A0A087XB16_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087XB16, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,130 aa.

						>A0A087XB16_POEFO|A0A087XB16
MRINLWSISPSLCLLLCALLFLSPCAHSHPQPCQVLKRIGHTVRVGALHVQPRLVATAPGSSSEDAEGALPRDQPLELGKPAKTGAGALGYGNLRTRAATNNQRGTSRSKSQARQRDGNPSKEDGVFSPRESVLLAAEALNRAMLLPYNLSLEIVMAVGSALGELPAFSYSSTGIPEDEDPLSFLESVCHTVVVQGVSAMLAFPRNRDELVKLEFVSLALQVPVVSVVQREFPRHSENRLHFQMAMRTVAAPPSQLLYYLLMMNGWWDFSIVLCQEWKINDFLFLIKNNSRFHLGTLVNLTTNSSSKSDQQQGLMRQLEALREHSSTRGVVTFGCDIREVRRLWTLATRMTLPEFHWVLGDSQNVAELRTDGLPLGLLAHGMMGSPSLDHYVQDSLEFVARAVGSAAQENPTMALIPGTTNCMDAQQSNGSSGEFLARFLANTSFEGQSGFISKESQSQNIISEAHHYIWSLQLDPLGQPTWTRLGRWRRGRVLMDQGAWPSHQGSGSGGDWRRSARLHMRVVTLVEHPFVFTREVDGDGMCPAGQLCLDPLTNETSVLKGLFQKLAGHNGSVPTELKKCCYGYCIDLLEKLAEDIGFTFDLYIVGDGKYGGYKNGRWTGLVGDLLSGAAHLAVTSFSINSARSQVIDFTSPFFSTSLGILVRTRDTAAPIGAFMWPLHWSMWLGIFVSLHVTAVFLTLYEWHSPFGMTPRGRNRNRVFSFSSALNVCYAILFGRTVAIKPPKCWTGRLLMNLWAIFCLFCLSTYTANLAAVMVGEKTYEQLSGIHDPKLHHPSQGFRFATVRESSAEDYVKKSFPEMHEYMRRYNVPATPDGIHHLKADPQKLDAFIMDKALLDYEVSIDADCKTLTVGKPFAIEGYGIGLPQNSPLTSNFSELVSQYKSDGFMDMLHDKWYKVVPCGKRSFAVTETLQMGIKHFSGLFVMLCVGVALSLLTTIAEHIVYKLVIPRVKEPRSKYWLHTSQRLHRALNSVFIDDKLPSVTKPEKRCNEGNNQSASWNPAESSHCNRRRFLPQDIQNDLEHPSSQDLPPPPPPSPRPHPHTLPLLEKHMPIVTTSNGRSDLTLGQVGQNPLVQELSELEGQITAIKLQLQSAMRRKRELERYQTENQQTNQ
					

Structure Viewer

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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	33.6	Very low	34.7	Very low	240 Å²	240	157.8 Å²	157.8	100%	1.182	81%	0.807	S	S	*	*				0	156.3	0	-83	160.7	153.2	0	0	109.6
2	R	32.3	Very low	35.5	Very low	245 Å²	245	155.8 Å²	155.8	93%	0.925	80%	0.798	S	S	*	*			trans	-83.1	138.7	161.7	-72.7	-179.6	175.6	169.7	-1.7	108.1
3	I	31.7	Very low	35.6	Very low	146 Å²	146	150.9 Å²	150.9	75%	0.749	79%	0.785	S	S	*	*			trans	-111.7	120.1	170.7	-67.2	164.3	0	0	0	107.4	L5	I3-L5 HydrophobicContact CG2-CD1 4.32Å
4	N	28.1	Very low	36	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	78%	0.779	S	S	*	*			trans	-89.3	123.9	164.1	-74.3	-1.9	0	0	0	107.8
5	L	34.1	Very low	36.4	Very low	145 Å²	145	148.3 Å²	148.3	76%	0.759	77%	0.772	S	S	*	*			trans	-67.9	167.5	151.5	-94.6	61.4	0	0	0	108.9	I3	I3-L5 HydrophobicContact CG2-CD1 4.32Å
6	W	35.4	Very low	36.6	Very low	260 Å²	260	146.6 Å²	146.6	99%	0.985	76%	0.763	S	S	*	*			trans	90.3	59	-170.3	-65.9	71.1	0	0	0	116.2
7	S	34.7	Very low	36.4	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	75%	0.753	S	S	*	*			trans	-159.7	115.8	139.6	-173.4	0	0	0	0	110
8	I	33.3	Very low	36.5	Very low	168 Å²	168	139.2 Å²	139.2	86%	0.862	74%	0.744	S	S	*	*			trans	-134.6	121.4	166.6	-61.6	-178.9	0	0	0	106.5
9	S	36.7	Very low	36.6	Very low	75 Å²	75	139.4 Å²	139.4	52%	0.524	74%	0.744	S	S	.	*			trans	-92.3	151.8	-173.8	-171.7	0	0	0	0	111.6	S11	S9-S11 PolarHBondContact O-N 3.26Å
10	P	40.5	Very low	36.5	Very low	109 Å²	109	139.6 Å²	139.6	71%	0.708	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-13	-175.6	-23.8	35.2	0	0	0	116.1	L12 C13	P10-L12 PolarHBondContact O-N 3.33Å; P10-L12 VanDerWaalsContact O-N 3.08Å; P10-C13 PolarHBondContact O-N 2.81Å; P10-C13 VanDerWaalsContact O-N 3.15Å
11	S	41.2	Very low	36.4	Very low	82 Å²	82	142 Å²	142	57%	0.573	75%	0.749	S	S	*	*	H	α-helix	trans	-55.6	-28.6	-170.9	-49.6	0	0	0	0	115	S9 C13	S9-S11 PolarHBondContact O-N 3.26Å; S11-C13 VanDerWaalsContact C-N 3.3Å; S11-C13 PolarHBondContact O-N 3.46Å
12	L	44	Very low	36.2	Very low	134 Å²	134	138.3 Å²	138.3	70%	0.702	73%	0.733	S	S	*	*	H	α-helix	trans	-69.5	-26.5	-177.7	-155.7	74.4	0	0	0	113	P10	P10-L12 PolarHBondContact O-N 3.33Å; P10-L12 VanDerWaalsContact O-N 3.08Å
13	C	37.3	Very low	36.3	Very low	92 Å²	92	131.8 Å²	131.8	62%	0.622	73%	0.725	S	S	*	*	H	α-helix	trans	-75.1	-36	-177.3	-157.2	0	0	0	0	112.1	P10 S11 L15 L16	P10-C13 PolarHBondContact O-N 2.81Å; P10-C13 VanDerWaalsContact O-N 3.15Å; S11-C13 VanDerWaalsContact C-N 3.3Å; S11-C13 PolarHBondContact O-N 3.46Å; C13-L15 PolarHBondContact O-N 3.37Å; C13-L16 PolarHBondContact O-N 3.09Å
14	L	41.6	Very low	36.4	Very low	135 Å²	135	131 Å²	131	71%	0.707	73%	0.73	S	S	*	*	H	α-helix	trans	-67.5	-32.5	178.9	-85.2	158.8	0	0	0	113.1	L16 C17	L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.47Å; L14-C17 PolarHBondContact O-N 3.36Å
15	L	41.4	Very low	36.4	Very low	128 Å²	128	128.7 Å²	128.7	67%	0.67	72%	0.724	S	S	*	*	H	α-helix	trans	-66.2	-35.5	179.2	-132.8	80	0	0	0	112.4	C13	C13-L15 PolarHBondContact O-N 3.37Å
16	L	39.4	Very low	36.3	Very low	121 Å²	121	126.7 Å²	126.7	63%	0.634	73%	0.729	S	S	*	*	H	α-helix	trans	-72.3	-30.9	-179.6	-87.9	153.3	0	0	0	113.2	C13 L14	C13-L16 PolarHBondContact O-N 3.09Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.47Å
17	C	34.5	Very low	36.3	Very low	86 Å²	86	122.6 Å²	122.6	58%	0.581	72%	0.72	S	S	*	*	H	α-helix	trans	-74.6	-24.5	176.8	-67.9	0	0	0	0	113.6	L14 L19	L14-C17 PolarHBondContact O-N 3.36Å; C17-L19 VanDerWaalsContact C-N 3.32Å; C17-L19 PolarHBondContact O-N 3.48Å
18	A	38.1	Very low	36.3	Very low	73 Å²	73	122.5 Å²	122.5	60%	0.603	72%	0.72	S	S	*	*	H	α-helix	trans	-71.9	-23.8	-178.4	0	0	0	0	0	113.8	L20	A18-L20 VanDerWaalsContact C-N 3.34Å; A18-L20 PolarHBondContact O-N 3.15Å
19	L	38.2	Very low	36.6	Very low	143 Å²	143	120 Å²	120	75%	0.749	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-0.4	-173.6	-73.8	166.2	0	0	0	114.9	C17	C17-L19 VanDerWaalsContact C-N 3.32Å; C17-L19 PolarHBondContact O-N 3.48Å
20	L	33.9	Very low	37.1	Very low	144 Å²	144	120.5 Å²	120.5	75%	0.754	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	3.1	-174.3	-69	173.2	0	0	0	115	A18	A18-L20 VanDerWaalsContact C-N 3.34Å; A18-L20 PolarHBondContact O-N 3.15Å
21	F	34.7	Very low	37.7	Very low	191 Å²	191	122 Å²	122	84%	0.838	70%	0.703	S	S	*	*			trans	-128.9	45.8	-176.2	-77.3	-73.8	0	0	0	114.1
22	L	29.9	Very low	38.6	Very low	161 Å²	161	119.8 Å²	119.8	84%	0.843	69%	0.687	S	S	*	*			trans	-125.1	114.1	167.2	-79.7	169.4	0	0	0	111.1
23	S	33.5	Very low	39.7	Very low	108 Å²	108	116.2 Å²	116.2	76%	0.755	67%	0.672	S	S	*	*			trans	-66.8	146	174.2	-58.4	0	0	0	0	111.3	C25	S23-C25 PolarHBondContact O-N 2.54Å
24	P	34.7	Very low	41.5	Very low	130 Å²	130	118.4 Å²	118.4	84%	0.844	67%	0.673	S	S	*	*			trans	-72.9	101.9	-178	29.1	-34.6	0	0	0	111.7	A26	P24-A26 PolarHBondContact O-N 3.16Å
25	C	28.5	Very low	43.2	Very low	103 Å²	103	112.4 Å²	112.4	70%	0.696	64%	0.642	S	S	*	*			trans	-62.3	114.3	160.3	-71.3	0	0	0	0	108.9	S23 H27	S23-C25 PolarHBondContact O-N 2.54Å; C25-H27 PolarHBondContact O-N 3.44Å; C25-H27 PolarHBondContact O-ND1 2.91Å
26	A	31.3	Very low	45	Very low	103 Å²	103	107.2 Å²	107.2	85%	0.851	62%	0.615	S	S	*	*			trans	-61.9	106.1	176.7	0	0	0	0	0	109.9	P24 S28	P24-A26 PolarHBondContact O-N 3.16Å; A26-S28 PolarHBondContact O-N 3.24Å
27	H	34.1	Very low	46.7	Very low	174 Å²	174	110.3 Å²	110.3	81%	0.806	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-68.3	127.7	176.6	-74.9	50.4	0	0	0	109	C25 H29	C25-H27 PolarHBondContact O-N 3.44Å; C25-H27 PolarHBondContact O-ND1 2.91Å; H27-H29 PolarHBondContact O-N 3.22Å
28	S	34.9	Very low	48.8	Very low	113 Å²	113	115.3 Å²	115.3	79%	0.79	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-62.8	125.6	-179.4	26.2	0	0	0	0	110.8	A26	A26-S28 PolarHBondContact O-N 3.24Å
29	H	39.4	Very low	50.8	Low	116 Å²	116	113 Å²	113	54%	0.537	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-53.5	146.2	173.4	-156.2	-81.9	0	0	0	110.3	H27 Q31 C33	H27-H29 PolarHBondContact O-N 3.22Å; H29-Q31 PolarHBondContact O-N 2.87Å; H29-Q31 VanDerWaalsContact O-N 3.1Å; H29-C33 PolarHBondContact CE1-SG 3.1Å
30	P	48.2	Very low	52.7	Low	85 Å²	85	108.9 Å²	108.9	55%	0.552	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-47.9	122.1	176.7	15.2	-31	0	0	0	111.7	P32 C33	P30-P32 VanDerWaalsContact O-N 3.17Å; P30-C33 PolarHBondContact O-N 2.95Å; P30-C33 VanDerWaalsContact O-N 3.13Å
31	Q	53.8	Low	55	Low	141 Å²	141	106.4 Å²	106.4	66%	0.659	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.4	-40.4	-167.4	-71	-176.1	-21	0	0	116.5	H29 C33 Q34	H29-Q31 PolarHBondContact O-N 2.87Å; H29-Q31 VanDerWaalsContact O-N 3.1Å; Q31-C33 PolarHBondContact O-N 3.33Å; Q31-C33 VanDerWaalsContact O-N 3.09Å; Q31-Q34 PolarHBondContact O-N 3.01Å; Q31-Q34 VanDerWaalsContact O-N 3.13Å
32	P	59.6	Low	57.6	Low	35 Å²	35	99 Å²	99	23%	0.227	55%	0.554	C	S	.	*	H	α-helix	trans	-54.9	-31.4	179.6	17.8	-32.7	0	0	0	113.9	P30 Q34 V35 L36 Y148	P30-P32 VanDerWaalsContact O-N 3.17Å; P32-Q34 VanDerWaalsContact C-N 3.27Å; P32-Q34 PolarHBondContact O-N 3.2Å; P32-V35 PolarHBondContact O-N 3.14Å; P32-V35 VanDerWaalsContact O-N 3.16Å; P32-L36 HydrophobicContact CB-CD1 4.44Å; P32-L36 WeakPolarHBondContact O-CB 3.38Å; P32-L36 WeakPolarHBondContact O-CG 3.15Å; P32-L36 PolarHBondContact O-N 3.06Å; P32-Y148 HydrophobicContact CB-CD1 4.46Å; P32-Y148 HydrophobicContact CB-CE1 4.18Å; P32-Y148 HydrophobicContact CG-CE1 4.45Å
33	C	66	Low	60.5	Low	58 Å²	58	91.6 Å²	91.6	39%	0.392	52%	0.516	S	S	.	.	H	α-helix	trans	-62.5	-30.4	-178.8	-61	0	0	0	0	113.8	H29 P30 Q31 K37	H29-C33 PolarHBondContact CE1-SG 3.1Å; P30-C33 PolarHBondContact O-N 2.95Å; P30-C33 VanDerWaalsContact O-N 3.13Å; Q31-C33 PolarHBondContact O-N 3.33Å; Q31-C33 VanDerWaalsContact O-N 3.09Å; C33-K37 PolarHBondContact O-N 3.4Å
34	Q	76.1	Confident	63.3	Low	139 Å²	139	89.5 Å²	89.5	65%	0.65	49%	0.491	S	S	*	.	H	α-helix	trans	-78.9	-36.4	176.1	-66.8	-172.3	-7	0	0	111.9	Q31 P32 R38	Q31-Q34 PolarHBondContact O-N 3.01Å; Q31-Q34 VanDerWaalsContact O-N 3.13Å; P32-Q34 VanDerWaalsContact C-N 3.27Å; P32-Q34 PolarHBondContact O-N 3.2Å; Q34-R38 PolarHBondContact O-N 3.29Å
35	V	77.8	Confident	66	Low	9 Å²	9	83.4 Å²	83.4	6%	0.055	45%	0.451	C	S	.	.	H	α-helix	trans	-67.1	-47.8	176.7	-175.1	0	0	0	0	110.7	P32 K37 R38 I39 T412 L415 I416	P32-V35 PolarHBondContact O-N 3.14Å; P32-V35 VanDerWaalsContact O-N 3.16Å; V35-K37 VanDerWaalsContact C-N 3.28Å; V35-K37 PolarHBondContact O-N 3.13Å; V35-R38 WeakPolarHBondContact O-CA 3.23Å; V35-R38 WeakPolarHBondContact O-CB 3.31Å; V35-R38 PolarHBondContact O-N 3.41Å; V35-I39 PolarHBondContact O-N 3.44Å; V35-I39 VanDerWaalsContact O-N 3.15Å; V35-T412 HydrophobicContact CG2-CG2 3.76Å; V35-L415 HydrophobicContact CG1-CB 4.02Å; V35-L415 HydrophobicContact CG1-CD1 4.1Å; V35-I416 HydrophobicContact CG1-CG1 4.23Å
36	L	78.4	Confident	69	Low	19 Å²	19	78.5 Å²	78.5	10%	0.099	42%	0.418	C	S	.	.	H	α-helix	trans	-57.3	-39.6	177.8	-68.1	169.7	0	0	0	112.3	P32 R38 I39 G40 H41 L150	P32-L36 HydrophobicContact CB-CD1 4.44Å; P32-L36 WeakPolarHBondContact O-CB 3.38Å; P32-L36 WeakPolarHBondContact O-CG 3.15Å; P32-L36 PolarHBondContact O-N 3.06Å; L36-R38 VanDerWaalsContact C-N 3.28Å; L36-R38 PolarHBondContact O-N 2.8Å; L36-I39 HydrophobicContact CD2-CD1 4.46Å; L36-I39 PolarHBondContact O-N 3.42Å; L36-G40 PolarHBondContact O-N 2.92Å; L36-G40 VanDerWaalsContact O-N 3.14Å; L36-H41 PolarHBondContact O-N 2.72Å; L36-L150 HydrophobicContact CD2-CD2 3.63Å; L36-L150 HydrophobicContact CD2-CG 4.26Å
37	K	75.9	Confident	71.8	Confident	186 Å²	186	73.6 Å²	73.6	81%	0.809	38%	0.378	S	S	*	.	H	α-helix	trans	-64.6	-29.4	174.2	-175.2	176.8	177.5	-176.8	0	113	C33 V35	C33-K37 PolarHBondContact O-N 3.4Å; V35-K37 VanDerWaalsContact C-N 3.28Å; V35-K37 PolarHBondContact O-N 3.13Å
38	R	78.9	Confident	74.4	Confident	190 Å²	190	65.3 Å²	65.3	72%	0.717	34%	0.34	S	S	*	.	H	α-helix	trans	-80.2	-31.3	-179.6	-163.9	177.1	-172.1	179.9	1.4	113	Q34 V35 L36	Q34-R38 PolarHBondContact O-N 3.29Å; V35-R38 WeakPolarHBondContact O-CA 3.23Å; V35-R38 WeakPolarHBondContact O-CB 3.31Å; V35-R38 PolarHBondContact O-N 3.41Å; L36-R38 VanDerWaalsContact C-N 3.28Å; L36-R38 PolarHBondContact O-N 2.8Å
39	I	78.7	Confident	76.6	Confident	26 Å²	26	61.3 Å²	61.3	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-101.1	0.4	-176.5	70.7	-174.3	0	0	0	114	V35 L36 H41 T42 L150 L415	V35-I39 PolarHBondContact O-N 3.44Å; V35-I39 VanDerWaalsContact O-N 3.15Å; L36-I39 HydrophobicContact CD2-CD1 4.46Å; L36-I39 PolarHBondContact O-N 3.42Å; I39-H41 PolarHBondContact O-N 3.08Å; I39-T42 PolarHBondContact O-N 3.01Å; I39-L150 HydrophobicContact CD1-CD2 3.9Å; I39-L415 HydrophobicContact CD1-CB 3.81Å; I39-L415 HydrophobicContact CD1-CD1 3.83Å; I39-L415 HydrophobicContact CD1-CG 4.28Å; I39-L415 WeakPolarHBondContact CG2-O 3.28Å
40	G	78.3	Confident	78.4	Confident	56 Å²	56	56.8 Å²	56.8	58%	0.577	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	21.6	176	0	0	0	0	0	115.1	L36 T42	L36-G40 PolarHBondContact O-N 2.92Å; L36-G40 VanDerWaalsContact O-N 3.14Å; G40-T42 VanDerWaalsContact C-N 3.25Å; G40-T42 PolarHBondContact O-N 3.41Å
41	H	83.2	Confident	79.6	Confident	91 Å²	91	56.4 Å²	56.4	42%	0.421	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	15.2	-171.3	-66.8	-102.1	0	0	0	116.4	L36 I39 L150 S151	L36-H41 PolarHBondContact O-N 2.72Å; I39-H41 PolarHBondContact O-N 3.08Å; H41-L150 HydrophobicContact CB-CD2 4.37Å; H41-L150 WeakPolarHBondContact O-CA 3.43Å; H41-L150 WeakPolarHBondContact O-CD2 3.37Å; H41-S151 PolarHBondContact O-N 2.03Å; H41-S151 VanDerWaalsContact O-N 3.15Å
42	T	88.3	Confident	80.4	Confident	37 Å²	37	54.1 Å²	54.1	23%	0.227	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	152.3	173.3	68	0	0	0	0	112.7	I39 G40 S151 E153	I39-T42 PolarHBondContact O-N 3.01Å; G40-T42 VanDerWaalsContact C-N 3.25Å; G40-T42 PolarHBondContact O-N 3.41Å; T42-S151 CarbonylContact C-O 3.57Å; T42-S151 WeakPolarHBondContact CA-O 3.44Å; T42-E153 PolarHBondContact OG1-OE2 2.98Å
43	V	90.9	Very high	81	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.2	169.7	172.8	0	0	0	0	107.7	L146 L150 S151 L152 E153 V403 L415	V43-L146 HydrophobicContact CB-CD1 4Å; V43-L146 HydrophobicContact CG2-CD1 4.02Å; V43-L150 HydrophobicContact CG2-CB 4.28Å; V43-L150 HydrophobicContact CG2-CD1 3.91Å; V43-S151 PolarHBondContact N-O 3.06Å; V43-L152 WeakPolarHBondContact O-CA 3.02Å; V43-E153 PolarHBondContact O-N 3.5Å; V43-V403 HydrophobicContact CG1-CG1 3.98Å; V43-L415 HydrophobicContact CG2-CD2 3.97Å
44	R	91.9	Very high	80.8	Confident	63 Å²	63	58.4 Å²	58.4	24%	0.238	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.1	-170.7	-71.3	171	170.9	-159.3	-17	111.7	E153 V155 Q195 V197 S198	R44-E153 WeakPolarHBondContact CA-O 3.36Å; R44-E153 HydrophobicContact CG-CB 4.11Å; R44-E153 HydrophobicContact CG-CG 4.36Å; R44-E153 WeakPolarHBondContact CG-OE2 3.37Å; R44-E153 IonicContact CZ-OE2 3.57Å; R44-E153 IonicContact NE-OE2 2.66Å; R44-E153 PolarHBondContact NE-OE2 2.97Å; R44-E153 IonicContact NH2-OE1 3.9Å; R44-E153 PolarHBondContact NH2-OE1 3.27Å; R44-E153 IonicContact NH2-OE2 3.35Å; R44-E153 PolarHBondContact NH2-OE2 2.87Å; R44-E153 VanDerWaalsContact NH2-OE2 3.08Å; R44-V155 HydrophobicContact CB-CG2 4.24Å; R44-V155 HydrophobicContact CG-CG2 4.32Å; R44-Q195 WeakPolarHBondContact CD-O 3.38Å; R44-Q195 PolarHBondContact NH1-O 3.25Å; R44-V197 HydrophobicContact CB-CG1 4.07Å; R44-V197 CarbonylContact O-C 3.32Å; R44-V197 WeakPolarHBondContact O-CA 3.11Å; R44-S198 PolarHBondContact O-N 2.91Å
45	V	92.8	Very high	80.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.4	175.3	-177.2	0	0	0	0	109.1	L152 E153 I154 V155 A199 L396 V399	V45-L152 HydrophobicContact CG2-CD1 4.16Å; V45-L152 HydrophobicContact CG2-CD2 4.37Å; V45-L152 HydrophobicContact CG2-CG 4.21Å; V45-E153 PolarHBondContact N-O 3.38Å; V45-I154 HydrophobicContact CB-CD1 4.24Å; V45-I154 WeakPolarHBondContact O-CA 3.14Å; V45-V155 PolarHBondContact O-N 2.64Å; V45-A199 WeakPolarHBondContact CA-O 3.28Å; V45-L396 HydrophobicContact CB-CD1 4.32Å; V45-L396 HydrophobicContact CG1-CD1 3.99Å; V45-L396 HydrophobicContact CG2-CD1 4.36Å; V45-V399 HydrophobicContact CG1-CG1 4.43Å; V45-V399 HydrophobicContact CG2-CG1 4Å
46	G	91.1	Very high	78.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	145.6	176	0	0	0	0	0	111.8	V155 A199 M200 L201	G46-V155 CarbonylContact C-O 3.46Å; G46-V155 VanDerWaalsContact CA-O 3.28Å; G46-V155 WeakPolarHBondContact CA-O 3.33Å; G46-A199 PolarHBondContact N-O 3.41Å; G46-M200 CarbonylContact O-C 3.56Å; G46-M200 WeakPolarHBondContact O-CA 3.35Å; G46-L201 PolarHBondContact O-N 2.92Å
47	A	90.2	Very high	76.6	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.008	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	117.3	176.9	0	0	0	0	0	111.3	V50 V133 I154 V155 M156 A157 L201	A47-V50 HydrophobicContact CB-CG1 3.93Å; A47-V133 HydrophobicContact CB-CG1 4.44Å; A47-I154 HydrophobicContact CB-CG2 3.79Å; A47-V155 PolarHBondContact N-O 3.43Å; A47-M156 HydrophobicContact CB-CG 3.9Å; A47-M156 WeakPolarHBondContact O-CA 3.26Å; A47-A157 PolarHBondContact O-N 3.45Å; A47-L201 WeakPolarHBondContact CA-O 3.33Å
48	L	88.2	Confident	74.4	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.9	-170.8	-53.1	-177.6	0	0	0	112.1	V50 A157 F184 V188 V192 M200 L201 A202 F203 L213	L48-V50 VanDerWaalsContact C-N 3.26Å; L48-V50 PolarHBondContact O-N 3.02Å; L48-A157 HydrophobicContact CD2-CB 3.59Å; L48-F184 HydrophobicContact CD1-CZ 4.4Å; L48-V188 HydrophobicContact CD1-CG2 4.26Å; L48-V188 HydrophobicContact CD2-CG2 3.88Å; L48-V192 HydrophobicContact CD2-CG2 4.04Å; L48-M200 HydrophobicContact CD1-CB 4.47Å; L48-M200 HydrophobicContact CD1-SD 3.85Å; L48-L201 PolarHBondContact N-O 2.91Å; L48-A202 HydrophobicContact CB-CB 4.02Å; L48-A202 WeakPolarHBondContact O-CA 3.39Å; L48-F203 PolarHBondContact O-N 3.39Å; L48-L213 HydrophobicContact CB-CD2 4.32Å; L48-L213 HydrophobicContact CD1-CD2 3.51Å
49	H	81.9	Confident	72	Confident	29 Å²	29	54.7 Å²	54.7	13%	0.134	34%	0.335	C	S	.	.	S	Bend	trans	55.6	34.4	-178.2	-56.2	-97.5	0	0	0	114.2	Q51 F184 E209	H49-Q51 PolarHBondContact O-N 2.85Å; H49-F184 AromaticContact CE1-CE2 3.79Å; H49-F184 AromaticContact NE2-CE2 3.28Å; H49-F184 VanDerWaalsContact NE2-CE2 3.28Å; H49-F184 WeakPolarHBondContact NE2-CE2 3.31Å; H49-F184 AromaticContact NE2-CZ 3.39Å; H49-F184 WeakPolarHBondContact NE2-CZ 3.24Å; H49-E209 IonicContact CE1-OE2 3.19Å; H49-E209 IonicContact CG-OE2 2.7Å; H49-E209 IonicContact ND1-OE1 3.21Å; H49-E209 IonicContact ND1-OE2 3.4Å; H49-E209 PolarHBondContact ND1-OE2 3.19Å; H49-E209 VanDerWaalsContact ND1-OE2 3.17Å
50	V	76.2	Confident	69.9	Low	21 Å²	21	57.5 Å²	57.5	13%	0.127	37%	0.371	C	S	.	.			trans	-76.4	21.1	-171.7	-60.6	0	0	0	0	115.4	A47 L48 R130 M156 F203	A47-V50 HydrophobicContact CB-CG1 3.93Å; L48-V50 VanDerWaalsContact C-N 3.26Å; L48-V50 PolarHBondContact O-N 3.02Å; V50-R130 HydrophobicContact CB-CB 4.05Å; V50-R130 HydrophobicContact CG2-CB 4.31Å; V50-R130 WeakPolarHBondContact O-CB 3.46Å; V50-R130 PolarHBondContact O-N 3.1Å; V50-M156 HydrophobicContact CG2-CG 4.39Å; V50-F203 HydrophobicContact CG1-CD2 4.29Å; V50-F203 HydrophobicContact CG1-CE2 4.36Å
51	Q	73.7	Confident	67.4	Low	77 Å²	77	60.3 Å²	60.3	36%	0.36	38%	0.381	S	S	.	.			trans	-75.3	139.8	-177	-71.2	172	-1.9	0	0	112.2	H49 P129 D178	H49-Q51 PolarHBondContact O-N 2.85Å; Q51-P129 WeakPolarHBondContact O-CD 3.19Å; Q51-P129 WeakPolarHBondContact O-CG 3.22Å; Q51-D178 PolarHBondContact NE2-OD2 3.37Å
52	P	71	Confident	64.7	Low	92 Å²	92	61.2 Å²	61.2	60%	0.597	40%	0.398	S	S	*	.			trans	-68.4	142.1	177.4	29.6	-34.8	0	0	0	111.5	V126 F127	P52-V126 HydrophobicContact CB-CG1 4.41Å; P52-F127 CarbonylContact C-O 3.56Å; P52-F127 WeakPolarHBondContact CA-O 3.4Å
