14Å; A725-Y785 HydrophobicContact CB-CD1 4.22Å; A725-Y785 HydrophobicContact CB-CD2 4.1Å; A725-Y785 HydrophobicContact CB-CG 3.76Å
726	L	92.8	Very high	90.8	Very high	45 Å²	45	47.7 Å²	47.7	24%	0.236	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-44.7	177.7	-176.9	74	0	0	0	112.4	V687 A690 L694 K722 L723 T724 A729 A730	V687-L726 HydrophobicContact CG1-CD2 4.27Å; A690-L726 HydrophobicContact CB-CD2 3.74Å; L694-L726 HydrophobicContact CD1-CD2 3.96Å; L694-L726 HydrophobicContact CD1-CG 3.94Å; K722-L726 WeakPolarHBondContact O-CB 3.45Å; K722-L726 PolarHBondContact O-N 2.82Å; L723-L726 HydrophobicContact CD2-CD2 4.28Å; L723-L726 PolarHBondContact O-N 2.87Å; T724-L726 PolarHBondContact O-N 2.94Å; L726-A729 PolarHBondContact O-N 2.87Å; L726-A730 WeakPolarHBondContact O-CB 3.46Å; L726-A730 PolarHBondContact O-N 3.09Å
727	L	93.5	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-71.3	-43.1	-179.1	-68.9	165.7	0	0	0	111.5	L678 T682 L694 V701 P711 L712 A715 L723 T724 A729 A730 G731 A732	L678-L727 HydrophobicContact CD1-CD2 4.48Å; L678-L727 HydrophobicContact CD2-CD2 4.3Å; T682-L727 HydrophobicContact CG2-CD1 3.99Å; L694-L727 HydrophobicContact CD1-CD2 4.23Å; V701-L727 HydrophobicContact CG1-CB 4.29Å; V701-L727 HydrophobicContact CG1-CD2 3.7Å; P711-L727 HydrophobicContact CB-CD1 4.19Å; P711-L727 HydrophobicContact CB-CD2 4.12Å; L712-L727 HydrophobicContact CB-CD1 4.4Å; L712-L727 HydrophobicContact CD1-CB 3.85Å; L712-L727 HydrophobicContact CD1-CD1 4.15Å; A715-L727 HydrophobicContact CB-CD1 3.86Å; L723-L727 WeakPolarHBondContact O-CB 3.46Å; L723-L727 VanDerWaalsContact O-CG 3.25Å; L723-L727 WeakPolarHBondContact O-CG 3.3Å; L723-L727 PolarHBondContact O-N 2.92Å; T724-L727 PolarHBondContact O-N 2.88Å; L727-A729 VanDerWaalsContact C-N 3.33Å; L727-A729 PolarHBondContact O-N 2.89Å; L727-A730 CarbonylContact O-C 3.57Å; L727-A730 PolarHBondContact O-N 2.6Å; L727-A730 VanDerWaalsContact O-N 3.13Å; L727-G731 PolarHBondContact O-N 3.06Å; L727-G731 VanDerWaalsContact O-N 3.12Å; L727-A732 HydrophobicContact CB-CB 4.12Å; L727-A732 VanDerWaalsContact O-CB 3.3Å; L727-A732 WeakPolarHBondContact O-CB 3.39Å; L727-A732 PolarHBondContact O-N 3.17Å
728	M	91.4	Very high	90.5	Very high	50 Å²	50	49.7 Å²	49.7	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-42.4	173.1	-69	-66.6	-70.6	0	0	111.2	L712 T724 A730 G731 P734 L780	L712-M728 HydrophobicContact CD1-CG 4.23Å; L712-M728 HydrophobicContact CD1-SD 4.32Å; L712-M728 HydrophobicContact CD2-SD 3.85Å; T724-M728 HydrophobicContact CG2-CG 4.36Å; T724-M728 WeakPolarHBondContact O-CB 3.2Å; T724-M728 WeakPolarHBondContact O-CG 3.29Å; T724-M728 PolarHBondContact O-N 3.42Å; M728-A730 VanDerWaalsContact C-N 3.28Å; M728-A730 PolarHBondContact O-N 2.81Å; M728-G731 PolarHBondContact O-N 2.99Å; M728-P734 HydrophobicContact CE-CB 4.25Å; M728-P734 HydrophobicContact CE-CG 4.07Å; M728-P734 HydrophobicContact SD-CB 4.13Å; M728-P734 HydrophobicContact SD-CG 4.38Å; M728-L780 HydrophobicContact CG-CD2 4.48Å; M728-L780 HydrophobicContact SD-CD2 4Å
729	A	89.8	Confident	90.2	Very high	93 Å²	93	51 Å²	51	77%	0.769	29%	0.285	S	S	*	.	H	α-helix	trans	-67.6	-25.4	175.2	0	0	0	0	0	113.7	A725 L726 L727 G731	A725-A729 WeakPolarHBondContact O-CB 3.44Å; A725-A729 PolarHBondContact O-N 2.75Å; L726-A729 PolarHBondContact O-N 2.87Å; L727-A729 VanDerWaalsContact C-N 3.33Å; L727-A729 PolarHBondContact O-N 2.89Å; A729-G731 VanDerWaalsContact C-N 3.3Å
730	A	89	Confident	89.6	Confident	46 Å²	46	54.1 Å²	54.1	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-79.7	-10.4	170.8	0	0	0	0	0	113.4	L694 V701 L726 L727 M728	L694-A730 HydrophobicContact CD1-CB 4.14Å; L694-A730 HydrophobicContact CD2-CB 4.04Å; V701-A730 HydrophobicContact CG1-CB 4.09Å; V701-A730 HydrophobicContact CG2-CB 3.8Å; L726-A730 WeakPolarHBondContact O-CB 3.46Å; L726-A730 PolarHBondContact O-N 3.09Å; L727-A730 CarbonylContact O-C 3.57Å; L727-A730 PolarHBondContact O-N 2.6Å; L727-A730 VanDerWaalsContact O-N 3.13Å; M728-A730 VanDerWaalsContact C-N 3.28Å; M728-A730 PolarHBondContact O-N 2.81Å
731	G	88.6	Confident	88.5	Confident	53 Å²	53	56.9 Å²	56.9	55%	0.546	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	27.2	177	0	0	0	0	0	115.6	L727 M728 A729	L727-G731 PolarHBondContact O-N 3.06Å; L727-G731 VanDerWaalsContact O-N 3.12Å; M728-G731 PolarHBondContact O-N 2.99Å; A729-G731 VanDerWaalsContact C-N 3.3Å
732	A	92.6	Very high	86.8	Confident	9 Å²	9	57.2 Å²	57.2	7%	0.074	31%	0.314	C	S	.	.			trans	-61	150.5	172.6	0	0	0	0	0	113.2	V701 D702 L712 L727 P734	V701-A732 HydrophobicContact CB-CB 4.44Å; V701-A732 HydrophobicContact CG1-CB 3.64Å; D702-A732 WeakPolarHBondContact OD1-CA 3.33Å; L712-A732 HydrophobicContact CB-CB 4.24Å; L712-A732 HydrophobicContact CD1-CB 4.4Å; L712-A732 HydrophobicContact CD2-CB 3.79Å; L712-A732 HydrophobicContact CG-CB 4.37Å; L727-A732 HydrophobicContact CB-CB 4.12Å; L727-A732 VanDerWaalsContact O-CB 3.3Å; L727-A732 WeakPolarHBondContact O-CB 3.39Å; L727-A732 PolarHBondContact O-N 3.17Å; A732-P734 WeakPolarHBondContact O-CD 3.48Å
733	D	91.1	Very high	85.1	Confident	68 Å²	68	58.5 Å²	58.5	36%	0.364	32%	0.32	S	S	.	.			trans	-93.4	111.8	176.5	-174.2	-10.1	0	0	0	111.9	D702 H735 R736	D702-D733 PolarHBondContact OD1-N 3.39Å; D702-D733 PolarHBondContact OD2-N 2.76Å; D733-H735 PolarHBondContact O-N 2.85Å; D733-H735 WeakPolarHBondContact OD1-CA 3.43Å; D733-H735 PolarHBondContact OD1-N 2.88Å; D733-R736 HydrophobicContact CB-CB 4.07Å; D733-R736 PolarHBondContact OD1-N 2.93Å
734	P	90.9	Very high	82.8	Confident	17 Å²	17	65.5 Å²	65.5	11%	0.11	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-9.1	179	33.8	-38.4	0	0	0	114.1	L712 M728 A732 P767 V768 L780	L712-P734 HydrophobicContact CD2-CB 4.26Å; M728-P734 HydrophobicContact CE-CB 4.25Å; M728-P734 HydrophobicContact CE-CG 4.07Å; M728-P734 HydrophobicContact SD-CB 4.13Å; M728-P734 HydrophobicContact SD-CG 4.38Å; A732-P734 WeakPolarHBondContact O-CD 3.48Å; P734-P767 WeakPolarHBondContact O-CD 2.91Å; P734-V768 HydrophobicContact CB-CG2 4.14Å; P734-V768 WeakPolarHBondContact O-CG2 3.5Å; P734-L780 HydrophobicContact CB-CB 4.43Å; P734-L780 HydrophobicContact CB-CD2 3.96Å
735	H	89.8	Confident	80.4	Confident	125 Å²	125	73.4 Å²	73.4	58%	0.579	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-0.1	-176.9	-60.1	-43.4	0	0	0	113.8	D733 E737 T766	D733-H735 PolarHBondContact O-N 2.85Å; D733-H735 WeakPolarHBondContact OD1-CA 3.43Å; D733-H735 PolarHBondContact OD1-N 2.88Å; H735-E737 PolarHBondContact O-N 2.84Å; H735-T766 WeakPolarHBondContact O-CG2 3.39Å
736	R	87.6	Confident	78	Confident	95 Å²	95	79.3 Å²	79.3	36%	0.358	42%	0.415	S	S	.	.			trans	-69	125.8	178	-175.2	161.3	176	179.8	-10.4	111.5	D702 C704 H713 D733 P767	D702-R736 VanDerWaalsContact O-CZ 3.23Å; D702-R736 PolarHBondContact O-NH1 3.36Å; D702-R736 PolarHBondContact O-NH2 2.92Å; C704-R736 PolarHBondContact SG-NH2 2.74Å; H713-R736 PolarHBondContact CE1-O 2.76Å; H713-R736 PolarHBondContact NE2-O 2.79Å; D733-R736 HydrophobicContact CB-CB 4.07Å; D733-R736 PolarHBondContact OD1-N 2.93Å; R736-P767 VanDerWaalsContact O-CD 3.29Å; R736-P767 WeakPolarHBondContact O-CD 3.5Å
737	E	87.9	Confident	75.6	Confident	75 Å²	75	85.1 Å²	85.1	35%	0.35	44%	0.441	S	S	.	.			trans	-80.9	143.1	179.3	-65.9	179.8	-166.7	0	0	112.4	H735 Y761 G764 T766	H735-E737 PolarHBondContact O-N 2.84Å; E737-Y761 PolarHBondContact OE2-OH 2.94Å; E737-G764 PolarHBondContact OE2-N 3.16Å; E737-T766 HydrophobicContact CG-CG2 3.74Å
738	N	87.1	Confident	73.3	Confident	4 Å²	4	93.2 Å²	93.2	2%	0.021	48%	0.479	C	S	.	.			trans	-94.7	-168.4	166.8	75.7	3.5	0	0	0	111.8	N707 S709 E740 G764 T765	N707-N738 WeakPolarHBondContact O-CB 3.48Å; S709-N738 PolarHBondContact OG-ND2 2.82Å; N738-E740 PolarHBondContact OD1-N 3.05Å; N738-E740 PolarHBondContact OD1-O 3.04Å; N738-G764 WeakPolarHBondContact O-CA 3.13Å; N738-T765 PolarHBondContact N-O 3.03Å; N738-T765 WeakPolarHBondContact OD1-CB 3.37Å; N738-T765 PolarHBondContact OD1-N 2.99Å; N738-T765 PolarHBondContact OD1-O 2.99Å
739	F	84.7	Confident	71.2	Confident	159 Å²	159	99.6 Å²	99.6	70%	0.697	51%	0.508	S	S	*	.	S	Bend	trans	-100.2	17	177.2	-52.8	-40.3	0	0	0	113.9	N707	N707-F739 VanDerWaalsContact C-CD2 3.46Å; N707-F739 PolarHBondContact O-N 2.98Å
740	E	75.3	Confident	68.8	Low	84 Å²	84	103.1 Å²	103.1	39%	0.393	51%	0.509	S	S	.	.	S	Bend	trans	-96.7	116.3	173.6	-68.1	178.8	178.6	0	0	109.1	N707 N738 T765	N707-E740 PolarHBondContact ND2-OE1 2.87Å; N738-E740 PolarHBondContact OD1-N 3.05Å; N738-E740 PolarHBondContact OD1-O 3.04Å; E740-T765 WeakPolarHBondContact O-CB 3.29Å; E740-T765 PolarHBondContact O-N 3.4Å; E740-T765 PolarHBondContact O-OG1 3.44Å
741	P	68.3	Low	66.6	Low	70 Å²	70	108.4 Å²	108.4	46%	0.455	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-67.4	135.3	-175.6	27	-34.2	0	0	0	110.9	F743 I762	P741-F743 PolarHBondContact O-N 3.19Å; P741-F743 VanDerWaalsContact O-N 3.12Å; P741-I762 HydrophobicContact CB-CG2 3.63Å
742	L	56.5	Low	64.6	Low	56 Å²	56	113.2 Å²	113.2	29%	0.293	54%	0.544	S	S	.	.	S	Bend	trans	-60.8	-23.7	-177	-80.7	164.6	0	0	0	114.4	G764 T765 N769	L742-G764 WeakPolarHBondContact CD1-O 3.43Å; L742-T765 HydrophobicContact CD2-CG2 3.88Å; L742-T765 WeakPolarHBondContact CD2-OG1 3.41Å; L742-N769 HydrophobicContact CD2-CB 3.73Å; L742-N769 VanDerWaalsContact CD2-ND2 3.31Å; L742-N769 WeakPolarHBondContact CD2-ND2 3.41Å
743	F	54.1	Low	62.2	Low	163 Å²	163	122.4 Å²	122.4	72%	0.715	59%	0.585	S	S	*	*			trans	-138.6	127.5	173.7	-61.3	-86.2	0	0	0	109.1	P741 R745	P741-F743 PolarHBondContact O-N 3.19Å; P741-F743 VanDerWaalsContact O-N 3.12Å; F743-R745 PolarHBondContact O-N 3.33Å
744	I	45	Very low	60.2	Low	146 Å²	146	128.6 Å²	128.6	75%	0.749	61%	0.612	S	S	*	*			trans	-69.9	114.9	146.4	-62.3	172.4	0	0	0	104.4	D746	I744-D746 PolarHBondContact O-N 3.14Å
745	R	41.9	Very low	57.7	Low	166 Å²	166	136.3 Å²	136.3	63%	0.626	65%	0.647	S	S	*	*			trans	-61.5	119.4	158.2	-105.8	176.6	67.8	-179.7	-2.6	105	F743 E747 E750	F743-R745 PolarHBondContact O-N 3.33Å; R745-E747 VanDerWaalsContact C-N 3.3Å; R745-E747 PolarHBondContact O-N 2.88Å; R745-E750 IonicContact NH2-OE1 2.81Å; R745-E750 PolarHBondContact NH2-OE1 3.42Å; R745-E750 VanDerWaalsContact NH2-OE1 3.16Å
746	D	41	Very low	55.9	Low	141 Å²	141	140.4 Å²	140.4	75%	0.754	67%	0.666	S	S	*	*			trans	-62.9	102.6	160.7	-74.9	-52.6	0	0	0	105.9	I744 E748	I744-D746 PolarHBondContact O-N 3.14Å; D746-E748 PolarHBondContact O-N 2.86Å
747	E	40.7	Very low	53.8	Low	168 Å²	168	142.6 Å²	142.6	79%	0.785	69%	0.685	S	S	*	*			trans	-73.8	62.4	173.3	-73.5	166.8	-175.1	0	0	109.3	R745	R745-E747 VanDerWaalsContact C-N 3.3Å; R745-E747 PolarHBondContact O-N 2.88Å
748	E	45.7	Very low	51.9	Low	170 Å²	170	147 Å²	147	79%	0.794	71%	0.71	S	S	*	*			trans	-75.8	127.1	153.5	-63.4	-165.1	146.4	0	0	107.6	D746	D746-E748 PolarHBondContact O-N 2.86Å
749	E	47.9	Very low	50.1	Low	183 Å²	183	156.1 Å²	156.1	86%	0.855	75%	0.753	S	S	*	*			trans	70.4	92.9	176.2	-52.3	-174.3	175.3	0	0	116.8
750	E	40.3	Very low	48.6	Very low	167 Å²	167	151.3 Å²	151.3	78%	0.78	75%	0.749	S	S	*	*			trans	-157.5	94.4	147.8	-106.5	161	-120.5	0	0	109.1	R745	R745-E750 IonicContact NH2-OE1 2.81Å; R745-E750 PolarHBondContact NH2-OE1 3.42Å; R745-E750 VanDerWaalsContact NH2-OE1 3.16Å
751	D	42.4	Very low	47.6	Very low	158 Å²	158	156.6 Å²	156.6	85%	0.845	77%	0.766	S	S	*	*			trans	-110.5	131.5	156.8	-98.5	-33	0	0	0	105.4
752	D	45.7	Very low	47.3	Very low	154 Å²	154	158.8 Å²	158.8	82%	0.824	77%	0.773	S	S	*	*			trans	55.1	98.9	170.3	-60	-27.8	0	0	0	119.4
753	E	43	Very low	47.7	Very low	202 Å²	202	158.5 Å²	158.5	94%	0.944	78%	0.776	S	S	*	*				-166.9	162.9	106.4	-103	175	-162.2	0	0	112.3
754	E	48.8	Very low	48.7	Very low	198 Å²	198	151 Å²	151	93%	0.925	74%	0.744	S	S	*	*			trans	-95.4	102.5	-171.2	-63.1	178.4	147.9	0	0	113
755	E	38.9	Very low	50.6	Low	179 Å²	179	144.8 Å²	144.8	84%	0.836	71%	0.713	S	S	*	*			trans	-133.5	124.5	163.4	-67.2	-162.4	133.4	0	0	112.4	D757	E755-D757 PolarHBondContact O-N 3.13Å
756	E	51.4	Low	52.8	Low	210 Å²	210	137.5 Å²	137.5	98%	0.981	69%	0.687	S	S	*	*			trans	-82	75.7	171.9	-71.3	-174.6	133.8	0	0	110.5
757	D	42.5	Very low	55.1	Low	142 Å²	142	130.8 Å²	130.8	76%	0.759	65%	0.651	S	S	*	*			trans	-108.1	147.2	170.2	-102	-15.8	0	0	0	111.3	E755 E759	E755-D757 PolarHBondContact O-N 3.13Å; D757-E759 PolarHBondContact O-N 2.92Å
758	D	49.3	Very low	57.4	Low	166 Å²	166	124.1 Å²	124.1	89%	0.888	62%	0.622	S	S	*	*			trans	-49.9	127.7	-172.6	-91	-46.7	0	0	0	113.2	G760	D758-G760 PolarHBondContact O-N 2.99Å
759	E	49.7	Very low	59.3	Low	197 Å²	197	120.5 Å²	120.5	92%	0.921	61%	0.608	S	S	*	*			trans	-57.6	96.8	167.5	-76.4	-175.1	174.2	0	0	109.5	D757 Y761	D757-E759 PolarHBondContact O-N 2.92Å; E759-Y761 PolarHBondContact O-N 2.72Å
760	G	52.7	Low	61.1	Low	58 Å²	58	114.5 Å²	114.5	60%	0.598	58%	0.581	S	S	*	*			trans	-59.2	123.4	-169.9	0	0	0	0	0	112.3	D758 I762	D758-G760 PolarHBondContact O-N 2.99Å; G760-I762 WeakPolarHBondContact O-CG1 3.31Å; G760-I762 PolarHBondContact O-N 2.73Å
761	Y	54.8	Low	63.4	Low	195 Å²	195	107.8 Å²	107.8	77%	0.765	55%	0.554	S	S	*	*			trans	-51.9	102.6	179.3	178.6	-91.7	0	0	0	111.2	E737 E759 S763	E737-Y761 PolarHBondContact OE2-OH 2.94Å; E759-Y761 PolarHBondContact O-N 2.72Å; Y761-S763 PolarHBondContact O-N 2.89Å
762	I	60.8	Low	65.6	Low	115 Å²	115	103.4 Å²	103.4	59%	0.59	54%	0.54	S	S	*	.			trans	-75	111.5	175.1	-53	179.6	0	0	0	107.1	P741 G760	P741-I762 HydrophobicContact CB-CG2 3.63Å; G760-I762 WeakPolarHBondContact O-CG1 3.31Å; G760-I762 PolarHBondContact O-N 2.73Å
763	S	64.4	Low	67.7	Low	51 Å²	51	97.6 Å²	97.6	36%	0.357	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-62.6	140.2	179.6	54.9	0	0	0	0	111.5	Y761	Y761-S763 PolarHBondContact O-N 2.89Å
764	G	75.6	Confident	69.7	Low	5 Å²	5	92.3 Å²	92.3	5%	0.052	49%	0.494	C	S	.	.	B	Isolated β-bridge	trans	-74.3	167.5	-176.4	0	0	0	0	0	112.8	E737 N738 L742	E737-G764 PolarHBondContact OE2-N 3.16Å; N738-G764 WeakPolarHBondContact O-CA 3.13Å; L742-G764 WeakPolarHBondContact CD1-O 3.43Å
765	T	85.3	Confident	71.5	Confident	16 Å²	16	86.2 Å²	86.2	10%	0.098	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-77.5	136.4	176.4	-58	0	0	0	0	110.1	H713 N738 E740 L742 N769 M770	H713-T765 PolarHBondContact NE2-O 3.29Å; H713-T765 VanDerWaalsContact NE2-O 3.08Å; N738-T765 PolarHBondContact N-O 3.03Å; N738-T765 WeakPolarHBondContact OD1-CB 3.37Å; N738-T765 PolarHBondContact OD1-N 2.99Å; N738-T765 PolarHBondContact OD1-O 2.99Å; E740-T765 WeakPolarHBondContact O-CB 3.29Å; E740-T765 PolarHBondContact O-N 3.4Å; E740-T765 PolarHBondContact O-OG1 3.44Å; L742-T765 HydrophobicContact CD2-CG2 3.88Å; L742-T765 WeakPolarHBondContact CD2-OG1 3.41Å; T765-N769 HydrophobicContact CG2-CB 4.11Å; T765-M770 HydrophobicContact CG2-CG 3.43Å; T765-M770 VanDerWaalsContact CG2-CG 3.43Å; T765-M770 HydrophobicContact CG2-SD 4.19Å
766	T	89	Confident	73.8	Confident	13 Å²	13	77.7 Å²	77.7	8%	0.08	43%	0.425	C	S	.	.			trans	-104.4	161.3	177.2	63	0	0	0	0	111.3	H735 E737 V768 N769 M770	H735-T766 WeakPolarHBondContact O-CG2 3.39Å; E737-T766 HydrophobicContact CG-CG2 3.74Å; T766-V768 PolarHBondContact O-N 3.23Å; T766-N769 PolarHBondContact O-N 3.45Å; T766-N769 VanDerWaalsContact OG1-CG 3.28Å; T766-N769 PolarHBondContact OG1-N 3.33Å; T766-N769 PolarHBondContact OG1-ND2 2.93Å; T766-M770 WeakPolarHBondContact O-CG 3.37Å; T766-M770 PolarHBondContact O-N 3.15Å; T766-M770 VanDerWaalsContact O-N 3.09Å
767	P	88.9	Confident	75.6	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-38.7	174	-27.1	33.8	0	0	0	113.9	L712 A716 P734 R736 N769 M770 A771 L780	L712-P767 HydrophobicContact CB-CB 4.45Å; L712-P767 HydrophobicContact CB-CG 4.22Å; L712-P767 HydrophobicContact CD2-CB 3.92Å; L712-P767 HydrophobicContact CD2-CG 3.94Å; L712-P767 HydrophobicContact CG-CB 3.86Å; L712-P767 HydrophobicContact CG-CG 4.07Å; A716-P767 HydrophobicContact CB-CB 4.33Å; A716-P767 WeakPolarHBondContact CB-O 3.33Å; P734-P767 WeakPolarHBondContact O-CD 2.91Å; R736-P767 VanDerWaalsContact O-CD 3.29Å; R736-P767 WeakPolarHBondContact O-CD 3.5Å; P767-N769 VanDerWaalsContact C-N 3.31Å; P767-N769 PolarHBondContact O-N 2.7Å; P767-M770 PolarHBondContact O-N 2.96Å; P767-A771 PolarHBondContact O-N 3.34Å; P767-L780 HydrophobicContact CB-CD2 4.22Å
768	V	88.2	Confident	77.8	Confident	28 Å²	28	68 Å²	68	17%	0.17	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-43.5	174.1	169.2	0	0	0	0	111.3	P734 T766 M770 A771 L777 L780	P734-V768 HydrophobicContact CB-CG2 4.14Å; P734-V768 WeakPolarHBondContact O-CG2 3.5Å; T766-V768 PolarHBondContact O-N 3.23Å; V768-M770 VanDerWaalsContact C-N 3.29Å; V768-M770 PolarHBondContact O-N 3.3Å; V768-A771 WeakPolarHBondContact O-CB 3.36Å; V768-A771 PolarHBondContact O-N 2.77Å; V768-L777 HydrophobicContact CG1-CD1 3.9Å; V768-L780 HydrophobicContact CG2-CB 3.95Å
769	N	86.5	Confident	79.6	Confident	93 Å²	93	60.8 Å²	60.8	50%	0.497	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-19.5	-180	-64.3	-11.9	0	0	0	112.7	L742 T765 T766 P767	L742-N769 HydrophobicContact CD2-CB 3.73Å; L742-N769 VanDerWaalsContact CD2-ND2 3.31Å; L742-N769 WeakPolarHBondContact CD2-ND2 3.41Å; T765-N769 HydrophobicContact CG2-CB 4.11Å; T766-N769 PolarHBondContact O-N 3.45Å; T766-N769 VanDerWaalsContact OG1-CG 3.28Å; T766-N769 PolarHBondContact OG1-N 3.33Å; T766-N769 PolarHBondContact OG1-ND2 2.93Å; P767-N769 VanDerWaalsContact C-N 3.31Å; P767-N769 PolarHBondContact O-N 2.7Å
770	M	86.1	Confident	81.4	Confident	58 Å²	58	51.6 Å²	51.6	29%	0.286	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.4	173.7	-58.2	-165.9	85.4	0	0	114.4	H713 A716 G717 T765 T766 P767 V768 A772	H713-M770 HydrophobicContact CB-SD 3.81Å; A716-M770 CarbonylContact C-O 3.59Å; A716-M770 HydrophobicContact CB-CB 4.4Å; G717-M770 VanDerWaalsContact CA-O 3.32Å; G717-M770 WeakPolarHBondContact CA-O 3.47Å; G717-M770 PolarHBondContact N-O 2.8Å; T765-M770 HydrophobicContact CG2-CG 3.43Å; T765-M770 VanDerWaalsContact CG2-CG 3.43Å; T765-M770 HydrophobicContact CG2-SD 4.19Å; T766-M770 WeakPolarHBondContact O-CG 3.37Å; T766-M770 PolarHBondContact O-N 3.15Å; T766-M770 VanDerWaalsContact O-N 3.09Å; P767-M770 PolarHBondContact O-N 2.96Å; V768-M770 VanDerWaalsContact C-N 3.29Å; V768-M770 PolarHBondContact O-N 3.3Å; M770-A772 PolarHBondContact O-N 3.04Å
771	A	88.2	Confident	83	Confident	26 Å²	26	53.6 Å²	53.6	22%	0.215	30%	0.296	C	S	.	.			trans	-62.1	102.2	-170.3	0	0	0	0	0	113.2	P767 V768 S773 V776 L777 L780	P767-A771 PolarHBondContact O-N 3.34Å; V768-A771 WeakPolarHBondContact O-CB 3.36Å; V768-A771 PolarHBondContact O-N 2.77Å; A771-S773 VanDerWaalsContact C-N 3.26Å; A771-S773 PolarHBondContact O-N 2.84Å; A771-V776 HydrophobicContact CB-CG1 4.03Å; A771-L777 HydrophobicContact CB-CB 3.88Å; A771-L777 HydrophobicContact CB-CD1 4.08Å; A771-L780 HydrophobicContact CB-CD1 4.02Å
772	A	88.9	Confident	84.2	Confident	66 Å²	66	46.9 Å²	46.9	55%	0.545	29%	0.286	S	S	.	.			trans	-75.5	-7.5	-173.9	0	0	0	0	0	114.8	A716 M770	A716-A772 WeakPolarHBondContact O-CB 3.43Å; A716-A772 PolarHBondContact O-N 3.08Å; M770-A772 PolarHBondContact O-N 3.04Å
773	S	88.2	Confident	85.1	Confident	31 Å²	31	47.6 Å²	47.6	22%	0.217	29%	0.287	C	S	.	.	S	Bend	trans	-142.8	149.7	176.2	72.8	0	0	0	0	111.3	A771 E775 V776 L777	A771-S773 VanDerWaalsContact C-N 3.26Å; A771-S773 PolarHBondContact O-N 2.84Å; S773-E775 VanDerWaalsContact C-N 3.28Å; S773-E775 PolarHBondContact O-N 2.77Å; S773-V776 PolarHBondContact O-N 3.31Å; S773-V776 VanDerWaalsContact O-N 3.14Å; S773-V776 WeakPolarHBondContact OG-CB 3.19Å; S773-V776 WeakPolarHBondContact OG-CG2 3.18Å; S773-V776 PolarHBondContact OG-N 3.15Å; S773-L777 PolarHBondContact O-N 3.22Å
774	P	85.9	Confident	85.5	Confident	91 Å²	91	53.9 Å²	53.9	59%	0.591	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-36.6	179.2	25.2	-33.8	0	0	0	111.7	V776 L777 D778	P774-V776 PolarHBondContact O-N 3.24Å; P774-L777 CarbonylContact O-C 3.5Å; P774-L777 WeakPolarHBondContact O-CB 3.47Å; P774-L777 PolarHBondContact O-N 3.15Å; P774-D778 WeakPolarHBondContact O-CB 3.39Å; P774-D778 VanDerWaalsContact O-CG 3.27Å; P774-D778 PolarHBondContact O-N 2.96Å
775	E	85.8	Confident	85.4	Confident	70 Å²	70	58.1 Å²	58.1	33%	0.327	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-29.4	177.4	-60.3	178.1	-165.3	0	0	112.4	I721 S773 L779 R788	I721-E775 HydrophobicContact CD1-CB 4.11Å; I721-E775 WeakPolarHBondContact CD1-OE2 3.44Å; I721-E775 HydrophobicContact CG1-CB 4.22Å; S773-E775 VanDerWaalsContact C-N 3.28Å; S773-E775 PolarHBondContact O-N 2.77Å; E775-L779 WeakPolarHBondContact O-CG 3.14Å; E775-L779 PolarHBondContact O-N 3.29Å; E775-R788 IonicContact OE1-CZ 2.73Å; E775-R788 IonicContact OE1-NH1 3.71Å; E775-R788 PolarHBondContact OE1-NH1 2.64Å; E775-R788 IonicContact OE1-NH2 2.74Å; E775-R788 PolarHBondContact OE1-NH2 2.97Å; E775-R788 IonicContact OE2-CZ 3.21Å; E775-R788 IonicContact OE2-NH1 2.83Å; E775-R788 PolarHBondContact OE2-NH1 2.87Å; E775-R788 IonicContact OE2-NH2 2.69Å
776	V	88.3	Confident	84.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-77.2	-40.4	170.9	159.5	0	0	0	0	111.5	A716 I721 T724 A771 S773 P774 D778 L779 L780	A716-V776 HydrophobicContact CB-CG1 4.17Å; I721-V776 HydrophobicContact CB-CG2 4.43Å; I721-V776 HydrophobicContact CG1-CG2 3.94Å; T724-V776 HydrophobicContact CG2-CG1 4.22Å; A771-V776 HydrophobicContact CB-CG1 4.03Å; S773-V776 PolarHBondContact O-N 3.31Å; S773-V776 VanDerWaalsContact O-N 3.14Å; S773-V776 WeakPolarHBondContact OG-CB 3.19Å; S773-V776 WeakPolarHBondContact OG-CG2 3.18Å; S773-V776 PolarHBondContact OG-N 3.15Å; P774-V776 PolarHBondContact O-N 3.24Å; V776-D778 VanDerWaalsContact C-N 3.32Å; V776-D778 PolarHBondContact O-N 3.43Å; V776-L779 PolarHBondContact O-N 3.27Å; V776-L780 HydrophobicContact CG1-CD1 3.75Å; V776-L780 HydrophobicContact CG1-CG 4.4Å; V776-L780 VanDerWaalsContact O-CG 3.27Å; V776-L780 WeakPolarHBondContact O-CG 3.31Å; V776-L780 PolarHBondContact O-N 3.31Å
777	L	88.4	Confident	83	Confident	65 Å²	65	69.2 Å²	69.2	34%	0.34	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-40.6	176.2	-177.9	60.2	0	0	0	111.6	V768 A771 S773 P774 L780 N781	V768-L777 HydrophobicContact CG1-CD1 3.9Å; A771-L777 HydrophobicContact CB-CB 3.88Å; A771-L777 HydrophobicContact CB-CD1 4.08Å; S773-L777 PolarHBondContact O-N 3.22Å; P774-L777 CarbonylContact O-C 3.5Å; P774-L777 WeakPolarHBondContact O-CB 3.47Å; P774-L777 PolarHBondContact O-N 3.15Å; L777-L780 PolarHBondContact O-N 3.03Å; L777-N781 WeakPolarHBondContact O-CB 3.45Å; L777-N781 PolarHBondContact O-N 3.32Å; L777-N781 PolarHBondContact O-ND2 3.1Å
778	D	88.6	Confident	81.2	Confident	84 Å²	84	78.3 Å²	78.3	45%	0.449	42%	0.417	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.9	-70.3	-29.2	0	0	0	111.7	P774 V776 N781 G782 Q783	P774-D778 WeakPolarHBondContact O-CB 3.39Å; P774-D778 VanDerWaalsContact O-CG 3.27Å; P774-D778 PolarHBondContact O-N 2.96Å; V776-D778 VanDerWaalsContact C-N 3.32Å; V776-D778 PolarHBondContact O-N 3.43Å; D778-N781 CarbonylContact O-C 3.58Å; D778-N781 PolarHBondContact O-N 3.43Å; D778-G782 PolarHBondContact O-N 3.5Å; D778-Q783 HydrophobicContact CB-CB 4.38Å; D778-Q783 HydrophobicContact CB-CG 3.99Å; D778-Q783 WeakPolarHBondContact O-CB 3.47Å; D778-Q783 WeakPolarHBondContact O-CG 3.46Å; D778-Q783 PolarHBondContact O-N 2.81Å