53	R	71.3	Confident	61.8	Low	40 Å²	40	64.6 Å²	64.6	15%	0.151	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	142.3	-177.1	61.8	-175.7	179.2	-154.6	-2.8	112.8	F127 F203	R53-F127 HydrophobicContact CG-CB 4.48Å; R53-F127 HydrophobicContact CG-CD1 4.25Å; R53-F127 PolarHBondContact N-O 3.1Å; R53-F127 PolarHBondContact O-N 2.87Å; R53-F203 PolarHBondContact NH1-O 3.34Å
54	L	62	Low	58.8	Low	144 Å²	144	71.5 Å²	71.5	75%	0.754	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.1	167	-81.4	157.9	0	0	0	110.2	G125 V126	L54-G125 CarbonylContact C-O 3.5Å; L54-G125 WeakPolarHBondContact CA-O 3.31Å; L54-V126 HydrophobicContact CD2-CG2 3.75Å; L54-V126 HydrophobicContact CG-CG2 4.25Å
55	V	60.6	Low	55.7	Low	34 Å²	34	76.6 Å²	76.6	21%	0.206	49%	0.487	C	S	.	.			trans	-119.5	114.3	179.4	-174.6	0	0	0	0	108.9	T57 G125 F127 L388	V55-T57 PolarHBondContact O-N 2.84Å; V55-G125 PolarHBondContact N-O 3.15Å; V55-F127 HydrophobicContact CG2-CB 3.61Å; V55-L388 HydrophobicContact CG1-CD1 4.34Å; V55-L388 HydrophobicContact CG2-CD1 4.02Å
56	A	46.7	Very low	52.5	Low	99 Å²	99	81.4 Å²	81.4	82%	0.818	53%	0.527	S	S	*	.			trans	-72.9	116.3	175.9	0	0	0	0	0	110.4	A58	A56-A58 PolarHBondContact O-N 3.19Å
57	T	37.4	Very low	49.4	Very low	134 Å²	134	91 Å²	91	82%	0.822	57%	0.572	S	S	*	*			trans	-73.6	106.3	171.9	39.1	0	0	0	0	110	V55	V55-T57 PolarHBondContact O-N 2.84Å
58	A	29.2	Very low	46.3	Very low	77 Å²	77	94.5 Å²	94.5	64%	0.636	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-69.7	135.2	172.1	0	0	0	0	0	110.1	A56	A56-A58 PolarHBondContact O-N 3.19Å
59	P	29.1	Very low	43.3	Very low	120 Å²	120	99.1 Å²	99.1	78%	0.779	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-66.4	142.2	168	30	-33.7	0	0	0	109.4
60	G	34.3	Very low	40.6	Very low	86 Å²	86	105.9 Å²	105.9	89%	0.887	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-69.7	130.7	177.7	0	0	0	0	0	111.8
61	S	25.1	Very low	38.9	Very low	114 Å²	114	110.5 Å²	110.5	80%	0.797	71%	0.713	S	S	*	*			trans	-134.1	133.3	170.2	59.2	0	0	0	0	110.2
62	S	26.5	Very low	36.6	Very low	111 Å²	111	118.4 Å²	118.4	78%	0.776	74%	0.739	S	S	*	*			trans	-73.8	-170.2	164.6	47.1	0	0	0	0	111.1
63	S	26.9	Very low	34.5	Very low	108 Å²	108	120 Å²	120	76%	0.755	74%	0.743	S	S	*	*			trans	74.3	90.1	176.2	76.8	0	0	0	0	118.8
64	E	29.8	Very low	32.4	Very low	150 Å²	150	126.4 Å²	126.4	70%	0.701	78%	0.775	S	S	*	*				55.3	135.4	121.2	-56.4	-168	172.8	0	0	122.2	K278	E64-K278 WeakPolarHBondContact OE1-CE 3.25Å; E64-K278 IonicContact OE1-NZ 3.71Å; E64-K278 PolarHBondContact OE1-NZ 3.12Å; E64-K278 IonicContact OE2-NZ 3.45Å; E64-K278 PolarHBondContact OE2-NZ 3.24Å
65	D	26.3	Very low	31.2	Very low	169 Å²	169	124.3 Å²	124.3	90%	0.904	77%	0.769	S	S	*	*			trans	-72.4	152.6	175.6	-53.3	-86.7	0	0	0	113.9
66	A	25.6	Very low	29.5	Very low	104 Å²	104	130.3 Å²	130.3	86%	0.86	80%	0.799	S	S	*	*			trans	-138.6	149.2	165.5	0	0	0	0	0	111.2
67	E	26.3	Very low	28.5	Very low	202 Å²	202	134.2 Å²	134.2	94%	0.944	80%	0.801	S	S	*	*			trans	-67.6	164.9	-163.6	-53.9	168.6	100.9	0	0	116.5
68	G	24.3	Very low	27.9	Very low	74 Å²	74	135.3 Å²	135.3	76%	0.763	80%	0.801	S	S	*	*			trans	138.6	101.9	132.8	0	0	0	0	0	120.5
69	A	24.3	Very low	27.7	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	81%	0.808	S	S	*	*			trans	48.2	115.2	138.8	0	0	0	0	0	123.6
70	L	25.1	Very low	27.5	Very low	172 Å²	172	139.2 Å²	139.2	90%	0.901	81%	0.813	S	S	*	*			trans	51.5	147.4	133.9	-69.4	167.3	0	0	0	123
71	P	42.6	Very low	28	Very low	118 Å²	118	140.7 Å²	140.7	77%	0.766	81%	0.807	S	S	*	*			trans	-100.5	168.2	-164.2	40.4	-38.2	0	0	0	116.5
72	R	25.4	Very low	28	Very low	243 Å²	243	140.1 Å²	140.1	92%	0.917	81%	0.809	S	S	*	*			trans	-155.9	171.7	158	-130.2	174.1	-179.5	173.2	0.6	113.6
73	D	26.3	Very low	28	Very low	125 Å²	125	144.2 Å²	144.2	67%	0.668	81%	0.813	S	S	*	*			trans	-99.1	147.4	-150.3	-53.7	-93.2	0	0	0	118.4
74	Q	25.9	Very low	28	Very low	175 Å²	175	146 Å²	146	82%	0.818	82%	0.819	S	S	*	*			trans	64	168.2	143	-69.6	179.2	38.8	0	0	119.4
75	P	37.2	Very low	27.8	Very low	99 Å²	99	142.2 Å²	142.2	64%	0.643	82%	0.82	S	S	*	*				-137.7	175.2	-60.2	41.3	-25.4	0	0	0	114.4
76	L	24.7	Very low	27.9	Very low	160 Å²	160	139.8 Å²	139.8	84%	0.838	82%	0.824	S	S	*	*			trans	47.9	127.9	149.3	-72.3	163	0	0	0	122.1
77	E	25.5	Very low	28	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	82%	0.822	S	S	*	*				-169.8	161.5	121.5	-108.7	-57.5	120.8	0	0	111.1
78	L	24.9	Very low	28	Very low	157 Å²	157	133.7 Å²	133.7	82%	0.822	82%	0.816	S	S	*	*			trans	-132	106.4	-168.7	179.1	65.7	0	0	0	113.4
79	G	25.1	Very low	28.2	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	82%	0.822	S	S	*	*			trans	-123.2	132.8	178.4	0	0	0	0	0	114.2
80	K	25.4	Very low	28.4	Very low	202 Å²	202	136.4 Å²	136.4	88%	0.878	81%	0.812	S	S	*	*			trans	-124.5	177.6	-179	-123.6	-175.3	-177.6	169.6	0	111
81	P	45.8	Very low	28.6	Very low	116 Å²	116	138.8 Å²	138.8	75%	0.753	81%	0.811	S	S	*	*				-120	177.9	-115.1	41.7	-28	0	0	0	115.6
82	A	24	Very low	27.9	Very low	102 Å²	102	136.3 Å²	136.3	84%	0.843	81%	0.806	S	S	*	*			trans	-112.8	169.7	169.8	0	0	0	0	0	112.6
83	K	27.8	Very low	28.1	Very low	197 Å²	197	130.7 Å²	130.7	86%	0.857	79%	0.794	S	S	*	*			trans	-122.4	176.8	-168.2	-68.4	-178.2	177.5	177.6	0	113.3
84	T	26.7	Very low	28.2	Very low	146 Å²	146	130.7 Å²	130.7	90%	0.896	79%	0.794	S	S	*	*			trans	83.5	146.1	163.6	78.1	0	0	0	0	117.4
85	G	25.8	Very low	28.4	Very low	70 Å²	70	132 Å²	132	72%	0.722	79%	0.791	S	S	*	*			cis	174.5	167.1	-12.4	0	0	0	0	0	116.3
86	A	28	Very low	27.8	Very low	118 Å²	118	132.8 Å²	132.8	98%	0.975	79%	0.794	S	S	*	*			trans	49.5	131.5	150.3	0	0	0	0	0	122.7
87	G	26.8	Very low	28	Very low	80 Å²	80	136.8 Å²	136.8	83%	0.825	80%	0.798	S	S	*	*			trans	179.8	131.7	161.2	0	0	0	0	0	111.3
88	A	26.7	Very low	27.9	Very low	98 Å²	98	132.5 Å²	132.5	81%	0.81	79%	0.794	S	S	*	*			trans	-156.3	152.7	-175.7	0	0	0	0	0	112.8
89	L	28.1	Very low	28	Very low	172 Å²	172	129.3 Å²	129.3	90%	0.901	79%	0.79	S	S	*	*			trans	167.9	147.3	159.9	-94.5	156.3	0	0	0	108.3
90	G	28	Very low	28.1	Very low	56 Å²	56	132 Å²	132	58%	0.577	79%	0.791	S	S	*	*			cis	165.9	145.3	-11.7	0	0	0	0	0	113.2
91	Y	30.1	Very low	28.2	Very low	222 Å²	222	129 Å²	129	87%	0.871	79%	0.785	S	S	*	*			trans	62.4	155.7	172.3	-61.6	-89	0	0	0	117.2
92	G	28.6	Very low	27.3	Very low	65 Å²	65	130.2 Å²	130.2	67%	0.67	79%	0.785	S	S	*	*			cis	175.1	166.5	-3.5	0	0	0	0	0	108.1
93	N	28.5	Very low	27.6	Very low	126 Å²	126	135 Å²	135	67%	0.674	79%	0.79	S	S	*	*			cis	-167.6	143	8.9	-95.8	-18.2	0	0	0	111.1
94	L	29.7	Very low	27.5	Very low	124 Å²	124	137.6 Å²	137.6	65%	0.649	79%	0.794	S	S	*	*			trans	59.4	154.5	140.4	-79	70.3	0	0	0	120.5
95	R	28.2	Very low	27.5	Very low	204 Å²	204	134.4 Å²	134.4	77%	0.77	79%	0.791	S	S	*	*			cis	-158.9	156.5	-1.6	-134.5	177.8	-164.3	151.3	4	113.7
96	T	26.6	Very low	27.5	Very low	114 Å²	114	137.4 Å²	137.4	70%	0.699	80%	0.795	S	S	*	*			trans	29.6	133.3	148.6	46	0	0	0	0	122.2
97	R	26.8	Very low	27.4	Very low	244 Å²	244	136.8 Å²	136.8	92%	0.921	78%	0.784	S	S	*	*			cis	88.5	107.7	22.6	-163.6	-169	-169.7	-172.2	6	117.6
98	A	24.1	Very low	27.5	Very low	92 Å²	92	144.6 Å²	144.6	76%	0.76	79%	0.788	S	S	*	*			trans	-151.4	127.9	147.3	0	0	0	0	0	106.4
99	A	26.9	Very low	27.4	Very low	91 Å²	91	145.2 Å²	145.2	75%	0.752	79%	0.787	S	S	*	*				76.6	131.3	60.9	0	0	0	0	0	111.8
100	T	26.9	Very low	27.5	Very low	133 Å²	133	147.1 Å²	147.1	82%	0.816	79%	0.788	S	S	*	*			cis	-149.2	144.5	25.7	42	0	0	0	0	116.7
101	N	28.1	Very low	27.4	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	80%	0.8	S	S	*	*			trans	61.6	111.1	135.6	-147.1	22	0	0	0	124.5
102	N	27.7	Very low	27.4	Very low	141 Å²	141	148.5 Å²	148.5	75%	0.754	80%	0.8	S	S	*	*			trans	31.9	130.8	139.1	-68.2	-29.4	0	0	0	124
103	Q	28.6	Very low	27.3	Very low	202 Å²	202	150.4 Å²	150.4	94%	0.944	81%	0.81	S	S	*	*				-155.3	176	115.8	-112.8	-179	55.1	0	0	113.3
104	R	27.6	Very low	27.2	Very low	252 Å²	252	155.8 Å²	155.8	95%	0.951	82%	0.82	S	S	*	*			trans	-85.6	152.4	-166.3	-61	168.9	172.2	160.3	-5.7	113.5
105	G	25.5	Very low	27.2	Very low	80 Å²	80	159 Å²	159	83%	0.825	83%	0.832	S	S	*	*			trans	178.3	108	167.9	0	0	0	0	0	116.1
106	T	26.5	Very low	27	Very low	133 Å²	133	160.3 Å²	160.3	82%	0.816	84%	0.837	S	S	*	*			trans	-67.6	122	-171.5	44.4	0	0	0	0	118.5
107	S	26.1	Very low	27.2	Very low	105 Å²	105	162.4 Å²	162.4	73%	0.734	84%	0.844	S	S	*	*			trans	75.4	156	132.6	81.1	0	0	0	0	123.2
108	R	27.3	Very low	27	Very low	244 Å²	244	154 Å²	154	92%	0.921	83%	0.833	S	S	*	*			trans	78.1	87.7	160.4	-68.9	-175.5	166.6	-173.5	-3.3	120.8
109	S	25.2	Very low	27	Very low	110 Å²	110	156.7 Å²	156.7	77%	0.769	84%	0.835	S	S	*	*				-140.3	135.1	127.5	52.2	0	0	0	0	107.4
110	K	29.7	Very low	27.2	Very low	213 Å²	213	158.6 Å²	158.6	93%	0.926	84%	0.839	S	S	*	*				49.8	84.3	76.7	-84.8	-164.7	175.6	-173.2	0	112.9
111	S	27.8	Very low	27.1	Very low	118 Å²	118	156.3 Å²	156.3	83%	0.825	83%	0.829	S	S	*	*			trans	-102.9	124.4	161.3	43.2	0	0	0	0	110
112	Q	28.4	Very low	27.5	Very low	188 Å²	188	159.9 Å²	159.9	88%	0.879	84%	0.838	S	S	*	*			trans	-77.5	143.9	166.7	-71.3	167.8	-65.6	0	0	109.2	R114	Q112-R114 PolarHBondContact O-N 2.88Å
113	A	27	Very low	27.8	Very low	106 Å²	106	161.4 Å²	161.4	88%	0.876	84%	0.841	S	S	*	*			trans	-66.9	114.2	167.9	0	0	0	0	0	109.4
114	R	26.1	Very low	28.3	Very low	238 Å²	238	158.9 Å²	158.9	90%	0.898	83%	0.833	S	S	*	*			trans	-97	111.8	158.4	-90.8	-174.8	168.3	177.7	-4	107.7	Q112 R116	Q112-R114 PolarHBondContact O-N 2.88Å; R114-R116 PolarHBondContact O-N 3.17Å
115	Q	29.5	Very low	29.6	Very low	191 Å²	191	148.8 Å²	148.8	89%	0.893	81%	0.808	S	S	*	*			trans	-53.1	135.1	158.5	-107.6	161.8	-57.4	0	0	108.4
116	R	25.3	Very low	31.6	Very low	232 Å²	232	148.7 Å²	148.7	88%	0.875	79%	0.791	S	S	*	*			trans	-133.9	100.4	177.3	-175.4	-177.7	-171	-176.4	2.8	107.7	R114 G118	R114-R116 PolarHBondContact O-N 3.17Å; R116-G118 PolarHBondContact O-N 3.22Å
117	D	29.1	Very low	34.2	Very low	158 Å²	158	142.7 Å²	142.7	85%	0.845	75%	0.754	S	S	*	*			trans	-58.8	135.6	168.3	-58.5	-65.4	0	0	0	109.5
118	G	24.4	Very low	37	Very low	67 Å²	67	139 Å²	139	69%	0.691	73%	0.728	S	S	*	*			trans	-148.7	141	-178.9	0	0	0	0	0	109.3	R116	R116-G118 PolarHBondContact O-N 3.22Å
119	N	22.4	Very low	39.6	Very low	149 Å²	149	127.4 Å²	127.4	80%	0.797	69%	0.685	S	S	*	*			trans	-55.9	146.7	176.5	-77	-29.6	0	0	0	110.9	S121	N119-S121 PolarHBondContact O-N 3.35Å
120	P	31.2	Very low	42.5	Very low	131 Å²	131	129.1 Å²	129.1	85%	0.851	67%	0.674	S	S	*	*			trans	-72.6	70.5	166.7	32.6	-35.1	0	0	0	110.2
121	S	25.9	Very low	45.2	Very low	85 Å²	85	124.6 Å²	124.6	59%	0.594	66%	0.656	S	S	*	*			trans	-61.1	134.1	157.1	43.1	0	0	0	0	108.3	N119 E123	N119-S121 PolarHBondContact O-N 3.35Å; S121-E123 PolarHBondContact O-N 2.75Å
122	K	36.4	Very low	48.1	Very low	215 Å²	215	119.2 Å²	119.2	94%	0.935	62%	0.619	S	S	*	*			trans	-57.1	106.8	177.7	-65.3	173.9	176.6	179	0	110.1
123	E	34.2	Very low	51	Low	173 Å²	173	110.4 Å²	110.4	81%	0.808	58%	0.577	S	S	*	*			trans	-110.7	154.5	163.7	-66.9	-169	154.2	0	0	109.1	S121	S121-E123 PolarHBondContact O-N 2.75Å
124	D	38.3	Very low	54	Low	148 Å²	148	109 Å²	109	79%	0.791	56%	0.555	S	S	*	*			trans	-68.7	145.2	-150.1	-64.4	-64.2	0	0	0	115.4	V126	D124-V126 PolarHBondContact O-N 2.85Å
125	G	54.6	Low	57.1	Low	41 Å²	41	103.2 Å²	103.2	42%	0.423	54%	0.541	S	S	.	.			trans	-73	60.6	-179.4	0	0	0	0	0	114	L54 V55	L54-G125 CarbonylContact C-O 3.5Å; L54-G125 WeakPolarHBondContact CA-O 3.31Å; V55-G125 PolarHBondContact N-O 3.15Å
126	V	68.8	Low	60	Low	77 Å²	77	94.2 Å²	94.2	47%	0.467	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.2	172.4	-177.8	0	0	0	0	109	P52 L54 D124	P52-V126 HydrophobicContact CB-CG1 4.41Å; L54-V126 HydrophobicContact CD2-CG2 3.75Å; L54-V126 HydrophobicContact CG-CG2 4.25Å; D124-V126 PolarHBondContact O-N 2.85Å
127	F	79.9	Confident	63.2	Low	7 Å²	7	83.6 Å²	83.6	3%	0.031	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.2	174.3	173.6	-112.8	0	0	0	109.6	P52 R53 V55 P129 F203 M246 L388 V392	P52-F127 CarbonylContact C-O 3.56Å; P52-F127 WeakPolarHBondContact CA-O 3.4Å; R53-F127 HydrophobicContact CG-CB 4.48Å; R53-F127 HydrophobicContact CG-CD1 4.25Å; R53-F127 PolarHBondContact N-O 3.1Å; R53-F127 PolarHBondContact O-N 2.87Å; V55-F127 HydrophobicContact CG2-CB 3.61Å; F127-P129 HydrophobicContact CD1-CB 4.44Å; F127-P129 HydrophobicContact CD1-CG 4.12Å; F127-P129 HydrophobicContact CE1-CB 3.65Å; F127-P129 HydrophobicContact CE1-CG 3.74Å; F127-P129 HydrophobicContact CZ-CB 3.84Å; F127-P129 HydrophobicContact CZ-CG 4.4Å; F127-P129 WeakPolarHBondContact O-CD 3.2Å; F127-F203 HydrophobicContact CE1-CD1 4.47Å; F127-M246 HydrophobicContact CE1-CE 4.03Å; F127-M246 HydrophobicContact CE2-CE 4.47Å; F127-M246 HydrophobicContact CZ-CE 3.75Å; F127-L388 HydrophobicContact CB-CD1 3.94Å; F127-L388 HydrophobicContact CD2-CB 3.68Å; F127-L388 HydrophobicContact CD2-CD1 3.89Å; F127-L388 HydrophobicContact CD2-CG 4.45Å; F127-L388 HydrophobicContact CE2-CB 3.77Å; F127-L388 HydrophobicContact CG-CD1 3.97Å; F127-V392 HydrophobicContact CE2-CG2 3.86Å; F127-V392 HydrophobicContact CZ-CG2 3.63Å
128	S	84.6	Confident	66.2	Low	29 Å²	29	80.8 Å²	80.8	20%	0.203	44%	0.443	C	S	.	.			trans	-111.6	78.5	-178.2	48.2	0	0	0	0	111.6	R130 E131 S132	S128-R130 PolarHBondContact O-N 3.25Å; S128-E131 WeakPolarHBondContact CB-OE2 3.5Å; S128-E131 PolarHBondContact O-N 3.18Å; S128-E131 PolarHBondContact OG-OE2 3.36Å; S128-S132 PolarHBondContact O-N 3.06Å; S128-S132 PolarHBondContact O-OG 3.15Å
129	P	83.5	Confident	69.3	Low	0 Å²	0	79.3 Å²	79.3	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-56	-28.1	-171.5	13.8	-24.6	0	0	0	114.3	Q51 F127 E131 V133 F203	Q51-P129 WeakPolarHBondContact O-CD 3.19Å; Q51-P129 WeakPolarHBondContact O-CG 3.22Å; F127-P129 HydrophobicContact CD1-CB 4.44Å; F127-P129 HydrophobicContact CD1-CG 4.12Å; F127-P129 HydrophobicContact CE1-CB 3.65Å; F127-P129 HydrophobicContact CE1-CG 3.74Å; F127-P129 HydrophobicContact CZ-CB 3.84Å; F127-P129 HydrophobicContact CZ-CG 4.4Å; F127-P129 WeakPolarHBondContact O-CD 3.2Å; P129-E131 VanDerWaalsContact C-N 3.33Å; P129-E131 PolarHBondContact O-N 2.97Å; P129-V133 WeakPolarHBondContact O-CB 3.49Å; P129-V133 VanDerWaalsContact O-CG2 3.26Å; P129-V133 WeakPolarHBondContact O-CG2 3.5Å; P129-V133 PolarHBondContact O-N 2.99Å; P129-F203 HydrophobicContact CB-CB 4.33Å; P129-F203 HydrophobicContact CB-CD1 4.07Å; P129-F203 HydrophobicContact CB-CD2 3.61Å; P129-F203 HydrophobicContact CB-CE1 4.34Å; P129-F203 HydrophobicContact CB-CE2 3.91Å; P129-F203 HydrophobicContact CB-CG 3.71Å; P129-F203 HydrophobicContact CB-CZ 4.26Å; P129-F203 HydrophobicContact CG-CB 4.41Å; P129-F203 HydrophobicContact CG-CD2 4.37Å; P129-F203 HydrophobicContact CG-CG 4.3Å
130	R	84.9	Confident	72.5	Confident	146 Å²	146	72.7 Å²	72.7	55%	0.551	39%	0.389	S	S	*	.	H	α-helix	trans	-54.3	-45.8	170	-178.8	170.9	-171.4	-159.8	1.3	113.2	V50 S128 L134 M156	V50-R130 HydrophobicContact CB-CB 4.05Å; V50-R130 HydrophobicContact CG2-CB 4.31Å; V50-R130 WeakPolarHBondContact O-CB 3.46Å; V50-R130 PolarHBondContact O-N 3.1Å; S128-R130 PolarHBondContact O-N 3.25Å; R130-L134 HydrophobicContact CG-CD1 4.35Å; R130-L134 WeakPolarHBondContact O-CD1 3.42Å; R130-L134 VanDerWaalsContact O-CG 3.28Å; R130-L134 WeakPolarHBondContact O-CG 3.38Å; R130-L134 PolarHBondContact O-N 3.35Å; R130-M156 HydrophobicContact CG-SD 3.73Å
131	E	86.6	Confident	75.4	Confident	118 Å²	118	69 Å²	69	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-78.6	-43.4	-176.2	-62.6	176.1	139.7	0	0	110	S128 P129 V133 L134 L135	S128-E131 WeakPolarHBondContact CB-OE2 3.5Å; S128-E131 PolarHBondContact O-N 3.18Å; S128-E131 PolarHBondContact OG-OE2 3.36Å; P129-E131 VanDerWaalsContact C-N 3.33Å; P129-E131 PolarHBondContact O-N 2.97Å; E131-V133 VanDerWaalsContact C-N 3.32Å; E131-V133 PolarHBondContact O-N 3.13Å; E131-L134 PolarHBondContact O-N 2.99Å; E131-L134 VanDerWaalsContact O-N 3.17Å; E131-L135 WeakPolarHBondContact O-CB 3.43Å; E131-L135 WeakPolarHBondContact O-CG 3.45Å; E131-L135 PolarHBondContact O-N 2.94Å
132	S	88.5	Confident	78.4	Confident	5 Å²	5	73.7 Å²	73.7	4%	0.035	37%	0.367	C	S	.	.	H	α-helix	trans	-53.6	-44.8	173.8	-44.4	0	0	0	0	112.5	S128 A136 D389	S128-S132 PolarHBondContact O-N 3.06Å; S128-S132 PolarHBondContact O-OG 3.15Å; S132-A136 VanDerWaalsContact O-CB 3.25Å; S132-A136 WeakPolarHBondContact O-CB 3.44Å; S132-A136 PolarHBondContact O-N 3.3Å; S132-D389 VanDerWaalsContact CB-OD1 3.23Å; S132-D389 WeakPolarHBondContact CB-OD1 3.49Å; S132-D389 PolarHBondContact OG-OD1 3.35Å
133	V	89.9	Confident	80.7	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-68.6	-39.2	178.6	171	0	0	0	0	112.3	A47 P129 E131 A137 I154 L201 F203 V392	A47-V133 HydrophobicContact CB-CG1 4.44Å; P129-V133 WeakPolarHBondContact O-CB 3.49Å; P129-V133 VanDerWaalsContact O-CG2 3.26Å; P129-V133 WeakPolarHBondContact O-CG2 3.5Å; P129-V133 PolarHBondContact O-N 2.99Å; E131-V133 VanDerWaalsContact C-N 3.32Å; E131-V133 PolarHBondContact O-N 3.13Å; V133-A137 WeakPolarHBondContact O-CB 3.46Å; V133-A137 PolarHBondContact O-N 3.36Å; V133-I154 HydrophobicContact CG1-CD1 3.73Å; V133-I154 HydrophobicContact CG1-CG1 3.93Å; V133-I154 HydrophobicContact CG1-CG2 3.85Å; V133-L201 HydrophobicContact CG2-CD2 3.88Å; V133-F203 HydrophobicContact CG2-CE2 3.62Å; V133-F203 HydrophobicContact CG2-CZ 3.46Å; V133-F203 VanDerWaalsContact CG2-CZ 3.46Å; V133-V392 HydrophobicContact CB-CG1 4.34Å; V133-V392 HydrophobicContact CG2-CG1 3.48Å; V133-V392 VanDerWaalsContact CG2-CG1 3.48Å
134	L	90.3	Very high	83.1	Confident	77 Å²	77	65 Å²	65	40%	0.403	34%	0.341	S	S	.	.	H	α-helix	trans	-69.4	-41	178.9	-70.9	170.5	0	0	0	111.8	R130 E131 A137 E138 I154 M156	R130-L134 HydrophobicContact CG-CD1 4.35Å; R130-L134 WeakPolarHBondContact O-CD1 3.42Å; R130-L134 VanDerWaalsContact O-CG 3.28Å; R130-L134 WeakPolarHBondContact O-CG 3.38Å; R130-L134 PolarHBondContact O-N 3.35Å; E131-L134 PolarHBondContact O-N 2.99Å; E131-L134 VanDerWaalsContact O-N 3.17Å; L134-A137 PolarHBondContact O-N 3.38Å; L134-E138 PolarHBondContact O-N 3.49Å; L134-I154 HydrophobicContact CD2-CB 4.39Å; L134-M156 HydrophobicContact CD1-CE 4.34Å; L134-M156 HydrophobicContact CD2-CE 4.19Å
135	L	90.2	Very high	85.2	Confident	116 Å²	116	60.4 Å²	60.4	61%	0.607	32%	0.317	S	S	*	.	H	α-helix	trans	-64.4	-43.2	174.2	-69.6	170.6	0	0	0	111.5	E131 E138 A139	E131-L135 WeakPolarHBondContact O-CB 3.43Å; E131-L135 WeakPolarHBondContact O-CG 3.45Å; E131-L135 PolarHBondContact O-N 2.94Å; L135-E138 PolarHBondContact O-N 3.38Å; L135-A139 WeakPolarHBondContact O-CB 3.41Å; L135-A139 PolarHBondContact O-N 2.96Å
136	A	91.6	Very high	86.7	Confident	3 Å²	3	59.3 Å²	59.3	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-46.5	172.9	0	0	0	0	0	111.8	S132 E138 A139 L140 Q393 L396	S132-A136 VanDerWaalsContact O-CB 3.25Å; S132-A136 WeakPolarHBondContact O-CB 3.44Å; S132-A136 PolarHBondContact O-N 3.3Å; A136-E138 VanDerWaalsContact C-N 3.32Å; A136-E138 PolarHBondContact O-N 2.99Å; A136-A139 PolarHBondContact O-N 3.41Å; A136-L140 WeakPolarHBondContact O-CB 3.28Å; A136-L140 WeakPolarHBondContact O-CG 3.45Å; A136-L140 PolarHBondContact O-N 3.36Å; A136-Q393 HydrophobicContact CB-CB 3.95Å; A136-Q393 HydrophobicContact CB-CG 4.19Å; A136-L396 HydrophobicContact CB-CD2 3.93Å
137	A	92.1	Very high	87.4	Confident	8 Å²	8	57.2 Å²	57.2	7%	0.066	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-39.6	178.2	0	0	0	0	0	112.2	V133 L134 N141 L152 I154 L396	V133-A137 WeakPolarHBondContact O-CB 3.46Å; V133-A137 PolarHBondContact O-N 3.36Å; L134-A137 PolarHBondContact O-N 3.38Å; A137-N141 WeakPolarHBondContact O-CB 3.33Å; A137-N141 PolarHBondContact O-N 3.05Å; A137-N141 PolarHBondContact O-ND2 2.9Å; A137-L152 HydrophobicContact CB-CD2 4.07Å; A137-I154 HydrophobicContact CB-CD1 4.09Å; A137-I154 HydrophobicContact CB-CG1 3.57Å; A137-L396 HydrophobicContact CB-CD2 3.96Å
138	E	91.8	Very high	87.6	Confident	99 Å²	99	61.1 Å²	61.1	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-44	174.6	-161.2	-171.4	174.1	0	0	111.9	L134 L135 A136 L140 N141 R142	L134-E138 PolarHBondContact O-N 3.49Å; L135-E138 PolarHBondContact O-N 3.38Å; A136-E138 VanDerWaalsContact C-N 3.32Å; A136-E138 PolarHBondContact O-N 2.99Å; E138-L140 PolarHBondContact O-N 3.15Å; E138-N141 PolarHBondContact O-N 3.37Å; E138-R142 VanDerWaalsContact CD-NH2 3.27Å; E138-R142 VanDerWaalsContact O-CG 3.32Å; E138-R142 WeakPolarHBondContact O-CG 3.4Å; E138-R142 PolarHBondContact O-N 3.38Å; E138-R142 IonicContact OE1-CZ 2.64Å; E138-R142 IonicContact OE1-NE 3.77Å; E138-R142 PolarHBondContact OE1-NE 3.39Å; E138-R142 IonicContact OE1-NH2 3.97Å; E138-R142 PolarHBondContact OE1-NH2 3.27Å; E138-R142 IonicContact OE2-NH2 3.17Å
139	A	89.6	Confident	87.5	Confident	37 Å²	37	66 Å²	66	31%	0.306	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-45.2	177.9	0	0	0	0	0	112.4	L135 A136 R142 A143	L135-A139 WeakPolarHBondContact O-CB 3.41Å; L135-A139 PolarHBondContact O-N 2.96Å; A136-A139 PolarHBondContact O-N 3.41Å; A139-R142 PolarHBondContact O-N 3.26Å; A139-A143 PolarHBondContact O-N 3.21Å; A139-A143 VanDerWaalsContact O-N 3.15Å
140	L	90	Very high	87.7	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-71.2	-34.6	-179.4	-62.6	171.8	0	0	0	112.5	A136 E138 A143 M144 L145 Q393 L396 E397	A136-L140 WeakPolarHBondContact O-CB 3.28Å; A136-L140 WeakPolarHBondContact O-CG 3.45Å; A136-L140 PolarHBondContact O-N 3.36Å; E138-L140 PolarHBondContact O-N 3.15Å; L140-A143 PolarHBondContact O-N 3Å; L140-M144 PolarHBondContact O-N 3.06Å; L140-L145 HydrophobicContact CD2-CD1 3.61Å; L140-Q393 HydrophobicContact CD2-CG 4.46Å; L140-L396 HydrophobicContact CD1-CB 3.9Å; L140-L396 HydrophobicContact CD1-CD2 3.89Å; L140-L396 HydrophobicContact CD1-CG 3.71Å; L140-E397 HydrophobicContact CD1-CB 4.03Å; L140-E397 HydrophobicContact CD2-CB 3.67Å; L140-E397 VanDerWaalsContact CD2-CD 3.48Å; L140-E397 HydrophobicContact CD2-CG 3.59Å; L140-E397 VanDerWaalsContact CD2-OE2 3.27Å; L140-E397 WeakPolarHBondContact CD2-OE2 3.33Å
141	N	91	Very high	88	Confident	55 Å²	55	62.1 Å²	62.1	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-40.7	171.2	-85.8	-58.1	0	0	0	112	A137 E138 A143 M144 S151 L152	A137-N141 WeakPolarHBondContact O-CB 3.33Å; A137-N141 PolarHBondContact O-N 3.05Å; A137-N141 PolarHBondContact O-ND2 2.9Å; E138-N141 PolarHBondContact O-N 3.37Å; N141-A143 PolarHBondContact O-N 3.27Å; N141-M144 PolarHBondContact O-N 2.95Å; N141-S151 VanDerWaalsContact OD1-CA 3.25Å; N141-S151 WeakPolarHBondContact OD1-CA 3.29Å; N141-S151 VanDerWaalsContact OD1-CB 3.27Å; N141-S151 WeakPolarHBondContact OD1-CB 3.05Å; N141-L152 PolarHBondContact ND2-O 3.03Å; N141-L152 PolarHBondContact OD1-N 3.5Å
142	R	89.5	Confident	88.2	Confident	182 Å²	182	57 Å²	57	69%	0.687	30%	0.299	S	S	*	.	H	α-helix	trans	-64.8	-26.7	173.9	-67.6	169.5	-177.9	-168.2	5.3	112.7	E138 A139	E138-R142 VanDerWaalsContact CD-NH2 3.27Å; E138-R142 VanDerWaalsContact O-CG 3.32Å; E138-R142 WeakPolarHBondContact O-CG 3.4Å; E138-R142 PolarHBondContact O-N 3.38Å; E138-R142 IonicContact OE1-CZ 2.64Å; E138-R142 IonicContact OE1-NE 3.77Å; E138-R142 PolarHBondContact OE1-NE 3.39Å; E138-R142 IonicContact OE1-NH2 3.97Å; E138-R142 PolarHBondContact OE1-NH2 3.27Å; E138-R142 IonicContact OE2-NH2 3.17Å; A139-R142 PolarHBondContact O-N 3.26Å
143	A	85.5	Confident	88.4	Confident	58 Å²	58	60.3 Å²	60.3	48%	0.479	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.3	178	0	0	0	0	0	114.8	A139 L140 N141 L145	A139-A143 PolarHBondContact O-N 3.21Å; A139-A143 VanDerWaalsContact O-N 3.15Å; L140-A143 PolarHBondContact O-N 3Å; N141-A143 PolarHBondContact O-N 3.27Å; A143-L145 VanDerWaalsContact C-N 3.33Å; A143-L145 HydrophobicContact CB-CD1 4.43Å; A143-L145 HydrophobicContact CB-CG 4.05Å; A143-L145 PolarHBondContact O-N 2.88Å
144	M	84.2	Confident	88.5	Confident	147 Å²	147	61.5 Å²	61.5	72%	0.724	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	41.3	176.4	-57.9	-174.3	-180	0	0	114.7	L140 N141 L146	L140-M144 PolarHBondContact O-N 3.06Å; N141-M144 PolarHBondContact O-N 2.95Å; M144-L146 VanDerWaalsContact C-N 3.31Å; M144-L146 PolarHBondContact O-N 2.97Å
145	L	82.3	Confident	88.4	Confident	53 Å²	53	58.6 Å²	58.6	28%	0.277	31%	0.305	S	S	.	.			trans	-72.3	-15.8	-174.8	-67.1	173.8	0	0	0	115.3	L140 A143 E397	L140-L145 HydrophobicContact CD2-CD1 3.61Å; A143-L145 VanDerWaalsContact C-N 3.33Å; A143-L145 HydrophobicContact CB-CD1 4.43Å; A143-L145 HydrophobicContact CB-CG 4.05Å; A143-L145 PolarHBondContact O-N 2.88Å; L145-E397 HydrophobicContact CD1-CG 3.79Å
146	L	86.5	Confident	88.1	Confident	17 Å²	17	55.3 Å²	55.3	9%	0.089	29%	0.287	C	S	.	.	S	Bend	trans	-94.5	141.1	180	-67.3	171.7	0	0	0	111.5	V43 M144 L150 L152 A400	V43-L146 HydrophobicContact CB-CD1 4Å; V43-L146 HydrophobicContact CG2-CD1 4.02Å; M144-L146 VanDerWaalsContact C-N 3.31Å; M144-L146 PolarHBondContact O-N 2.97Å; L146-L150 HydrophobicContact CB-CB 3.9Å; L146-L150 HydrophobicContact CD1-CB 4.17Å; L146-L152 HydrophobicContact CD1-CB 4.19Å; L146-A400 WeakPolarHBondContact CD2-O 3.47Å
147	P	82.9	Confident	87.2	Confident	34 Å²	34	56.2 Å²	56.2	22%	0.221	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-66.9	170.4	177	30.4	-36.3	0	0	0	112	N149 L150 A407	P147-N149 PolarHBondContact O-N 2.82Å; P147-L150 WeakPolarHBondContact O-CB 3.47Å; P147-L150 WeakPolarHBondContact O-CD1 3.46Å; P147-L150 VanDerWaalsContact O-CG 3.25Å; P147-L150 WeakPolarHBondContact O-CG 3.25Å; P147-L150 PolarHBondContact O-N 2.9Å; P147-A407 HydrophobicContact CG-CB 4.19Å
148	Y	83.9	Confident	85.7	Confident	89 Å²	89	60 Å²	60	35%	0.349	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	58.9	18.6	174.5	-44.9	-66.4	0	0	0	116.2	P32 L150	P32-Y148 HydrophobicContact CB-CD1 4.46Å; P32-Y148 HydrophobicContact CB-CE1 4.18Å; P32-Y148 HydrophobicContact CG-CE1 4.45Å; Y148-L150 VanDerWaalsContact C-N 3.31Å; Y148-L150 HydrophobicContact CD2-CD1 4.47Å
149	N	82.8	Confident	83.8	Confident	132 Å²	132	57.2 Å²	57.2	71%	0.706	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	57.1	44	-175	-165.9	86.2	0	0	0	112	P147	P147-N149 PolarHBondContact O-N 2.82Å
150	L	87.8	Confident	81.4	Confident	13 Å²	13	59.3 Å²	59.3	7%	0.068	33%	0.327	C	S	.	.			trans	-79.6	144.5	170.2	-66.6	170	0	0	0	110.8	L36 I39 H41 V43 L146 P147 Y148 L415	L36-L150 HydrophobicContact CD2-CD2 3.63Å; L36-L150 HydrophobicContact CD2-CG 4.26Å; I39-L150 HydrophobicContact CD1-CD2 3.9Å; H41-L150 HydrophobicContact CB-CD2 4.37Å; H41-L150 WeakPolarHBondContact O-CA 3.43Å; H41-L150 WeakPolarHBondContact O-CD2 3.37Å; V43-L150 HydrophobicContact CG2-CB 4.28Å; V43-L150 HydrophobicContact CG2-CD1 3.91Å; L146-L150 HydrophobicContact CB-CB 3.9Å; L146-L150 HydrophobicContact CD1-CB 4.17Å; P147-L150 WeakPolarHBondContact O-CB 3.47Å; P147-L150 WeakPolarHBondContact O-CD1 3.46Å; P147-L150 VanDerWaalsContact O-CG 3.25Å; P147-L150 WeakPolarHBondContact O-CG 3.25Å; P147-L150 PolarHBondContact O-N 2.9Å; Y148-L150 VanDerWaalsContact C-N 3.31Å; Y148-L150 HydrophobicContact CD2-CD1 4.47Å; L150-L415 HydrophobicContact CD1-CD1 4.04Å; L150-L415 HydrophobicContact CD1-CD2 3.86Å
151	S	90.3	Very high	78.9	Confident	51 Å²	51	62.9 Å²	62.9	36%	0.357	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	152.9	168.3	56.4	0	0	0	0	111.9	H41 T42 V43 N141	H41-S151 PolarHBondContact O-N 2.03Å; H41-S151 VanDerWaalsContact O-N 3.15Å; T42-S151 CarbonylContact C-O 3.57Å; T42-S151 WeakPolarHBondContact CA-O 3.44Å; V43-S151 PolarHBondContact N-O 3.06Å; N141-S151 VanDerWaalsContact OD1-CA 3.25Å; N141-S151 WeakPolarHBondContact OD1-CA 3.29Å; N141-S151 VanDerWaalsContact OD1-CB 3.27Å; N141-S151 WeakPolarHBondContact OD1-CB 3.05Å
152	L	91.8	Very high	76.1	Confident	11 Å²	11	68.9 Å²	68.9	6%	0.058	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.2	177	-169.6	152.5	0	0	0	110.2	V43 V45 A137 N141 L146 I154 L396 A400	V43-L152 WeakPolarHBondContact O-CA 3.02Å; V45-L152 HydrophobicContact CG2-CD1 4.16Å; V45-L152 HydrophobicContact CG2-CD2 4.37Å; V45-L152 HydrophobicContact CG2-CG 4.21Å; A137-L152 HydrophobicContact CB-CD2 4.07Å; N141-L152 PolarHBondContact ND2-O 3.03Å; N141-L152 PolarHBondContact OD1-N 3.5Å; L146-L152 HydrophobicContact CD1-CB 4.19Å; L152-I154 HydrophobicContact CD2-CD1 3.55Å; L152-I154 HydrophobicContact CD2-CG1 4.14Å; L152-L396 HydrophobicContact CD1-CD1 4.22Å; L152-L396 HydrophobicContact CD1-CG 4.39Å; L152-L396 HydrophobicContact CD2-CD1 4.17Å; L152-L396 HydrophobicContact CD2-CD2 4.25Å; L152-L396 HydrophobicContact CD2-CG 4.49Å; L152-A400 HydrophobicContact CD1-CB 3.94Å
153	E	92.4	Very high	73.5	Confident	73 Å²	73	63.6 Å²	63.6	34%	0.341	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.9	-179.1	-178.1	176.1	-156	0	0	109.9	T42 V43 R44 V45	T42-E153 PolarHBondContact OG1-OE2 2.98Å; V43-E153 PolarHBondContact O-N 3.5Å; R44-E153 WeakPolarHBondContact CA-O 3.36Å; R44-E153 HydrophobicContact CG-CB 4.11Å; R44-E153 HydrophobicContact CG-CG 4.36Å; R44-E153 WeakPolarHBondContact CG-OE2 3.37Å; R44-E153 IonicContact CZ-OE2 3.57Å; R44-E153 IonicContact NE-OE2 2.66Å; R44-E153 PolarHBondContact NE-OE2 2.97Å; R44-E153 IonicContact NH2-OE1 3.9Å; R44-E153 PolarHBondContact NH2-OE1 3.27Å; R44-E153 IonicContact NH2-OE2 3.35Å; R44-E153 PolarHBondContact NH2-OE2 2.87Å; R44-E153 VanDerWaalsContact NH2-OE2 3.08Å; V45-E153 PolarHBondContact N-O 3.38Å
154	I	92.3	Very high	70.8	Confident	27 Å²	27	70.4 Å²	70.4	14%	0.138	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.2	-179.6	-60.5	-63.2	0	0	0	110.3	V45 A47 V133 L134 A137 L152 M156 L396	V45-I154 HydrophobicContact CB-CD1 4.24Å; V45-I154 WeakPolarHBondContact O-CA 3.14Å; A47-I154 HydrophobicContact CB-CG2 3.79Å; V133-I154 HydrophobicContact CG1-CD1 3.73Å; V133-I154 HydrophobicContact CG1-CG1 3.93Å; V133-I154 HydrophobicContact CG1-CG2 3.85Å; L134-I154 HydrophobicContact CD2-CB 4.39Å; A137-I154 HydrophobicContact CB-CD1 4.09Å; A137-I154 HydrophobicContact CB-CG1 3.57Å; L152-I154 HydrophobicContact CD2-CD1 3.55Å; L152-I154 HydrophobicContact CD2-CG1 4.14Å; I154-M156 HydrophobicContact CG2-CG 4.16Å; I154-L396 HydrophobicContact CD1-CD1 3.98Å; I154-L396 HydrophobicContact CD1-CD2 4.04Å
155	V	89.1	Confident	68.1	Low	16 Å²	16	70.7 Å²	70.7	10%	0.097	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	102.4	175.6	-173.7	0	0	0	0	109.1	R44 V45 G46 A47 T191 V192 Q195 V197	R44-V155 HydrophobicContact CB-CG2 4.24Å; R44-V155 HydrophobicContact CG-CG2 4.32Å; V45-V155 PolarHBondContact O-N 2.64Å; G46-V155 CarbonylContact C-O 3.46Å; G46-V155 VanDerWaalsContact CA-O 3.28Å; G46-V155 WeakPolarHBondContact CA-O 3.33Å; A47-V155 PolarHBondContact N-O 3.43Å; V155-T191 WeakPolarHBondContact CG1-O 3.38Å; V155-V192 HydrophobicContact CG1-CB 4.47Å; V155-V192 HydrophobicContact CG1-CG1 4.42Å; V155-V192 HydrophobicContact CG1-CG2 4.46Å; V155-Q195 HydrophobicContact CG1-CB 3.99Å; V155-Q195 HydrophobicContact CG1-CG 3.85Å; V155-Q195 HydrophobicContact CG2-CB 4.03Å; V155-Q195 HydrophobicContact CG2-CG 4.45Å; V155-V197 HydrophobicContact CB-CG1 4.13Å; V155-V197 HydrophobicContact CG2-CG1 4.17Å
156	M	83.7	Confident	65.8	Low	47 Å²	47	74.8 Å²	74.8	23%	0.232	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	140.6	177.5	-73.1	163.5	-78.8	0	0	111.3	A47 V50 R130 L134 I154 V158	A47-M156 HydrophobicContact CB-CG 3.9Å; A47-M156 WeakPolarHBondContact O-CA 3.26Å; V50-M156 HydrophobicContact CG2-CG 4.39Å; R130-M156 HydrophobicContact CG-SD 3.73Å; L134-M156 HydrophobicContact CD1-CE 4.34Å; L134-M156 HydrophobicContact CD2-CE 4.19Å; I154-M156 HydrophobicContact CG2-CG 4.16Å; M156-V158 PolarHBondContact O-N 2.73Å
157	A	71.3	Confident	63.2	Low	23 Å²	23	77.1 Å²	77.1	19%	0.19	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-64.1	130.9	164.2	0	0	0	0	0	110.1	A47 L48 T191 V192	A47-A157 PolarHBondContact O-N 3.45Å; L48-A157 HydrophobicContact CD2-CB 3.59Å; A157-T191 WeakPolarHBondContact CA-OG1 3.48Å; A157-V192 HydrophobicContact CB-CG2 3.86Å
158	V	60.4	Low	60.6	Low	86 Å²	86	84.3 Å²	84.3	52%	0.521	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-94.9	116.6	175.6	-170.7	0	0	0	0	107.7	M156 S187 T191	M156-V158 PolarHBondContact O-N 2.73Å; V158-S187 PolarHBondContact O-OG 3.45Å; V158-T191 HydrophobicContact CB-CG2 4.1Å; V158-T191 HydrophobicContact CG2-CG2 4.28Å; V158-T191 PolarHBondContact N-OG1 2.99Å
159	G	53	Low	58.1	Low	42 Å²	42	86 Å²	86	43%	0.433	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-58.5	141.2	169.4	0	0	0	0	0	109.8	A161	G159-A161 PolarHBondContact O-N 3.04Å
160	S	39.7	Very low	55.5	Low	81 Å²	81	89.5 Å²	89.5	57%	0.566	53%	0.526	S	S	*	.	S	Bend	trans	-69.4	41.3	-145.9	-51.2	0	0	0	0	118.9	L162	S160-L162 PolarHBondContact O-N 3.06Å
161	A	36	Very low	52.9	Low	83 Å²	83	94.8 Å²	94.8	69%	0.686	56%	0.564	S	S	*	*			trans	-84.6	101	165.7	0	0	0	0	0	110.4	G159 G163	G159-A161 PolarHBondContact O-N 3.04Å; A161-G163 VanDerWaalsContact C-N 3.34Å; A161-G163 PolarHBondContact O-N 3.47Å
162	L	33.4	Very low	50	Low	182 Å²	182	97.6 Å²	97.6	95%	0.953	58%	0.584	S	S	*	*			trans	-70.1	81.7	-179.4	-90.2	165.8	0	0	0	113.1	S160	S160-L162 PolarHBondContact O-N 3.06Å
163	G	33.8	Very low	47.4	Very low	71 Å²	71	104.4 Å²	104.4	73%	0.732	63%	0.626	S	S	*	*			trans	72.1	103.4	151.9	0	0	0	0	0	117.6	A161	A161-G163 VanDerWaalsContact C-N 3.34Å; A161-G163 PolarHBondContact O-N 3.47Å
164	E	28.5	Very low	44.4	Very low	201 Å²	201	103.7 Å²	103.7	94%	0.939	64%	0.638	S	S	*	*			trans	-139.3	158.3	158	-127.5	172.6	-146.6	0	0	111.7
165	L	28.1	Very low	41.6	Very low	153 Å²	153	109.6 Å²	109.6	80%	0.801	67%	0.668	S	S	*	*			trans	-77	157.9	-172.9	-76.9	165.6	0	0	0	112.3	A167	L165-A167 VanDerWaalsContact C-N 3.35Å; L165-A167 PolarHBondContact O-N 2.97Å
166	P	34	Very low	39.6	Very low	138 Å²	138	112.2 Å²	112.2	90%	0.896	69%	0.685	S	S	*	*	S	Bend	trans	-74.4	80.3	-170.6	30.6	-37.1	0	0	0	113.4
167	A	33.1	Very low	37.6	Very low	67 Å²	67	117.6 Å²	117.6	55%	0.554	71%	0.71	S	S	*	*			trans	-145.8	145.8	165.4	0	0	0	0	0	110.5	L165	L165-A167 VanDerWaalsContact C-N 3.35Å; L165-A167 PolarHBondContact O-N 2.97Å
168	F	28.2	Very low	36.6	Very low	184 Å²	184	118.5 Å²	118.5	81%	0.807	71%	0.712	S	S	*	*			trans	69.2	112.2	177.8	-49.6	-71.1	0	0	0	116.9	Y170	F168-Y170 HydrophobicContact CB-CD2 4.4Å; F168-Y170 HydrophobicContact CB-CE2 4.09Å
169	S	30.3	Very low	36.5	Very low	124 Å²	124	120.6 Å²	120.6	87%	0.867	72%	0.716	S	S	*	*			trans	-82.6	122.9	167.5	39.3	0	0	0	0	111
170	Y	28.4	Very low	37.4	Very low	207 Å²	207	122.4 Å²	122.4	81%	0.812	72%	0.716	S	S	*	*			trans	-116.1	122.9	169.6	-82.9	-78.5	0	0	0	111.4	F168 S172	F168-Y170 HydrophobicContact CB-CD2 4.4Å; F168-Y170 HydrophobicContact CB-CE2 4.09Å; Y170-S172 PolarHBondContact O-N 3.17Å
171	S	33.9	Very low	39.2	Very low	123 Å²	123	122.4 Å²	122.4	86%	0.86	71%	0.713	S	S	*	*			trans	-77.6	108.7	164.2	53.8	0	0	0	0	109.2
172	S	28.2	Very low	41.4	Very low	111 Å²	111	124 Å²	124	78%	0.776	71%	0.71	S	S	*	*			trans	-118.5	113.4	171.5	-173.4	0	0	0	0	110	Y170 G174	Y170-S172 PolarHBondContact O-N 3.17Å; S172-G174 PolarHBondContact O-N 2.99Å
173	T	38.7	Very low	43.6	Very low	154 Å²	154	117.4 Å²	117.4	95%	0.945	68%	0.679	S	S	*	*			trans	-91.7	90	170.8	51.2	0	0	0	0	109.1
174	G	29.1	Very low	45.9	Very low	57 Å²	57	114.8 Å²	114.8	59%	0.588	65%	0.647	S	S	*	*			trans	-152.8	127.7	178.9	0	0	0	0	0	111.9	S172	S172-G174 PolarHBondContact O-N 2.99Å
175	I	32.8	Very low	48.5	Very low	151 Å²	151	107.8 Å²	107.8	77%	0.774	62%	0.616	S	S	*	*			trans	23.9	114.7	157.1	-48.3	177	0	0	0	116.7	E177	I175-E177 PolarHBondContact O-N 3.33Å
176	P	46.4	Very low	51.1	Low	71 Å²	71	106 Å²	106	46%	0.461	60%	0.604	S	S	.	*			trans	-72.8	115.1	172.5	30.8	-32.7	0	0	0	111	D178	P176-D178 PolarHBondContact O-N 3.45Å
177	E	42.9	Very low	53.4	Low	161 Å²	161	100.1 Å²	100.1	75%	0.752	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-76.8	-1.3	177.2	-61.9	-175.8	143.3	0	0	113.3	I175 E179	I175-E177 PolarHBondContact O-N 3.33Å; E177-E179 PolarHBondContact O-N 3.33Å
178	D	50.6	Low	55.9	Low	41 Å²	41	96.9 Å²	96.9	22%	0.219	54%	0.54	C	S	.	.	G	3₁₀ helix	trans	-69.8	-3	176.1	-62.8	-52.7	0	0	0	114.9	Q51 P176 D180 K212	Q51-D178 PolarHBondContact NE2-OD2 3.37Å; P176-D178 PolarHBondContact O-N 3.45Å; D178-D180 VanDerWaalsContact C-N 3.32Å; D178-D180 PolarHBondContact O-N 3.12Å; D178-K212 PolarHBondContact O-NZ 2.73Å
179	E	56.8	Low	58.7	Low	131 Å²	131	88.9 Å²	88.9	61%	0.612	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-65.5	-32.7	179.8	-74.8	-72.9	133.1	0	0	112.1	E177 K212	E177-E179 PolarHBondContact O-N 3.33Å; E179-K212 VanDerWaalsContact C-NZ 3.34Å; E179-K212 PolarHBondContact O-NZ 3.44Å
180	D	72.3	Confident	61.3	Low	80 Å²	80	89.2 Å²	89.2	43%	0.428	49%	0.494	S	S	.	.			trans	-76	125.3	179.9	-163.1	-45.9	0	0	0	111.7	D178 L182 F184	D178-D180 VanDerWaalsContact C-N 3.32Å; D178-D180 PolarHBondContact O-N 3.12Å; D180-L182 VanDerWaalsContact C-N 3.28Å; D180-L182 PolarHBondContact O-N 3Å; D180-L182 VanDerWaalsContact OD1-CB 3.25Å; D180-L182 WeakPolarHBondContact OD1-CB 3.47Å; D180-L182 PolarHBondContact OD1-N 2.85Å; D180-F184 WeakPolarHBondContact O-CB 3.35Å; D180-F184 PolarHBondContact O-N 3.39Å
181	P	78.4	Confident	63.9	Low	80 Å²	80	81.1 Å²	81.1	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-63.9	-27.6	174.9	27	-35.1	0	0	0	114.1	L185 K212	P181-L185 WeakPolarHBondContact O-CB 3.3Å; P181-L185 PolarHBondContact O-N 3.16Å; P181-K212 HydrophobicContact CB-CD 4.42Å
182	L	81	Confident	66.4	Low	117 Å²	117	75.2 Å²	75.2	61%	0.613	43%	0.425	S	S	*	.	H	α-helix	trans	-71.7	-51.3	179.4	-177	64.4	0	0	0	110.8	D180 F184 L185 E186	D180-L182 VanDerWaalsContact C-N 3.28Å; D180-L182 PolarHBondContact O-N 3Å; D180-L182 VanDerWaalsContact OD1-CB 3.25Å; D180-L182 WeakPolarHBondContact OD1-CB 3.47Å; D180-L182 PolarHBondContact OD1-N 2.85Å; L182-F184 VanDerWaalsContact C-N 3.26Å; L182-F184 PolarHBondContact O-N 3.07Å; L182-L185 PolarHBondContact O-N 3.14Å; L182-L185 VanDerWaalsContact O-N 3.11Å; L182-E186 WeakPolarHBondContact O-CB 3.48Å; L182-E186 PolarHBondContact O-N 2.96Å