779	L	87.6	Confident	79.1	Confident	15 Å²	15	81.8 Å²	81.8	8%	0.079	44%	0.443	C	S	.	.	H	α-helix	trans	-63.5	-43.1	173.1	-72.9	176.3	0	0	0	112.7	I721 T724 A725 E775 V776 N781 G782 Q783 Y785	I721-L779 HydrophobicContact CG2-CD1 3.64Å; T724-L779 HydrophobicContact CG2-CB 4.24Å; T724-L779 HydrophobicContact CG2-CD1 4.46Å; A725-L779 HydrophobicContact CB-CD1 4.14Å; E775-L779 WeakPolarHBondContact O-CG 3.14Å; E775-L779 PolarHBondContact O-N 3.29Å; V776-L779 PolarHBondContact O-N 3.27Å; L779-N781 VanDerWaalsContact C-N 3.26Å; L779-N781 PolarHBondContact O-N 3.45Å; L779-G782 PolarHBondContact O-N 2.9Å; L779-Q783 WeakPolarHBondContact CD2-O 3.49Å; L779-Y785 HydrophobicContact CD1-CD2 4.31Å; L779-Y785 HydrophobicContact CD2-CD2 4.38Å
780	L	87.8	Confident	77	Confident	4 Å²	4	86.2 Å²	86.2	2%	0.021	46%	0.461	C	S	.	.	H	α-helix	trans	-66.6	-29.3	178.1	-69	166.1	0	0	0	112.1	L712 A716 T724 M728 P734 P767 V768 A771 V776 L777 G782	L712-L780 HydrophobicContact CD1-CD2 3.94Å; L712-L780 HydrophobicContact CD2-CD2 3.77Å; L712-L780 HydrophobicContact CG-CD2 3.96Å; A716-L780 HydrophobicContact CB-CD1 4Å; T724-L780 HydrophobicContact CG2-CD2 3.87Å; T724-L780 HydrophobicContact CG2-CG 3.92Å; M728-L780 HydrophobicContact CG-CD2 4.48Å; M728-L780 HydrophobicContact SD-CD2 4Å; P734-L780 HydrophobicContact CB-CB 4.43Å; P734-L780 HydrophobicContact CB-CD2 3.96Å; P767-L780 HydrophobicContact CB-CD2 4.22Å; V768-L780 HydrophobicContact CG2-CB 3.95Å; A771-L780 HydrophobicContact CB-CD1 4.02Å; V776-L780 HydrophobicContact CG1-CD1 3.75Å; V776-L780 HydrophobicContact CG1-CG 4.4Å; V776-L780 VanDerWaalsContact O-CG 3.27Å; V776-L780 WeakPolarHBondContact O-CG 3.31Å; V776-L780 PolarHBondContact O-N 3.31Å; L777-L780 PolarHBondContact O-N 3.03Å; L780-G782 PolarHBondContact O-N 3.11Å
781	N	86.4	Confident	74.8	Confident	99 Å²	99	92.4 Å²	92.4	53%	0.529	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	6.3	169.8	-72.1	-56.1	0	0	0	113.8	L777 D778 L779	L777-N781 WeakPolarHBondContact O-CB 3.45Å; L777-N781 PolarHBondContact O-N 3.32Å; L777-N781 PolarHBondContact O-ND2 3.1Å; D778-N781 CarbonylContact O-C 3.58Å; D778-N781 PolarHBondContact O-N 3.43Å; L779-N781 VanDerWaalsContact C-N 3.26Å; L779-N781 PolarHBondContact O-N 3.45Å
782	G	78.4	Confident	72.3	Confident	55 Å²	55	95.3 Å²	95.3	57%	0.567	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	22.8	172.3	0	0	0	0	0	116	D778 L779 L780	D778-G782 PolarHBondContact O-N 3.5Å; L779-G782 PolarHBondContact O-N 2.9Å; L780-G782 PolarHBondContact O-N 3.11Å
783	Q	79.8	Confident	69.8	Low	130 Å²	130	100.6 Å²	100.6	61%	0.607	52%	0.524	S	S	*	.			trans	-67.5	145.3	161.1	-64.4	-57.1	-78.3	0	0	110.5	D778 L779	D778-Q783 HydrophobicContact CB-CB 4.38Å; D778-Q783 HydrophobicContact CB-CG 3.99Å; D778-Q783 WeakPolarHBondContact O-CB 3.47Å; D778-Q783 WeakPolarHBondContact O-CG 3.46Å; D778-Q783 PolarHBondContact O-N 2.81Å; L779-Q783 WeakPolarHBondContact CD2-O 3.49Å
784	E	72.7	Confident	67.7	Low	182 Å²	182	105.4 Å²	105.4	85%	0.85	55%	0.546	S	S	*	.			trans	-72	142.6	173.3	-67	-172.1	177.6	0	0	110.7	E786	E784-E786 PolarHBondContact O-N 3.18Å
785	Y	74.1	Confident	65.9	Low	95 Å²	95	103.3 Å²	103.3	37%	0.373	53%	0.532	S	S	.	.			trans	-74.4	95	175.9	175.6	-110.4	0	0	0	110.7	I721 A725 L779 P787	I721-Y785 HydrophobicContact CG2-CD2 3.98Å; I721-Y785 HydrophobicContact CG2-CE2 3.67Å; A725-Y785 HydrophobicContact CB-CD1 4.22Å; A725-Y785 HydrophobicContact CB-CD2 4.1Å; A725-Y785 HydrophobicContact CB-CG 3.76Å; L779-Y785 HydrophobicContact CD1-CD2 4.31Å; L779-Y785 HydrophobicContact CD2-CD2 4.38Å; Y785-P787 HydrophobicContact CE1-CB 3.88Å; Y785-P787 WeakPolarHBondContact O-CD 3.46Å
786	E	64.3	Low	64.3	Low	172 Å²	172	105 Å²	105	80%	0.804	55%	0.549	S	S	*	.			trans	-69.4	112	162.2	-69	-163.5	160.7	0	0	109.2	E784 R788	E784-E786 PolarHBondContact O-N 3.18Å; E786-R788 PolarHBondContact O-N 2.8Å; E786-R788 VanDerWaalsContact O-N 3.11Å
787	P	59.7	Low	62.8	Low	89 Å²	89	113.3 Å²	113.3	58%	0.578	59%	0.588	S	S	*	*			trans	-65.8	118.1	172.9	27.8	-32.9	0	0	0	108.2	Y785 S789	Y785-P787 HydrophobicContact CE1-CB 3.88Å; Y785-P787 WeakPolarHBondContact O-CD 3.46Å; P787-S789 PolarHBondContact O-N 3.41Å
788	R	51.9	Low	61.4	Low	191 Å²	191	111 Å²	111	72%	0.721	58%	0.58	S	S	*	*			trans	-60.5	90	165.7	-79.4	-171.4	177	134	1.7	108.9	E775 E786 Q790	E775-R788 IonicContact OE1-CZ 2.73Å; E775-R788 IonicContact OE1-NH1 3.71Å; E775-R788 PolarHBondContact OE1-NH1 2.64Å; E775-R788 IonicContact OE1-NH2 2.74Å; E775-R788 PolarHBondContact OE1-NH2 2.97Å; E775-R788 IonicContact OE2-CZ 3.21Å; E775-R788 IonicContact OE2-NH1 2.83Å; E775-R788 PolarHBondContact OE2-NH1 2.87Å; E775-R788 IonicContact OE2-NH2 2.69Å; E786-R788 PolarHBondContact O-N 2.8Å; E786-R788 VanDerWaalsContact O-N 3.11Å; R788-Q790 PolarHBondContact O-N 3.33Å
789	S	44.3	Very low	60.5	Low	102 Å²	102	109.7 Å²	109.7	71%	0.713	57%	0.573	S	S	*	*			trans	-61.2	101.9	168.8	56.7	0	0	0	0	107.4	P787 Q791	P787-S789 PolarHBondContact O-N 3.41Å; S789-Q791 PolarHBondContact O-N 3.42Å; S789-Q791 VanDerWaalsContact O-N 3.08Å
790	Q	42.3	Very low	59.6	Low	185 Å²	185	109 Å²	109	86%	0.864	57%	0.57	S	S	*	*			trans	-47.2	120.7	151.9	-71.4	176.6	-46.3	0	0	105.5	R788 A792	R788-Q790 PolarHBondContact O-N 3.33Å; Q790-A792 PolarHBondContact O-N 3.13Å
791	Q	39.5	Very low	58.4	Low	189 Å²	189	112.4 Å²	112.4	88%	0.883	59%	0.593	S	S	*	*			trans	-56.3	114.8	-179.7	-72.3	175.5	-42.2	0	0	106.9	S789 F793	S789-Q791 PolarHBondContact O-N 3.42Å; S789-Q791 VanDerWaalsContact O-N 3.08Å; Q791-F793 PolarHBondContact O-N 2.99Å
792	A	35.5	Very low	57.6	Low	86 Å²	86	111.3 Å²	111.3	71%	0.711	59%	0.59	S	S	*	*			trans	-52.3	121.2	166.9	0	0	0	0	0	105.7	Q790 I794	Q790-A792 PolarHBondContact O-N 3.13Å; A792-I794 VanDerWaalsContact C-N 3.32Å; A792-I794 WeakPolarHBondContact O-CG1 3.15Å; A792-I794 PolarHBondContact O-N 3.18Å
793	F	36.5	Very low	57.2	Low	178 Å²	178	109.5 Å²	109.5	78%	0.781	57%	0.567	S	S	*	*			trans	-64	97.2	-173.8	-176.3	-87.9	0	0	0	107.9	Q791 P795	Q791-F793 PolarHBondContact O-N 2.99Å; F793-P795 HydrophobicContact CE1-CB 4.39Å; F793-P795 WeakPolarHBondContact O-CD 3.5Å
794	I	43.6	Very low	56.9	Low	131 Å²	131	107.3 Å²	107.3	67%	0.672	56%	0.56	S	S	*	*			trans	-72.8	108.2	172	-53.6	-179.7	0	0	0	104.3	A792	A792-I794 VanDerWaalsContact C-N 3.32Å; A792-I794 WeakPolarHBondContact O-CG1 3.15Å; A792-I794 PolarHBondContact O-N 3.18Å
795	P	48.3	Very low	57	Low	47 Å²	47	103 Å²	103	31%	0.305	55%	0.546	S	S	.	.			trans	-59.2	147.6	172.9	28.6	-34.7	0	0	0	108.2	F793 Q797	F793-P795 HydrophobicContact CE1-CB 4.39Å; F793-P795 WeakPolarHBondContact O-CD 3.5Å; P795-Q797 PolarHBondContact O-N 2.89Å
796	P	52.8	Low	57	Low	106 Å²	106	105.3 Å²	105.3	69%	0.688	56%	0.56	S	S	*	*			trans	-54.2	117.7	-180	23.1	-33.4	0	0	0	109.3	G798 G855	P796-G798 PolarHBondContact O-N 3.04Å; P796-G798 VanDerWaalsContact O-N 3.12Å; P796-G855 VanDerWaalsContact O-CA 3.3Å; P796-G855 WeakPolarHBondContact O-CA 3.49Å
797	Q	55.8	Low	57.5	Low	174 Å²	174	98.4 Å²	98.4	81%	0.813	53%	0.53	S	S	*	.			trans	-67.9	113.4	-176.8	-72.8	-174.7	-21.7	0	0	109.3	P795	P795-Q797 PolarHBondContact O-N 2.89Å
798	G	60.3	Low	58.2	Low	16 Å²	16	95.8 Å²	95.8	17%	0.165	51%	0.509	C	S	.	.			trans	-70.7	159	175.4	0	0	0	0	0	112.7	P796 L800 G855 G856	P796-G798 PolarHBondContact O-N 3.04Å; P796-G798 VanDerWaalsContact O-N 3.12Å; G798-L800 PolarHBondContact O-N 2.83Å; G798-L800 VanDerWaalsContact O-N 3.11Å; G798-G855 WeakPolarHBondContact CA-O 3.46Å; G798-G856 WeakPolarHBondContact CA-O 3.31Å
799	D	69.1	Low	59.5	Low	58 Å²	58	94.8 Å²	94.8	31%	0.31	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-69.8	-0.8	-179.8	66.7	-26	0	0	0	113.7	S801 V802 T857 V858	D799-S801 PolarHBondContact O-N 2.79Å; D799-V802 HydrophobicContact CB-CG2 4.39Å; D799-V802 VanDerWaalsContact O-CB 3.22Å; D799-V802 WeakPolarHBondContact O-CB 3.25Å; D799-V802 VanDerWaalsContact O-CG2 3.31Å; D799-V802 WeakPolarHBondContact O-CG2 3.29Å; D799-V802 PolarHBondContact O-N 3.35Å; D799-T857 WeakPolarHBondContact OD1-CA 3.36Å; D799-T857 WeakPolarHBondContact OD1-CB 3.45Å; D799-V858 HydrophobicContact CB-CG2 4.47Å; D799-V858 PolarHBondContact OD1-N 2.69Å; D799-V858 WeakPolarHBondContact OD2-CB 3.46Å
800	L	67.6	Low	61	Low	1 Å²	1	92 Å²	92	1%	0.005	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-57.3	-25.4	177.2	-140	79.3	0	0	0	113.5	G798 V802 L803 K808 L848 Y851 E852 V858 L861	G798-L800 PolarHBondContact O-N 2.83Å; G798-L800 VanDerWaalsContact O-N 3.11Å; L800-V802 PolarHBondContact O-N 3.3Å; L800-L803 HydrophobicContact CD1-CD1 4.34Å; L800-L803 HydrophobicContact CG-CD1 4.44Å; L800-L803 PolarHBondContact O-N 3.47Å; L800-K808 WeakPolarHBondContact O-CE 3.35Å; L800-K808 PolarHBondContact O-NZ 3.28Å; L800-L848 HydrophobicContact CD2-CD2 4.16Å; L800-Y851 HydrophobicContact CD1-CD1 4.38Å; L800-Y851 HydrophobicContact CD1-CE1 4.23Å; L800-Y851 HydrophobicContact CD2-CD1 3.78Å; L800-Y851 HydrophobicContact CD2-CE1 4.42Å; L800-E852 HydrophobicContact CB-CG 4.42Å; L800-E852 HydrophobicContact CD2-CB 4Å; L800-V858 HydrophobicContact CD1-CG2 4.07Å; L800-L861 HydrophobicContact CD1-CB 4.19Å; L800-L861 HydrophobicContact CD1-CD2 3.9Å
801	S	64.3	Low	62.6	Low	74 Å²	74	83.3 Å²	83.3	52%	0.517	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-62.1	-23.7	173.9	58.6	0	0	0	0	113.9	D799 L803 E852	D799-S801 PolarHBondContact O-N 2.79Å; S801-L803 VanDerWaalsContact C-N 3.34Å; S801-L803 PolarHBondContact O-N 3.03Å; S801-E852 WeakPolarHBondContact CA-OE1 3.07Å
802	V	68.9	Low	64.4	Low	77 Å²	77	74.9 Å²	74.9	47%	0.467	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-76.8	-18.5	-176.6	-175.4	0	0	0	0	112.8	D799 L800 D804 M887	D799-V802 HydrophobicContact CB-CG2 4.39Å; D799-V802 VanDerWaalsContact O-CB 3.22Å; D799-V802 WeakPolarHBondContact O-CB 3.25Å; D799-V802 VanDerWaalsContact O-CG2 3.31Å; D799-V802 WeakPolarHBondContact O-CG2 3.29Å; D799-V802 PolarHBondContact O-N 3.35Å; L800-V802 PolarHBondContact O-N 3.3Å; V802-D804 PolarHBondContact O-N 2.92Å; V802-M887 HydrophobicContact CG1-CE 3.41Å; V802-M887 VanDerWaalsContact CG1-CE 3.41Å; V802-M887 HydrophobicContact CG1-SD 3.51Å; V802-M887 VanDerWaalsContact CG1-SD 3.51Å
803	L	69.4	Low	66.4	Low	17 Å²	17	72.6 Å²	72.6	9%	0.089	40%	0.395	C	S	.	.	S	Bend	trans	-72.1	124.7	176	-71.2	169	0	0	0	111.6	L800 S801 V807 K808 V858 L877	L800-L803 HydrophobicContact CD1-CD1 4.34Å; L800-L803 HydrophobicContact CG-CD1 4.44Å; L800-L803 PolarHBondContact O-N 3.47Å; S801-L803 VanDerWaalsContact C-N 3.34Å; S801-L803 PolarHBondContact O-N 3.03Å; L803-V807 HydrophobicContact CD2-CG1 4.45Å; L803-K808 HydrophobicContact CB-CD 4.48Å; L803-K808 HydrophobicContact CB-CG 3.96Å; L803-K808 WeakPolarHBondContact O-CE 3.21Å; L803-V858 HydrophobicContact CD1-CG1 4.3Å; L803-V858 HydrophobicContact CD1-CG2 3.87Å; L803-V858 HydrophobicContact CD2-CG1 4.42Å; L803-V858 HydrophobicContact CG-CG2 3.96Å; L803-L877 HydrophobicContact CD1-CD1 3.72Å; L803-L877 HydrophobicContact CD2-CD1 3.54Å; L803-L877 HydrophobicContact CG-CD1 4.3Å
804	D	74.3	Confident	68.3	Low	83 Å²	83	64.6 Å²	64.6	44%	0.444	36%	0.361	S	S	.	.			trans	-56.1	147	178.8	170.9	59.1	0	0	0	113.1	V802 Q806 V807 K808	V802-D804 PolarHBondContact O-N 2.92Å; D804-Q806 PolarHBondContact O-N 3.24Å; D804-Q806 WeakPolarHBondContact OD2-CA 3.45Å; D804-Q806 WeakPolarHBondContact OD2-CB 3.1Å; D804-Q806 VanDerWaalsContact OD2-CG 3.31Å; D804-Q806 WeakPolarHBondContact OD2-CG 3.47Å; D804-Q806 PolarHBondContact OD2-N 3.45Å; D804-V807 HydrophobicContact CB-CG2 4.19Å; D804-V807 WeakPolarHBondContact O-CA 3.3Å; D804-V807 WeakPolarHBondContact O-CB 3.14Å; D804-V807 PolarHBondContact O-N 3.43Å; D804-K808 PolarHBondContact O-N 1.9Å