183	S	79.6	Confident	69.2	Low	44 Å²	44	70 Å²	70	31%	0.308	39%	0.388	S	S	.	.	H	α-helix	trans	-61.7	-35.8	177.7	-53.5	0	0	0	0	112.2	S187	S183-S187 WeakPolarHBondContact O-CB 3.18Å; S183-S187 PolarHBondContact O-N 3.09Å
184	F	82.5	Confident	71.5	Confident	15 Å²	15	66.6 Å²	66.6	7%	0.066	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-48.5	171.3	173.3	-107.4	0	0	0	112.1	L48 H49 D180 L182 S187 V188 K212 L213 V216	L48-F184 HydrophobicContact CD1-CZ 4.4Å; H49-F184 AromaticContact CE1-CE2 3.79Å; H49-F184 AromaticContact NE2-CE2 3.28Å; H49-F184 VanDerWaalsContact NE2-CE2 3.28Å; H49-F184 WeakPolarHBondContact NE2-CE2 3.31Å; H49-F184 AromaticContact NE2-CZ 3.39Å; H49-F184 WeakPolarHBondContact NE2-CZ 3.24Å; D180-F184 WeakPolarHBondContact O-CB 3.35Å; D180-F184 PolarHBondContact O-N 3.39Å; L182-F184 VanDerWaalsContact C-N 3.26Å; L182-F184 PolarHBondContact O-N 3.07Å; F184-S187 PolarHBondContact O-N 2.84Å; F184-V188 HydrophobicContact CD2-CG2 4.35Å; F184-V188 HydrophobicContact CE1-CG2 4.31Å; F184-V188 HydrophobicContact CE2-CG2 3.97Å; F184-V188 HydrophobicContact CZ-CG2 3.95Å; F184-V188 VanDerWaalsContact O-CG2 3.32Å; F184-V188 WeakPolarHBondContact O-CG2 3.26Å; F184-V188 PolarHBondContact O-N 2.91Å; F184-K212 HydrophobicContact CD1-CB 4.22Å; F184-K212 HydrophobicContact CD1-CD 4.15Å; F184-K212 HydrophobicContact CE1-CB 3.98Å; F184-L213 HydrophobicContact CZ-CD2 4.02Å; F184-V216 HydrophobicContact CE1-CG2 4.02Å
185	L	82.3	Confident	74.2	Confident	55 Å²	55	68 Å²	68	29%	0.288	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-41.9	178.3	-177.7	63.9	0	0	0	111.7	P181 L182 V188 C189 V216	P181-L185 WeakPolarHBondContact O-CB 3.3Å; P181-L185 PolarHBondContact O-N 3.16Å; L182-L185 PolarHBondContact O-N 3.14Å; L182-L185 VanDerWaalsContact O-N 3.11Å; L185-V188 PolarHBondContact O-N 2.99Å; L185-C189 VanDerWaalsContact O-CB 3.31Å; L185-C189 WeakPolarHBondContact O-CB 3.39Å; L185-C189 PolarHBondContact O-N 3.49Å; L185-C189 PolarHBondContact O-SG 3.25Å; L185-V216 HydrophobicContact CD1-CG2 4.06Å
186	E	82.8	Confident	76.7	Confident	114 Å²	114	61.2 Å²	61.2	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-47.5	176.4	-170.4	177.6	177.1	0	0	111.4	L182 C189 H190	L182-E186 WeakPolarHBondContact O-CB 3.48Å; L182-E186 PolarHBondContact O-N 2.96Å; E186-C189 PolarHBondContact O-N 2.89Å; E186-H190 WeakPolarHBondContact O-CB 3.31Å; E186-H190 PolarHBondContact O-CD2 3.47Å; E186-H190 PolarHBondContact O-N 3.49Å
187	S	83	Confident	78.8	Confident	15 Å²	15	58.1 Å²	58.1	11%	0.105	31%	0.306	C	S	.	.	H	α-helix	trans	-58.9	-49.2	174.5	176.2	0	0	0	0	111.8	V158 S183 F184 C189 H190 T191	V158-S187 PolarHBondContact O-OG 3.45Å; S183-S187 WeakPolarHBondContact O-CB 3.18Å; S183-S187 PolarHBondContact O-N 3.09Å; F184-S187 PolarHBondContact O-N 2.84Å; S187-C189 VanDerWaalsContact C-N 3.32Å; S187-C189 PolarHBondContact O-N 3.38Å; S187-H190 PolarHBondContact O-N 3.32Å; S187-T191 WeakPolarHBondContact O-CB 3.43Å; S187-T191 PolarHBondContact O-N 2.88Å; S187-T191 PolarHBondContact O-OG1 3.26Å
188	V	86.2	Confident	81	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-57.3	-45.8	177.2	169.7	0	0	0	0	111	L48 F184 L185 V192 V193 M200 V216 L220	L48-V188 HydrophobicContact CD1-CG2 4.26Å; L48-V188 HydrophobicContact CD2-CG2 3.88Å; F184-V188 HydrophobicContact CD2-CG2 4.35Å; F184-V188 HydrophobicContact CE1-CG2 4.31Å; F184-V188 HydrophobicContact CE2-CG2 3.97Å; F184-V188 HydrophobicContact CZ-CG2 3.95Å; F184-V188 VanDerWaalsContact O-CG2 3.32Å; F184-V188 WeakPolarHBondContact O-CG2 3.26Å; F184-V188 PolarHBondContact O-N 2.91Å; L185-V188 PolarHBondContact O-N 2.99Å; V188-V192 WeakPolarHBondContact O-CA 3.47Å; V188-V192 VanDerWaalsContact O-CB 3.32Å; V188-V192 WeakPolarHBondContact O-CB 3.37Å; V188-V192 PolarHBondContact O-N 2.96Å; V188-V193 HydrophobicContact CG1-CG2 4.08Å; V188-V193 PolarHBondContact O-N 2.96Å; V188-M200 HydrophobicContact CG1-CE 4.16Å; V188-M200 HydrophobicContact CG1-SD 4.47Å; V188-V216 HydrophobicContact CG1-CG1 4.25Å; V188-L220 HydrophobicContact CG1-CD1 4.31Å
189	C	86.6	Confident	83.1	Confident	16 Å²	16	49.1 Å²	49.1	11%	0.108	26%	0.264	C	S	.	.	I	π-helix	trans	-64.1	-55.2	180	-74.5	0	0	0	0	112.5	L185 E186 S187 T191 V194 C422	L185-C189 VanDerWaalsContact O-CB 3.31Å; L185-C189 WeakPolarHBondContact O-CB 3.39Å; L185-C189 PolarHBondContact O-N 3.49Å; L185-C189 PolarHBondContact O-SG 3.25Å; E186-C189 PolarHBondContact O-N 2.89Å; S187-C189 VanDerWaalsContact C-N 3.32Å; S187-C189 PolarHBondContact O-N 3.38Å; C189-T191 PolarHBondContact O-N 3.47Å; C189-V194 WeakPolarHBondContact O-CG2 3.5Å; C189-V194 PolarHBondContact O-N 3.03Å; C189-C422 WeakPolarHBondContact CA-SG 3.43Å; C189-C422 HydrophobicContact CB-CB 3.92Å; C189-C422 WeakPolarHBondContact CB-SG 3.33Å; C189-C422 WeakPolarHBondContact SG-CB 3.49Å; C189-C422 CovalentContact SG-SG 2.03Å; C189-C422 PolarHBondContact SG-SG 3.23Å
190	H	84.3	Confident	84.8	Confident	131 Å²	131	43 Å²	43	61%	0.606	24%	0.235	S	C	*	.	I	π-helix	trans	-72.1	-28.7	-174.6	-79.2	-83.9	0	0	0	114.1	E186 S187	E186-H190 WeakPolarHBondContact O-CB 3.31Å; E186-H190 PolarHBondContact O-CD2 3.47Å; E186-H190 PolarHBondContact O-N 3.49Å; S187-H190 PolarHBondContact O-N 3.32Å
191	T	82.9	Confident	85.8	Confident	36 Å²	36	39.2 Å²	39.2	22%	0.221	22%	0.215	C	C	.	.	I	π-helix	trans	-104.1	-35.3	-175.2	68.5	0	0	0	0	114	V155 A157 V158 S187 C189 Q195	V155-T191 WeakPolarHBondContact CG1-O 3.38Å; A157-T191 WeakPolarHBondContact CA-OG1 3.48Å; V158-T191 HydrophobicContact CB-CG2 4.1Å; V158-T191 HydrophobicContact CG2-CG2 4.28Å; V158-T191 PolarHBondContact N-OG1 2.99Å; S187-T191 WeakPolarHBondContact O-CB 3.43Å; S187-T191 PolarHBondContact O-N 2.88Å; S187-T191 PolarHBondContact O-OG1 3.26Å; C189-T191 PolarHBondContact O-N 3.47Å; T191-Q195 WeakPolarHBondContact O-CG 3.47Å
192	V	86.5	Confident	86.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.	I	π-helix	trans	-104.5	-51	-174.1	-172.2	0	0	0	0	112.2	L48 V155 A157 V188 Q195 V197 M200	L48-V192 HydrophobicContact CD2-CG2 4.04Å; V155-V192 HydrophobicContact CG1-CB 4.47Å; V155-V192 HydrophobicContact CG1-CG1 4.42Å; V155-V192 HydrophobicContact CG1-CG2 4.46Å; A157-V192 HydrophobicContact CB-CG2 3.86Å; V188-V192 WeakPolarHBondContact O-CA 3.47Å; V188-V192 VanDerWaalsContact O-CB 3.32Å; V188-V192 WeakPolarHBondContact O-CB 3.37Å; V188-V192 PolarHBondContact O-N 2.96Å; V192-Q195 PolarHBondContact O-N 3.34Å; V192-V197 HydrophobicContact CG1-CG1 3.77Å; V192-V197 HydrophobicContact CG1-CG2 3.94Å; V192-M200 HydrophobicContact CG1-CE 4.19Å
193	V	87.3	Confident	86.9	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.012	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-69.6	-40.6	-174.7	-177.5	0	0	0	0	111.9	V188 Q195 G196 M200 L220	V188-V193 HydrophobicContact CG1-CG2 4.08Å; V188-V193 PolarHBondContact O-N 2.96Å; V193-Q195 PolarHBondContact O-N 2.92Å; V193-Q195 VanDerWaalsContact O-N 3.13Å; V193-G196 PolarHBondContact O-N 3Å; V193-M200 HydrophobicContact CG2-CE 3.97Å; V193-L220 HydrophobicContact CG2-CD1 3.54Å
194	V	86.3	Confident	87.3	Confident	81 Å²	81	27.9 Å²	27.9	49%	0.491	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-58	-24.8	175.3	165.4	0	0	0	0	112.9	C189 G196	C189-V194 WeakPolarHBondContact O-CG2 3.5Å; C189-V194 PolarHBondContact O-N 3.03Å; V194-G196 VanDerWaalsContact C-N 3.32Å
195	Q	86	Confident	87.4	Confident	86 Å²	86	31.9 Å²	31.9	40%	0.402	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-81.6	-7.6	175.2	-63.9	-61.6	-23.1	0	0	114	R44 V155 T191 V192 V193	R44-Q195 WeakPolarHBondContact CD-O 3.38Å; R44-Q195 PolarHBondContact NH1-O 3.25Å; V155-Q195 HydrophobicContact CG1-CB 3.99Å; V155-Q195 HydrophobicContact CG1-CG 3.85Å; V155-Q195 HydrophobicContact CG2-CB 4.03Å; V155-Q195 HydrophobicContact CG2-CG 4.45Å; T191-Q195 WeakPolarHBondContact O-CG 3.47Å; V192-Q195 PolarHBondContact O-N 3.34Å; V193-Q195 PolarHBondContact O-N 2.92Å; V193-Q195 VanDerWaalsContact O-N 3.13Å
196	G	86.8	Confident	87.4	Confident	10 Å²	10	31.9 Å²	31.9	10%	0.103	16%	0.162	C	C	.	.			trans	72	59.6	176.2	0	0	0	0	0	113.7	V193 V194	V193-G196 PolarHBondContact O-N 3Å; V194-G196 VanDerWaalsContact C-N 3.32Å
197	V	90.2	Very high	87.5	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.03	17%	0.165	C	C	.	.			trans	-75.6	145.3	177.3	-65.3	0	0	0	0	112.8	R44 V155 V192 M200 V222	R44-V197 HydrophobicContact CB-CG1 4.07Å; R44-V197 CarbonylContact O-C 3.32Å; R44-V197 WeakPolarHBondContact O-CA 3.11Å; V155-V197 HydrophobicContact CB-CG1 4.13Å; V155-V197 HydrophobicContact CG2-CG1 4.17Å; V192-V197 HydrophobicContact CG1-CG1 3.77Å; V192-V197 HydrophobicContact CG1-CG2 3.94Å; V197-M200 HydrophobicContact CG2-CE 3.85Å; V197-M200 HydrophobicContact CG2-CG 4.19Å; V197-V222 HydrophobicContact CG2-CG1 4.46Å
198	S	89.7	Confident	87.5	Confident	10 Å²	10	38.1 Å²	38.1	7%	0.07	19%	0.187	C	C	.	.	S	Bend	trans	-83.9	-28.2	175.5	-52.7	0	0	0	0	112.9	R44 L436	R44-S198 PolarHBondContact O-N 2.91Å; S198-L436 WeakPolarHBondContact O-CD1 3.42Å
199	A	92.9	Very high	87.5	Confident	3 Å²	3	38.6 Å²	38.6	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	168.1	-179.7	0	0	0	0	0	109.9	V45 G46 P223 V399	V45-A199 WeakPolarHBondContact CA-O 3.28Å; G46-A199 PolarHBondContact N-O 3.41Å; A199-P223 CarbonylContact C-O 3.46Å; A199-P223 WeakPolarHBondContact CA-O 3.42Å; A199-P223 HydrophobicContact CB-CG 3.98Å; A199-V399 HydrophobicContact CB-CG1 3.71Å
200	M	93.1	Very high	87.5	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	144.4	174.4	-53.6	-179.3	-175.9	0	0	112.1	G46 L48 V188 V192 V193 V197 L220 V222 P223 V224 V225	G46-M200 CarbonylContact O-C 3.56Å; G46-M200 WeakPolarHBondContact O-CA 3.35Å; L48-M200 HydrophobicContact CD1-CB 4.47Å; L48-M200 HydrophobicContact CD1-SD 3.85Å; V188-M200 HydrophobicContact CG1-CE 4.16Å; V188-M200 HydrophobicContact CG1-SD 4.47Å; V192-M200 HydrophobicContact CG1-CE 4.19Å; V193-M200 HydrophobicContact CG2-CE 3.97Å; V197-M200 HydrophobicContact CG2-CE 3.85Å; V197-M200 HydrophobicContact CG2-CG 4.19Å; M200-L220 HydrophobicContact CE-CD1 3.92Å; M200-V222 HydrophobicContact CE-CB 4.48Å; M200-V222 HydrophobicContact CE-CG1 4.17Å; M200-V222 HydrophobicContact CG-CG1 4.03Å; M200-P223 PolarHBondContact N-O 3.36Å; M200-V224 HydrophobicContact CB-CG2 4.24Å; M200-V224 CarbonylContact O-C 3.54Å; M200-V224 WeakPolarHBondContact O-CA 3.4Å; M200-V225 PolarHBondContact O-N 3.13Å
201	L	93.9	Very high	87.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.2	174.1	-175.3	64.5	0	0	0	108.9	G46 A47 L48 V133 F203 V225 V227 L396	G46-L201 PolarHBondContact O-N 2.92Å; A47-L201 WeakPolarHBondContact CA-O 3.33Å; L48-L201 PolarHBondContact N-O 2.91Å; V133-L201 HydrophobicContact CG2-CD2 3.88Å; L201-F203 HydrophobicContact CD2-CE2 4.43Å; L201-F203 HydrophobicContact CD2-CZ 3.83Å; L201-F203 HydrophobicContact CG-CE2 4.21Å; L201-F203 HydrophobicContact CG-CZ 3.82Å; L201-V225 CarbonylContact C-O 3.5Å; L201-V225 WeakPolarHBondContact CA-O 3.19Å; L201-V225 HydrophobicContact CD1-CB 4.02Å; L201-V225 HydrophobicContact CD1-CG1 4.04Å; L201-V227 HydrophobicContact CD1-CG2 3.59Å; L201-V227 HydrophobicContact CG-CG2 4.47Å; L201-L396 HydrophobicContact CD2-CB 4.32Å; L201-L396 HydrophobicContact CD2-CD1 4.45Å
202	A	92	Very high	87.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.8	-172.6	0	0	0	0	0	113.3	L48 P204 L213 V224 V225 S226 V227	L48-A202 HydrophobicContact CB-CB 4.02Å; L48-A202 WeakPolarHBondContact O-CA 3.39Å; A202-P204 WeakPolarHBondContact O-CD 3.37Å; A202-L213 HydrophobicContact CB-CD1 3.55Å; A202-L213 HydrophobicContact CB-CD2 3.68Å; A202-L213 HydrophobicContact CB-CG 4.27Å; A202-V224 HydrophobicContact CB-CG1 4.34Å; A202-V225 PolarHBondContact N-O 3.44Å; A202-S226 CarbonylContact O-C 3.57Å; A202-S226 WeakPolarHBondContact O-CA 3.39Å; A202-V227 PolarHBondContact O-N 3.45Å
203	F	90.6	Very high	88	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.			trans	-123.4	53.2	-175.6	-55.7	-78.6	0	0	0	113.9	L48 V50 R53 F127 P129 V133 L201 V227 V392	L48-F203 PolarHBondContact O-N 3.39Å; V50-F203 HydrophobicContact CG1-CD2 4.29Å; V50-F203 HydrophobicContact CG1-CE2 4.36Å; R53-F203 PolarHBondContact NH1-O 3.34Å; F127-F203 HydrophobicContact CE1-CD1 4.47Å; P129-F203 HydrophobicContact CB-CB 4.33Å; P129-F203 HydrophobicContact CB-CD1 4.07Å; P129-F203 HydrophobicContact CB-CD2 3.61Å; P129-F203 HydrophobicContact CB-CE1 4.34Å; P129-F203 HydrophobicContact CB-CE2 3.91Å; P129-F203 HydrophobicContact CB-CG 3.71Å; P129-F203 HydrophobicContact CB-CZ 4.26Å; P129-F203 HydrophobicContact CG-CB 4.41Å; P129-F203 HydrophobicContact CG-CD2 4.37Å; P129-F203 HydrophobicContact CG-CG 4.3Å; V133-F203 HydrophobicContact CG2-CE2 3.62Å; V133-F203 HydrophobicContact CG2-CZ 3.46Å; V133-F203 VanDerWaalsContact CG2-CZ 3.46Å; L201-F203 HydrophobicContact CD2-CE2 4.43Å; L201-F203 HydrophobicContact CD2-CZ 3.83Å; L201-F203 HydrophobicContact CG-CE2 4.21Å; L201-F203 HydrophobicContact CG-CZ 3.82Å; F203-V227 HydrophobicContact CD1-CB 3.86Å; F203-V227 HydrophobicContact CD1-CG2 4.11Å; F203-V227 HydrophobicContact CE1-CB 3.79Å; F203-V227 HydrophobicContact CE1-CG2 3.62Å; F203-V227 HydrophobicContact CZ-CG2 4.38Å; F203-V392 HydrophobicContact CE1-CG1 4.31Å; F203-V392 HydrophobicContact CE1-CG2 3.94Å; F203-V392 HydrophobicContact CZ-CG1 4.01Å; F203-V392 HydrophobicContact CZ-CG2 4.43Å
204	P	88.6	Confident	88.1	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.019	18%	0.183	C	C	.	.			trans	-56.6	145.8	-171.8	23	-31.9	0	0	0	113	A202 E209 L210 L213 V228	A202-P204 WeakPolarHBondContact O-CD 3.37Å; P204-E209 WeakPolarHBondContact CA-OE2 3.35Å; P204-E209 HydrophobicContact CB-CB 3.75Å; P204-L210 HydrophobicContact CB-CB 4.44Å; P204-L210 HydrophobicContact CG-CB 4.45Å; P204-L210 HydrophobicContact CG-CD1 3.7Å; P204-L213 HydrophobicContact CB-CD1 3.91Å; P204-L213 HydrophobicContact CG-CD1 3.8Å; P204-V228 HydrophobicContact CG-CG1 3.88Å
205	R	82.6	Confident	88.2	Confident	100 Å²	100	39.7 Å²	39.7	38%	0.377	19%	0.187	S	C	.	.	S	Bend	trans	-93.8	-35.6	-176.3	-61.3	180	-71.7	-152.4	-3.5	112.4	E209	R205-E209 WeakPolarHBondContact CB-OE2 3.48Å; R205-E209 IonicContact CZ-OE1 3.78Å; R205-E209 PolarHBondContact N-OE2 3.41Å; R205-E209 IonicContact NE-OE1 3.24Å; R205-E209 PolarHBondContact NE-OE1 2.9Å; R205-E209 IonicContact NE-OE2 3.71Å; R205-E209 IonicContact NH2-OE1 2.75Å; R205-E209 PolarHBondContact NH2-OE1 3.04Å
206	N	84.2	Confident	88.3	Confident	54 Å²	54	35.8 Å²	35.8	29%	0.289	17%	0.169	S	C	.	.	S	Bend	trans	-133.5	179.6	-177.3	63.1	12.5	0	0	0	110.8	D208 E209 L210	N206-D208 VanDerWaalsContact C-N 3.28Å; N206-D208 PolarHBondContact O-N 3.26Å; N206-D208 PolarHBondContact OD1-N 3.17Å; N206-E209 WeakPolarHBondContact OD1-CB 3.25Å; N206-E209 VanDerWaalsContact OD1-CG 3.26Å; N206-E209 WeakPolarHBondContact OD1-CG 3.29Å; N206-E209 PolarHBondContact OD1-N 3.31Å; N206-L210 PolarHBondContact O-N 2.97Å
207	R	83.9	Confident	88.4	Confident	155 Å²	155	35.4 Å²	35.4	59%	0.585	17%	0.165	S	C	*	.	H	α-helix	trans	-67.7	-30.2	177.6	-173.3	177.5	-179.7	-177.9	-0.7	112.2	L210 V211	R207-L210 WeakPolarHBondContact O-CB 3.46Å; R207-L210 PolarHBondContact O-N 3.17Å; R207-V211 WeakPolarHBondContact O-CG2 3.39Å; R207-V211 PolarHBondContact O-N 3.15Å
208	D	83.8	Confident	88.3	Confident	106 Å²	106	39.8 Å²	39.8	57%	0.567	19%	0.188	S	C	*	.	H	α-helix	trans	-75	-40.9	-172.2	-45.1	-63.2	0	0	0	111.2	N206 L210 V211 K212	N206-D208 VanDerWaalsContact C-N 3.28Å; N206-D208 PolarHBondContact O-N 3.26Å; N206-D208 PolarHBondContact OD1-N 3.17Å; D208-L210 VanDerWaalsContact C-N 3.3Å; D208-L210 PolarHBondContact O-N 3.22Å; D208-V211 PolarHBondContact O-N 2.81Å; D208-K212 WeakPolarHBondContact O-CG 3.38Å; D208-K212 PolarHBondContact O-N 3.42Å
209	E	85.8	Confident	88.1	Confident	9 Å²	9	42.4 Å²	42.4	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-38.8	168	-71.2	176.5	-173.6	0	0	111.9	H49 P204 R205 N206 V211 K212 L213	H49-E209 IonicContact CE1-OE2 3.19Å; H49-E209 IonicContact CG-OE2 2.7Å; H49-E209 IonicContact ND1-OE1 3.21Å; H49-E209 IonicContact ND1-OE2 3.4Å; H49-E209 PolarHBondContact ND1-OE2 3.19Å; H49-E209 VanDerWaalsContact ND1-OE2 3.17Å; P204-E209 WeakPolarHBondContact CA-OE2 3.35Å; P204-E209 HydrophobicContact CB-CB 3.75Å; R205-E209 WeakPolarHBondContact CB-OE2 3.48Å; R205-E209 IonicContact CZ-OE1 3.78Å; R205-E209 PolarHBondContact N-OE2 3.41Å; R205-E209 IonicContact NE-OE1 3.24Å; R205-E209 PolarHBondContact NE-OE1 2.9Å; R205-E209 IonicContact NE-OE2 3.71Å; R205-E209 IonicContact NH2-OE1 2.75Å; R205-E209 PolarHBondContact NH2-OE1 3.04Å; N206-E209 WeakPolarHBondContact OD1-CB 3.25Å; N206-E209 VanDerWaalsContact OD1-CG 3.26Å; N206-E209 WeakPolarHBondContact OD1-CG 3.29Å; N206-E209 PolarHBondContact OD1-N 3.31Å; E209-V211 VanDerWaalsContact C-N 3.34Å; E209-V211 PolarHBondContact O-N 3.15Å; E209-K212 PolarHBondContact O-N 2.92Å; E209-L213 WeakPolarHBondContact O-CD1 3.39Å; E209-L213 VanDerWaalsContact O-CG 3.26Å; E209-L213 WeakPolarHBondContact O-CG 3.5Å; E209-L213 PolarHBondContact O-N 3.4Å
210	L	86.8	Confident	87.8	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-40.7	175.3	-167.9	76	0	0	0	111.7	P204 N206 R207 D208 L213 E214 F232 H241	P204-L210 HydrophobicContact CB-CB 4.44Å; P204-L210 HydrophobicContact CG-CB 4.45Å; P204-L210 HydrophobicContact CG-CD1 3.7Å; N206-L210 PolarHBondContact O-N 2.97Å; R207-L210 WeakPolarHBondContact O-CB 3.46Å; R207-L210 PolarHBondContact O-N 3.17Å; D208-L210 VanDerWaalsContact C-N 3.3Å; D208-L210 PolarHBondContact O-N 3.22Å; L210-L213 PolarHBondContact O-N 3.48Å; L210-E214 PolarHBondContact O-N 3.47Å; L210-F232 HydrophobicContact CD2-CB 3.69Å; L210-F232 HydrophobicContact CD2-CD2 3.91Å; L210-F232 HydrophobicContact CD2-CG 4.07Å; L210-H241 PolarHBondContact O-CE1 3.36Å
211	V	86.9	Confident	87.6	Confident	76 Å²	76	46 Å²	46	46%	0.461	23%	0.226	S	C	.	.	H	α-helix	trans	-71.4	-37.4	176.9	172.8	0	0	0	0	111.9	R207 D208 E209 L213 E214 F215	R207-V211 WeakPolarHBondContact O-CG2 3.39Å; R207-V211 PolarHBondContact O-N 3.15Å; D208-V211 PolarHBondContact O-N 2.81Å; E209-V211 VanDerWaalsContact C-N 3.34Å; E209-V211 PolarHBondContact O-N 3.15Å; V211-L213 VanDerWaalsContact C-N 3.33Å; V211-L213 PolarHBondContact O-N 2.93Å; V211-E214 PolarHBondContact O-N 2.97Å; V211-F215 PolarHBondContact O-N 3.42Å
212	K	87.8	Confident	87.4	Confident	41 Å²	41	46.2 Å²	46.2	18%	0.178	23%	0.228	C	C	.	.	H	α-helix	trans	-55.7	-48.7	170	-71.7	-178.5	-176.5	-172.7	0	110.6	D178 E179 P181 F184 D208 E209 E214 F215 V216	D178-K212 PolarHBondContact O-NZ 2.73Å; E179-K212 VanDerWaalsContact C-NZ 3.34Å; E179-K212 PolarHBondContact O-NZ 3.44Å; P181-K212 HydrophobicContact CB-CD 4.42Å; F184-K212 HydrophobicContact CD1-CB 4.22Å; F184-K212 HydrophobicContact CD1-CD 4.15Å; F184-K212 HydrophobicContact CE1-CB 3.98Å; D208-K212 WeakPolarHBondContact O-CG 3.38Å; D208-K212 PolarHBondContact O-N 3.42Å; E209-K212 PolarHBondContact O-N 2.92Å; K212-E214 VanDerWaalsContact C-N 3.34Å; K212-E214 PolarHBondContact O-N 2.94Å; K212-F215 PolarHBondContact O-N 3.44Å; K212-V216 WeakPolarHBondContact O-CG2 3.37Å; K212-V216 PolarHBondContact O-N 3.36Å