805	V	74.3	Confident	69.9	Low	92 Å²	92	58.4 Å²	58.4	56%	0.558	33%	0.33	S	S	*	.	H	α-helix	trans	-60.4	-29.4	-176.8	-177.2	0	0	0	0	112.3	R809	V805-R809 VanDerWaalsContact O-CB 3.29Å; V805-R809 WeakPolarHBondContact O-CB 3.31Å; V805-R809 PolarHBondContact O-N 3.46Å; V805-R809 VanDerWaalsContact O-N 3.14Å
806	Q	73.8	Confident	71.3	Confident	144 Å²	144	59.2 Å²	59.2	67%	0.673	33%	0.329	S	S	*	.	H	α-helix	trans	-74.9	-39	174.8	-49.7	-176.9	47.4	0	0	111.1	D804 R809 A810	D804-Q806 PolarHBondContact O-N 3.24Å; D804-Q806 WeakPolarHBondContact OD2-CA 3.45Å; D804-Q806 WeakPolarHBondContact OD2-CB 3.1Å; D804-Q806 VanDerWaalsContact OD2-CG 3.31Å; D804-Q806 WeakPolarHBondContact OD2-CG 3.47Å; D804-Q806 PolarHBondContact OD2-N 3.45Å; Q806-R809 PolarHBondContact O-N 3.44Å; Q806-A810 WeakPolarHBondContact O-CB 3.44Å; Q806-A810 PolarHBondContact O-N 2.88Å
807	V	75.2	Confident	72.4	Confident	27 Å²	27	58.3 Å²	58.3	16%	0.164	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-49.4	174.9	-178.1	0	0	0	0	110.4	L803 D804 R809 A810 V811 L877 A880	L803-V807 HydrophobicContact CD2-CG1 4.45Å; D804-V807 HydrophobicContact CB-CG2 4.19Å; D804-V807 WeakPolarHBondContact O-CA 3.3Å; D804-V807 WeakPolarHBondContact O-CB 3.14Å; D804-V807 PolarHBondContact O-N 3.43Å; V807-R809 VanDerWaalsContact C-N 3.3Å; V807-R809 PolarHBondContact O-N 3.36Å; V807-A810 PolarHBondContact O-N 3.46Å; V807-A810 VanDerWaalsContact O-N 3.13Å; V807-V811 HydrophobicContact CG1-CG2 4.44Å; V807-V811 WeakPolarHBondContact O-CG2 3.2Å; V807-V811 PolarHBondContact O-N 2.95Å; V807-L877 HydrophobicContact CG1-CD1 4.46Å; V807-A880 HydrophobicContact CB-CB 4.43Å; V807-A880 HydrophobicContact CG1-CB 3.71Å; V807-A880 HydrophobicContact CG2-CB 3.78Å
808	K	75.6	Confident	73.2	Confident	34 Å²	34	53.6 Å²	53.6	15%	0.148	31%	0.308	C	S	.	.	H	α-helix	trans	-54.1	-45.7	174.5	-72.4	-175.3	175.6	-178.1	0	111.7	L800 L803 D804 V811 C812 E852	L800-K808 WeakPolarHBondContact O-CE 3.35Å; L800-K808 PolarHBondContact O-NZ 3.28Å; L803-K808 HydrophobicContact CB-CD 4.48Å; L803-K808 HydrophobicContact CB-CG 3.96Å; L803-K808 WeakPolarHBondContact O-CE 3.21Å; D804-K808 PolarHBondContact O-N 1.9Å; K808-V811 PolarHBondContact O-N 3.38Å; K808-C812 PolarHBondContact O-N 3.46Å; K808-C812 PolarHBondContact O-SG 2.73Å; K808-E852 IonicContact NZ-OE1 3.19Å; K808-E852 PolarHBondContact NZ-OE1 2.75Å; K808-E852 IonicContact NZ-OE2 2.79Å; K808-E852 PolarHBondContact NZ-OE2 3.03Å
809	R	78	Confident	73.8	Confident	170 Å²	170	54.9 Å²	54.9	64%	0.642	32%	0.322	S	S	*	.	H	α-helix	trans	-65.2	-39.4	177.8	-170.6	179.6	-60.3	147.8	6.3	112.9	V805 Q806 V807 G813	V805-R809 VanDerWaalsContact O-CB 3.29Å; V805-R809 WeakPolarHBondContact O-CB 3.31Å; V805-R809 PolarHBondContact O-N 3.46Å; V805-R809 VanDerWaalsContact O-N 3.14Å; Q806-R809 PolarHBondContact O-N 3.44Å; V807-R809 VanDerWaalsContact C-N 3.3Å; V807-R809 PolarHBondContact O-N 3.36Å; R809-G813 PolarHBondContact O-N 2.9Å
810	A	75.8	Confident	73.9	Confident	42 Å²	42	53.8 Å²	53.8	35%	0.347	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-37.9	176.8	0	0	0	0	0	112.3	Q806 V807 A814 I876	Q806-A810 WeakPolarHBondContact O-CB 3.44Å; Q806-A810 PolarHBondContact O-N 2.88Å; V807-A810 PolarHBondContact O-N 3.46Å; V807-A810 VanDerWaalsContact O-N 3.13Å; A810-A814 WeakPolarHBondContact O-CB 3.16Å; A810-A814 PolarHBondContact O-N 3.14Å; A810-I876 HydrophobicContact CB-CD1 4.41Å; A810-I876 HydrophobicContact CB-CG2 3.87Å
811	V	76.2	Confident	74.5	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.018	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-48.8	172.5	166.8	0	0	0	0	111	V807 K808 G813 A814 L815 L848 A873 I876 L877	V807-V811 HydrophobicContact CG1-CG2 4.44Å; V807-V811 WeakPolarHBondContact O-CG2 3.2Å; V807-V811 PolarHBondContact O-N 2.95Å; K808-V811 PolarHBondContact O-N 3.38Å; V811-G813 PolarHBondContact O-N 2.74Å; V811-A814 PolarHBondContact O-N 2.87Å; V811-L815 HydrophobicContact CG1-CD1 3.91Å; V811-L815 WeakPolarHBondContact O-CG 3.29Å; V811-L815 PolarHBondContact O-N 3.4Å; V811-L848 HydrophobicContact CG1-CD1 4.02Å; V811-A873 HydrophobicContact CG1-CB 4.26Å; V811-I876 HydrophobicContact CG2-CG2 3.99Å; V811-L877 HydrophobicContact CG2-CB 4.33Å
812	C	78	Confident	75.1	Confident	13 Å²	13	54 Å²	54	9%	0.088	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-50	176.3	-63.4	0	0	0	0	111.5	K808 A814 L815 E816 R845	K808-C812 PolarHBondContact O-N 3.46Å; K808-C812 PolarHBondContact O-SG 2.73Å; C812-A814 VanDerWaalsContact C-N 3.29Å; C812-A814 PolarHBondContact O-N 2.9Å; C812-L815 PolarHBondContact O-N 2.91Å; C812-L815 VanDerWaalsContact O-N 3.13Å; C812-E816 PolarHBondContact O-N 2.67Å; C812-R845 HydrophobicContact CB-CB 4.37Å
813	G	76.3	Confident	75.5	Confident	38 Å²	38	54.8 Å²	54.8	39%	0.392	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-30	-179.5	0	0	0	0	0	114	R809 V811 A817	R809-G813 PolarHBondContact O-N 2.9Å; V811-G813 PolarHBondContact O-N 2.74Å; G813-A817 WeakPolarHBondContact O-CB 3.3Å; G813-A817 PolarHBondContact O-N 2.82Å
814	A	77.4	Confident	76	Confident	10 Å²	10	54 Å²	54	8%	0.083	31%	0.308	C	S	.	.	H	α-helix	trans	-71.6	-44.2	171.3	0	0	0	0	0	111.9	A810 V811 C812 E816 A817 E818 R872 A873 I876	A810-A814 WeakPolarHBondContact O-CB 3.16Å; A810-A814 PolarHBondContact O-N 3.14Å; V811-A814 PolarHBondContact O-N 2.87Å; C812-A814 VanDerWaalsContact C-N 3.29Å; C812-A814 PolarHBondContact O-N 2.9Å; A814-E816 VanDerWaalsContact C-N 3.34Å; A814-E816 PolarHBondContact O-N 3.16Å; A814-A817 PolarHBondContact O-N 3.49Å; A814-E818 WeakPolarHBondContact O-CB 3.43Å; A814-E818 WeakPolarHBondContact O-CG 3.46Å; A814-E818 PolarHBondContact O-N 2.99Å; A814-R872 HydrophobicContact CB-CB 4.13Å; A814-A873 HydrophobicContact CB-CB 4.01Å; A814-I876 HydrophobicContact CB-CD1 3.99Å
815	L	77.1	Confident	76.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-65.2	-33.8	177.9	-71.7	171.1	0	0	0	113.3	V811 C812 G819 C820 W821 L824 A844 L848 L865 A873	V811-L815 HydrophobicContact CG1-CD1 3.91Å; V811-L815 WeakPolarHBondContact O-CG 3.29Å; V811-L815 PolarHBondContact O-N 3.4Å; C812-L815 PolarHBondContact O-N 2.91Å; C812-L815 VanDerWaalsContact O-N 3.13Å; L815-G819 WeakPolarHBondContact O-CA 3.18Å; L815-G819 PolarHBondContact O-N 3.11Å; L815-C820 HydrophobicContact CD2-CB 4.41Å; L815-C820 PolarHBondContact O-N 3.04Å; L815-W821 HydrophobicContact CB-CB 4.4Å; L815-L824 HydrophobicContact CD1-CD2 3.62Å; L815-L824 HydrophobicContact CD2-CD2 4.01Å; L815-L824 HydrophobicContact CG-CD2 4.49Å; L815-A844 HydrophobicContact CB-CB 3.61Å; L815-A844 HydrophobicContact CD1-CB 4.42Å; L815-L848 HydrophobicContact CD1-CD1 3.81Å; L815-L865 HydrophobicContact CD2-CD2 3.9Å; L815-A873 HydrophobicContact CD2-CB 3.92Å; L815-A873 HydrophobicContact CG-CB 3.82Å
816	E	78.3	Confident	76.4	Confident	63 Å²	63	51.3 Å²	51.3	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-74	-42.1	173.1	-86	150.9	-164.7	0	0	112.2	C812 A814 E818 N842 A844 R845	C812-E816 PolarHBondContact O-N 2.67Å; A814-E816 VanDerWaalsContact C-N 3.34Å; A814-E816 PolarHBondContact O-N 3.16Å; E816-E818 VanDerWaalsContact C-N 3.33Å; E816-E818 PolarHBondContact O-N 3.46Å; E816-N842 WeakPolarHBondContact OE1-CA 3.08Å; E816-N842 WeakPolarHBondContact OE1-CB 3.37Å; E816-A844 HydrophobicContact CG-CB 3.71Å; E816-A844 PolarHBondContact OE1-N 3.03Å; E816-A844 VanDerWaalsContact OE1-N 3.08Å; E816-R845 PolarHBondContact OE1-N 3.37Å; E816-R845 VanDerWaalsContact OE1-N 3.12Å
817	A	74.6	Confident	76.5	Confident	87 Å²	87	49.4 Å²	49.4	72%	0.719	28%	0.277	S	S	*	.	H	α-helix	trans	-69	-28	178.2	0	0	0	0	0	113.9	G813 A814	G813-A817 WeakPolarHBondContact O-CB 3.3Å; G813-A817 PolarHBondContact O-N 2.82Å; A814-A817 PolarHBondContact O-N 3.49Å
818	E	73.8	Confident	76.5	Confident	75 Å²	75	49.1 Å²	49.1	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-101.6	-9	-179.8	-63.3	176.8	167.1	0	0	112.9	A814 E816 C820 C871 R872	A814-E818 WeakPolarHBondContact O-CB 3.43Å; A814-E818 WeakPolarHBondContact O-CG 3.46Å; A814-E818 PolarHBondContact O-N 2.99Å; E816-E818 VanDerWaalsContact C-N 3.33Å; E816-E818 PolarHBondContact O-N 3.46Å; E818-C820 PolarHBondContact O-N 3.06Å; E818-C820 PolarHBondContact O-SG 3.43Å; E818-C871 WeakPolarHBondContact OE2-CA 3.4Å; E818-C871 WeakPolarHBondContact OE2-CB 3.48Å; E818-R872 VanDerWaalsContact OE1-CB 3.29Å; E818-R872 WeakPolarHBondContact OE1-CB 3.34Å; E818-R872 WeakPolarHBondContact OE1-CD 3.29Å; E818-R872 WeakPolarHBondContact OE1-CG 3.39Å; E818-R872 PolarHBondContact OE1-N 3.44Å; E818-R872 PolarHBondContact OE2-N 2.92Å
819	G	71.1	Confident	76.4	Confident	43 Å²	43	50.4 Å²	50.4	44%	0.443	30%	0.297	S	S	.	.			trans	71.2	4.1	176.4	0	0	0	0	0	115.5	L815 W821	L815-G819 WeakPolarHBondContact O-CA 3.18Å; L815-G819 PolarHBondContact O-N 3.11Å; G819-W821 PolarHBondContact O-N 3.32Å; G819-W821 VanDerWaalsContact O-N 3.14Å
820	C	73.1	Confident	76.3	Confident	35 Å²	35	43.4 Å²	43.4	24%	0.236	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-3.8	-170.4	-54.4	0	0	0	0	115.1	L815 E818 E822 N823 L824	L815-C820 HydrophobicContact CD2-CB 4.41Å; L815-C820 PolarHBondContact O-N 3.04Å; E818-C820 PolarHBondContact O-N 3.06Å; E818-C820 PolarHBondContact O-SG 3.43Å; C820-E822 VanDerWaalsContact C-N 3.33Å; C820-E822 PolarHBondContact O-N 3.31Å; C820-N823 PolarHBondContact O-N 3.11Å; C820-L824 PolarHBondContact O-N 2.97Å; C820-L824 VanDerWaalsContact O-N 3.15Å
821	W	80	Confident	76.1	Confident	24 Å²	24	42 Å²	42	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-29.9	-171.9	65.3	-93.6	0	0	0	114	L815 G819 L824 A825 F837 R838 P843 A844 L847	L815-W821 HydrophobicContact CB-CB 4.4Å; G819-W821 PolarHBondContact O-N 3.32Å; G819-W821 VanDerWaalsContact O-N 3.14Å; W821-L824 WeakPolarHBondContact O-CB 3.18Å; W821-L824 PolarHBondContact O-N 3.2Å; W821-A825 PolarHBondContact O-N 3Å; W821-F837 HydrophobicContact CE3-CB 4.5Å; W821-F837 HydrophobicContact CH2-CB 4.17Å; W821-F837 HydrophobicContact CZ3-CB 3.65Å; W821-F837 HydrophobicContact CZ3-CD2 4.45Å; W821-R838 HydrophobicContact CH2-CG 3.68Å; W821-R838 HydrophobicContact CZ2-CG 4.26Å; W821-P843 HydrophobicContact CD2-CB 3.83Å; W821-P843 HydrophobicContact CE3-CB 4Å; W821-P843 HydrophobicContact CH2-CB 3.55Å; W821-P843 HydrophobicContact CH2-CG 4.3Å; W821-P843 HydrophobicContact CZ2-CB 3.38Å; W821-P843 HydrophobicContact CZ2-CG 3.88Å; W821-P843 HydrophobicContact CZ3-CB 3.87Å; W821-A844 HydrophobicContact CB-CB 3.73Å; W821-A844 HydrophobicContact CG-CB 4.12Å; W821-L847 HydrophobicContact CE3-CD1 4.27Å; W821-L847 WeakPolarHBondContact O-CD1 3.48Å
822	E	77.1	Confident	75.9	Confident	57 Å²	57	49.2 Å²	49.2	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-67.7	-36.9	176.6	-63	-169.3	172.9	0	0	112.4	C820 A825 H826 R838	C820-E822 VanDerWaalsContact C-N 3.33Å; C820-E822 PolarHBondContact O-N 3.31Å; E822-A825 WeakPolarHBondContact O-CB 3.35Å; E822-H826 PolarHBondContact O-N 2.9Å; E822-H826 PolarHBondContact O-ND1 3Å; E822-R838 IonicContact OE1-CZ 3.12Å; E822-R838 VanDerWaalsContact OE1-CZ 3.23Å; E822-R838 IonicContact OE1-NE 2.65Å; E822-R838 PolarHBondContact OE1-NE 3.09Å; E822-R838 IonicContact OE1-NH2 2.71Å; E822-R838 PolarHBondContact OE1-NH2 2.84Å; E822-R838 IonicContact OE2-CZ 2.72Å; E822-R838 IonicContact OE2-NE 3.02Å; E822-R838 IonicContact OE2-NH2 2.72Å; E822-R838 PolarHBondContact OE2-NH2 2.99Å
823	N	76.1	Confident	75.7	Confident	93 Å²	93	52.4 Å²	52.4	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-69.9	-40	174.4	-71.7	-12.2	0	0	0	110.3	C820 A825 H826 H827	C820-N823 PolarHBondContact O-N 3.11Å; N823-A825 VanDerWaalsContact C-N 3.34Å; N823-A825 PolarHBondContact O-N 2.77Å; N823-H826 PolarHBondContact O-N 3.49Å; N823-H827 PolarHBondContact O-N 3.12Å; N823-H827 PolarHBondContact O-ND1 3.27Å
824	L	79.2	Confident	75.7	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-60.5	-43	174.8	-172.7	65.3	0	0	0	111.4	L815 C820 W821 H826 H827 L828 L847 L861 A864 L865	L815-L824 HydrophobicContact CD1-CD2 3.62Å; L815-L824 HydrophobicContact CD2-CD2 4.01Å; L815-L824 HydrophobicContact CG-CD2 4.49Å; C820-L824 PolarHBondContact O-N 2.97Å; C820-L824 VanDerWaalsContact O-N 3.15Å; W821-L824 WeakPolarHBondContact O-CB 3.18Å; W821-L824 PolarHBondContact O-N 3.2Å; L824-H826 VanDerWaalsContact C-N 3.3Å; L824-H826 PolarHBondContact O-N 3.38Å; L824-H827 PolarHBondContact O-N 3.14Å; L824-H827 VanDerWaalsContact O-N 3.11Å; L824-L828 HydrophobicContact CD1-CD1 4.13Å; L824-L828 HydrophobicContact CD1-CG 4.21Å; L824-L828 HydrophobicContact CD2-CD1 4.37Å; L824-L828 HydrophobicContact CG-CD1 3.83Å; L824-L828 HydrophobicContact CG-CG 4.25Å; L824-L828 WeakPolarHBondContact O-CB 3.39Å; L824-L828 WeakPolarHBondContact O-CG 3.26Å; L824-L828 PolarHBondContact O-N 3.22Å; L824-L847 HydrophobicContact CD2-CD2 4.13Å; L824-L861 HydrophobicContact CD1-CD1 4.22Å; L824-L861 HydrophobicContact CD2-CD1 4.1Å; L824-A864 HydrophobicContact CD1-CB 3.63Å; L824-L865 HydrophobicContact CD1-CD2 3.87Å; L824-L865 HydrophobicContact CD1-CG 3.99Å; L824-L865 HydrophobicContact CD2-CD2 4Å
825	A	79.4	Confident	75.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-54	-44.9	176.2	0	0	0	0	0	112.5	W821 E822 N823 L828 G829 L830 G831 N834 L847	W821-A825 PolarHBondContact O-N 3Å; E822-A825 WeakPolarHBondContact O-CB 3.35Å; N823-A825 VanDerWaalsContact C-N 3.34Å; N823-A825 PolarHBondContact O-N 2.77Å; A825-L828 PolarHBondContact O-N 3.48Å; A825-G829 PolarHBondContact O-N 2.87Å; A825-L830 CarbonylContact O-C 3.58Å; A825-L830 PolarHBondContact O-N 3.3Å; A825-G831 PolarHBondContact O-N 3.39Å; A825-N834 WeakPolarHBondContact CB-OD1 3.36Å; A825-L847 HydrophobicContact CB-CD1 3.47Å; A825-L847 VanDerWaalsContact CB-CD1 3.47Å
826	H	78.8	Confident	75.3	Confident	117 Å²	117	58 Å²	58	54%	0.542	35%	0.346	S	S	.	.	H	α-helix	trans	-66.8	-39.8	177.8	-71.5	93.4	0	0	0	112.4	E822 N823 L824 L828 G829 N834	E822-H826 PolarHBondContact O-N 2.9Å; E822-H826 PolarHBondContact O-ND1 3Å; N823-H826 PolarHBondContact O-N 3.49Å; L824-H826 VanDerWaalsContact C-N 3.3Å; L824-H826 PolarHBondContact O-N 3.38Å; H826-L828 VanDerWaalsContact C-N 3.33Å; H826-G829 PolarHBondContact O-N 3.25Å; H826-N834 PolarHBondContact CE1-ND2 2.96Å; H826-N834 PolarHBondContact ND1-ND2 3.19Å
827	H	75.8	Confident	75.3	Confident	104 Å²	104	55.4 Å²	55.4	48%	0.481	33%	0.333	S	S	.	.	H	α-helix	trans	-72.8	-25.1	178.7	-70.9	74	0	0	0	112.9	N823 L824 A864 S867	N823-H827 PolarHBondContact O-N 3.12Å; N823-H827 PolarHBondContact O-ND1 3.27Å; L824-H827 PolarHBondContact O-N 3.14Å; L824-H827 VanDerWaalsContact O-N 3.11Å; H827-A864 HydrophobicContact CB-CB 3.84Å; H827-S867 PolarHBondContact CD2-OG 3.14Å; H827-S867 VanDerWaalsContact CD2-OG 3.3Å
828	L	76	Confident	75.5	Confident	22 Å²	22	58.3 Å²	58.3	12%	0.115	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	7.8	173	-62.7	-179.5	0	0	0	113.7	L824 A825 H826 L830 L847 Y851 L861 A864	L824-L828 HydrophobicContact CD1-CD1 4.13Å; L824-L828 HydrophobicContact CD1-CG 4.21Å; L824-L828 HydrophobicContact CD2-CD1 4.37Å; L824-L828 HydrophobicContact CG-CD1 3.83Å; L824-L828 HydrophobicContact CG-CG 4.25Å; L824-L828 WeakPolarHBondContact O-CB 3.39Å; L824-L828 WeakPolarHBondContact O-CG 3.26Å; L824-L828 PolarHBondContact O-N 3.22Å; A825-L828 PolarHBondContact O-N 3.48Å; H826-L828 VanDerWaalsContact C-N 3.33Å; L828-L830 PolarHBondContact O-N 3.03Å; L828-L830 VanDerWaalsContact O-N 3.1Å; L828-L847 HydrophobicContact CD1-CD2 4.36Å; L828-Y851 HydrophobicContact CB-CD2 4.15Å; L828-Y851 HydrophobicContact CB-CE2 3.99Å; L828-Y851 HydrophobicContact CD1-CD1 4.06Å; L828-Y851 HydrophobicContact CD1-CD2 4.17Å; L828-Y851 HydrophobicContact CD1-CE1 4.19Å; L828-Y851 HydrophobicContact CD1-CE2 4.31Å; L828-Y851 HydrophobicContact CD1-CG 4.07Å; L828-Y851 HydrophobicContact CD2-CE1 4.08Å; L828-Y851 HydrophobicContact CD2-CE2 3.99Å; L828-Y851 HydrophobicContact CG-CE2 4.32Å; L828-L861 HydrophobicContact CD1-CD1 4.06Å; L828-A864 HydrophobicContact CD2-CB 3.42Å; L828-A864 VanDerWaalsContact CD2-CB 3.42Å; L828-A864 HydrophobicContact CG-CB 3.94Å
829	G	71.9	Confident	75.6	Confident	60 Å²	60	62 Å²	62	62%	0.619	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-13.3	-179.3	0	0	0	0	0	115.6	A825 H826 G831	A825-G829 PolarHBondContact O-N 2.87Å; H826-G829 PolarHBondContact O-N 3.25Å; G829-G831 PolarHBondContact O-N 2.99Å; G829-G831 VanDerWaalsContact O-N 3.15Å
830	L	77.1	Confident	75.9	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.12	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-76.8	10	178.7	-60.1	179.6	0	0	0	114.2	A825 L828 I832 L833 F837 Y851	A825-L830 CarbonylContact O-C 3.58Å; A825-L830 PolarHBondContact O-N 3.3Å; L828-L830 PolarHBondContact O-N 3.03Å; L828-L830 VanDerWaalsContact O-N 3.1Å; L830-I832 PolarHBondContact O-N 3.24Å; L830-L833 HydrophobicContact CD2-CD1 4.3Å; L830-L833 PolarHBondContact O-N 3.39Å; L830-F837 HydrophobicContact CB-CE2 4.18Å; L830-F837 HydrophobicContact CB-CZ 4.43Å; L830-F837 HydrophobicContact CD1-CZ 4.47Å; L830-Y851 HydrophobicContact CD1-CD2 3.9Å; L830-Y851 HydrophobicContact CD1-CG 4.29Å; L830-Y851 HydrophobicContact CG-CD2 4.46Å
831	G	71.6	Confident	75.9	Confident	14 Å²	14	65.2 Å²	65.2	14%	0.144	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-57.8	-25.6	-173.3	0	0	0	0	0	115	A825 G829 L833 N834	A825-G831 PolarHBondContact O-N 3.39Å; G829-G831 PolarHBondContact O-N 2.99Å; G829-G831 VanDerWaalsContact O-N 3.15Å; G831-L833 VanDerWaalsContact C-N 3.27Å; G831-L833 PolarHBondContact O-N 2.96Å; G831-N834 WeakPolarHBondContact CA-ND2 3.38Å; G831-N834 WeakPolarHBondContact O-CB 3.48Å; G831-N834 PolarHBondContact O-N 3.43Å; G831-N834 PolarHBondContact O-ND2 2.9Å
832	I	72.3	Confident	75.9	Confident	154 Å²	154	67.8 Å²	67.8	79%	0.79	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-64.1	-32.4	175.5	-60.4	168.5	0	0	0	111.3	L830 N834	L830-I832 PolarHBondContact O-N 3.24Å; I832-N834 VanDerWaalsContact C-N 3.33Å; I832-N834 PolarHBondContact O-N 2.9Å
833	L	73.1	Confident	76	Confident	79 Å²	79	66.1 Å²	66.1	41%	0.414	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-85	0.7	-177.3	-61.8	176.6	0	0	0	113.8	L830 G831 T835 A836 F837	L830-L833 HydrophobicContact CD2-CD1 4.3Å; L830-L833 PolarHBondContact O-N 3.39Å; G831-L833 VanDerWaalsContact C-N 3.27Å; G831-L833 PolarHBondContact O-N 2.96Å; L833-T835 PolarHBondContact O-N 2.99Å; L833-T835 VanDerWaalsContact O-N 3.15Å; L833-A836 WeakPolarHBondContact O-CA 3.2Å; L833-A836 WeakPolarHBondContact O-CB 2.87Å; L833-A836 PolarHBondContact O-N 3.25Å; L833-F837 HydrophobicContact CB-CD2 4.2Å; L833-F837 HydrophobicContact CB-CE1 4.05Å; L833-F837 HydrophobicContact CB-CE2 3.59Å; L833-F837 HydrophobicContact CB-CZ 3.5Å; L833-F837 VanDerWaalsContact CB-CZ 3.5Å; L833-F837 HydrophobicContact CD1-CE1 4.48Å; L833-F837 HydrophobicContact CD1-CZ 3.93Å; L833-F837 HydrophobicContact CG-CZ 4.38Å; L833-F837 WeakPolarHBondContact O-CD2 3.34Å; L833-F837 WeakPolarHBondContact O-CG 3.36Å; L833-F837 PolarHBondContact O-N 3.2Å
834	N	76.6	Confident	76.1	Confident	13 Å²	13	61.7 Å²	61.7	7%	0.07	35%	0.346	C	S	.	.	H	α-helix	trans	-54.8	-34.7	-179.9	-86.2	-50.5	0	0	0	113.6	A825 H826 G831 I832 F837 R838	A825-N834 WeakPolarHBondContact CB-OD1 3.36Å; H826-N834 PolarHBondContact CE1-ND2 2.96Å; H826-N834 PolarHBondContact ND1-ND2 3.19Å; G831-N834 WeakPolarHBondContact CA-ND2 3.38Å; G831-N834 WeakPolarHBondContact O-CB 3.48Å; G831-N834 PolarHBondContact O-N 3.43Å; G831-N834 PolarHBondContact O-ND2 2.9Å; I832-N834 VanDerWaalsContact C-N 3.33Å; I832-N834 PolarHBondContact O-N 2.9Å; N834-F837 PolarHBondContact O-N 3.05Å; N834-R838 WeakPolarHBondContact O-CB 3.4Å; N834-R838 WeakPolarHBondContact O-CG 3.3Å; N834-R838 PolarHBondContact O-N 3.29Å
835	T	73.7	Confident	76.2	Confident	99 Å²	99	67.8 Å²	67.8	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-64.3	-39.1	174.9	42.5	0	0	0	0	112.3	L833 L839	L833-T835 PolarHBondContact O-N 2.99Å; L833-T835 VanDerWaalsContact O-N 3.15Å; T835-L839 WeakPolarHBondContact O-CG 3.32Å
836	A	71.2	Confident	76.3	Confident	55 Å²	55	70.1 Å²	70.1	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-70.7	-42.7	173.9	0	0	0	0	0	111.7	L833 R838 L839 S840	L833-A836 WeakPolarHBondContact O-CA 3.2Å; L833-A836 WeakPolarHBondContact O-CB 2.87Å; L833-A836 PolarHBondContact O-N 3.25Å; A836-R838 PolarHBondContact O-N 2.9Å; A836-L839 PolarHBondContact O-N 3.1Å; A836-L839 VanDerWaalsContact O-N 3.12Å; A836-S840 PolarHBondContact O-N 3.17Å
837	F	79.8	Confident	76.4	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.035	36%	0.358	C	S	.	.	H	α-helix	trans	-62.4	-39.6	177.3	-58.1	-33.7	0	0	0	112.3	W821 L830 L833 N834 L839 S840 P843 T846 L847 S850	W821-F837 HydrophobicContact CE3-CB 4.5Å; W821-F837 HydrophobicContact CH2-CB 4.17Å; W821-F837 HydrophobicContact CZ3-CB 3.65Å; W821-F837 HydrophobicContact CZ3-CD2 4.45Å; L830-F837 HydrophobicContact CB-CE2 4.18Å; L830-F837 HydrophobicContact CB-CZ 4.43Å; L830-F837 HydrophobicContact CD1-CZ 4.47Å; L833-F837 HydrophobicContact CB-CD2 4.2Å; L833-F837 HydrophobicContact CB-CE1 4.05Å; L833-F837 HydrophobicContact CB-CE2 3.59Å; L833-F837 HydrophobicContact CB-CZ 3.5Å; L833-F837 VanDerWaalsContact CB-CZ 3.5Å; L833-F837 HydrophobicContact CD1-CE1 4.48Å; L833-F837 HydrophobicContact CD1-CZ 3.93Å; L833-F837 HydrophobicContact CG-CZ 4.38Å; L833-F837 WeakPolarHBondContact O-CD2 3.34Å; L833-F837 WeakPolarHBondContact O-CG 3.36Å; L833-F837 PolarHBondContact O-N 3.2Å; N834-F837 PolarHBondContact O-N 3.05Å; F837-L839 PolarHBondContact O-N 3.16Å; F837-S840 WeakPolarHBondContact O-CB 3.15Å; F837-S840 PolarHBondContact O-N 2.86Å; F837-S840 PolarHBondContact O-OG 2.85Å; F837-P843 HydrophobicContact CB-CB 4.5Å; F837-P843 WeakPolarHBondContact O-CB 3.46Å; F837-P843 WeakPolarHBondContact O-CG 3.37Å; F837-T846 HydrophobicContact CD1-CG2 3.98Å; F837-T846 HydrophobicContact CE1-CG2 4.34Å; F837-L847 HydrophobicContact CD2-CB 4.22Å; F837-L847 HydrophobicContact CD2-CD1 4.21Å; F837-L847 HydrophobicContact CE2-CB 4.22Å; F837-L847 HydrophobicContact CE2-CD1 4.19Å; F837-L847 HydrophobicContact CE2-CG 4.27Å; F837-L847 HydrophobicContact CG-CB 4.48Å; F837-L847 HydrophobicContact CZ-CB 4.46Å; F837-S850 WeakPolarHBondContact CE1-OG 3.43Å; F837-S850 WeakPolarHBondContact CZ-OG 3.46Å
838	R	77.4	Confident	76.5	Confident	148 Å²	148	60 Å²	60	56%	0.558	34%	0.337	S	S	*	.	H	α-helix	trans	-59.1	-25.5	173.8	-79.9	-174.4	179.3	157.7	1.9	114.2	W821 E822 N834 A836	W821-R838 HydrophobicContact CH2-CG 3.68Å; W821-R838 HydrophobicContact CZ2-CG 4.26Å; E822-R838 IonicContact OE1-CZ 3.12Å; E822-R838 VanDerWaalsContact OE1-CZ 3.23Å; E822-R838 IonicContact OE1-NE 2.65Å; E822-R838 PolarHBondContact OE1-NE 3.09Å; E822-R838 IonicContact OE1-NH2 2.71Å; E822-R838 PolarHBondContact OE1-NH2 2.84Å; E822-R838 IonicContact OE2-CZ 2.72Å; E822-R838 IonicContact OE2-NE 3.02Å; E822-R838 IonicContact OE2-NH2 2.72Å; E822-R838 PolarHBondContact OE2-NH2 2.99Å; N834-R838 WeakPolarHBondContact O-CB 3.4Å; N834-R838 WeakPolarHBondContact O-CG 3.3Å; N834-R838 PolarHBondContact O-N 3.29Å; A836-R838 PolarHBondContact O-N 2.9Å
839	L	77.4	Confident	76.6	Confident	154 Å²	154	62.8 Å²	62.8	81%	0.806	35%	0.349	S	S	*	.	H	α-helix	trans	-87.6	-10.7	178.4	-65.3	169.4	0	0	0	112.7	T835 A836 F837	T835-L839 WeakPolarHBondContact O-CG 3.32Å; A836-L839 PolarHBondContact O-N 3.1Å; A836-L839 VanDerWaalsContact O-N 3.12Å; F837-L839 PolarHBondContact O-N 3.16Å