213	L	89.4	Confident	87.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-37.4	177.9	-71	163.1	0	0	0	112.8	L48 F184 A202 P204 E209 L210 V211 V216 S217 V224	L48-L213 HydrophobicContact CB-CD2 4.32Å; L48-L213 HydrophobicContact CD1-CD2 3.51Å; F184-L213 HydrophobicContact CZ-CD2 4.02Å; A202-L213 HydrophobicContact CB-CD1 3.55Å; A202-L213 HydrophobicContact CB-CD2 3.68Å; A202-L213 HydrophobicContact CB-CG 4.27Å; P204-L213 HydrophobicContact CB-CD1 3.91Å; P204-L213 HydrophobicContact CG-CD1 3.8Å; E209-L213 WeakPolarHBondContact O-CD1 3.39Å; E209-L213 VanDerWaalsContact O-CG 3.26Å; E209-L213 WeakPolarHBondContact O-CG 3.5Å; E209-L213 PolarHBondContact O-N 3.4Å; L210-L213 PolarHBondContact O-N 3.48Å; V211-L213 VanDerWaalsContact C-N 3.33Å; V211-L213 PolarHBondContact O-N 2.93Å; L213-V216 PolarHBondContact O-N 3.33Å; L213-S217 PolarHBondContact O-N 3.16Å; L213-V224 HydrophobicContact CB-CG1 4.47Å; L213-V224 HydrophobicContact CD2-CG1 4.42Å
214	E	88.4	Confident	87.6	Confident	31 Å²	31	46.3 Å²	46.3	15%	0.145	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-47.7	177.3	-169	161.4	-153.4	0	0	111.4	L210 V211 K212 S217 L218 R234 S236 N238 H241	L210-E214 PolarHBondContact O-N 3.47Å; V211-E214 PolarHBondContact O-N 2.97Å; K212-E214 VanDerWaalsContact C-N 3.34Å; K212-E214 PolarHBondContact O-N 2.94Å; E214-S217 PolarHBondContact O-N 3.14Å; E214-S217 PolarHBondContact O-OG 2.88Å; E214-L218 PolarHBondContact O-N 3.47Å; E214-R234 IonicContact OE1-NH1 2.76Å; E214-S236 WeakPolarHBondContact OE1-CB 3.15Å; E214-S236 PolarHBondContact OE1-OG 3.16Å; E214-N238 HydrophobicContact CG-CB 4.26Å; E214-N238 WeakPolarHBondContact CG-ND2 3.47Å; E214-N238 PolarHBondContact O-ND2 2.77Å; E214-N238 WeakPolarHBondContact OE1-CB 3.41Å; E214-H241 WeakPolarHBondContact CA-ND1 3.32Å; E214-H241 WeakPolarHBondContact CB-ND1 3.34Å
215	F	87.9	Confident	87.9	Confident	135 Å²	135	46.2 Å²	46.2	59%	0.592	23%	0.228	S	C	*	.	H	α-helix	trans	-60.7	-45	175	-178.4	-95.1	0	0	0	112.1	V211 K212 S217 L218 A219	V211-F215 PolarHBondContact O-N 3.42Å; K212-F215 PolarHBondContact O-N 3.44Å; F215-S217 VanDerWaalsContact C-N 3.35Å; F215-S217 PolarHBondContact O-N 3.11Å; F215-L218 PolarHBondContact O-N 3.33Å; F215-A219 HydrophobicContact CE1-CB 4.29Å; F215-A219 WeakPolarHBondContact O-CB 3.43Å; F215-A219 PolarHBondContact O-N 3.08Å
216	V	88.2	Confident	88.4	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.024	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-44.8	176.8	167	0	0	0	0	111.7	F184 L185 V188 K212 L213 L218 L220	F184-V216 HydrophobicContact CE1-CG2 4.02Å; L185-V216 HydrophobicContact CD1-CG2 4.06Å; V188-V216 HydrophobicContact CG1-CG1 4.25Å; K212-V216 WeakPolarHBondContact O-CG2 3.37Å; K212-V216 PolarHBondContact O-N 3.36Å; L213-V216 PolarHBondContact O-N 3.33Å; V216-L218 VanDerWaalsContact C-N 3.32Å; V216-L218 PolarHBondContact O-N 2.88Å; V216-L220 HydrophobicContact CG1-CD1 3.66Å; V216-L220 HydrophobicContact CG1-CG 4.32Å; V216-L220 WeakPolarHBondContact O-CB 3.36Å; V216-L220 WeakPolarHBondContact O-CG 3.01Å; V216-L220 PolarHBondContact O-N 3.32Å
217	S	90.1	Very high	88.8	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-40.6	179	73.3	0	0	0	0	112.9	L213 E214 F215 Q221 V222 N238 L240	L213-S217 PolarHBondContact O-N 3.16Å; E214-S217 PolarHBondContact O-N 3.14Å; E214-S217 PolarHBondContact O-OG 2.88Å; F215-S217 VanDerWaalsContact C-N 3.35Å; F215-S217 PolarHBondContact O-N 3.11Å; S217-Q221 WeakPolarHBondContact O-CA 3.39Å; S217-Q221 PolarHBondContact O-N 3.41Å; S217-Q221 VanDerWaalsContact O-N 3.09Å; S217-V222 WeakPolarHBondContact CA-O 3.14Å; S217-V222 WeakPolarHBondContact CB-O 3.44Å; S217-V222 PolarHBondContact O-N 2.98Å; S217-N238 PolarHBondContact OG-ND2 3.08Å; S217-L240 VanDerWaalsContact O-CD1 3.29Å; S217-L240 WeakPolarHBondContact O-CD1 3.24Å
218	L	88.1	Confident	89	Confident	97 Å²	97	31.5 Å²	31.5	51%	0.508	17%	0.169	S	C	.	.	H	α-helix	trans	-75.1	-42.4	-177.5	-173.7	65.2	0	0	0	111.9	E214 F215 V216 Q221	E214-L218 PolarHBondContact O-N 3.47Å; F215-L218 PolarHBondContact O-N 3.33Å; V216-L218 VanDerWaalsContact C-N 3.32Å; V216-L218 PolarHBondContact O-N 2.88Å; L218-Q221 PolarHBondContact O-NE2 3.13Å
219	A	86	Confident	89	Confident	66 Å²	66	30.4 Å²	30.4	55%	0.545	16%	0.16	S	C	.	.	H	α-helix	trans	-69.4	-42.7	-179.8	0	0	0	0	0	112.5	F215	F215-A219 HydrophobicContact CE1-CB 4.29Å; F215-A219 WeakPolarHBondContact O-CB 3.43Å; F215-A219 PolarHBondContact O-N 3.08Å
220	L	86	Confident	88.9	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-84.9	-12.1	-179.9	-59	-178.6	0	0	0	113.8	V188 V193 M200 V216 V222 T419 C422	V188-L220 HydrophobicContact CG1-CD1 4.31Å; V193-L220 HydrophobicContact CG2-CD1 3.54Å; M200-L220 HydrophobicContact CE-CD1 3.92Å; V216-L220 HydrophobicContact CG1-CD1 3.66Å; V216-L220 HydrophobicContact CG1-CG 4.32Å; V216-L220 WeakPolarHBondContact O-CB 3.36Å; V216-L220 WeakPolarHBondContact O-CG 3.01Å; V216-L220 PolarHBondContact O-N 3.32Å; L220-V222 HydrophobicContact CB-CB 4.41Å; L220-V222 HydrophobicContact CB-CG2 4.12Å; L220-V222 PolarHBondContact O-N 3.04Å; L220-T419 VanDerWaalsContact O-CG2 3.3Å; L220-T419 WeakPolarHBondContact O-CG2 3.24Å; L220-T419 PolarHBondContact O-OG1 3.12Å; L220-C422 HydrophobicContact CD2-CB 4.21Å; L220-C422 VanDerWaalsContact CD2-SG 3.54Å
221	Q	88.4	Confident	88.7	Confident	69 Å²	69	44 Å²	44	32%	0.322	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	38.2	-172.3	-65.3	-70.6	-58	0	0	112.9	S217 L218 S431 G433	S217-Q221 WeakPolarHBondContact O-CA 3.39Å; S217-Q221 PolarHBondContact O-N 3.41Å; S217-Q221 VanDerWaalsContact O-N 3.09Å; L218-Q221 PolarHBondContact O-NE2 3.13Å; Q221-S431 PolarHBondContact OE1-OG 3.28Å; Q221-G433 VanDerWaalsContact O-CA 3.3Å; Q221-G433 WeakPolarHBondContact O-CA 3.36Å
222	V	89.9	Confident	88.5	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.042	20%	0.204	C	C	.	.			trans	-119.1	129.5	177.9	177.6	0	0	0	0	109.1	V197 M200 S217 L220	V197-V222 HydrophobicContact CG2-CG1 4.46Å; M200-V222 HydrophobicContact CE-CB 4.48Å; M200-V222 HydrophobicContact CE-CG1 4.17Å; M200-V222 HydrophobicContact CG-CG1 4.03Å; S217-V222 WeakPolarHBondContact CA-O 3.14Å; S217-V222 WeakPolarHBondContact CB-O 3.44Å; S217-V222 PolarHBondContact O-N 2.98Å; L220-V222 HydrophobicContact CB-CB 4.41Å; L220-V222 HydrophobicContact CB-CG2 4.12Å; L220-V222 PolarHBondContact O-N 3.04Å
223	P	93.4	Very high	88.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	23%	0.225	C	C	.	.			trans	-70.9	138.1	-179	28.2	-33.8	0	0	0	111.8	A199 M200 L240 L436 L440	A199-P223 CarbonylContact C-O 3.46Å; A199-P223 WeakPolarHBondContact CA-O 3.42Å; A199-P223 HydrophobicContact CB-CG 3.98Å; M200-P223 PolarHBondContact N-O 3.36Å; P223-L240 CarbonylContact C-O 3.45Å; P223-L240 WeakPolarHBondContact CA-O 3.43Å; P223-L436 HydrophobicContact CG-CB 4.33Å; P223-L440 HydrophobicContact CB-CD1 3.65Å; P223-L440 HydrophobicContact CG-CD1 3.95Å
224	V	93.6	Very high	87.2	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130	-179.4	178.4	0	0	0	0	109.6	M200 A202 L213 L240 H241 F242	M200-V224 HydrophobicContact CB-CG2 4.24Å; M200-V224 CarbonylContact O-C 3.54Å; M200-V224 WeakPolarHBondContact O-CA 3.4Å; A202-V224 HydrophobicContact CB-CG1 4.34Å; L213-V224 HydrophobicContact CB-CG1 4.47Å; L213-V224 HydrophobicContact CD2-CG1 4.42Å; V224-L240 PolarHBondContact N-O 3.03Å; V224-H241 WeakPolarHBondContact O-CA 3.38Å; V224-F242 PolarHBondContact O-N 2.79Å
225	V	94.5	Very high	86.2	Confident	1 Å²	1	56 Å²	56	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.6	168.8	-178.6	0	0	0	0	108.3	M200 L201 A202 F242 V399 I461	M200-V225 PolarHBondContact O-N 3.13Å; L201-V225 CarbonylContact C-O 3.5Å; L201-V225 WeakPolarHBondContact CA-O 3.19Å; L201-V225 HydrophobicContact CD1-CB 4.02Å; L201-V225 HydrophobicContact CD1-CG1 4.04Å; A202-V225 PolarHBondContact N-O 3.44Å; V225-F242 HydrophobicContact CG2-CB 4.36Å; V225-V399 HydrophobicContact CG2-CG2 3.78Å; V225-I461 HydrophobicContact CG1-CD1 3.98Å
226	S	93.1	Very high	85.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.2	178.7	-67.4	0	0	0	0	111.8	A202 H241 F242 Q243 M244	A202-S226 CarbonylContact O-C 3.57Å; A202-S226 WeakPolarHBondContact O-CA 3.39Å; S226-H241 PolarHBondContact OG-NE2 3.21Å; S226-F242 PolarHBondContact N-O 2.88Å; S226-Q243 WeakPolarHBondContact O-CA 3.25Å; S226-M244 PolarHBondContact O-N 3.24Å
227	V	91.9	Very high	84.7	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.7	-178.8	-153.5	0	0	0	0	109.8	L201 A202 F203 M244 M246 S395	L201-V227 HydrophobicContact CD1-CG2 3.59Å; L201-V227 HydrophobicContact CG-CG2 4.47Å; A202-V227 PolarHBondContact O-N 3.45Å; F203-V227 HydrophobicContact CD1-CB 3.86Å; F203-V227 HydrophobicContact CD1-CG2 4.11Å; F203-V227 HydrophobicContact CE1-CB 3.79Å; F203-V227 HydrophobicContact CE1-CG2 3.62Å; F203-V227 HydrophobicContact CZ-CG2 4.38Å; V227-M244 WeakPolarHBondContact CA-O 3.41Å; V227-M244 HydrophobicContact CG1-CB 4.37Å; V227-M246 HydrophobicContact CB-CE 4.16Å; V227-M246 HydrophobicContact CG1-CE 3.62Å; V227-M246 HydrophobicContact CG1-CG 4.01Å; V227-S395 VanDerWaalsContact CG2-OG 3.25Å; V227-S395 WeakPolarHBondContact CG2-OG 3.49Å
228	V	89.5	Confident	84.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	143.7	-165.3	-65.1	0	0	0	0	112.1	P204 R230 F232 Q243 M244 A245 M246	P204-V228 HydrophobicContact CG-CG1 3.88Å; V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 WeakPolarHBondContact CB-O 3.37Å; V228-R230 VanDerWaalsContact CG2-O 3.22Å; V228-R230 WeakPolarHBondContact CG2-O 3.47Å; V228-R230 PolarHBondContact O-N 3.14Å; V228-F232 HydrophobicContact CB-CD2 4.23Å; V228-F232 HydrophobicContact CB-CE2 4.05Å; V228-F232 HydrophobicContact CG1-CD2 3.97Å; V228-F232 HydrophobicContact CG1-CE2 3.82Å; V228-Q243 HydrophobicContact CG2-CG 3.79Å; V228-M244 PolarHBondContact N-O 3.35Å; V228-A245 CarbonylContact O-C 3.58Å; V228-A245 WeakPolarHBondContact O-CA 3.27Å; V228-M246 WeakPolarHBondContact O-CG 3.18Å; V228-M246 PolarHBondContact O-N 3.21Å
229	Q	83.6	Confident	84.5	Confident	82 Å²	82	65.6 Å²	65.6	38%	0.383	32%	0.315	S	S	.	.	S	Bend	trans	-70.7	-29.9	-178	-73.3	-179.8	-15.3	0	0	113.6	M246	Q229-M246 HydrophobicContact CG-SD 3.88Å
230	R	82.3	Confident	84.7	Confident	197 Å²	197	62.8 Å²	62.8	74%	0.743	29%	0.29	S	S	*	.	S	Bend	trans	-135.2	151	172.8	-66.9	-176.2	178.2	-174.8	-2.1	107.9	V228 F232	V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 WeakPolarHBondContact CB-O 3.37Å; V228-R230 VanDerWaalsContact CG2-O 3.22Å; V228-R230 WeakPolarHBondContact CG2-O 3.47Å; V228-R230 PolarHBondContact O-N 3.14Å; R230-F232 PolarHBondContact O-N 3.07Å
231	E	83.5	Confident	85	Confident	106 Å²	106	62.3 Å²	62.3	50%	0.495	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-66.9	129.4	175.6	-166.8	-176.3	159.5	0	0	110.3	N460	E231-N460 PolarHBondContact OE1-ND2 3.29Å
232	F	83.4	Confident	85.1	Confident	51 Å²	51	59.1 Å²	59.1	22%	0.224	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-93.8	122.4	168.8	-63.9	-71.7	0	0	0	108.3	L210 V228 R230 R234 Q243	L210-F232 HydrophobicContact CD2-CB 3.69Å; L210-F232 HydrophobicContact CD2-CD2 3.91Å; L210-F232 HydrophobicContact CD2-CG 4.07Å; V228-F232 HydrophobicContact CB-CD2 4.23Å; V228-F232 HydrophobicContact CB-CE2 4.05Å; V228-F232 HydrophobicContact CG1-CD2 3.97Å; V228-F232 HydrophobicContact CG1-CE2 3.82Å; R230-F232 PolarHBondContact O-N 3.07Å; F232-R234 PolarHBondContact O-N 3.43Å; F232-Q243 PolarHBondContact O-NE2 2.89Å
233	P	78.9	Confident	85.2	Confident	97 Å²	97	58.9 Å²	58.9	63%	0.63	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-68.7	128.8	-177.3	26.6	-33.9	0	0	0	111.3
234	R	70.4	Confident	85.1	Confident	64 Å²	64	58.8 Å²	58.8	24%	0.242	27%	0.271	C	S	.	.			trans	-109.2	153.7	-177.2	-62.5	-174.4	-179.3	-141.3	5.6	112.2	E214 F232 H241	E214-R234 IonicContact OE1-NH1 2.76Å; F232-R234 PolarHBondContact O-N 3.43Å; R234-H241 PolarHBondContact NH1-ND1 3.47Å; R234-H241 PolarHBondContact NH1-O 3.07Å; R234-H241 PolarHBondContact NH2-CE1 2.98Å; R234-H241 PolarHBondContact NH2-ND1 3.49Å; R234-H241 PolarHBondContact NH2-NE2 3.37Å
235	H	66.5	Low	84.9	Confident	186 Å²	186	59.6 Å²	59.6	86%	0.861	28%	0.278	S	S	*	.			trans	-132.1	23.8	173	-70.2	70.2	0	0	0	111
236	S	69.6	Low	84.5	Confident	61 Å²	61	60.5 Å²	60.5	43%	0.427	28%	0.282	S	S	.	.			trans	-109.9	143.5	-171.3	172	0	0	0	0	111.5	E214 N238	E214-S236 WeakPolarHBondContact OE1-CB 3.15Å; E214-S236 PolarHBondContact OE1-OG 3.16Å; S236-N238 PolarHBondContact OG-N 2.95Å
237	E	75.6	Confident	84.1	Confident	183 Å²	183	68.6 Å²	68.6	86%	0.855	31%	0.313	S	S	*	.			trans	-88.3	2.5	179.5	-57.5	-166.9	150.6	0	0	113.8	R239	E237-R239 PolarHBondContact O-N 2.93Å; E237-R239 VanDerWaalsContact O-N 3.07Å
238	N	86.4	Confident	83.7	Confident	17 Å²	17	70.2 Å²	70.2	9%	0.091	32%	0.323	C	S	.	.			trans	-60.8	113.3	-173.8	-176.2	0.7	0	0	0	112.4	E214 S217 S236 L240	E214-N238 HydrophobicContact CG-CB 4.26Å; E214-N238 WeakPolarHBondContact CG-ND2 3.47Å; E214-N238 PolarHBondContact O-ND2 2.77Å; E214-N238 WeakPolarHBondContact OE1-CB 3.41Å; S217-N238 PolarHBondContact OG-ND2 3.08Å; S236-N238 PolarHBondContact OG-N 2.95Å; N238-L240 VanDerWaalsContact C-N 3.34Å; N238-L240 PolarHBondContact O-N 3.4Å; N238-L240 WeakPolarHBondContact OD1-CB 3.34Å; N238-L240 PolarHBondContact OD1-N 3.42Å
239	R	87.1	Confident	83.4	Confident	179 Å²	179	73 Å²	73	68%	0.675	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-7.7	-178.5	-62.9	-176.1	173.5	-172.8	-3.6	114.8	E237	E237-R239 PolarHBondContact O-N 2.93Å; E237-R239 VanDerWaalsContact O-N 3.07Å
240	L	90.1	Very high	83	Confident	7 Å²	7	71.7 Å²	71.7	4%	0.037	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-13	-179.2	-59	-177.7	0	0	0	112.9	S217 P223 V224 N238 A437	S217-L240 VanDerWaalsContact O-CD1 3.29Å; S217-L240 WeakPolarHBondContact O-CD1 3.24Å; P223-L240 CarbonylContact C-O 3.45Å; P223-L240 WeakPolarHBondContact CA-O 3.43Å; V224-L240 PolarHBondContact N-O 3.03Å; N238-L240 VanDerWaalsContact C-N 3.34Å; N238-L240 PolarHBondContact O-N 3.4Å; N238-L240 WeakPolarHBondContact OD1-CB 3.34Å; N238-L240 PolarHBondContact OD1-N 3.42Å; L240-A437 HydrophobicContact CD2-CB 3.75Å
241	H	92.3	Very high	82.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.2	-172.7	-170.7	-166	0	0	0	112.3	L210 E214 V224 S226 R234	L210-H241 PolarHBondContact O-CE1 3.36Å; E214-H241 WeakPolarHBondContact CA-ND1 3.32Å; E214-H241 WeakPolarHBondContact CB-ND1 3.34Å; V224-H241 WeakPolarHBondContact O-CA 3.38Å; S226-H241 PolarHBondContact OG-NE2 3.21Å; R234-H241 PolarHBondContact NH1-ND1 3.47Å; R234-H241 PolarHBondContact NH1-O 3.07Å; R234-H241 PolarHBondContact NH2-CE1 2.98Å; R234-H241 PolarHBondContact NH2-ND1 3.49Å; R234-H241 PolarHBondContact NH2-NE2 3.37Å
242	F	92.2	Very high	82.6	Confident	1 Å²	1	60.4 Å²	60.4	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	154.2	179	-61	-91.6	0	0	0	111.8	V224 V225 S226 A437 L440 A441 Q459 I461	V224-F242 PolarHBondContact O-N 2.79Å; V225-F242 HydrophobicContact CG2-CB 4.36Å; S226-F242 PolarHBondContact N-O 2.88Å; F242-A437 HydrophobicContact CE2-CB 4.44Å; F242-L440 HydrophobicContact CD2-CB 4.46Å; F242-L440 HydrophobicContact CD2-CD1 4.29Å; F242-L440 HydrophobicContact CE1-CB 4.29Å; F242-L440 HydrophobicContact CE2-CB 3.73Å; F242-L440 HydrophobicContact CE2-CD1 3.79Å; F242-L440 HydrophobicContact CE2-CG 4.38Å; F242-L440 HydrophobicContact CZ-CB 3.63Å; F242-A441 HydrophobicContact CE1-CB 4.43Å; F242-Q459 WeakPolarHBondContact CA-O 3.28Å; F242-Q459 HydrophobicContact CD1-CB 4.34Å; F242-I461 HydrophobicContact CB-CD1 3.9Å; F242-I461 HydrophobicContact CB-CG1 4.29Å
243	Q	91.1	Very high	82.4	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.009	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.8	-177.9	-174.2	162.3	-72	0	0	111.6	S226 V228 F232 Q459 N460 I461	S226-Q243 WeakPolarHBondContact O-CA 3.25Å; V228-Q243 HydrophobicContact CG2-CG 3.79Å; F232-Q243 PolarHBondContact O-NE2 2.89Å; Q243-Q459 PolarHBondContact N-O 2.94Å; Q243-Q459 VanDerWaalsContact N-O 3.14Å; Q243-N460 CarbonylContact O-C 3.52Å; Q243-N460 WeakPolarHBondContact O-CA 3.47Å; Q243-I461 PolarHBondContact O-N 2.7Å
244	M	91.3	Very high	82.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.6	175.2	-172.6	157.4	167.8	0	0	109.8	S226 V227 V228 Y391 D394 S395 I452 I461	S226-M244 PolarHBondContact O-N 3.24Å; V227-M244 WeakPolarHBondContact CA-O 3.41Å; V227-M244 HydrophobicContact CG1-CB 4.37Å; V228-M244 PolarHBondContact N-O 3.35Å; M244-Y391 HydrophobicContact CE-CD1 3.87Å; M244-D394 HydrophobicContact CE-CB 3.83Å; M244-S395 PolarHBondContact SD-OG 3.38Å; M244-I452 HydrophobicContact CE-CD1 3.71Å; M244-I461 HydrophobicContact CB-CB 4.02Å; M244-I461 HydrophobicContact CB-CD1 4.39Å; M244-I461 HydrophobicContact CB-CG2 4.44Å; M244-I461 HydrophobicContact CG-CB 4.21Å; M244-I461 HydrophobicContact CG-CG2 4.15Å; M244-I461 HydrophobicContact SD-CB 4.37Å; M244-I461 HydrophobicContact SD-CG2 3.76Å
245	A	89.1	Confident	83.4	Confident	18 Å²	18	57.4 Å²	57.4	15%	0.149	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	139.6	173.8	0	0	0	0	0	110.3	V228 R247	V228-A245 CarbonylContact O-C 3.58Å; V228-A245 WeakPolarHBondContact O-CA 3.27Å; A245-R247 HydrophobicContact CB-CB 4.39Å; A245-R247 PolarHBondContact O-N 3.05Å
246	M	86.4	Confident	84.4	Confident	20 Å²	20	48.5 Å²	48.5	10%	0.099	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	49.4	173.1	-62.5	172	161.9	0	0	111.1	F127 V227 V228 Q229 L388 Y391	F127-M246 HydrophobicContact CE1-CE 4.03Å; F127-M246 HydrophobicContact CE2-CE 4.47Å; F127-M246 HydrophobicContact CZ-CE 3.75Å; V227-M246 HydrophobicContact CB-CE 4.16Å; V227-M246 HydrophobicContact CG1-CE 3.62Å; V227-M246 HydrophobicContact CG1-CG 4.01Å; V228-M246 WeakPolarHBondContact O-CG 3.18Å; V228-M246 PolarHBondContact O-N 3.21Å; Q229-M246 HydrophobicContact CG-SD 3.88Å; M246-L388 HydrophobicContact CB-CD2 4.26Å; M246-L388 HydrophobicContact SD-CD2 3.93Å; M246-Y391 HydrophobicContact CB-CD2 4.04Å; M246-Y391 HydrophobicContact CB-CE2 4.17Å; M246-Y391 HydrophobicContact CB-CG 4.22Å; M246-Y391 HydrophobicContact CG-CD2 4.25Å; M246-Y391 HydrophobicContact CG-CG 4.16Å; M246-Y391 PolarHBondContact O-OH 2.99Å
247	R	85.8	Confident	85.2	Confident	170 Å²	170	45.6 Å²	45.6	64%	0.642	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	131.6	-177	155	178.4	149	141	-8.6	108	A245 Y391	A245-R247 HydrophobicContact CB-CB 4.39Å; A245-R247 PolarHBondContact O-N 3.05Å; R247-Y391 WeakPolarHBondContact CA-OH 3.46Å; R247-Y391 PolarHBondContact N-OH 3.46Å
248	T	83.6	Confident	85.8	Confident	34 Å²	34	38.6 Å²	38.6	21%	0.209	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.3	166.7	51.5	0	0	0	0	111.4	P386 Y391 S449 S463 A465	T248-P386 HydrophobicContact CG2-CG 3.83Å; T248-Y391 PolarHBondContact N-OH 3.06Å; T248-S449 WeakPolarHBondContact CG2-O 3.28Å; T248-S463 CarbonylContact C-O 3.6Å; T248-S463 VanDerWaalsContact CA-O 3.23Å; T248-S463 WeakPolarHBondContact CA-O 3.5Å; T248-A465 HydrophobicContact CG2-CB 4.41Å