840	S	76	Confident	76.8	Confident	24 Å²	24	61.2 Å²	61.2	17%	0.168	33%	0.329	C	S	.	.	S	Bend	trans	-82.2	151.1	175.9	78.7	0	0	0	0	111.8	A836 F837 N842 P843 T846	A836-S840 PolarHBondContact O-N 3.17Å; F837-S840 WeakPolarHBondContact O-CB 3.15Å; F837-S840 PolarHBondContact O-N 2.86Å; F837-S840 PolarHBondContact O-OG 2.85Å; S840-N842 VanDerWaalsContact C-N 3.29Å; S840-N842 PolarHBondContact O-N 3.13Å; S840-P843 WeakPolarHBondContact OG-CA 3.46Å; S840-T846 PolarHBondContact OG-OG1 3.44Å
841	P	73.7	Confident	76.9	Confident	120 Å²	120	61 Å²	61	78%	0.779	33%	0.327	S	S	*	.	S	Bend	trans	-73.3	-15.6	-177.4	28.9	-35.6	0	0	0	114.6
842	N	79.1	Confident	77.2	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	33%	0.334	S	S	.	.	S	Bend	trans	-140.9	82.3	176.2	-63.8	-66.6	0	0	0	109.2	E816 S840 A844 R845 T846	E816-N842 WeakPolarHBondContact OE1-CA 3.08Å; E816-N842 WeakPolarHBondContact OE1-CB 3.37Å; S840-N842 VanDerWaalsContact C-N 3.29Å; S840-N842 PolarHBondContact O-N 3.13Å; N842-A844 PolarHBondContact O-N 3.48Å; N842-R845 HydrophobicContact CB-CB 3.96Å; N842-R845 WeakPolarHBondContact O-CB 3.41Å; N842-R845 PolarHBondContact O-N 2.65Å; N842-T846 PolarHBondContact O-N 3.25Å; N842-T846 PolarHBondContact O-OG1 3.04Å
843	P	79.6	Confident	77.3	Confident	23 Å²	23	61.7 Å²	61.7	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-36.1	-166.9	-27.5	36.2	0	0	0	115.6	W821 F837 S840 R845 L847	W821-P843 HydrophobicContact CD2-CB 3.83Å; W821-P843 HydrophobicContact CE3-CB 4Å; W821-P843 HydrophobicContact CH2-CB 3.55Å; W821-P843 HydrophobicContact CH2-CG 4.3Å; W821-P843 HydrophobicContact CZ2-CB 3.38Å; W821-P843 HydrophobicContact CZ2-CG 3.88Å; W821-P843 HydrophobicContact CZ3-CB 3.87Å; F837-P843 HydrophobicContact CB-CB 4.5Å; F837-P843 WeakPolarHBondContact O-CB 3.46Å; F837-P843 WeakPolarHBondContact O-CG 3.37Å; S840-P843 WeakPolarHBondContact OG-CA 3.46Å; P843-R845 VanDerWaalsContact C-N 3.35Å; P843-L847 VanDerWaalsContact O-CB 3.24Å; P843-L847 WeakPolarHBondContact O-CB 3.3Å; P843-L847 PolarHBondContact O-N 3.39Å
844	A	79.6	Confident	77	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72.7	-33.6	179.4	0	0	0	0	0	111.3	L815 E816 W821 N842 L848	L815-A844 HydrophobicContact CB-CB 3.61Å; L815-A844 HydrophobicContact CD1-CB 4.42Å; E816-A844 HydrophobicContact CG-CB 3.71Å; E816-A844 PolarHBondContact OE1-N 3.03Å; E816-A844 VanDerWaalsContact OE1-N 3.08Å; W821-A844 HydrophobicContact CB-CB 3.73Å; W821-A844 HydrophobicContact CG-CB 4.12Å; N842-A844 PolarHBondContact O-N 3.48Å; A844-L848 PolarHBondContact O-N 3.44Å
845	R	80.6	Confident	76.7	Confident	128 Å²	128	61.3 Å²	61.3	48%	0.483	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-51.6	171.5	-178	-178.2	170.9	161.3	4.1	111.8	C812 E816 N842 P843 L847 L848 E849	C812-R845 HydrophobicContact CB-CB 4.37Å; E816-R845 PolarHBondContact OE1-N 3.37Å; E816-R845 VanDerWaalsContact OE1-N 3.12Å; N842-R845 HydrophobicContact CB-CB 3.96Å; N842-R845 WeakPolarHBondContact O-CB 3.41Å; N842-R845 PolarHBondContact O-N 2.65Å; P843-R845 VanDerWaalsContact C-N 3.35Å; R845-L847 VanDerWaalsContact C-N 3.25Å; R845-L847 PolarHBondContact O-N 2.99Å; R845-L848 PolarHBondContact O-N 3.45Å; R845-L848 VanDerWaalsContact O-N 3.11Å; R845-E849 HydrophobicContact CG-CG 4.36Å; R845-E849 IonicContact CZ-OE1 2.72Å; R845-E849 IonicContact NE-OE1 3.67Å; R845-E849 PolarHBondContact NE-OE1 3.38Å; R845-E849 IonicContact NE-OE2 2.84Å; R845-E849 PolarHBondContact NE-OE2 2.77Å; R845-E849 IonicContact NH2-OE1 2.76Å; R845-E849 PolarHBondContact NH2-OE1 3.04Å; R845-E849 WeakPolarHBondContact O-CG 3.49Å; R845-E849 PolarHBondContact O-N 3.02Å
846	T	80.4	Confident	76.8	Confident	50 Å²	50	56.9 Å²	56.9	31%	0.307	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-34.9	-179.6	-60.1	0	0	0	0	111.6	F837 S840 N842 S850	F837-T846 HydrophobicContact CD1-CG2 3.98Å; F837-T846 HydrophobicContact CE1-CG2 4.34Å; S840-T846 PolarHBondContact OG-OG1 3.44Å; N842-T846 PolarHBondContact O-N 3.25Å; N842-T846 PolarHBondContact O-OG1 3.04Å; T846-S850 WeakPolarHBondContact O-CB 3.31Å; T846-S850 PolarHBondContact O-N 3.48Å; T846-S850 PolarHBondContact O-OG 3.17Å
847	L	81.6	Confident	77.1	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59	-52.2	169.2	175.3	149	0	0	0	112	W821 L824 A825 L828 F837 P843 R845 E849 S850 Y851	W821-L847 HydrophobicContact CE3-CD1 4.27Å; W821-L847 WeakPolarHBondContact O-CD1 3.48Å; L824-L847 HydrophobicContact CD2-CD2 4.13Å; A825-L847 HydrophobicContact CB-CD1 3.47Å; A825-L847 VanDerWaalsContact CB-CD1 3.47Å; L828-L847 HydrophobicContact CD1-CD2 4.36Å; F837-L847 HydrophobicContact CD2-CB 4.22Å; F837-L847 HydrophobicContact CD2-CD1 4.21Å; F837-L847 HydrophobicContact CE2-CB 4.22Å; F837-L847 HydrophobicContact CE2-CD1 4.19Å; F837-L847 HydrophobicContact CE2-CG 4.27Å; F837-L847 HydrophobicContact CG-CB 4.48Å; F837-L847 HydrophobicContact CZ-CB 4.46Å; P843-L847 VanDerWaalsContact O-CB 3.24Å; P843-L847 WeakPolarHBondContact O-CB 3.3Å; P843-L847 PolarHBondContact O-N 3.39Å; R845-L847 VanDerWaalsContact C-N 3.25Å; R845-L847 PolarHBondContact O-N 2.99Å; L847-E849 PolarHBondContact O-N 2.88Å; L847-S850 PolarHBondContact O-N 3.5Å; L847-S850 PolarHBondContact O-OG 3.49Å; L847-Y851 WeakPolarHBondContact O-CB 3.22Å; L847-Y851 PolarHBondContact O-N 3.32Å
848	L	78.8	Confident	77	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-40.6	-179.4	-109.1	121.3	0	0	0	112.5	L800 V811 L815 A844 R845 Y851 E852 L861	L800-L848 HydrophobicContact CD2-CD2 4.16Å; V811-L848 HydrophobicContact CG1-CD1 4.02Å; L815-L848 HydrophobicContact CD1-CD1 3.81Å; A844-L848 PolarHBondContact O-N 3.44Å; R845-L848 PolarHBondContact O-N 3.45Å; R845-L848 VanDerWaalsContact O-N 3.11Å; L848-Y851 PolarHBondContact O-N 2.94Å; L848-E852 WeakPolarHBondContact O-CB 3.2Å; L848-E852 PolarHBondContact O-N 2.64Å; L848-L861 HydrophobicContact CD2-CD2 4.26Å
849	E	76.4	Confident	76.8	Confident	81 Å²	81	52 Å²	52	38%	0.379	30%	0.296	S	S	.	.	H	α-helix	trans	-64.7	-39.5	175.6	-70.9	173.6	155	0	0	111.4	R845 L847 V853	R845-E849 HydrophobicContact CG-CG 4.36Å; R845-E849 IonicContact CZ-OE1 2.72Å; R845-E849 IonicContact NE-OE1 3.67Å; R845-E849 PolarHBondContact NE-OE1 3.38Å; R845-E849 IonicContact NE-OE2 2.84Å; R845-E849 PolarHBondContact NE-OE2 2.77Å; R845-E849 IonicContact NH2-OE1 2.76Å; R845-E849 PolarHBondContact NH2-OE1 3.04Å; R845-E849 WeakPolarHBondContact O-CG 3.49Å; R845-E849 PolarHBondContact O-N 3.02Å; L847-E849 PolarHBondContact O-N 2.88Å; E849-V853 WeakPolarHBondContact O-CG2 3.39Å; E849-V853 PolarHBondContact O-N 3.22Å; E849-V853 VanDerWaalsContact O-N 3.07Å
850	S	77.4	Confident	76.8	Confident	27 Å²	27	48.6 Å²	48.6	19%	0.189	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-33.4	174.3	73.9	0	0	0	0	113.3	F837 T846 L847 S854	F837-S850 WeakPolarHBondContact CE1-OG 3.43Å; F837-S850 WeakPolarHBondContact CZ-OG 3.46Å; T846-S850 WeakPolarHBondContact O-CB 3.31Å; T846-S850 PolarHBondContact O-N 3.48Å; T846-S850 PolarHBondContact O-OG 3.17Å; L847-S850 PolarHBondContact O-N 3.5Å; L847-S850 PolarHBondContact O-OG 3.49Å; S850-S854 VanDerWaalsContact O-CB 3.31Å; S850-S854 WeakPolarHBondContact O-CB 3.49Å; S850-S854 PolarHBondContact O-N 3.21Å; S850-S854 PolarHBondContact O-OG 2.94Å
851	Y	79.4	Confident	77	Confident	19 Å²	19	47.5 Å²	47.5	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-71.4	-37.7	176.5	-172.7	-118.3	0	0	0	111.7	L800 L828 L830 L847 L848 S854 G855 G856 T857 D860 L861	L800-Y851 HydrophobicContact CD1-CD1 4.38Å; L800-Y851 HydrophobicContact CD1-CE1 4.23Å; L800-Y851 HydrophobicContact CD2-CD1 3.78Å; L800-Y851 HydrophobicContact CD2-CE1 4.42Å; L828-Y851 HydrophobicContact CB-CD2 4.15Å; L828-Y851 HydrophobicContact CB-CE2 3.99Å; L828-Y851 HydrophobicContact CD1-CD1 4.06Å; L828-Y851 HydrophobicContact CD1-CD2 4.17Å; L828-Y851 HydrophobicContact CD1-CE1 4.19Å; L828-Y851 HydrophobicContact CD1-CE2 4.31Å; L828-Y851 HydrophobicContact CD1-CG 4.07Å; L828-Y851 HydrophobicContact CD2-CE1 4.08Å; L828-Y851 HydrophobicContact CD2-CE2 3.99Å; L828-Y851 HydrophobicContact CG-CE2 4.32Å; L830-Y851 HydrophobicContact CD1-CD2 3.9Å; L830-Y851 HydrophobicContact CD1-CG 4.29Å; L830-Y851 HydrophobicContact CG-CD2 4.46Å; L847-Y851 WeakPolarHBondContact O-CB 3.22Å; L847-Y851 PolarHBondContact O-N 3.32Å; L848-Y851 PolarHBondContact O-N 2.94Å; Y851-S854 PolarHBondContact O-N 3Å; Y851-G855 PolarHBondContact O-N 3.46Å; Y851-G856 PolarHBondContact O-N 3.32Å; Y851-T857 PolarHBondContact OH-N 2.92Å; Y851-D860 VanDerWaalsContact OH-CB 3.26Å; Y851-D860 WeakPolarHBondContact OH-CB 3.48Å; Y851-L861 HydrophobicContact CE1-CB 4.38Å
852	E	77.9	Confident	77.1	Confident	65 Å²	65	42.7 Å²	42.7	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-46.1	171.8	-171.5	162.1	-176.2	0	0	111.7	L800 S801 K808 L848 S854 G855	L800-E852 HydrophobicContact CB-CG 4.42Å; L800-E852 HydrophobicContact CD2-CB 4Å; S801-E852 WeakPolarHBondContact CA-OE1 3.07Å; K808-E852 IonicContact NZ-OE1 3.19Å; K808-E852 PolarHBondContact NZ-OE1 2.75Å; K808-E852 IonicContact NZ-OE2 2.79Å; K808-E852 PolarHBondContact NZ-OE2 3.03Å; L848-E852 WeakPolarHBondContact O-CB 3.2Å; L848-E852 PolarHBondContact O-N 2.64Å; E852-S854 PolarHBondContact O-N 2.97Å; E852-G855 PolarHBondContact O-N 2.83Å; E852-G855 VanDerWaalsContact O-N 3.15Å
853	V	73.8	Confident	77	Confident	117 Å²	117	41.4 Å²	41.4	71%	0.709	24%	0.239	S	C	*	.	H	α-helix	trans	-64.9	-27.4	174.7	171.1	0	0	0	0	112.3	E849 G855	E849-V853 WeakPolarHBondContact O-CG2 3.39Å; E849-V853 PolarHBondContact O-N 3.22Å; E849-V853 VanDerWaalsContact O-N 3.07Å; V853-G855 VanDerWaalsContact C-N 3.27Å; V853-G855 PolarHBondContact O-N 3.44Å
854	S	67.4	Low	76.9	Confident	68 Å²	68	40.6 Å²	40.6	48%	0.476	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-0.3	176.9	-57	0	0	0	0	113.7	S850 Y851 E852	S850-S854 VanDerWaalsContact O-CB 3.31Å; S850-S854 WeakPolarHBondContact O-CB 3.49Å; S850-S854 PolarHBondContact O-N 3.21Å; S850-S854 PolarHBondContact O-OG 2.94Å; Y851-S854 PolarHBondContact O-N 3Å; E852-S854 PolarHBondContact O-N 2.97Å
855	G	69.6	Low	76.8	Confident	16 Å²	16	40.6 Å²	40.6	17%	0.165	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	21.2	-179.2	0	0	0	0	0	115	P796 G798 Y851 E852 V853	P796-G855 VanDerWaalsContact O-CA 3.3Å; P796-G855 WeakPolarHBondContact O-CA 3.49Å; G798-G855 WeakPolarHBondContact CA-O 3.46Å; Y851-G855 PolarHBondContact O-N 3.46Å; E852-G855 PolarHBondContact O-N 2.83Å; E852-G855 VanDerWaalsContact O-N 3.15Å; V853-G855 VanDerWaalsContact C-N 3.27Å; V853-G855 PolarHBondContact O-N 3.44Å
856	G	75.2	Confident	76.6	Confident	6 Å²	6	41.5 Å²	41.5	6%	0.062	24%	0.238	C	C	.	.			trans	-64.3	154.7	-179	0	0	0	0	0	114.8	G798 Y851	G798-G856 WeakPolarHBondContact CA-O 3.31Å; Y851-G856 PolarHBondContact O-N 3.32Å
857	T	79	Confident	76.3	Confident	38 Å²	38	42.5 Å²	42.5	23%	0.233	25%	0.247	C	C	.	.			trans	-108.2	156.9	-175.1	81.2	0	0	0	0	114	D799 Y851 S859 D860 L861	D799-T857 WeakPolarHBondContact OD1-CA 3.36Å; D799-T857 WeakPolarHBondContact OD1-CB 3.45Å; Y851-T857 PolarHBondContact OH-N 2.92Å; T857-S859 VanDerWaalsContact C-N 3.3Å; T857-S859 PolarHBondContact OG1-N 3.46Å; T857-D860 WeakPolarHBondContact OG1-CB 3.15Å; T857-D860 PolarHBondContact OG1-N 2.89Å; T857-D860 PolarHBondContact OG1-OD2 3.46Å; T857-L861 WeakPolarHBondContact O-CB 3.46Å; T857-L861 PolarHBondContact O-N 2.6Å