249	V	81.6	Confident	85.7	Confident	58 Å²	58	40.9 Å²	40.9	35%	0.352	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.1	169	-178	0	0	0	0	108.2	I462 S463 A465	V249-I462 HydrophobicContact CG2-CB 4.3Å; V249-I462 HydrophobicContact CG2-CG2 4.33Å; V249-S463 PolarHBondContact N-O 2.97Å; V249-A465 WeakPolarHBondContact O-CB 3.22Å; V249-A465 PolarHBondContact O-N 3.46Å
250	A	75.5	Confident	85.6	Confident	55 Å²	55	32.7 Å²	32.7	46%	0.455	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-72.5	151.9	177.8	0	0	0	0	0	111.7	M382	A250-M382 HydrophobicContact CB-CE 4.23Å; A250-M382 HydrophobicContact CB-SD 4.07Å
251	A	75.9	Confident	85.2	Confident	8 Å²	8	32.4 Å²	32.4	7%	0.066	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-68.1	136.9	175.4	0	0	0	0	0	110.9	P253 L256 H467 W488	A251-P253 WeakPolarHBondContact O-CD 3.41Å; A251-P253 VanDerWaalsContact O-N 3.15Å; A251-L256 HydrophobicContact CB-CD1 4.03Å; A251-H467 HydrophobicContact CB-CB 3.99Å; A251-W488 HydrophobicContact CB-CB 4.44Å; A251-W488 HydrophobicContact CB-CD2 4.43Å; A251-W488 HydrophobicContact CB-CG 3.87Å
252	P	81.2	Confident	84.6	Confident	58 Å²	58	34.8 Å²	34.8	38%	0.377	19%	0.185	S	C	.	.			trans	-64.1	111.6	174.4	24.2	-31.9	0	0	0	110.2	S254 Q255 L256	P252-S254 VanDerWaalsContact C-N 3.31Å; P252-S254 PolarHBondContact O-N 2.83Å; P252-Q255 HydrophobicContact CB-CB 4.28Å; P252-Q255 HydrophobicContact CG-CB 3.94Å; P252-Q255 PolarHBondContact O-N 2.95Å; P252-Q255 VanDerWaalsContact O-N 3.13Å; P252-L256 PolarHBondContact O-N 2.95Å; P252-L256 VanDerWaalsContact O-N 3.12Å
253	P	80	Confident	83.7	Confident	53 Å²	53	39.1 Å²	39.1	34%	0.344	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-36.7	-168.9	-24.5	35.7	0	0	0	112.9	A251 Q255 L256 L257	A251-P253 WeakPolarHBondContact O-CD 3.41Å; A251-P253 VanDerWaalsContact O-N 3.15Å; P253-Q255 VanDerWaalsContact C-N 3.35Å; P253-Q255 PolarHBondContact O-N 3.18Å; P253-L256 PolarHBondContact O-N 3.16Å; P253-L257 VanDerWaalsContact O-CB 3.24Å; P253-L257 WeakPolarHBondContact O-CB 3.46Å; P253-L257 PolarHBondContact O-N 3.38Å
254	S	85.1	Confident	82.8	Confident	26 Å²	26	41 Å²	41	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-56.9	-43.4	175.4	50.9	0	0	0	0	112.9	P252 Y258	P252-S254 VanDerWaalsContact C-N 3.31Å; P252-S254 PolarHBondContact O-N 2.83Å; S254-Y258 VanDerWaalsContact O-CB 3.3Å; S254-Y258 WeakPolarHBondContact O-CB 3.39Å; S254-Y258 PolarHBondContact O-N 2.79Å; S254-Y258 VanDerWaalsContact O-N 3.11Å
255	Q	85.2	Confident	81.7	Confident	69 Å²	69	42.5 Å²	42.5	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-73.8	-40.2	179.2	-158.8	-172.9	22.9	0	0	111.6	P252 P253 Y258 Y259 L285 W488	P252-Q255 HydrophobicContact CB-CB 4.28Å; P252-Q255 HydrophobicContact CG-CB 3.94Å; P252-Q255 PolarHBondContact O-N 2.95Å; P252-Q255 VanDerWaalsContact O-N 3.13Å; P253-Q255 VanDerWaalsContact C-N 3.35Å; P253-Q255 PolarHBondContact O-N 3.18Å; Q255-Y258 PolarHBondContact O-N 2.76Å; Q255-Y259 HydrophobicContact CG-CD2 4.33Å; Q255-Y259 HydrophobicContact CG-CE2 4.34Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.43Å; Q255-Y259 PolarHBondContact O-N 3Å; Q255-Y259 VanDerWaalsContact O-N 3.08Å; Q255-L285 HydrophobicContact CB-CD1 4.35Å; Q255-W488 HydrophobicContact CB-CH2 4.24Å; Q255-W488 HydrophobicContact CB-CZ2 4.39Å; Q255-W488 HydrophobicContact CG-CH2 4.05Å; Q255-W488 HydrophobicContact CG-CZ2 4.38Å
256	L	87.1	Confident	81.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-47.4	178.5	-174.7	158.3	0	0	0	111.3	A251 P252 P253 Y259 L260 H380 H467 I469 W488	A251-L256 HydrophobicContact CB-CD1 4.03Å; P252-L256 PolarHBondContact O-N 2.95Å; P252-L256 VanDerWaalsContact O-N 3.12Å; P253-L256 PolarHBondContact O-N 3.16Å; L256-Y259 PolarHBondContact O-N 3.39Å; L256-L260 HydrophobicContact CD2-CD1 3.6Å; L256-L260 HydrophobicContact CD2-CG 4.04Å; L256-L260 PolarHBondContact O-N 2.94Å; L256-H380 HydrophobicContact CD2-CB 3.93Å; L256-H380 WeakPolarHBondContact CD2-CD2 3.39Å; L256-H467 WeakPolarHBondContact CD1-CD2 3.26Å; L256-H467 WeakPolarHBondContact CD1-NE2 3.46Å; L256-I469 HydrophobicContact CD2-CG1 4.38Å; L256-W488 HydrophobicContact CB-CD2 4.28Å; L256-W488 HydrophobicContact CB-CE3 3.95Å; L256-W488 HydrophobicContact CB-CH2 4.23Å; L256-W488 HydrophobicContact CB-CZ3 3.96Å; L256-W488 HydrophobicContact CD1-CB 3.79Å; L256-W488 HydrophobicContact CD1-CD2 3.93Å; L256-W488 HydrophobicContact CD1-CE3 3.99Å; L256-W488 HydrophobicContact CD1-CG 3.92Å; L256-W488 HydrophobicContact CG-CD2 4.15Å; L256-W488 HydrophobicContact CG-CE3 3.72Å; L256-W488 HydrophobicContact CG-CZ3 4.15Å
257	L	87.8	Confident	80.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-44.2	176.1	-179.6	66.7	0	0	0	111.9	P253 Y259 L260 L261 F282 V331 F333 V358	P253-L257 VanDerWaalsContact O-CB 3.24Å; P253-L257 WeakPolarHBondContact O-CB 3.46Å; P253-L257 PolarHBondContact O-N 3.38Å; L257-Y259 VanDerWaalsContact C-N 3.3Å; L257-Y259 PolarHBondContact O-N 3.03Å; L257-L260 PolarHBondContact O-N 2.89Å; L257-L260 VanDerWaalsContact O-N 3.14Å; L257-L261 HydrophobicContact CD1-CG 4.49Å; L257-L261 WeakPolarHBondContact O-CG 3.25Å; L257-L261 PolarHBondContact O-N 3.26Å; L257-F282 HydrophobicContact CB-CD2 4.41Å; L257-F282 HydrophobicContact CB-CE2 4.16Å; L257-F282 HydrophobicContact CD2-CD1 4.33Å; L257-F282 HydrophobicContact CD2-CD2 3.88Å; L257-F282 HydrophobicContact CD2-CE1 4.01Å; L257-F282 HydrophobicContact CD2-CE2 3.53Å; L257-F282 HydrophobicContact CD2-CG 4.27Å; L257-F282 HydrophobicContact CD2-CZ 3.6Å; L257-F282 HydrophobicContact CG-CD2 4.27Å; L257-F282 HydrophobicContact CG-CE2 3.66Å; L257-F282 HydrophobicContact CG-CZ 3.99Å; L257-V331 HydrophobicContact CD1-CG1 4.35Å; L257-V331 HydrophobicContact CD2-CG1 3.75Å; L257-F333 HydrophobicContact CD2-CE1 3.93Å; L257-F333 HydrophobicContact CD2-CE2 4.41Å; L257-F333 HydrophobicContact CD2-CZ 3.44Å; L257-F333 VanDerWaalsContact CD2-CZ 3.44Å; L257-V358 HydrophobicContact CD1-CG1 3.63Å
258	Y	87.1	Confident	80.7	Confident	36 Å²	36	38.9 Å²	38.9	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-54.8	-44.3	174	170.6	-92.7	0	0	0	112.2	S254 Q255 M262 L285 I286 N289 F292	S254-Y258 VanDerWaalsContact O-CB 3.3Å; S254-Y258 WeakPolarHBondContact O-CB 3.39Å; S254-Y258 PolarHBondContact O-N 2.79Å; S254-Y258 VanDerWaalsContact O-N 3.11Å; Q255-Y258 PolarHBondContact O-N 2.76Å; Y258-M262 HydrophobicContact CD1-CE 4.08Å; Y258-M262 HydrophobicContact CE1-CE 3.41Å; Y258-M262 VanDerWaalsContact CE1-CE 3.41Å; Y258-M262 HydrophobicContact CE1-CG 4.47Å; Y258-M262 HydrophobicContact CE1-SD 3.84Å; Y258-M262 PolarHBondContact O-N 2.95Å; Y258-M262 VanDerWaalsContact O-N 3.16Å; Y258-L285 HydrophobicContact CD2-CB 3.92Å; Y258-L285 HydrophobicContact CE2-CB 4.42Å; Y258-L285 WeakPolarHBondContact CE2-O 3.06Å; Y258-L285 HydrophobicContact CG-CB 4.28Å; Y258-I286 HydrophobicContact CD2-CD1 3.89Å; Y258-I286 HydrophobicContact CD2-CG1 4.46Å; Y258-I286 HydrophobicContact CE2-CD1 4.49Å; Y258-N289 HydrophobicContact CE2-CB 4.34Å; Y258-N289 PolarHBondContact OH-ND2 3Å; Y258-F292 AromaticContact CD2-CE2 3.99Å; Y258-F292 HydrophobicContact CD2-CE2 3.99Å; Y258-F292 HydrophobicContact CE2-CD2 4.19Å; Y258-F292 AromaticContact CE2-CE2 3.62Å; Y258-F292 HydrophobicContact CE2-CE2 3.62Å
259	Y	84.9	Confident	80.8	Confident	65 Å²	65	37.3 Å²	37.3	26%	0.255	21%	0.206	S	C	.	.	H	α-helix	trans	-67.4	-40.4	174.8	-91.1	-78.4	0	0	0	113.1	Q255 L256 L257 L261 M262 M263 W488 G491 R492	Q255-Y259 HydrophobicContact CG-CD2 4.33Å; Q255-Y259 HydrophobicContact CG-CE2 4.34Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.43Å; Q255-Y259 PolarHBondContact O-N 3Å; Q255-Y259 VanDerWaalsContact O-N 3.08Å; L256-Y259 PolarHBondContact O-N 3.39Å; L257-Y259 VanDerWaalsContact C-N 3.3Å; L257-Y259 PolarHBondContact O-N 3.03Å; Y259-L261 PolarHBondContact O-N 3.06Å; Y259-M262 HydrophobicContact CD1-CE 3.91Å; Y259-M262 HydrophobicContact CE1-CE 4Å; Y259-M262 PolarHBondContact O-N 3.01Å; Y259-M263 WeakPolarHBondContact O-CG 3.32Å; Y259-M263 PolarHBondContact O-N 3.11Å; Y259-W488 AromaticContact CD2-CH2 3.83Å; Y259-W488 HydrophobicContact CD2-CH2 3.83Å; Y259-W488 AromaticContact CD2-CZ3 3.95Å; Y259-W488 HydrophobicContact CD2-CZ3 3.95Å; Y259-W488 HydrophobicContact CE2-CH2 4.36Å; Y259-W488 HydrophobicContact CG-CZ3 4.3Å; Y259-G491 WeakPolarHBondContact CE2-O 3.5Å; Y259-G491 VanDerWaalsContact CZ-O 3.29Å; Y259-R492 HydrophobicContact CE1-CG 4.45Å
260	L	83.4	Confident	81.1	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-45.2	175.8	-75.2	177.2	0	0	0	111.9	L256 L257 M263 N264 I469 V493	L256-L260 HydrophobicContact CD2-CD1 3.6Å; L256-L260 HydrophobicContact CD2-CG 4.04Å; L256-L260 PolarHBondContact O-N 2.94Å; L257-L260 PolarHBondContact O-N 2.89Å; L257-L260 VanDerWaalsContact O-N 3.14Å; L260-M263 PolarHBondContact O-N 2.86Å; L260-N264 PolarHBondContact O-N 3.26Å; L260-N264 VanDerWaalsContact O-N 3.15Å; L260-N264 PolarHBondContact O-ND2 3Å; L260-I469 HydrophobicContact CD1-CG1 4.31Å; L260-I469 HydrophobicContact CD2-CD1 4Å; L260-I469 HydrophobicContact CD2-CG1 4.14Å; L260-I469 HydrophobicContact CD2-CG2 4.18Å; L260-V493 HydrophobicContact CD2-CG2 4.14Å; L260-V493 HydrophobicContact CG-CG2 4.48Å
261	L	83.8	Confident	81.7	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-41.8	178.7	-62.8	-178.4	0	0	0	111.6	L257 Y259 G265 W266 F269 F282 I286 F292 V331	L257-L261 HydrophobicContact CD1-CG 4.49Å; L257-L261 WeakPolarHBondContact O-CG 3.25Å; L257-L261 PolarHBondContact O-N 3.26Å; Y259-L261 PolarHBondContact O-N 3.06Å; L261-G265 PolarHBondContact O-N 2.83Å; L261-W266 HydrophobicContact CD2-CB 4.18Å; L261-W266 HydrophobicContact CD2-CE3 3.89Å; L261-W266 PolarHBondContact O-N 2.98Å; L261-F269 HydrophobicContact CD1-CD1 3.98Å; L261-F269 HydrophobicContact CD1-CD2 4.24Å; L261-F269 HydrophobicContact CD1-CE1 3.82Å; L261-F269 HydrophobicContact CD1-CE2 4.09Å; L261-F269 HydrophobicContact CD1-CG 4.2Å; L261-F269 HydrophobicContact CD1-CZ 3.87Å; L261-F282 HydrophobicContact CD1-CE2 4.17Å; L261-F282 HydrophobicContact CD1-CZ 3.71Å; L261-I286 HydrophobicContact CD1-CD1 4.47Å; L261-F292 HydrophobicContact CB-CE1 3.76Å; L261-F292 HydrophobicContact CB-CZ 3.95Å; L261-V331 HydrophobicContact CD1-CG2 4.42Å; L261-V331 HydrophobicContact CD2-CG2 4.39Å
262	M	79.4	Confident	82.2	Confident	50 Å²	50	31.6 Å²	31.6	25%	0.246	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-45.9	174.8	-74.5	-156.7	-54.3	0	0	112.8	Y258 Y259 N264 G265 W267 F292	Y258-M262 HydrophobicContact CD1-CE 4.08Å; Y258-M262 HydrophobicContact CE1-CE 3.41Å; Y258-M262 VanDerWaalsContact CE1-CE 3.41Å; Y258-M262 HydrophobicContact CE1-CG 4.47Å; Y258-M262 HydrophobicContact CE1-SD 3.84Å; Y258-M262 PolarHBondContact O-N 2.95Å; Y258-M262 VanDerWaalsContact O-N 3.16Å; Y259-M262 HydrophobicContact CD1-CE 3.91Å; Y259-M262 HydrophobicContact CE1-CE 4Å; Y259-M262 PolarHBondContact O-N 3.01Å; M262-N264 VanDerWaalsContact C-N 3.33Å; M262-N264 PolarHBondContact O-N 2.92Å; M262-G265 PolarHBondContact O-N 3.03Å; M262-G265 VanDerWaalsContact O-N 3.17Å; M262-W267 HydrophobicContact CB-CH2 4.33Å; M262-W267 HydrophobicContact CG-CH2 4.11Å; M262-W267 HydrophobicContact CG-CZ3 3.99Å; M262-F292 HydrophobicContact CB-CZ 4.39Å; M262-F292 HydrophobicContact CG-CE2 3.62Å; M262-F292 HydrophobicContact CG-CZ 3.45Å; M262-F292 VanDerWaalsContact CG-CZ 3.45Å; M262-F292 HydrophobicContact SD-CE2 4.42Å
263	M	72.4	Confident	82.5	Confident	93 Å²	93	29.7 Å²	29.7	46%	0.458	15%	0.152	S	C	.	.	H	α-helix	trans	-68.3	-31	-176.6	-66.5	-150.1	-41.9	0	0	113.1	Y259 L260 G265 V493 M495	Y259-M263 WeakPolarHBondContact O-CG 3.32Å; Y259-M263 PolarHBondContact O-N 3.11Å; L260-M263 PolarHBondContact O-N 2.86Å; M263-G265 VanDerWaalsContact C-N 3.32Å; M263-V493 HydrophobicContact CE-CB 3.64Å; M263-V493 HydrophobicContact CE-CG1 3.62Å; M263-V493 HydrophobicContact CE-CG2 4.5Å; M263-V493 HydrophobicContact SD-CB 4.38Å; M263-M495 HydrophobicContact CE-CG 4.07Å; M263-M495 HydrophobicContact CE-SD 3.68Å
264	N	72.7	Confident	82.5	Confident	41 Å²	41	27.9 Å²	27.9	22%	0.219	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-3.2	175.4	-68.3	-80.6	0	0	0	113.3	L260 M262 W266 W500	L260-N264 PolarHBondContact O-N 3.26Å; L260-N264 VanDerWaalsContact O-N 3.15Å; L260-N264 PolarHBondContact O-ND2 3Å; M262-N264 VanDerWaalsContact C-N 3.33Å; M262-N264 PolarHBondContact O-N 2.92Å; N264-W266 VanDerWaalsContact C-N 3.26Å; N264-W266 HydrophobicContact CB-CD2 3.65Å; N264-W266 HydrophobicContact CB-CE3 4.12Å; N264-W266 HydrophobicContact CB-CG 3.92Å; N264-W266 HydrophobicContact CB-CH2 4.47Å; N264-W266 HydrophobicContact CB-CZ2 4.06Å; N264-W266 HydrophobicContact CB-CZ3 4.49Å; N264-W266 VanDerWaalsContact O-CD1 3.31Å; N264-W266 PolarHBondContact O-N 3.06Å; N264-W500 WeakPolarHBondContact OD1-CZ2 3.44Å
265	G	67.9	Low	82.3	Confident	31 Å²	31	31.7 Å²	31.7	32%	0.32	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	26.3	-175.9	0	0	0	0	0	113.8	L261 M262 M263 W267	L261-G265 PolarHBondContact O-N 2.83Å; M262-G265 PolarHBondContact O-N 3.03Å; M262-G265 VanDerWaalsContact O-N 3.17Å; M263-G265 VanDerWaalsContact C-N 3.32Å; G265-W267 VanDerWaalsContact C-N 3.25Å; G265-W267 PolarHBondContact O-N 3.24Å; G265-W267 PolarHBondContact O-NE1 3.43Å
266	W	79.6	Confident	81.9	Confident	31 Å²	31	36.6 Å²	36.6	12%	0.117	18%	0.178	C	C	.	.			trans	-86	68.7	-178.6	-65.6	-12.8	0	0	0	110.6	L261 N264 H356 V358 L378	L261-W266 HydrophobicContact CD2-CB 4.18Å; L261-W266 HydrophobicContact CD2-CE3 3.89Å; L261-W266 PolarHBondContact O-N 2.98Å; N264-W266 VanDerWaalsContact C-N 3.26Å; N264-W266 HydrophobicContact CB-CD2 3.65Å; N264-W266 HydrophobicContact CB-CE3 4.12Å; N264-W266 HydrophobicContact CB-CG 3.92Å; N264-W266 HydrophobicContact CB-CH2 4.47Å; N264-W266 HydrophobicContact CB-CZ2 4.06Å; N264-W266 HydrophobicContact CB-CZ3 4.49Å; N264-W266 VanDerWaalsContact O-CD1 3.31Å; N264-W266 PolarHBondContact O-N 3.06Å; W266-H356 HydrophobicContact CD2-CB 4.4Å; W266-H356 AromaticContact CE2-CD2 3.46Å; W266-H356 VanDerWaalsContact CE2-CD2 3.46Å; W266-H356 AromaticContact CE2-CG 3.85Å; W266-H356 HydrophobicContact CE3-CB 4.44Å; W266-H356 HydrophobicContact CH2-CB 3.64Å; W266-H356 HydrophobicContact CZ2-CB 3.55Å; W266-H356 AromaticContact CZ2-CD2 3.54Å; W266-H356 AromaticContact CZ2-CG 3.5Å; W266-H356 VanDerWaalsContact CZ2-CG 3.5Å; W266-H356 HydrophobicContact CZ3-CB 4.09Å; W266-H356 AromaticContact NE1-CD2 3.36Å; W266-H356 PolarHBondContact NE1-CD2 3.18Å; W266-H356 AromaticContact NE1-NE2 3.96Å; W266-V358 HydrophobicContact CE3-CG2 4.13Å; W266-V358 HydrophobicContact CZ3-CG2 3.54Å; W266-L378 HydrophobicContact CH2-CD1 3.67Å; W266-L378 HydrophobicContact CH2-CG 4.25Å; W266-L378 HydrophobicContact CZ3-CD1 3.74Å
267	W	78.1	Confident	81.4	Confident	70 Å²	70	43.3 Å²	43.3	27%	0.265	20%	0.203	S	C	.	.			trans	-70.2	-35.9	-178.6	-54.6	112.7	0	0	0	112.8	M262 G265 R291 F292 H293	M262-W267 HydrophobicContact CB-CH2 4.33Å; M262-W267 HydrophobicContact CG-CH2 4.11Å; M262-W267 HydrophobicContact CG-CZ3 3.99Å; G265-W267 VanDerWaalsContact C-N 3.25Å; G265-W267 PolarHBondContact O-N 3.24Å; G265-W267 PolarHBondContact O-NE1 3.43Å; W267-R291 WeakPolarHBondContact CB-O 3.41Å; W267-R291 HydrophobicContact CD2-CB 4.15Å; W267-R291 HydrophobicContact CE3-CB 3.49Å; W267-R291 VanDerWaalsContact CE3-CB 3.49Å; W267-R291 HydrophobicContact CH2-CB 4.4Å; W267-R291 HydrophobicContact CZ3-CB 3.63Å; W267-R291 HydrophobicContact CZ3-CG 4.44Å; W267-F292 AromaticContact CE3-CD1 3.94Å; W267-F292 HydrophobicContact CE3-CD1 3.94Å; W267-F292 HydrophobicContact CE3-CD2 4.43Å; W267-F292 AromaticContact CE3-CE1 3.79Å; W267-F292 HydrophobicContact CE3-CE1 3.79Å; W267-F292 HydrophobicContact CE3-CE2 4.31Å; W267-F292 HydrophobicContact CE3-CG 4.27Å; W267-F292 HydrophobicContact CE3-CZ 4Å; W267-F292 HydrophobicContact CZ3-CD2 4.41Å; W267-F292 HydrophobicContact CZ3-CE1 4.15Å; W267-F292 AromaticContact CZ3-CE2 4Å; W267-F292 HydrophobicContact CZ3-CE2 4Å; W267-F292 AromaticContact CZ3-CZ 3.87Å; W267-F292 HydrophobicContact CZ3-CZ 3.87Å; W267-H293 PolarHBondContact O-N 3.03Å
268	D	83.5	Confident	81	Confident	32 Å²	32	50.2 Å²	50.2	17%	0.171	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.1	177.5	-51.8	-72.2	0	0	0	111.1	H293 S326 R328 G329	D268-H293 IonicContact OD1-CD2 2.71Å; D268-S326 WeakPolarHBondContact CB-O 3.03Å; D268-R328 PolarHBondContact O-N 3.39Å; D268-R328 IonicContact OD2-NH1 3.14Å; D268-R328 PolarHBondContact OD2-NH1 2.92Å; D268-G329 PolarHBondContact O-N 3.28Å
269	F	85.5	Confident	80.8	Confident	1 Å²	1	49 Å²	49	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.4	-179.8	72.7	-83.6	0	0	0	114.2	L261 I271 F282 I286 F292 H293 L294 G295 G329 V331	L261-F269 HydrophobicContact CD1-CD1 3.98Å; L261-F269 HydrophobicContact CD1-CD2 4.24Å; L261-F269 HydrophobicContact CD1-CE1 3.82Å; L261-F269 HydrophobicContact CD1-CE2 4.09Å; L261-F269 HydrophobicContact CD1-CG 4.2Å; L261-F269 HydrophobicContact CD1-CZ 3.87Å; F269-I271 HydrophobicContact CD2-CG1 4.14Å; F269-I271 HydrophobicContact CE2-CD1 4.02Å; F269-I271 HydrophobicContact CE2-CG1 3.79Å; F269-F282 AromaticContact CE2-CE1 3.85Å; F269-F282 HydrophobicContact CE2-CE1 3.85Å; F269-F282 AromaticContact CE2-CZ 3.88Å; F269-F282 HydrophobicContact CE2-CZ 3.88Å; F269-F282 HydrophobicContact CZ-CE1 4.04Å; F269-F282 AromaticContact CZ-CZ 3.83Å; F269-F282 HydrophobicContact CZ-CZ 3.83Å; F269-I286 HydrophobicContact CE1-CD1 3.91Å; F269-I286 HydrophobicContact CE1-CG2 4.39Å; F269-I286 HydrophobicContact CZ-CD1 3.77Å; F269-I286 HydrophobicContact CZ-CG1 4.01Å; F269-I286 HydrophobicContact CZ-CG2 4.13Å; F269-F292 HydrophobicContact CD1-CD1 4.19Å; F269-F292 HydrophobicContact CE1-CB 4.49Å; F269-F292 AromaticContact CE1-CD1 3.73Å; F269-F292 HydrophobicContact CE1-CD1 3.73Å; F269-F292 HydrophobicContact CE1-CE1 4.31Å; F269-F292 HydrophobicContact CE1-CG 4.37Å; F269-H293 PolarHBondContact N-O 2.98Å; F269-L294 HydrophobicContact CE2-CD1 4.06Å; F269-L294 HydrophobicContact CZ-CD1 4.42Å; F269-G295 PolarHBondContact O-N 3.1Å; F269-G329 CarbonylContact C-O 3.58Å; F269-G329 VanDerWaalsContact CA-O 3.25Å; F269-G329 WeakPolarHBondContact CA-O 3.49Å; F269-G329 WeakPolarHBondContact CB-O 3.15Å; F269-V331 HydrophobicContact CD2-CG2 3.88Å; F269-V331 HydrophobicContact CE2-CG2 4.36Å
270	S	86.8	Confident	80.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	158	170.9	-82.4	0	0	0	0	111.3	T296 G329 V331	S270-T296 WeakPolarHBondContact CB-O 3.29Å; S270-T296 PolarHBondContact OG-N 2.61Å; S270-T296 PolarHBondContact OG-O 2.68Å; S270-T296 PolarHBondContact OG-OG1 3.05Å; S270-G329 PolarHBondContact N-O 2.9Å; S270-V331 PolarHBondContact O-N 3.13Å
271	I	87.9	Confident	80.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.6	177.3	-62.2	175.3	0	0	0	109.5	F269 I279 F282 L283 L294 T296 L297 V298 V331 F333	F269-I271 HydrophobicContact CD2-CG1 4.14Å; F269-I271 HydrophobicContact CE2-CD1 4.02Å; F269-I271 HydrophobicContact CE2-CG1 3.79Å; I271-I279 HydrophobicContact CG2-CD1 4.07Å; I271-F282 HydrophobicContact CD1-CD1 4.4Å; I271-F282 HydrophobicContact CD1-CE1 4Å; I271-L283 HydrophobicContact CD1-CD2 3.9Å; I271-L294 HydrophobicContact CD1-CD1 3.56Å; I271-L294 HydrophobicContact CG1-CD1 3.72Å; I271-T296 PolarHBondContact N-O 3.03Å; I271-L297 HydrophobicContact CB-CD1 3.68Å; I271-L297 HydrophobicContact CG2-CD1 3.59Å; I271-L297 WeakPolarHBondContact O-CA 3.39Å; I271-V298 PolarHBondContact O-N 3.12Å; I271-V331 CarbonylContact C-O 3.59Å; I271-V331 WeakPolarHBondContact CA-O 3.22Å; I271-F333 HydrophobicContact CG2-CD2 3.69Å; I271-F333 HydrophobicContact CG2-CE2 3.95Å
272	V	87.2	Confident	81	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127	174.8	178	0	0	0	0	109.4	V298 L300 V330 V331 T332 F333 L343	V272-V298 WeakPolarHBondContact CA-O 3.38Å; V272-V298 HydrophobicContact CG2-CB 4.38Å; V272-L300 HydrophobicContact CG1-CD1 3.49Å; V272-L300 VanDerWaalsContact CG1-CD1 3.49Å; V272-L300 HydrophobicContact CG1-CG 4.05Å; V272-V330 HydrophobicContact CG2-CG1 3.78Å; V272-V331 PolarHBondContact N-O 3.16Å; V272-T332 HydrophobicContact CB-CG2 4.26Å; V272-T332 CarbonylContact O-C 3.58Å; V272-T332 WeakPolarHBondContact O-CA 3.35Å; V272-F333 PolarHBondContact O-N 2.9Å; V272-L343 HydrophobicContact CG1-CD1 4.23Å
273	L	86.4	Confident	81.3	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.7	174.8	-83.9	162.4	0	0	0	109.5	Q275 W277 I279 L297 V298 N299 L300 F333	L273-Q275 WeakPolarHBondContact CD2-O 3.44Å; L273-W277 HydrophobicContact CD2-CB 3.87Å; L273-I279 HydrophobicContact CD1-CD1 3.88Å; L273-I279 HydrophobicContact CD2-CD1 3.62Å; L273-I279 HydrophobicContact CD2-CG1 4.23Å; L273-I279 HydrophobicContact CG-CD1 3.81Å; L273-L297 HydrophobicContact CD1-CD1 4.05Å; L273-V298 PolarHBondContact N-O 3.12Å; L273-N299 HydrophobicContact CB-CB 4.36Å; L273-L300 VanDerWaalsContact O-CB 3.29Å; L273-L300 WeakPolarHBondContact O-CB 3.34Å; L273-L300 WeakPolarHBondContact O-CG 3.21Å; L273-L300 PolarHBondContact O-N 2.87Å; L273-F333 HydrophobicContact CD2-CB 4.11Å
274	C	81.5	Confident	81.9	Confident	15 Å²	15	58.7 Å²	58.7	10%	0.101	28%	0.281	C	S	.	.	S	Bend	trans	-89.8	-32	169.5	-60.9	0	0	0	0	112.5	T301 F333 G334 C335	C274-T301 WeakPolarHBondContact O-CG2 3.29Å; C274-F333 PolarHBondContact N-O 3.45Å; C274-G334 WeakPolarHBondContact CB-O 3.46Å; C274-C335 HydrophobicContact CB-CB 3.82Å; C274-C335 WeakPolarHBondContact CB-SG 3.34Å; C274-C335 WeakPolarHBondContact SG-CB 3.49Å; C274-C335 CovalentContact SG-SG 2.03Å; C274-C335 PolarHBondContact SG-SG 3.09Å
275	Q	80.3	Confident	82.5	Confident	105 Å²	105	59 Å²	59	49%	0.491	28%	0.283	S	S	.	.	S	Bend	trans	-138.7	165.9	-179.2	-61.9	-179.2	39.9	0	0	109.5	L273 W277 G334	L273-Q275 WeakPolarHBondContact CD2-O 3.44Å; Q275-W277 PolarHBondContact O-N 3.08Å; Q275-G334 WeakPolarHBondContact CG-O 3.49Å; Q275-G334 PolarHBondContact NE2-O 2.99Å
276	E	75.9	Confident	83.3	Confident	173 Å²	173	57.9 Å²	57.9	81%	0.808	27%	0.269	S	S	*	.			trans	-65.8	121.1	175.9	-66	-170.9	170.7	0	0	110.6
277	W	78.4	Confident	83.4	Confident	140 Å²	140	64.8 Å²	64.8	53%	0.53	30%	0.3	S	S	.	.			trans	-139.7	144.3	-172.5	-155.2	-109.9	0	0	0	111.5	L273 Q275 I279 F333 D361	L273-W277 HydrophobicContact CD2-CB 3.87Å; Q275-W277 PolarHBondContact O-N 3.08Å; W277-I279 PolarHBondContact O-N 3.22Å; W277-F333 HydrophobicContact CB-CB 4.35Å; W277-F333 AromaticContact CD1-CD1 3.91Å; W277-F333 HydrophobicContact CG-CB 4.26Å; W277-D361 VanDerWaalsContact CE2-OD1 3.24Å; W277-D361 HydrophobicContact CZ2-CB 4.48Å; W277-D361 PolarHBondContact NE1-OD1 3Å
278	K	79.2	Confident	83.8	Confident	145 Å²	145	67.8 Å²	67.8	63%	0.63	32%	0.321	S	S	*	.			trans	-81.1	78.3	-175.4	-71.9	-179.6	175.8	171.5	0	111.6	E64 N280	E64-K278 WeakPolarHBondContact OE1-CE 3.25Å; E64-K278 IonicContact OE1-NZ 3.71Å; E64-K278 PolarHBondContact OE1-NZ 3.12Å; E64-K278 IonicContact OE2-NZ 3.45Å; E64-K278 PolarHBondContact OE2-NZ 3.24Å; K278-N280 VanDerWaalsContact C-N 3.31Å; K278-N280 PolarHBondContact O-N 3.12Å
279	I	82	Confident	83.4	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.056	32%	0.322	C	S	.	.			trans	-82.8	-1.5	178	-35.7	161.9	0	0	0	113.3	I271 L273 W277 D281 F282 L283 F333	I271-I279 HydrophobicContact CG2-CD1 4.07Å; L273-I279 HydrophobicContact CD1-CD1 3.88Å; L273-I279 HydrophobicContact CD2-CD1 3.62Å; L273-I279 HydrophobicContact CD2-CG1 4.23Å; L273-I279 HydrophobicContact CG-CD1 3.81Å; W277-I279 PolarHBondContact O-N 3.22Å; I279-D281 VanDerWaalsContact C-N 3.32Å; I279-D281 PolarHBondContact O-N 2.88Å; I279-D281 VanDerWaalsContact O-N 3.15Å; I279-F282 HydrophobicContact CG2-CB 3.88Å; I279-F282 HydrophobicContact CG2-CD1 3.63Å; I279-F282 HydrophobicContact CG2-CG 4.22Å; I279-F282 PolarHBondContact O-N 3.05Å; I279-L283 HydrophobicContact CB-CD1 4.38Å; I279-L283 HydrophobicContact CB-CG 4.36Å; I279-L283 HydrophobicContact CG2-CG 4.11Å; I279-L283 PolarHBondContact O-N 3.19Å; I279-F333 HydrophobicContact CD1-CD2 3.86Å; I279-F333 HydrophobicContact CD1-CE2 4.32Å; I279-F333 HydrophobicContact CD1-CG 4.44Å; I279-F333 HydrophobicContact CG1-CD2 3.97Å; I279-F333 HydrophobicContact CG1-CE2 4.3Å; I279-F333 HydrophobicContact CG1-CG 4.2Å; I279-F333 HydrophobicContact CG2-CD2 4.11Å; I279-F333 HydrophobicContact CG2-CE1 4.45Å; I279-F333 HydrophobicContact CG2-CE2 3.58Å; I279-F333 HydrophobicContact CG2-CZ 3.76Å
280	N	85.1	Confident	82.9	Confident	121 Å²	121	73.3 Å²	73.3	65%	0.647	36%	0.36	S	S	*	.	H	α-helix	trans	-51.3	-45	-170.3	-70.4	-11.4	0	0	0	113.9	K278 L283 F284	K278-N280 VanDerWaalsContact C-N 3.31Å; K278-N280 PolarHBondContact O-N 3.12Å; N280-L283 PolarHBondContact O-N 2.56Å; N280-F284 WeakPolarHBondContact O-CB 3.37Å; N280-F284 PolarHBondContact O-N 2.97Å
281	D	83.9	Confident	82.4	Confident	110 Å²	110	81.1 Å²	81.1	59%	0.588	39%	0.389	S	S	*	.	H	α-helix	trans	-67.2	-38.8	-178.5	-54.4	-20.9	0	0	0	112.2	I279 F284 L285	I279-D281 VanDerWaalsContact C-N 3.32Å; I279-D281 PolarHBondContact O-N 2.88Å; I279-D281 VanDerWaalsContact O-N 3.15Å; D281-F284 PolarHBondContact O-N 3.33Å; D281-L285 WeakPolarHBondContact O-CG 3.27Å; D281-L285 PolarHBondContact O-N 3.1Å
282	F	86.6	Confident	82	Confident	3 Å²	3	81.9 Å²	81.9	1%	0.013	39%	0.392	C	S	.	.	H	α-helix	trans	-68.6	-43	175.7	175.1	-110.2	0	0	0	111.1	L257 L261 F269 I271 I279 F284 L285 I286 F333	L257-F282 HydrophobicContact CB-CD2 4.41Å; L257-F282 HydrophobicContact CB-CE2 4.16Å; L257-F282 HydrophobicContact CD2-CD1 4.33Å; L257-F282 HydrophobicContact CD2-CD2 3.88Å; L257-F282 HydrophobicContact CD2-CE1 4.01Å; L257-F282 HydrophobicContact CD2-CE2 3.53Å; L257-F282 HydrophobicContact CD2-CG 4.27Å; L257-F282 HydrophobicContact CD2-CZ 3.6Å; L257-F282 HydrophobicContact CG-CD2 4.27Å; L257-F282 HydrophobicContact CG-CE2 3.66Å; L257-F282 HydrophobicContact CG-CZ 3.99Å; L261-F282 HydrophobicContact CD1-CE2 4.17Å; L261-F282 HydrophobicContact CD1-CZ 3.71Å; F269-F282 AromaticContact CE2-CE1 3.85Å; F269-F282 HydrophobicContact CE2-CE1 3.85Å; F269-F282 AromaticContact CE2-CZ 3.88Å; F269-F282 HydrophobicContact CE2-CZ 3.88Å; F269-F282 HydrophobicContact CZ-CE1 4.04Å; F269-F282 AromaticContact CZ-CZ 3.83Å; F269-F282 HydrophobicContact CZ-CZ 3.83Å; I271-F282 HydrophobicContact CD1-CD1 4.4Å; I271-F282 HydrophobicContact CD1-CE1 4Å; I279-F282 HydrophobicContact CG2-CB 3.88Å; I279-F282 HydrophobicContact CG2-CD1 3.63Å; I279-F282 HydrophobicContact CG2-CG 4.22Å; I279-F282 PolarHBondContact O-N 3.05Å; F282-F284 VanDerWaalsContact C-N 3.26Å; F282-F284 PolarHBondContact O-N 3.22Å; F282-L285 PolarHBondContact O-N 2.79Å; F282-I286 HydrophobicContact CD1-CG1 4.45Å; F282-I286 HydrophobicContact CD2-CG1 4.14Å; F282-I286 HydrophobicContact CE1-CG1 4.11Å; F282-I286 HydrophobicContact CE2-CD1 3.93Å; F282-I286 HydrophobicContact CE2-CG1 3.75Å; F282-I286 HydrophobicContact CG-CG1 4.48Å; F282-I286 HydrophobicContact CZ-CD1 3.95Å; F282-I286 HydrophobicContact CZ-CG1 3.73Å; F282-I286 WeakPolarHBondContact O-CB 3.5Å; F282-I286 VanDerWaalsContact O-CG1 3.26Å; F282-I286 WeakPolarHBondContact O-CG1 3.48Å; F282-I286 PolarHBondContact O-N 3.29Å; F282-F333 HydrophobicContact CD1-CE2 4.1Å; F282-F333 AromaticContact CD1-CZ 3.8Å; F282-F333 HydrophobicContact CD1-CZ 3.8Å; F282-F333 HydrophobicContact CE1-CE2 4.22Å; F282-F333 HydrophobicContact CE1-CZ 4.1Å; F282-F333 HydrophobicContact CG-CZ 4.29Å
283	L	85.6	Confident	81.7	Confident	37 Å²	37	87.1 Å²	87.1	19%	0.194	42%	0.417	C	S	.	.	H	α-helix	trans	-62.4	-33.5	174.2	-67.9	175.7	0	0	0	112.2	I271 I279 N280 K287 L294	I271-L283 HydrophobicContact CD1-CD2 3.9Å; I279-L283 HydrophobicContact CB-CD1 4.38Å; I279-L283 HydrophobicContact CB-CG 4.36Å; I279-L283 HydrophobicContact CG2-CG 4.11Å; I279-L283 PolarHBondContact O-N 3.19Å; N280-L283 PolarHBondContact O-N 2.56Å; L283-K287 VanDerWaalsContact O-CB 3.31Å; L283-K287 WeakPolarHBondContact O-CB 3.44Å; L283-K287 VanDerWaalsContact O-CG 3.23Å; L283-K287 WeakPolarHBondContact O-CG 3.49Å; L283-K287 PolarHBondContact O-N 3.13Å; L283-L294 HydrophobicContact CD2-CD2 3.98Å
284	F	86.1	Confident	81.4	Confident	148 Å²	148	89.9 Å²	89.9	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-67.8	-48.8	173.8	-178.4	-97.1	0	0	0	112	N280 D281 F282 I286 K287 N288	N280-F284 WeakPolarHBondContact O-CB 3.37Å; N280-F284 PolarHBondContact O-N 2.97Å; D281-F284 PolarHBondContact O-N 3.33Å; F282-F284 VanDerWaalsContact C-N 3.26Å; F282-F284 PolarHBondContact O-N 3.22Å; F284-I286 VanDerWaalsContact C-N 3.31Å; F284-I286 PolarHBondContact O-N 2.89Å; F284-K287 PolarHBondContact O-N 3.41Å; F284-N288 PolarHBondContact O-N 3.12Å; F284-N288 VanDerWaalsContact O-N 3.13Å
285	L	84.3	Confident	81.2	Confident	47 Å²	47	90.4 Å²	90.4	25%	0.246	44%	0.439	C	S	.	.	H	α-helix	trans	-57.6	-42.5	176	-72.2	172.4	0	0	0	112.3	Q255 Y258 D281 F282	Q255-L285 HydrophobicContact CB-CD1 4.35Å; Y258-L285 HydrophobicContact CD2-CB 3.92Å; Y258-L285 HydrophobicContact CE2-CB 4.42Å; Y258-L285 WeakPolarHBondContact CE2-O 3.06Å; Y258-L285 HydrophobicContact CG-CB 4.28Å; D281-L285 WeakPolarHBondContact O-CG 3.27Å; D281-L285 PolarHBondContact O-N 3.1Å; F282-L285 PolarHBondContact O-N 2.79Å
286	I	85.3	Confident	81	Confident	8 Å²	8	86.7 Å²	86.7	4%	0.041	42%	0.424	C	S	.	.	H	α-helix	trans	-67.9	-47.7	178.4	-68.8	-69.7	0	0	0	111.4	Y258 L261 F269 F282 F284 N288 N289 F292	Y258-I286 HydrophobicContact CD2-CD1 3.89Å; Y258-I286 HydrophobicContact CD2-CG1 4.46Å; Y258-I286 HydrophobicContact CE2-CD1 4.49Å; L261-I286 HydrophobicContact CD1-CD1 4.47Å; F269-I286 HydrophobicContact CE1-CD1 3.91Å; F269-I286 HydrophobicContact CE1-CG2 4.39Å; F269-I286 HydrophobicContact CZ-CD1 3.77Å; F269-I286 HydrophobicContact CZ-CG1 4.01Å; F269-I286 HydrophobicContact CZ-CG2 4.13Å; F282-I286 HydrophobicContact CD1-CG1 4.45Å; F282-I286 HydrophobicContact CD2-CG1 4.14Å; F282-I286 HydrophobicContact CE1-CG1 4.11Å; F282-I286 HydrophobicContact CE2-CD1 3.93Å; F282-I286 HydrophobicContact CE2-CG1 3.75Å; F282-I286 HydrophobicContact CG-CG1 4.48Å; F282-I286 HydrophobicContact CZ-CD1 3.95Å; F282-I286 HydrophobicContact CZ-CG1 3.73Å; F282-I286 WeakPolarHBondContact O-CB 3.5Å; F282-I286 VanDerWaalsContact O-CG1 3.26Å; F282-I286 WeakPolarHBondContact O-CG1 3.48Å; F282-I286 PolarHBondContact O-N 3.29Å; F284-I286 VanDerWaalsContact C-N 3.31Å; F284-I286 PolarHBondContact O-N 2.89Å; I286-N288 PolarHBondContact O-N 3.1Å; I286-N289 PolarHBondContact O-N 2.91Å; I286-N289 VanDerWaalsContact O-N 3.1Å; I286-F292 HydrophobicContact CD1-CB 4.37Å; I286-F292 HydrophobicContact CD1-CD1 4.05Å; I286-F292 HydrophobicContact CD1-CD2 3.68Å; I286-F292 HydrophobicContact CD1-CE1 4.21Å; I286-F292 HydrophobicContact CD1-CE2 3.84Å; I286-F292 HydrophobicContact CD1-CG 3.78Å; I286-F292 HydrophobicContact CD1-CZ 4.09Å; I286-F292 HydrophobicContact CG2-CB 3.83Å; I286-F292 HydrophobicContact CG2-CG 4.38Å
287	K	82.3	Confident	81.3	Confident	175 Å²	175	83 Å²	83	76%	0.761	41%	0.409	S	S	*	.	H	α-helix	trans	-61.3	-25.1	178.4	-78.8	176.1	178.7	-179.2	0	113.9	L283 F284 N289	L283-K287 VanDerWaalsContact O-CB 3.31Å; L283-K287 WeakPolarHBondContact O-CB 3.44Å; L283-K287 VanDerWaalsContact O-CG 3.23Å; L283-K287 WeakPolarHBondContact O-CG 3.49Å; L283-K287 PolarHBondContact O-N 3.13Å; F284-K287 PolarHBondContact O-N 3.41Å; K287-N289 VanDerWaalsContact C-N 3.27Å; K287-N289 PolarHBondContact O-N 3.17Å
288	N	85.5	Confident	81.3	Confident	134 Å²	134	76.8 Å²	76.8	72%	0.717	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-9.8	178.4	-165.4	40.8	0	0	0	113.7	F284 I286	F284-N288 PolarHBondContact O-N 3.12Å; F284-N288 VanDerWaalsContact O-N 3.13Å; I286-N288 PolarHBondContact O-N 3.1Å
289	N	75.6	Confident	81.3	Confident	34 Å²	34	73 Å²	73	18%	0.182	37%	0.373	C	S	.	.			trans	-123.4	106.9	-177.2	-178	-10	0	0	0	111.2	Y258 I286 K287 R291 F292	Y258-N289 HydrophobicContact CE2-CB 4.34Å; Y258-N289 PolarHBondContact OH-ND2 3Å; I286-N289 PolarHBondContact O-N 2.91Å; I286-N289 VanDerWaalsContact O-N 3.1Å; K287-N289 VanDerWaalsContact C-N 3.27Å; K287-N289 PolarHBondContact O-N 3.17Å; N289-R291 PolarHBondContact O-N 3.37Å; N289-R291 PolarHBondContact OD1-N 3.13Å; N289-F292 HydrophobicContact CB-CD2 4.13Å; N289-F292 PolarHBondContact O-N 3.28Å; N289-F292 VanDerWaalsContact O-N 3.1Å
290	S	74.4	Confident	81	Confident	114 Å²	114	73.3 Å²	73.3	80%	0.797	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-7.7	-173.8	56.9	0	0	0	0	116
291	R	76.1	Confident	80.2	Confident	164 Å²	164	70.7 Å²	70.7	62%	0.619	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-19.5	173.4	-65.1	-170.6	178.5	-163.8	0.4	113.9	W267 N289	W267-R291 WeakPolarHBondContact CB-O 3.41Å; W267-R291 HydrophobicContact CD2-CB 4.15Å; W267-R291 HydrophobicContact CE3-CB 3.49Å; W267-R291 VanDerWaalsContact CE3-CB 3.49Å; W267-R291 HydrophobicContact CH2-CB 4.4Å; W267-R291 HydrophobicContact CZ3-CB 3.63Å; W267-R291 HydrophobicContact CZ3-CG 4.44Å; N289-R291 PolarHBondContact O-N 3.37Å; N289-R291 PolarHBondContact OD1-N 3.13Å
292	F	80.9	Confident	78.9	Confident	16 Å²	16	68 Å²	68	7%	0.07	35%	0.351	C	S	.	.			trans	-88.3	135.9	-178.5	-77.1	-68.6	0	0	0	112.2	Y258 L261 M262 W267 F269 I286 N289	Y258-F292 AromaticContact CD2-CE2 3.99Å; Y258-F292 HydrophobicContact CD2-CE2 3.99Å; Y258-F292 HydrophobicContact CE2-CD2 4.19Å; Y258-F292 AromaticContact CE2-CE2 3.62Å; Y258-F292 HydrophobicContact CE2-CE2 3.62Å; L261-F292 HydrophobicContact CB-CE1 3.76Å; L261-F292 HydrophobicContact CB-CZ 3.95Å; M262-F292 HydrophobicContact CB-CZ 4.39Å; M262-F292 HydrophobicContact CG-CE2 3.62Å; M262-F292 HydrophobicContact CG-CZ 3.45Å; M262-F292 VanDerWaalsContact CG-CZ 3.45Å; M262-F292 HydrophobicContact SD-CE2 4.42Å; W267-F292 AromaticContact CE3-CD1 3.94Å; W267-F292 HydrophobicContact CE3-CD1 3.94Å; W267-F292 HydrophobicContact CE3-CD2 4.43Å; W267-F292 AromaticContact CE3-CE1 3.79Å; W267-F292 HydrophobicContact CE3-CE1 3.79Å; W267-F292 HydrophobicContact CE3-CE2 4.31Å; W267-F292 HydrophobicContact CE3-CG 4.27Å; W267-F292 HydrophobicContact CE3-CZ 4Å; W267-F292 HydrophobicContact CZ3-CD2 4.41Å; W267-F292 HydrophobicContact CZ3-CE1 4.15Å; W267-F292 AromaticContact CZ3-CE2 4Å; W267-F292 HydrophobicContact CZ3-CE2 4Å; W267-F292 AromaticContact CZ3-CZ 3.87Å; W267-F292 HydrophobicContact CZ3-CZ 3.87Å; F269-F292 HydrophobicContact CD1-CD1 4.19Å; F269-F292 HydrophobicContact CE1-CB 4.49Å; F269-F292 AromaticContact CE1-CD1 3.73Å; F269-F292 HydrophobicContact CE1-CD1 3.73Å; F269-F292 HydrophobicContact CE1-CE1 4.31Å; F269-F292 HydrophobicContact CE1-CG 4.37Å; I286-F292 HydrophobicContact CD1-CB 4.37Å; I286-F292 HydrophobicContact CD1-CD1 4.05Å; I286-F292 HydrophobicContact CD1-CD2 3.68Å; I286-F292 HydrophobicContact CD1-CE1 4.21Å; I286-F292 HydrophobicContact CD1-CE2 3.84Å; I286-F292 HydrophobicContact CD1-CG 3.78Å; I286-F292 HydrophobicContact CD1-CZ 4.09Å; I286-F292 HydrophobicContact CG2-CB 3.83Å; I286-F292 HydrophobicContact CG2-CG 4.38Å; N289-F292 HydrophobicContact CB-CD2 4.13Å; N289-F292 PolarHBondContact O-N 3.28Å; N289-F292 VanDerWaalsContact O-N 3.1Å
293	H	80.3	Confident	77.4	Confident	111 Å²	111	76.3 Å²	76.3	51%	0.514	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	102.5	175.2	-61.5	-29.4	0	0	0	108.5	W267 D268 F269 G295	W267-H293 PolarHBondContact O-N 3.03Å; D268-H293 IonicContact OD1-CD2 2.71Å; F269-H293 PolarHBondContact N-O 2.98Å; H293-G295 PolarHBondContact O-N 2.78Å
294	L	80.8	Confident	75.8	Confident	76 Å²	76	77 Å²	77	40%	0.398	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	118.3	172.7	178.7	61.7	0	0	0	108.8	F269 I271 L283	F269-L294 HydrophobicContact CE2-CD1 4.06Å; F269-L294 HydrophobicContact CZ-CD1 4.42Å; I271-L294 HydrophobicContact CD1-CD1 3.56Å; I271-L294 HydrophobicContact CG1-CD1 3.72Å; L283-L294 HydrophobicContact CD2-CD2 3.98Å
295	G	75.9	Confident	74.2	Confident	26 Å²	26	76.4 Å²	76.4	27%	0.268	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-142.4	172.9	0	0	0	0	0	112.3	F269 H293	F269-G295 PolarHBondContact O-N 3.1Å; H293-G295 PolarHBondContact O-N 2.78Å
296	T	77.1	Confident	72.8	Confident	28 Å²	28	75.7 Å²	75.7	17%	0.172	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.6	179.1	41.8	0	0	0	0	112.4	S270 I271 A320	S270-T296 WeakPolarHBondContact CB-O 3.29Å; S270-T296 PolarHBondContact OG-N 2.61Å; S270-T296 PolarHBondContact OG-O 2.68Å; S270-T296 PolarHBondContact OG-OG1 3.05Å; I271-T296 PolarHBondContact N-O 3.03Å; T296-A320 PolarHBondContact OG1-O 2.96Å
297	L	81	Confident	71.5	Confident	95 Å²	95	84.2 Å²	84.2	50%	0.497	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	109	166.4	176.7	64.6	0	0	0	108.5	I271 L273	I271-L297 HydrophobicContact CB-CD1 3.68Å; I271-L297 HydrophobicContact CG2-CD1 3.59Å; I271-L297 WeakPolarHBondContact O-CA 3.39Å; L273-L297 HydrophobicContact CD1-CD1 4.05Å
298	V	79.3	Confident	70.3	Confident	9 Å²	9	79.5 Å²	79.5	6%	0.055	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.3	-178	-174.2	0	0	0	0	109.3	I271 V272 L273 L300 Q317 L321	I271-V298 PolarHBondContact O-N 3.12Å; V272-V298 WeakPolarHBondContact CA-O 3.38Å; V272-V298 HydrophobicContact CG2-CB 4.38Å; L273-V298 PolarHBondContact N-O 3.12Å; V298-L300 HydrophobicContact CG1-CD2 3.69Å; V298-L300 HydrophobicContact CG1-CG 4.47Å; V298-Q317 HydrophobicContact CG1-CB 3.95Å; V298-L321 HydrophobicContact CG2-CD2 4.05Å; V298-L321 HydrophobicContact CG2-CG 4.39Å
299	N	80.1	Confident	69	Low	66 Å²	66	77.5 Å²	77.5	35%	0.353	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.6	175.4	-170	5.3	0	0	0	111.3	L273 T301 Q317	L273-N299 HydrophobicContact CB-CB 4.36Å; N299-T301 PolarHBondContact ND2-OG1 3.17Å; N299-T301 WeakPolarHBondContact OD1-CG2 3.42Å; N299-T301 PolarHBondContact OD1-N 2.93Å; N299-T301 PolarHBondContact OD1-OG1 2.84Å; N299-Q317 PolarHBondContact O-NE2 2.98Å
300	L	73.9	Confident	68.3	Low	18 Å²	18	80.1 Å²	80.1	9%	0.094	44%	0.443	C	S	.	.			trans	-100	9.7	-172	-52.9	175.6	0	0	0	113.5	V272 L273 V298 T302 L314 Q317 L343	V272-L300 HydrophobicContact CG1-CD1 3.49Å; V272-L300 VanDerWaalsContact CG1-CD1 3.49Å; V272-L300 HydrophobicContact CG1-CG 4.05Å; L273-L300 VanDerWaalsContact O-CB 3.29Å; L273-L300 WeakPolarHBondContact O-CB 3.34Å; L273-L300 WeakPolarHBondContact O-CG 3.21Å; L273-L300 PolarHBondContact O-N 2.87Å; V298-L300 HydrophobicContact CG1-CD2 3.69Å; V298-L300 HydrophobicContact CG1-CG 4.47Å; L300-T302 PolarHBondContact O-N 2.96Å; L300-L314 HydrophobicContact CB-CD1 4.36Å; L300-L314 HydrophobicContact CD1-CD1 4.49Å; L300-L314 HydrophobicContact CD2-CD1 3.86Å; L300-L314 HydrophobicContact CD2-CG 4.37Å; L300-L314 HydrophobicContact CG-CD1 4.47Å; L300-Q317 HydrophobicContact CD2-CB 4.25Å; L300-L343 HydrophobicContact CD1-CD1 3.98Å; L300-L343 HydrophobicContact CD1-CD2 3.65Å; L300-L343 HydrophobicContact CD1-CG 4.4Å