858	V	76.3	Confident	75.7	Confident	10 Å²	10	43.7 Å²	43.7	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-35.3	173.5	-177.1	0	0	0	0	110.8	D799 L800 L803 L861 L862 L881	D799-V858 HydrophobicContact CB-CG2 4.47Å; D799-V858 PolarHBondContact OD1-N 2.69Å; D799-V858 WeakPolarHBondContact OD2-CB 3.46Å; L800-V858 HydrophobicContact CD1-CG2 4.07Å; L803-V858 HydrophobicContact CD1-CG1 4.3Å; L803-V858 HydrophobicContact CD1-CG2 3.87Å; L803-V858 HydrophobicContact CD2-CG1 4.42Å; L803-V858 HydrophobicContact CG-CG2 3.96Å; V858-L861 PolarHBondContact O-N 2.9Å; V858-L862 HydrophobicContact CG1-CD1 4.41Å; V858-L862 WeakPolarHBondContact O-CB 3.2Å; V858-L862 WeakPolarHBondContact O-CG 3.32Å; V858-L862 PolarHBondContact O-N 3.42Å; V858-L881 HydrophobicContact CG1-CD1 4.13Å; V858-L881 HydrophobicContact CG1-CD2 4.48Å
859	S	74.4	Confident	74.7	Confident	61 Å²	61	45.1 Å²	45.1	43%	0.427	27%	0.273	S	S	.	.	H	α-helix	trans	-64.8	-45.9	177	-177.3	0	0	0	0	111.9	T857 L862 A863	T857-S859 VanDerWaalsContact C-N 3.3Å; T857-S859 PolarHBondContact OG1-N 3.46Å; S859-L862 WeakPolarHBondContact O-CB 3.39Å; S859-L862 PolarHBondContact O-N 3.26Å; S859-A863 PolarHBondContact O-N 3.41Å
860	D	77.4	Confident	73.9	Confident	83 Å²	83	45.4 Å²	45.4	44%	0.444	30%	0.298	S	S	.	.	H	α-helix	trans	-69.1	-38.2	177.5	-64.3	-45.4	0	0	0	111.4	Y851 T857 L862 A863 A864	Y851-D860 VanDerWaalsContact OH-CB 3.26Å; Y851-D860 WeakPolarHBondContact OH-CB 3.48Å; T857-D860 WeakPolarHBondContact OG1-CB 3.15Å; T857-D860 PolarHBondContact OG1-N 2.89Å; T857-D860 PolarHBondContact OG1-OD2 3.46Å; D860-L862 VanDerWaalsContact C-N 3.34Å; D860-L862 PolarHBondContact O-N 3.07Å; D860-A863 PolarHBondContact O-N 3.48Å; D860-A864 VanDerWaalsContact O-CB 3.3Å; D860-A864 WeakPolarHBondContact O-CB 3.4Å; D860-A864 PolarHBondContact O-N 3.5Å
861	L	79.2	Confident	73.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-43.5	171.9	-178.4	61	0	0	0	111.6	L800 L824 L828 L848 Y851 T857 V858 A864 L865 L877	L800-L861 HydrophobicContact CD1-CB 4.19Å; L800-L861 HydrophobicContact CD1-CD2 3.9Å; L824-L861 HydrophobicContact CD1-CD1 4.22Å; L824-L861 HydrophobicContact CD2-CD1 4.1Å; L828-L861 HydrophobicContact CD1-CD1 4.06Å; L848-L861 HydrophobicContact CD2-CD2 4.26Å; Y851-L861 HydrophobicContact CE1-CB 4.38Å; T857-L861 WeakPolarHBondContact O-CB 3.46Å; T857-L861 PolarHBondContact O-N 2.6Å; V858-L861 PolarHBondContact O-N 2.9Å; L861-A864 PolarHBondContact O-N 3.26Å; L861-L865 HydrophobicContact CD1-CD1 4.07Å; L861-L865 HydrophobicContact CD1-CG 4.2Å; L861-L865 HydrophobicContact CG-CD1 3.91Å; L861-L865 HydrophobicContact CG-CG 4.47Å; L861-L865 WeakPolarHBondContact O-CB 3.42Å; L861-L865 WeakPolarHBondContact O-CD1 3.43Å; L861-L865 WeakPolarHBondContact O-CG 3.44Å; L861-L865 PolarHBondContact O-N 2.85Å; L861-L877 HydrophobicContact CD2-CD2 3.96Å; L861-L877 HydrophobicContact CG-CD2 4.04Å
862	L	76.4	Confident	72.9	Confident	19 Å²	19	52.2 Å²	52.2	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-42.4	173.5	-79.1	167.1	0	0	0	112.4	V858 S859 D860 L865 R866 L877 E878 L881	V858-L862 HydrophobicContact CG1-CD1 4.41Å; V858-L862 WeakPolarHBondContact O-CB 3.2Å; V858-L862 WeakPolarHBondContact O-CG 3.32Å; V858-L862 PolarHBondContact O-N 3.42Å; S859-L862 WeakPolarHBondContact O-CB 3.39Å; S859-L862 PolarHBondContact O-N 3.26Å; D860-L862 VanDerWaalsContact C-N 3.34Å; D860-L862 PolarHBondContact O-N 3.07Å; L862-L865 PolarHBondContact O-N 3.29Å; L862-R866 WeakPolarHBondContact O-CB 3.31Å; L862-R866 WeakPolarHBondContact O-CD 3.15Å; L862-R866 WeakPolarHBondContact O-CG 3.5Å; L862-R866 PolarHBondContact O-N 3.14Å; L862-L877 HydrophobicContact CD2-CB 4.37Å; L862-L877 HydrophobicContact CD2-CD2 3.72Å; L862-L877 HydrophobicContact CD2-CG 3.92Å; L862-L877 HydrophobicContact CG-CD2 3.87Å; L862-L877 HydrophobicContact CG-CG 4.35Å; L862-E878 HydrophobicContact CD2-CG 3.75Å; L862-L881 HydrophobicContact CD1-CD1 3.7Å
863	A	77.7	Confident	72.5	Confident	51 Å²	51	49.1 Å²	49.1	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-41.3	178.2	0	0	0	0	0	112	S859 D860 R866 S867	S859-A863 PolarHBondContact O-N 3.41Å; D860-A863 PolarHBondContact O-N 3.48Å; A863-R866 PolarHBondContact O-N 3.46Å; A863-S867 PolarHBondContact O-N 3.06Å; A863-S867 PolarHBondContact O-OG 3.11Å
864	A	76.6	Confident	72.6	Confident	6 Å²	6	44.7 Å²	44.7	5%	0.05	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-41.1	176.3	0	0	0	0	0	112.2	L824 H827 L828 D860 L861 S867 A868	L824-A864 HydrophobicContact CD1-CB 3.63Å; H827-A864 HydrophobicContact CB-CB 3.84Å; L828-A864 HydrophobicContact CD2-CB 3.42Å; L828-A864 VanDerWaalsContact CD2-CB 3.42Å; L828-A864 HydrophobicContact CG-CB 3.94Å; D860-A864 VanDerWaalsContact O-CB 3.3Å; D860-A864 WeakPolarHBondContact O-CB 3.4Å; D860-A864 PolarHBondContact O-N 3.5Å; L861-A864 PolarHBondContact O-N 3.26Å; A864-S867 WeakPolarHBondContact CA-OG 3.42Å; A864-S867 PolarHBondContact O-N 2.87Å; A864-S867 PolarHBondContact O-OG 2.76Å; A864-A868 WeakPolarHBondContact O-CB 3.43Å; A864-A868 PolarHBondContact O-N 2.92Å
865	L	76.8	Confident	72.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-37.5	173.6	-71	167.7	0	0	0	112.3	L815 L824 L861 L862 A873 L874 L877	L815-L865 HydrophobicContact CD2-CD2 3.9Å; L824-L865 HydrophobicContact CD1-CD2 3.87Å; L824-L865 HydrophobicContact CD1-CG 3.99Å; L824-L865 HydrophobicContact CD2-CD2 4Å; L861-L865 HydrophobicContact CD1-CD1 4.07Å; L861-L865 HydrophobicContact CD1-CG 4.2Å; L861-L865 HydrophobicContact CG-CD1 3.91Å; L861-L865 HydrophobicContact CG-CG 4.47Å; L861-L865 WeakPolarHBondContact O-CB 3.42Å; L861-L865 WeakPolarHBondContact O-CD1 3.43Å; L861-L865 WeakPolarHBondContact O-CG 3.44Å; L861-L865 PolarHBondContact O-N 2.85Å; L862-L865 PolarHBondContact O-N 3.29Å; L865-A873 HydrophobicContact CD2-CB 4.15Å; L865-L874 HydrophobicContact CB-CB 4.31Å; L865-L874 HydrophobicContact CB-CD1 4.4Å; L865-L877 HydrophobicContact CD1-CD2 3.69Å
866	R	77.6	Confident	73.2	Confident	146 Å²	146	47.4 Å²	47.4	55%	0.551	29%	0.289	S	S	*	.	H	α-helix	trans	-67.2	-35.5	175.8	-76.6	167.1	-178.4	160.5	0.2	112.6	L862 A863 L874 E878	L862-R866 WeakPolarHBondContact O-CB 3.31Å; L862-R866 WeakPolarHBondContact O-CD 3.15Å; L862-R866 WeakPolarHBondContact O-CG 3.5Å; L862-R866 PolarHBondContact O-N 3.14Å; A863-R866 PolarHBondContact O-N 3.46Å; R866-L874 HydrophobicContact CB-CD1 4.27Å; R866-L874 HydrophobicContact CG-CD1 3.59Å; R866-L874 HydrophobicContact CG-CG 4.5Å; R866-E878 IonicContact CZ-OE1 2.69Å; R866-E878 VanDerWaalsContact CZ-OE1 3.27Å; R866-E878 IonicContact NE-OE1 3.68Å; R866-E878 PolarHBondContact NE-OE1 3.17Å; R866-E878 IonicContact NH2-OE1 3.02Å; R866-E878 PolarHBondContact NH2-OE1 2.79Å
867	S	74	Confident	73.1	Confident	71 Å²	71	47.1 Å²	47.1	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-83.1	-31.6	178.9	45.9	0	0	0	0	113.5	H827 A863 A864 G869	H827-S867 PolarHBondContact CD2-OG 3.14Å; H827-S867 VanDerWaalsContact CD2-OG 3.3Å; A863-S867 PolarHBondContact O-N 3.06Å; A863-S867 PolarHBondContact O-OG 3.11Å; A864-S867 WeakPolarHBondContact CA-OG 3.42Å; A864-S867 PolarHBondContact O-N 2.87Å; A864-S867 PolarHBondContact O-OG 2.76Å; S867-G869 PolarHBondContact O-N 2.84Å
868	A	68	Low	72.9	Confident	25 Å²	25	48 Å²	48	21%	0.207	29%	0.287	C	S	.	.	H	α-helix	trans	-68.2	-13.3	174.7	0	0	0	0	0	114.4	A864	A864-A868 WeakPolarHBondContact O-CB 3.43Å; A864-A868 PolarHBondContact O-N 2.92Å
869	G	58.4	Low	72.6	Confident	37 Å²	37	48.9 Å²	48.9	38%	0.381	30%	0.299	S	S	.	.			trans	102.4	157.7	-179	0	0	0	0	0	113.2	S867 C871	S867-G869 PolarHBondContact O-N 2.84Å; G869-C871 VanDerWaalsContact C-N 3.34Å; G869-C871 PolarHBondContact O-N 3.46Å
870	G	59.6	Low	72.2	Confident	87 Å²	87	47.1 Å²	47.1	90%	0.897	29%	0.288	S	S	*	.			trans	-66.6	79	-167.9	0	0	0	0	0	115.5
871	C	66.4	Low	71.6	Confident	7 Å²	7	45.8 Å²	45.8	5%	0.047	28%	0.28	C	S	.	.			trans	-83.7	154	171.3	53.6	0	0	0	0	111.8	E818 G869 A873 L874	E818-C871 WeakPolarHBondContact OE2-CA 3.4Å; E818-C871 WeakPolarHBondContact OE2-CB 3.48Å; G869-C871 VanDerWaalsContact C-N 3.34Å; G869-C871 PolarHBondContact O-N 3.46Å; C871-A873 PolarHBondContact O-N 3.18Å; C871-L874 WeakPolarHBondContact O-CB 3.39Å; C871-L874 PolarHBondContact O-N 2.73Å; C871-L874 VanDerWaalsContact O-N 3.14Å
872	R	68.6	Low	70.7	Confident	183 Å²	183	53.7 Å²	53.7	69%	0.691	32%	0.317	S	S	*	.	H	α-helix	trans	-60.6	-27.9	175.6	-84.1	173.3	146.7	170.4	-6.6	113.1	A814 E818 L874 S875 I876	A814-R872 HydrophobicContact CB-CB 4.13Å; E818-R872 VanDerWaalsContact OE1-CB 3.29Å; E818-R872 WeakPolarHBondContact OE1-CB 3.34Å; E818-R872 WeakPolarHBondContact OE1-CD 3.29Å; E818-R872 WeakPolarHBondContact OE1-CG 3.39Å; E818-R872 PolarHBondContact OE1-N 3.44Å; E818-R872 PolarHBondContact OE2-N 2.92Å; R872-L874 PolarHBondContact O-N 3.22Å; R872-S875 PolarHBondContact O-N 2.99Å; R872-I876 VanDerWaalsContact O-CG1 3.31Å; R872-I876 WeakPolarHBondContact O-CG1 3.34Å; R872-I876 PolarHBondContact O-N 2.89Å
873	A	70.6	Confident	69.8	Low	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-54.5	-39.2	174.9	0	0	0	0	0	112.4	V811 A814 L815 L865 C871 I876 L877	V811-A873 HydrophobicContact CG1-CB 4.26Å; A814-A873 HydrophobicContact CB-CB 4.01Å; L815-A873 HydrophobicContact CD2-CB 3.92Å; L815-A873 HydrophobicContact CG-CB 3.82Å; L865-A873 HydrophobicContact CD2-CB 4.15Å; C871-A873 PolarHBondContact O-N 3.18Å; A873-I876 PolarHBondContact O-N 3.36Å; A873-L877 WeakPolarHBondContact O-CB 3.25Å; A873-L877 PolarHBondContact O-N 3Å
874	L	76	Confident	68.7	Low	24 Å²	24	62.8 Å²	62.8	13%	0.126	35%	0.354	C	S	.	.	H	α-helix	trans	-63.2	-49.4	176.6	-178.5	157.9	0	0	0	111.5	L865 R866 C871 R872 I876 L877 E878	L865-L874 HydrophobicContact CB-CB 4.31Å; L865-L874 HydrophobicContact CB-CD1 4.4Å; R866-L874 HydrophobicContact CB-CD1 4.27Å; R866-L874 HydrophobicContact CG-CD1 3.59Å; R866-L874 HydrophobicContact CG-CG 4.5Å; C871-L874 WeakPolarHBondContact O-CB 3.39Å; C871-L874 PolarHBondContact O-N 2.73Å; C871-L874 VanDerWaalsContact O-N 3.14Å; R872-L874 PolarHBondContact O-N 3.22Å; L874-I876 VanDerWaalsContact C-N 3.29Å; L874-I876 PolarHBondContact O-N 3.28Å; L874-L877 PolarHBondContact O-N 3.12Å; L874-E878 HydrophobicContact CD2-CG 4.24Å; L874-E878 VanDerWaalsContact CD2-OE2 3.31Å; L874-E878 WeakPolarHBondContact CD2-OE2 3.5Å; L874-E878 WeakPolarHBondContact O-CB 3.37Å; L874-E878 WeakPolarHBondContact O-CG 3.43Å; L874-E878 PolarHBondContact O-N 3.27Å
875	S	73.7	Confident	67.2	Low	81 Å²	81	67 Å²	67	57%	0.566	38%	0.38	S	S	*	.	H	α-helix	trans	-66.8	-29.8	179.5	-53.6	0	0	0	0	113.2	R872 G879	R872-S875 PolarHBondContact O-N 2.99Å; S875-G879 PolarHBondContact O-N 2.69Å
876	I	74.9	Confident	65.8	Low	60 Å²	60	73.6 Å²	73.6	31%	0.308	42%	0.416	S	S	.	.	H	α-helix	trans	-68.6	-45.9	172.7	-69.2	163.5	0	0	0	110.3	A810 V811 A814 R872 A873 L874 G879 A880	A810-I876 HydrophobicContact CB-CD1 4.41Å; A810-I876 HydrophobicContact CB-CG2 3.87Å; V811-I876 HydrophobicContact CG2-CG2 3.99Å; A814-I876 HydrophobicContact CB-CD1 3.99Å; R872-I876 VanDerWaalsContact O-CG1 3.31Å; R872-I876 WeakPolarHBondContact O-CG1 3.34Å; R872-I876 PolarHBondContact O-N 2.89Å; A873-I876 PolarHBondContact O-N 3.36Å; L874-I876 VanDerWaalsContact C-N 3.29Å; L874-I876 PolarHBondContact O-N 3.28Å; I876-G879 PolarHBondContact O-N 3.26Å; I876-A880 WeakPolarHBondContact O-CB 3.32Å; I876-A880 PolarHBondContact O-N 3.02Å
877	L	73.3	Confident	64.4	Low	0 Å²	0	70.6 Å²	70.6	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-68.9	-47	-178	-171.1	60.2	0	0	0	112	L803 V807 V811 L861 L862 L865 A873 L874 G879 A880 L881	L803-L877 HydrophobicContact CD1-CD1 3.72Å; L803-L877 HydrophobicContact CD2-CD1 3.54Å; L803-L877 HydrophobicContact CG-CD1 4.3Å; V807-L877 HydrophobicContact CG1-CD1 4.46Å; V811-L877 HydrophobicContact CG2-CB 4.33Å; L861-L877 HydrophobicContact CD2-CD2 3.96Å; L861-L877 HydrophobicContact CG-CD2 4.04Å; L862-L877 HydrophobicContact CD2-CB 4.37Å; L862-L877 HydrophobicContact CD2-CD2 3.72Å; L862-L877 HydrophobicContact CD2-CG 3.92Å; L862-L877 HydrophobicContact CG-CD2 3.87Å; L862-L877 HydrophobicContact CG-CG 4.35Å; L865-L877 HydrophobicContact CD1-CD2 3.69Å; A873-L877 WeakPolarHBondContact O-CB 3.25Å; A873-L877 PolarHBondContact O-N 3Å; L874-L877 PolarHBondContact O-N 3.12Å; L877-G879 VanDerWaalsContact C-N 3.32Å; L877-G879 PolarHBondContact O-N 3.28Å; L877-A880 PolarHBondContact O-N 3.31Å; L877-L881 HydrophobicContact CG-CD1 4.5Å; L877-L881 WeakPolarHBondContact O-CG 3.19Å; L877-L881 PolarHBondContact O-N 2.92Å; L877-L881 VanDerWaalsContact O-N 3.17Å
878	E	74.3	Confident	62.8	Low	55 Å²	55	69.9 Å²	69.9	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-63.4	-37.8	173.9	-68.5	-175.8	160.5	0	0	111.6	L862 R866 L874 A880 L881 H882	L862-E878 HydrophobicContact CD2-CG 3.75Å; R866-E878 IonicContact CZ-OE1 2.69Å; R866-E878 VanDerWaalsContact CZ-OE1 3.27Å; R866-E878 IonicContact NE-OE1 3.68Å; R866-E878 PolarHBondContact NE-OE1 3.17Å; R866-E878 IonicContact NH2-OE1 3.02Å; R866-E878 PolarHBondContact NH2-OE1 2.79Å; L874-E878 HydrophobicContact CD2-CG 4.24Å; L874-E878 VanDerWaalsContact CD2-OE2 3.31Å; L874-E878 WeakPolarHBondContact CD2-OE2 3.5Å; L874-E878 WeakPolarHBondContact O-CB 3.37Å; L874-E878 WeakPolarHBondContact O-CG 3.43Å; L874-E878 PolarHBondContact O-N 3.27Å; E878-A880 PolarHBondContact O-N 3.03Å; E878-L881 PolarHBondContact O-N 3.45Å; E878-H882 PolarHBondContact O-N 3.37Å; E878-H882 VanDerWaalsContact O-N 3.17Å; E878-H882 PolarHBondContact O-ND1 2.94Å
879	G	70.6	Confident	61.6	Low	30 Å²	30	76.6 Å²	76.6	31%	0.309	44%	0.435	S	S	.	.	H	α-helix	trans	-68.8	-28.1	177.4	0	0	0	0	0	114.6	S875 I876 L877 Q883	S875-G879 PolarHBondContact O-N 2.69Å; I876-G879 PolarHBondContact O-N 3.26Å; L877-G879 VanDerWaalsContact C-N 3.32Å; L877-G879 PolarHBondContact O-N 3.28Å; G879-Q883 PolarHBondContact O-NE2 2.93Å
880	A	66.2	Low	60.9	Low	23 Å²	23	82.9 Å²	82.9	19%	0.19	45%	0.454	C	S	.	.	H	α-helix	trans	-74.1	-43.7	172.9	0	0	0	0	0	111.7	V807 I876 L877 E878 H882 Q883	V807-A880 HydrophobicContact CB-CB 4.43Å; V807-A880 HydrophobicContact CG1-CB 3.71Å; V807-A880 HydrophobicContact CG2-CB 3.78Å; I876-A880 WeakPolarHBondContact O-CB 3.32Å; I876-A880 PolarHBondContact O-N 3.02Å; L877-A880 PolarHBondContact O-N 3.31Å; E878-A880 PolarHBondContact O-N 3.03Å; A880-H882 VanDerWaalsContact C-N 3.31Å; A880-H882 PolarHBondContact O-N 3.18Å; A880-Q883 PolarHBondContact O-N 2.7Å
881	L	65.7	Low	60.2	Low	55 Å²	55	83 Å²	83	29%	0.288	44%	0.437	S	S	.	.	H	α-helix	trans	-65.4	-32	179.7	-68.9	165.3	0	0	0	112.6	V858 L862 L877 E878 Q883	V858-L881 HydrophobicContact CG1-CD1 4.13Å; V858-L881 HydrophobicContact CG1-CD2 4.48Å; L862-L881 HydrophobicContact CD1-CD1 3.7Å; L877-L881 HydrophobicContact CG-CD1 4.5Å; L877-L881 WeakPolarHBondContact O-CG 3.19Å; L877-L881 PolarHBondContact O-N 2.92Å; L877-L881 VanDerWaalsContact O-N 3.17Å; E878-L881 PolarHBondContact O-N 3.45Å; L881-Q883 PolarHBondContact O-N 3.18Å
882	H	60.4	Low	58.7	Low	166 Å²	166	89.9 Å²	89.9	77%	0.769	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.1	173	-76.7	83.2	0	0	0	114.7	E878 A880	E878-H882 PolarHBondContact O-N 3.37Å; E878-H882 VanDerWaalsContact O-N 3.17Å; E878-H882 PolarHBondContact O-ND1 2.94Å; A880-H882 VanDerWaalsContact C-N 3.31Å; A880-H882 PolarHBondContact O-N 3.18Å
883	Q	57	Low	56.9	Low	156 Å²	156	87.8 Å²	87.8	73%	0.729	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-15.5	179.4	-71	176.4	53.5	0	0	113.9	G879 A880 L881	G879-Q883 PolarHBondContact O-NE2 2.93Å; A880-Q883 PolarHBondContact O-N 2.7Å; L881-Q883 PolarHBondContact O-N 3.18Å
884	N	53.7	Low	55.1	Low	106 Å²	106	92.8 Å²	92.8	57%	0.567	50%	0.504	S	S	*	.			trans	-121.4	89.5	174.6	-86.3	-16.6	0	0	0	110.2	D886 M887	N884-D886 VanDerWaalsContact C-N 3.27Å; N884-D886 PolarHBondContact O-N 3.28Å; N884-M887 HydrophobicContact CB-CG 4.31Å; N884-M887 PolarHBondContact O-N 3.49Å
885	P	45.9	Very low	53	Low	93 Å²	93	97.3 Å²	97.3	60%	0.604	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-66.1	-24.8	-174	26.3	-34.7	0	0	0	114.2	M887 A888	P885-M887 PolarHBondContact O-N 2.92Å; P885-M887 VanDerWaalsContact O-N 3.12Å; P885-A888 VanDerWaalsContact O-CB 3.32Å; P885-A888 WeakPolarHBondContact O-CB 3.4Å; P885-A888 PolarHBondContact O-N 2.97Å
886	D	47	Very low	51.1	Low	141 Å²	141	99.5 Å²	99.5	75%	0.754	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-61.1	-21.3	177.8	-62	-27.2	0	0	0	112.7	N884 A888	N884-D886 VanDerWaalsContact C-N 3.27Å; N884-D886 PolarHBondContact O-N 3.28Å; D886-A888 VanDerWaalsContact C-N 3.3Å; D886-A888 PolarHBondContact O-N 3.36Å
887	M	47.8	Very low	49.1	Very low	82 Å²	82	105 Å²	105	40%	0.404	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-82.7	-1.9	177	-61	-60.6	168.7	0	0	113.8	V802 N884 P885	V802-M887 HydrophobicContact CG1-CE 3.41Å; V802-M887 VanDerWaalsContact CG1-CE 3.41Å; V802-M887 HydrophobicContact CG1-SD 3.51Å; V802-M887 VanDerWaalsContact CG1-SD 3.51Å; N884-M887 HydrophobicContact CB-CG 4.31Å; N884-M887 PolarHBondContact O-N 3.49Å; P885-M887 PolarHBondContact O-N 2.92Å; P885-M887 VanDerWaalsContact O-N 3.12Å
888	A	40.9	Very low	47	Very low	57 Å²	57	112 Å²	112	47%	0.471	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-91	-20.8	-176	0	0	0	0	0	114.3	P885 D886	P885-A888 VanDerWaalsContact O-CB 3.32Å; P885-A888 WeakPolarHBondContact O-CB 3.4Å; P885-A888 PolarHBondContact O-N 2.97Å; D886-A888 VanDerWaalsContact C-N 3.3Å; D886-A888 PolarHBondContact O-N 3.36Å
889	E	42.5	Very low	45	Very low	165 Å²	165	117.2 Å²	117.2	77%	0.771	64%	0.635	S	S	*	*	S	Bend	trans	-87.6	-34.1	-174	-63.6	-157.9	144.7	0	0	113.7	V891	E889-V891 VanDerWaalsContact C-N 3.34Å; E889-V891 PolarHBondContact O-N 3.49Å
890	E	44.2	Very low	43	Very low	169 Å²	169	125.5 Å²	125.5	79%	0.79	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-69.9	-28.1	-178.8	-64.5	-162.9	134.9	0	0	113.4	Q892	E890-Q892 PolarHBondContact O-N 2.95Å
891	V	45	Very low	41.3	Very low	90 Å²	90	128.6 Å²	128.6	55%	0.545	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-70.7	-12.8	-176.4	-175.1	0	0	0	0	113.1	E889	E889-V891 VanDerWaalsContact C-N 3.34Å; E889-V891 PolarHBondContact O-N 3.49Å
892	Q	35.3	Very low	39.5	Very low	152 Å²	152	133.8 Å²	133.8	71%	0.71	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-99.6	-3.7	-171.3	-61.8	-165.1	20.2	0	0	116.2	E890	E890-Q892 PolarHBondContact O-N 2.95Å
893	N	29.9	Very low	38.1	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	72%	0.72	S	S	*	*			trans	-140	88.7	-177	-79.8	-65.4	0	0	0	114.6
894	P	32.9	Very low	36.8	Very low	106 Å²	106	129.8 Å²	129.8	69%	0.688	72%	0.722	S	S	*	*			trans	-75.8	129.2	165.6	30.7	-32.5	0	0	0	111.1	V896	P894-V896 PolarHBondContact O-N 2.83Å
895	P	32.1	Very low	35.7	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	74%	0.735	S	S	*	*			trans	-74.2	112.5	177.5	29	-33.3	0	0	0	111.3	Q897	P895-Q897 PolarHBondContact O-N 3.01Å; P895-Q897 VanDerWaalsContact O-N 3.07Å
896	V	34.4	Very low	34.8	Very low	127 Å²	127	135.4 Å²	135.4	77%	0.77	75%	0.747	S	S	*	*			trans	-71.3	102.6	177.6	-178.6	0	0	0	0	110.6	P894	P894-V896 PolarHBondContact O-N 2.83Å
897	Q	31.5	Very low	34.1	Very low	175 Å²	175	133.2 Å²	133.2	82%	0.818	74%	0.743	S	S	*	*			trans	-111.1	116.6	164.7	-67.6	-162.1	3	0	0	110.8	P895 L899	P895-Q897 PolarHBondContact O-N 3.01Å; P895-Q897 VanDerWaalsContact O-N 3.07Å; Q897-L899 PolarHBondContact O-N 3.43Å
898	N	30	Very low	33.2	Very low	149 Å²	149	132.6 Å²	132.6	80%	0.797	76%	0.757	S	S	*	*			trans	-78.4	116.7	174.1	-72.2	-90.3	0	0	0	109.5
899	L	31.4	Very low	32.7	Very low	164 Å²	164	136.1 Å²	136.1	86%	0.859	77%	0.772	S	S	*	*			trans	-119.4	131.2	156.1	-81.4	168.7	0	0	0	108.7	Q897	Q897-L899 PolarHBondContact O-N 3.43Å
900	K	29.9	Very low	32	Very low	203 Å²	203	134 Å²	134	88%	0.883	77%	0.774	S	S	*	*			trans	-71.6	145.7	178	-76.2	178.4	171.9	-179.6	0	109.8
901	A	29.7	Very low	31.2	Very low	88 Å²	88	132.8 Å²	132.8	73%	0.727	77%	0.773	S	S	*	*			trans	-68.7	132	158.5	0	0	0	0	0	109.8
902	D	27.1	Very low	30.6	Very low	164 Å²	164	133.4 Å²	133.4	88%	0.877	78%	0.782	S	S	*	*			trans	-116	137.5	146.6	-97.8	-49.9	0	0	0	107
903	L	32.8	Very low	30.3	Very low	164 Å²	164	129.3 Å²	129.3	86%	0.859	78%	0.78	S	S	*	*			trans	-95.8	104.6	-169.9	-75.3	163.6	0	0	0	110.9
904	G	28.4	Very low	30.3	Very low	74 Å²	74	128.6 Å²	128.6	76%	0.763	78%	0.781	S	S	*	*			trans	-112.7	99.8	166.7	0	0	0	0	0	110.4	D906	G904-D906 PolarHBondContact O-N 3.15Å
905	N	30.9	Very low	30.3	Very low	157 Å²	157	132.4 Å²	132.4	84%	0.84	79%	0.79	S	S	*	*			trans	-72.7	114.7	171.2	-97.1	25	0	0	0	109.6
906	D	27.7	Very low	30.2	Very low	160 Å²	160	134.3 Å²	134.3	86%	0.856	79%	0.792	S	S	*	*			trans	-130.1	118.8	154.1	-163.7	-3.4	0	0	0	108.3	G904	G904-D906 PolarHBondContact O-N 3.15Å
907	S	31.5	Very low	29.9	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	80%	0.796	S	S	*	*			trans	-126	64	-165.5	66.7	0	0	0	0	111.4	V909	S907-V909 PolarHBondContact O-N 3.47Å; S907-V909 VanDerWaalsContact O-N 3.08Å
908	G	28.7	Very low	30	Very low	68 Å²	68	132 Å²	132	70%	0.701	80%	0.796	S	S	*	*			trans	-69.7	94.1	170.9	0	0	0	0	0	111.7	C910	G908-C910 PolarHBondContact O-N 3.02Å
909	V	31.1	Very low	30.2	Very low	131 Å²	131	133.5 Å²	133.5	79%	0.794	83%	0.829	S	S	*	*			trans	-71.5	112.2	175.1	177.6	0	0	0	0	109.6	S907 D911	S907-V909 PolarHBondContact O-N 3.47Å; S907-V909 VanDerWaalsContact O-N 3.08Å; V909-D911 PolarHBondContact O-N 3.42Å
910	C	28.1	Very low	30.1	Very low	120 Å²	120	132 Å²	132	81%	0.811	83%	0.828	S	S	*	*			trans	-87.7	87.5	171.1	-60.9	0	0	0	0	109.1	G908	G908-C910 PolarHBondContact O-N 3.02Å
911	D	27.7	Very low	30.1	Very low	144 Å²	144	128.3 Å²	128.3	77%	0.77	83%	0.825	S	S	*	*			trans	-73.1	128	172.8	-164.7	-8.1	0	0	0	110.1	V909 G913	V909-D911 PolarHBondContact O-N 3.42Å; D911-G913 PolarHBondContact OD1-N 3.19Å
912	S	32.2	Very low	30.2	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	83%	0.83	S	S	*	*			trans	-131.9	50.3	-178.3	45.6	0	0	0	0	110.5	V914	S912-V914 VanDerWaalsContact C-N 3.31Å; S912-V914 PolarHBondContact O-N 3.25Å
913	G	28	Very low	30.3	Very low	66 Å²	66	128.5 Å²	128.5	68%	0.68	83%	0.828	S	S	*	*			trans	-60.2	80.1	177.1	0	0	0	0	0	114.6	D911 E915	D911-G913 PolarHBondContact OD1-N 3.19Å; G913-E915 PolarHBondContact O-N 3.07Å
914	V	30.9	Very low	30.2	Very low	123 Å²	123	126.3 Å²	126.3	75%	0.745	83%	0.826	S	S	*	*			trans	-92.7	84.7	164.7	-178.7	0	0	0	0	108.4	S912 L916	S912-V914 VanDerWaalsContact C-N 3.31Å; S912-V914 PolarHBondContact O-N 3.25Å; V914-L916 PolarHBondContact O-N 2.87Å
915	E	31.3	Very low	30.3	Very low	187 Å²	187	129.8 Å²	129.8	87%	0.874	83%	0.83	S	S	*	*			trans	-80.6	107.6	172.4	-69	-155.5	146.3	0	0	111	G913 S917	G913-E915 PolarHBondContact O-N 3.07Å; E915-S917 PolarHBondContact O-N 3.47Å
916	L	29.9	Very low	30.3	Very low	157 Å²	157	127.9 Å²	127.9	82%	0.822	83%	0.829	S	S	*	*			trans	-76.5	111.7	169.1	-74.3	167.2	0	0	0	109.7	V914	V914-L916 PolarHBondContact O-N 2.87Å
917	S	29.4	Very low	30.5	Very low	123 Å²	123	125.4 Å²	125.4	86%	0.86	83%	0.827	S	S	*	*			trans	-66.9	133	179.6	-40.3	0	0	0	0	112.5	E915	E915-S917 PolarHBondContact O-N 3.47Å
918	T	33.9	Very low	30.4	Very low	130 Å²	130	127.8 Å²	127.8	80%	0.798	84%	0.84	S	S	*	*			trans	-142.7	128.3	166.6	57.4	0	0	0	0	112.6
919	A	33.2	Very low	30.5	Very low	182 Å²	182	133.3 Å²	133.3	100%	1.504	85%	0.853	S	S	*	*			trans	61.4	0	163.5	0	0	0	0	0	117.5

Retrieved 919 of 919 residues in 315.2 ms (Link to these results)

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