301	T	68.7	Low	67.9	Low	66 Å²	66	79 Å²	79	41%	0.405	43%	0.425	S	S	.	.			trans	-70.6	55.7	178.6	56.5	0	0	0	0	113.2	C274 N299 N303	C274-T301 WeakPolarHBondContact O-CG2 3.29Å; N299-T301 PolarHBondContact ND2-OG1 3.17Å; N299-T301 WeakPolarHBondContact OD1-CG2 3.42Å; N299-T301 PolarHBondContact OD1-N 2.93Å; N299-T301 PolarHBondContact OD1-OG1 2.84Å; T301-N303 PolarHBondContact O-N 3.31Å
302	T	58	Low	67.4	Low	53 Å²	53	77.1 Å²	77.1	33%	0.325	42%	0.423	S	S	.	.			trans	-91.4	100.1	178.4	60.3	0	0	0	0	110.5	L300 S304	L300-T302 PolarHBondContact O-N 2.96Å; T302-S304 VanDerWaalsContact C-N 3.28Å; T302-S304 PolarHBondContact O-N 2.94Å
303	N	55.2	Low	66.8	Low	178 Å²	178	77.7 Å²	77.7	95%	0.952	43%	0.434	S	S	*	.			trans	-76.8	75.1	178	-164.9	4.4	0	0	0	111.2	T301	T301-N303 PolarHBondContact O-N 3.31Å
304	S	50.8	Low	66.3	Low	50 Å²	50	73.7 Å²	73.7	35%	0.35	42%	0.416	S	S	.	.			trans	-109.3	133.2	-179.6	-178.7	0	0	0	0	111.6	T302 S306	T302-S304 VanDerWaalsContact C-N 3.28Å; T302-S304 PolarHBondContact O-N 2.94Å; S304-S306 VanDerWaalsContact C-N 3.29Å; S304-S306 PolarHBondContact O-N 3.25Å
305	S	52	Low	65.8	Low	136 Å²	136	72.7 Å²	72.7	95%	0.951	41%	0.41	S	S	*	.	S	Bend	trans	-80	-4.5	-178.2	53.1	0	0	0	0	114.6
306	S	56.2	Low	65.7	Low	33 Å²	33	80.8 Å²	80.8	23%	0.231	43%	0.433	C	S	.	.			trans	-115	121.6	-173.8	174.8	0	0	0	0	112.4	S304 S308 D309 Q310	S304-S306 VanDerWaalsContact C-N 3.29Å; S304-S306 PolarHBondContact O-N 3.25Å; S306-S308 VanDerWaalsContact C-N 3.32Å; S306-S308 PolarHBondContact O-N 2.81Å; S306-S308 PolarHBondContact OG-OG 3.12Å; S306-D309 WeakPolarHBondContact CB-OD2 3.32Å; S306-D309 PolarHBondContact O-N 2.76Å; S306-D309 PolarHBondContact OG-OD2 3.27Å; S306-Q310 WeakPolarHBondContact O-CB 3.18Å; S306-Q310 PolarHBondContact O-N 3.36Å
307	K	56.5	Low	65.4	Low	186 Å²	186	82 Å²	82	81%	0.809	44%	0.436	S	S	*	.	H	α-helix	trans	-65.6	-29.9	-178.4	-71.5	-179.2	178.4	173.7	0	113.8	Q311	K307-Q311 PolarHBondContact O-N 3.2Å
308	S	57.4	Low	65.1	Low	76 Å²	76	77.5 Å²	77.5	53%	0.531	41%	0.413	S	S	.	.	H	α-helix	trans	-74.5	-48.8	177.1	39.5	0	0	0	0	111.4	S306 Q310 Q311 Q312	S306-S308 VanDerWaalsContact C-N 3.32Å; S306-S308 PolarHBondContact O-N 2.81Å; S306-S308 PolarHBondContact OG-OG 3.12Å; S308-Q310 VanDerWaalsContact C-N 3.34Å; S308-Q310 PolarHBondContact O-N 3.21Å; S308-Q311 PolarHBondContact O-N 3.45Å; S308-Q311 VanDerWaalsContact O-N 3.15Å; S308-Q312 PolarHBondContact O-N 2.92Å; S308-Q312 VanDerWaalsContact O-N 3.09Å
309	D	58.7	Low	64.8	Low	92 Å²	92	81.6 Å²	81.6	49%	0.492	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-35.4	-179.1	-58.2	-71.3	0	0	0	111.4	S306 Q311 Q312 G313	S306-D309 WeakPolarHBondContact CB-OD2 3.32Å; S306-D309 PolarHBondContact O-N 2.76Å; S306-D309 PolarHBondContact OG-OD2 3.27Å; D309-Q311 VanDerWaalsContact C-N 3.32Å; D309-Q311 PolarHBondContact O-N 2.91Å; D309-Q312 PolarHBondContact O-N 3.25Å; D309-G313 PolarHBondContact O-N 2.94Å
310	Q	61.8	Low	64.4	Low	89 Å²	89	79.9 Å²	79.9	42%	0.416	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-41.2	171.8	-170.7	177.5	40.2	0	0	111.6	S306 S308 L314	S306-Q310 WeakPolarHBondContact O-CB 3.18Å; S306-Q310 PolarHBondContact O-N 3.36Å; S308-Q310 VanDerWaalsContact C-N 3.34Å; S308-Q310 PolarHBondContact O-N 3.21Å; Q310-L314 WeakPolarHBondContact O-CB 3.31Å; Q310-L314 PolarHBondContact O-N 2.81Å
311	Q	64.5	Low	64.2	Low	91 Å²	91	79.2 Å²	79.2	43%	0.425	42%	0.423	S	S	.	.	H	α-helix	trans	-68.5	-43.1	177.9	-161.6	-176.5	-75.2	0	0	111.8	K307 S308 D309 L314 M315 L346	K307-Q311 PolarHBondContact O-N 3.2Å; S308-Q311 PolarHBondContact O-N 3.45Å; S308-Q311 VanDerWaalsContact O-N 3.15Å; D309-Q311 VanDerWaalsContact C-N 3.32Å; D309-Q311 PolarHBondContact O-N 2.91Å; Q311-L314 PolarHBondContact O-N 3.31Å; Q311-M315 HydrophobicContact CG-CE 4.06Å; Q311-M315 WeakPolarHBondContact O-CG 3.24Å; Q311-M315 PolarHBondContact O-N 2.96Å; Q311-M315 VanDerWaalsContact O-N 3.13Å; Q311-L346 HydrophobicContact CG-CD2 4.03Å
312	Q	66.8	Low	64.2	Low	124 Å²	124	83.7 Å²	83.7	58%	0.579	43%	0.432	S	S	*	.	H	α-helix	trans	-70.5	-33	177.5	-84.9	179.7	-51.4	0	0	113.5	S308 D309 M315 R316	S308-Q312 PolarHBondContact O-N 2.92Å; S308-Q312 VanDerWaalsContact O-N 3.09Å; D309-Q312 PolarHBondContact O-N 3.25Å; Q312-M315 PolarHBondContact O-N 3.17Å; Q312-R316 PolarHBondContact O-N 3.38Å
313	G	67.5	Low	64.2	Low	29 Å²	29	88.9 Å²	88.9	30%	0.299	45%	0.453	S	S	.	.	H	α-helix	trans	-60.6	-48.2	169.5	0	0	0	0	0	111.6	D309 M315 R316 Q317	D309-G313 PolarHBondContact O-N 2.94Å; G313-M315 VanDerWaalsContact C-N 3.26Å; G313-M315 PolarHBondContact O-N 3.31Å; G313-R316 PolarHBondContact O-N 3.31Å; G313-Q317 WeakPolarHBondContact O-CG 3.15Å; G313-Q317 PolarHBondContact O-N 3.27Å; G313-Q317 VanDerWaalsContact O-N 3.1Å
314	L	69.8	Low	64.3	Low	26 Å²	26	84.3 Å²	84.3	14%	0.136	43%	0.426	C	S	.	.	H	α-helix	trans	-59.5	-35.6	176.6	-138.2	82.3	0	0	0	112.5	L300 Q310 Q311 Q317 L318 L343 L346	L300-L314 HydrophobicContact CB-CD1 4.36Å; L300-L314 HydrophobicContact CD1-CD1 4.49Å; L300-L314 HydrophobicContact CD2-CD1 3.86Å; L300-L314 HydrophobicContact CD2-CG 4.37Å; L300-L314 HydrophobicContact CG-CD1 4.47Å; Q310-L314 WeakPolarHBondContact O-CB 3.31Å; Q310-L314 PolarHBondContact O-N 2.81Å; Q311-L314 PolarHBondContact O-N 3.31Å; L314-Q317 PolarHBondContact O-N 2.92Å; L314-L318 HydrophobicContact CD2-CD1 4.38Å; L314-L318 HydrophobicContact CG-CD1 4.46Å; L314-L318 WeakPolarHBondContact O-CB 3.37Å; L314-L318 VanDerWaalsContact O-CG 3.31Å; L314-L318 WeakPolarHBondContact O-CG 3.45Å; L314-L318 PolarHBondContact O-N 3.25Å; L314-L343 HydrophobicContact CD2-CD2 3.73Å; L314-L343 HydrophobicContact CG-CD2 4.41Å; L314-L346 HydrophobicContact CD2-CD1 3.55Å
315	M	71.3	Confident	64.3	Low	56 Å²	56	88 Å²	88	28%	0.276	45%	0.452	S	S	.	.	H	α-helix	trans	-60.3	-51	176	-53	-150.3	-177.2	0	0	111.3	Q311 Q312 G313 Q317 L318 E319 L346 M350	Q311-M315 HydrophobicContact CG-CE 4.06Å; Q311-M315 WeakPolarHBondContact O-CG 3.24Å; Q311-M315 PolarHBondContact O-N 2.96Å; Q311-M315 VanDerWaalsContact O-N 3.13Å; Q312-M315 PolarHBondContact O-N 3.17Å; G313-M315 VanDerWaalsContact C-N 3.26Å; G313-M315 PolarHBondContact O-N 3.31Å; M315-Q317 VanDerWaalsContact C-N 3.28Å; M315-Q317 PolarHBondContact O-N 3.18Å; M315-L318 PolarHBondContact O-N 2.91Å; M315-L318 VanDerWaalsContact O-N 3.14Å; M315-E319 WeakPolarHBondContact O-CG 3.18Å; M315-E319 PolarHBondContact O-N 2.92Å; M315-L346 HydrophobicContact CE-CD2 4.1Å; M315-M350 HydrophobicContact CB-CE 3.68Å; M315-M350 HydrophobicContact CG-CE 3.44Å; M315-M350 VanDerWaalsContact CG-CE 3.44Å; M315-M350 HydrophobicContact SD-CE 3.87Å
316	R	72.4	Confident	64.6	Low	196 Å²	196	84.4 Å²	84.4	74%	0.74	43%	0.427	S	S	*	.	H	α-helix	trans	-62.6	-33.9	179.3	-67.7	180	-179.7	163.2	1.3	113	Q312 G313	Q312-R316 PolarHBondContact O-N 3.38Å; G313-R316 PolarHBondContact O-N 3.31Å
317	Q	72.4	Confident	64.7	Low	53 Å²	53	83.5 Å²	83.5	25%	0.248	42%	0.42	C	S	.	.	H	α-helix	trans	-72.4	-34.4	175.8	-67.9	-171.9	-63.9	0	0	112.5	V298 N299 L300 G313 L314 M315	V298-Q317 HydrophobicContact CG1-CB 3.95Å; N299-Q317 PolarHBondContact O-NE2 2.98Å; L300-Q317 HydrophobicContact CD2-CB 4.25Å; G313-Q317 WeakPolarHBondContact O-CG 3.15Å; G313-Q317 PolarHBondContact O-N 3.27Å; G313-Q317 VanDerWaalsContact O-N 3.1Å; L314-Q317 PolarHBondContact O-N 2.92Å; M315-Q317 VanDerWaalsContact C-N 3.28Å; M315-Q317 PolarHBondContact O-N 3.18Å
318	L	74	Confident	65.2	Low	0 Å²	0	80.9 Å²	80.9	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-75.8	-28.1	174	-72.7	167.9	0	0	0	112.8	L314 M315 A320 L321 L343 L346 M350	L314-L318 HydrophobicContact CD2-CD1 4.38Å; L314-L318 HydrophobicContact CG-CD1 4.46Å; L314-L318 WeakPolarHBondContact O-CB 3.37Å; L314-L318 VanDerWaalsContact O-CG 3.31Å; L314-L318 WeakPolarHBondContact O-CG 3.45Å; L314-L318 PolarHBondContact O-N 3.25Å; M315-L318 PolarHBondContact O-N 2.91Å; M315-L318 VanDerWaalsContact O-N 3.14Å; L318-A320 PolarHBondContact O-N 3.44Å; L318-L321 HydrophobicContact CD2-CD1 3.78Å; L318-L321 VanDerWaalsContact O-CB 3.31Å; L318-L321 WeakPolarHBondContact O-CB 3.47Å; L318-L321 PolarHBondContact O-N 3.39Å; L318-L343 HydrophobicContact CD1-CD2 4.19Å; L318-L343 HydrophobicContact CD2-CD2 4.21Å; L318-L346 HydrophobicContact CD1-CB 4.13Å; L318-M350 HydrophobicContact CB-SD 4.02Å; L318-M350 HydrophobicContact CD1-CE 4.14Å; L318-M350 HydrophobicContact CD1-SD 4.18Å
319	E	73.3	Confident	66.2	Low	95 Å²	95	77.3 Å²	77.3	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-60.3	-26.1	173.2	-77.6	174	146.9	0	0	112.6	M315 L321 R322	M315-E319 WeakPolarHBondContact O-CG 3.18Å; M315-E319 PolarHBondContact O-N 2.92Å; E319-L321 PolarHBondContact O-N 3.06Å; E319-R322 WeakPolarHBondContact O-CB 3.33Å; E319-R322 PolarHBondContact O-N 3.3Å
320	A	70.5	Confident	67.5	Low	31 Å²	31	72.9 Å²	72.9	26%	0.256	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.8	172.7	0	0	0	0	0	114.1	T296 L318 R322	T296-A320 PolarHBondContact OG1-O 2.96Å; L318-A320 PolarHBondContact O-N 3.44Å; A320-R322 VanDerWaalsContact C-N 3.3Å
321	L	71.1	Confident	68.7	Low	3 Å²	3	68.7 Å²	68.7	2%	0.016	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.5	170.4	-59.1	171.9	0	0	0	112.1	V298 L318 E319 F355	V298-L321 HydrophobicContact CG2-CD2 4.05Å; V298-L321 HydrophobicContact CG2-CG 4.39Å; L318-L321 HydrophobicContact CD2-CD1 3.78Å; L318-L321 VanDerWaalsContact O-CB 3.31Å; L318-L321 WeakPolarHBondContact O-CB 3.47Å; L318-L321 PolarHBondContact O-N 3.39Å; E319-L321 PolarHBondContact O-N 3.06Å; L321-F355 HydrophobicContact CB-CE2 4.01Å; L321-F355 HydrophobicContact CB-CZ 3.81Å; L321-F355 HydrophobicContact CD1-CE2 4.35Å
322	R	68.2	Low	69.9	Low	160 Å²	160	64.3 Å²	64.3	60%	0.604	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-32.1	-175.2	-168.8	-177.7	174.6	-177.6	0.1	113.5	E319 A320 H324 L352	E319-R322 WeakPolarHBondContact O-CB 3.33Å; E319-R322 PolarHBondContact O-N 3.3Å; A320-R322 VanDerWaalsContact C-N 3.3Å; R322-H324 VanDerWaalsContact C-N 3.3Å; R322-H324 PolarHBondContact O-N 2.84Å; R322-L352 HydrophobicContact CB-CD2 3.84Å; R322-L352 HydrophobicContact CG-CD2 4.12Å
323	E	56.9	Low	70.9	Confident	162 Å²	162	58.9 Å²	58.9	76%	0.757	29%	0.29	S	S	*	.	S	Bend	trans	-70	-27.4	-175.9	-64.4	-173.2	126.1	0	0	112.8	S325	E323-S325 PolarHBondContact O-N 2.89Å
324	H	57.4	Low	71.6	Confident	83 Å²	83	57.9 Å²	57.9	38%	0.384	28%	0.28	S	S	.	.			trans	-93.4	81.9	-176.4	-67.2	79.9	0	0	0	111.1	R322 S326 T327	R322-H324 VanDerWaalsContact C-N 3.3Å; R322-H324 PolarHBondContact O-N 2.84Å; H324-S326 PolarHBondContact O-N 3.44Å; H324-T327 WeakPolarHBondContact CB-OG1 3.45Å; H324-T327 PolarHBondContact O-N 2.99Å; H324-T327 VanDerWaalsContact O-N 3.08Å; H324-T327 PolarHBondContact O-OG1 3.38Å
325	S	51.9	Low	72.2	Confident	128 Å²	128	57 Å²	57	90%	0.895	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-4.5	-175.7	62.5	0	0	0	0	116.5	E323	E323-S325 PolarHBondContact O-N 2.89Å
326	S	58	Low	72.4	Confident	60 Å²	60	57.9 Å²	57.9	42%	0.42	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-19.2	172.6	55.2	0	0	0	0	114.2	D268 H324 R328	D268-S326 WeakPolarHBondContact CB-O 3.03Å; H324-S326 PolarHBondContact O-N 3.44Å; S326-R328 PolarHBondContact O-N 3.12Å
327	T	59.2	Low	72.6	Confident	14 Å²	14	49.8 Å²	49.8	9%	0.086	25%	0.253	C	S	.	.			trans	-68.7	118	-169.2	-26.5	0	0	0	0	111.5	H324	H324-T327 WeakPolarHBondContact CB-OG1 3.45Å; H324-T327 PolarHBondContact O-N 2.99Å; H324-T327 VanDerWaalsContact O-N 3.08Å; H324-T327 PolarHBondContact O-OG1 3.38Å
328	R	65.7	Low	72.9	Confident	130 Å²	130	55.2 Å²	55.2	49%	0.491	27%	0.272	S	S	.	.			trans	-106.5	-31.2	-177.3	-72.7	177.5	173.6	93.6	-3	113.6	D268 S326 H356	D268-R328 PolarHBondContact O-N 3.39Å; D268-R328 IonicContact OD2-NH1 3.14Å; D268-R328 PolarHBondContact OD2-NH1 2.92Å; S326-R328 PolarHBondContact O-N 3.12Å; R328-H356 PolarHBondContact O-N 2.87Å
329	G	78.1	Confident	73.1	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	147.1	177.9	0	0	0	0	0	113.3	D268 F269 S270 H356	D268-G329 PolarHBondContact O-N 3.28Å; F269-G329 CarbonylContact C-O 3.58Å; F269-G329 VanDerWaalsContact CA-O 3.25Å; F269-G329 WeakPolarHBondContact CA-O 3.49Å; F269-G329 WeakPolarHBondContact CB-O 3.15Å; S270-G329 PolarHBondContact N-O 2.9Å; G329-H356 WeakPolarHBondContact CA-O 3.37Å
330	V	85.9	Confident	73.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	117.4	166.6	169.9	0	0	0	0	108.8	V272 F355 H356 W357 V358	V272-V330 HydrophobicContact CG2-CG1 3.78Å; V330-F355 HydrophobicContact CB-CB 4.18Å; V330-F355 HydrophobicContact CG2-CB 3.64Å; V330-F355 HydrophobicContact CG2-CD1 4.01Å; V330-F355 HydrophobicContact CG2-CD2 3.96Å; V330-F355 HydrophobicContact CG2-CG 3.6Å; V330-H356 PolarHBondContact N-O 3.47Å; V330-W357 HydrophobicContact CB-CE3 4.37Å; V330-W357 HydrophobicContact CG1-CD2 4.42Å; V330-W357 HydrophobicContact CG1-CE3 3.82Å; V330-W357 HydrophobicContact CG1-CH2 4.23Å; V330-W357 HydrophobicContact CG1-CZ3 3.71Å; V330-W357 WeakPolarHBondContact O-CA 3.3Å; V330-V358 PolarHBondContact O-N 3.42Å
331	V	88.5	Confident	73.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.4	177.2	-179.2	0	0	0	0	109.5	L257 L261 F269 S270 I271 V272 F333 V358	L257-V331 HydrophobicContact CD1-CG1 4.35Å; L257-V331 HydrophobicContact CD2-CG1 3.75Å; L261-V331 HydrophobicContact CD1-CG2 4.42Å; L261-V331 HydrophobicContact CD2-CG2 4.39Å; F269-V331 HydrophobicContact CD2-CG2 3.88Å; F269-V331 HydrophobicContact CE2-CG2 4.36Å; S270-V331 PolarHBondContact O-N 3.13Å; I271-V331 CarbonylContact C-O 3.59Å; I271-V331 WeakPolarHBondContact CA-O 3.22Å; V272-V331 PolarHBondContact N-O 3.16Å; V331-F333 HydrophobicContact CB-CE2 4.49Å; V331-F333 HydrophobicContact CG1-CD2 4.08Å; V331-F333 HydrophobicContact CG1-CE1 4.45Å; V331-F333 HydrophobicContact CG1-CE2 3.53Å; V331-F333 HydrophobicContact CG1-CZ 3.76Å; V331-V358 WeakPolarHBondContact CA-O 3.29Å; V331-V358 HydrophobicContact CG2-CB 4.4Å
332	T	88.8	Confident	74.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133	176.2	60.3	0	0	0	0	111.7	V272 W357 V358 L359 G360	V272-T332 HydrophobicContact CB-CG2 4.26Å; V272-T332 CarbonylContact O-C 3.58Å; V272-T332 WeakPolarHBondContact O-CA 3.35Å; T332-W357 HydrophobicContact CG2-CE3 4.01Å; T332-W357 HydrophobicContact CG2-CZ3 4.04Å; T332-V358 PolarHBondContact N-O 3Å; T332-V358 PolarHBondContact OG1-O 3.14Å; T332-L359 WeakPolarHBondContact OG1-CD2 3.46Å; T332-G360 PolarHBondContact O-N 3.07Å
333	F	87.8	Confident	74.8	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.6	172.8	-65.3	-78.1	0	0	0	112.2	L257 I271 V272 L273 C274 W277 I279 F282 V331 C335 D361	L257-F333 HydrophobicContact CD2-CE1 3.93Å; L257-F333 HydrophobicContact CD2-CE2 4.41Å; L257-F333 HydrophobicContact CD2-CZ 3.44Å; L257-F333 VanDerWaalsContact CD2-CZ 3.44Å; I271-F333 HydrophobicContact CG2-CD2 3.69Å; I271-F333 HydrophobicContact CG2-CE2 3.95Å; V272-F333 PolarHBondContact O-N 2.9Å; L273-F333 HydrophobicContact CD2-CB 4.11Å; C274-F333 PolarHBondContact N-O 3.45Å; W277-F333 HydrophobicContact CB-CB 4.35Å; W277-F333 AromaticContact CD1-CD1 3.91Å; W277-F333 HydrophobicContact CG-CB 4.26Å; I279-F333 HydrophobicContact CD1-CD2 3.86Å; I279-F333 HydrophobicContact CD1-CE2 4.32Å; I279-F333 HydrophobicContact CD1-CG 4.44Å; I279-F333 HydrophobicContact CG1-CD2 3.97Å; I279-F333 HydrophobicContact CG1-CE2 4.3Å; I279-F333 HydrophobicContact CG1-CG 4.2Å; I279-F333 HydrophobicContact CG2-CD2 4.11Å; I279-F333 HydrophobicContact CG2-CE1 4.45Å; I279-F333 HydrophobicContact CG2-CE2 3.58Å; I279-F333 HydrophobicContact CG2-CZ 3.76Å; F282-F333 HydrophobicContact CD1-CE2 4.1Å; F282-F333 AromaticContact CD1-CZ 3.8Å; F282-F333 HydrophobicContact CD1-CZ 3.8Å; F282-F333 HydrophobicContact CE1-CE2 4.22Å; F282-F333 HydrophobicContact CE1-CZ 4.1Å; F282-F333 HydrophobicContact CG-CZ 4.29Å; V331-F333 HydrophobicContact CB-CE2 4.49Å; V331-F333 HydrophobicContact CG1-CD2 4.08Å; V331-F333 HydrophobicContact CG1-CE1 4.45Å; V331-F333 HydrophobicContact CG1-CE2 3.53Å; V331-F333 HydrophobicContact CG1-CZ 3.76Å; F333-C335 PolarHBondContact O-N 3.47Å; F333-C335 PolarHBondContact O-SG 2.82Å; F333-C335 VanDerWaalsContact O-SG 3.39Å; F333-D361 WeakPolarHBondContact CA-OD2 3.12Å
334	G	83.1	Confident	75.8	Confident	8 Å²	8	51.2 Å²	51.2	8%	0.082	24%	0.241	C	C	.	.	S	Bend	trans	66	20.2	-177.9	0	0	0	0	0	114.1	C274 Q275 D361	C274-G334 WeakPolarHBondContact CB-O 3.46Å; Q275-G334 WeakPolarHBondContact CG-O 3.49Å; Q275-G334 PolarHBondContact NE2-O 2.99Å; G334-D361 PolarHBondContact N-OD1 2.88Å; G334-D361 PolarHBondContact N-OD2 2.81Å
335	C	80.8	Confident	76.8	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.061	24%	0.239	C	C	.	.			trans	-107.5	123.2	-169.4	-65.1	0	0	0	0	112.6	C274 F333 V340 D361	C274-C335 HydrophobicContact CB-CB 3.82Å; C274-C335 WeakPolarHBondContact CB-SG 3.34Å; C274-C335 WeakPolarHBondContact SG-CB 3.49Å; C274-C335 CovalentContact SG-SG 2.03Å; C274-C335 PolarHBondContact SG-SG 3.09Å; F333-C335 PolarHBondContact O-N 3.47Å; F333-C335 PolarHBondContact O-SG 2.82Å; F333-C335 VanDerWaalsContact O-SG 3.39Å; C335-V340 HydrophobicContact CB-CG2 3.89Å; C335-D361 PolarHBondContact N-OD2 3.16Å
336	D	77.1	Confident	78	Confident	73 Å²	73	44.3 Å²	44.3	39%	0.39	20%	0.199	S	C	.	.			trans	-65.4	147.4	168.4	172.4	17.5	0	0	0	110.1	R338 E339 V340	D336-R338 PolarHBondContact O-N 3.29Å; D336-R338 PolarHBondContact OD1-N 3.01Å; D336-R338 VanDerWaalsContact OD2-CB 3.27Å; D336-R338 WeakPolarHBondContact OD2-CB 3.42Å; D336-R338 WeakPolarHBondContact OD2-CD 3.37Å; D336-R338 VanDerWaalsContact OD2-CG 3.22Å; D336-R338 WeakPolarHBondContact OD2-CG 3.26Å; D336-E339 HydrophobicContact CB-CG 4.15Å; D336-E339 PolarHBondContact N-OE2 2.9Å; D336-E339 WeakPolarHBondContact O-CA 3.41Å; D336-E339 WeakPolarHBondContact O-CB 3.49Å; D336-E339 PolarHBondContact O-N 3.22Å; D336-V340 PolarHBondContact O-N 3.29Å
337	I	76.6	Confident	78.9	Confident	27 Å²	27	41.7 Å²	41.7	14%	0.138	18%	0.181	C	C	.	.	H	α-helix	trans	-55.5	-27.5	175.6	-157.3	65	0	0	0	112	R341 L359 L368 L373	I337-R341 WeakPolarHBondContact O-CB 3.35Å; I337-R341 PolarHBondContact O-N 3.49Å; I337-L359 HydrophobicContact CD1-CD1 3.94Å; I337-L368 HydrophobicContact CD1-CD2 4.19Å; I337-L373 HydrophobicContact CD1-CD1 3.69Å; I337-L373 HydrophobicContact CD1-CD2 3.93Å; I337-L373 HydrophobicContact CD1-CG 4.48Å; I337-L373 HydrophobicContact CG1-CD1 3.88Å; I337-L373 HydrophobicContact CG1-CD2 4.15Å
338	R	77.7	Confident	79.6	Confident	167 Å²	167	44.4 Å²	44.4	63%	0.63	20%	0.198	S	C	*	.	H	α-helix	trans	-70.6	-28.8	172.9	-52.8	176.7	70.3	-161.3	4.2	113.1	D336 R342	D336-R338 PolarHBondContact O-N 3.29Å; D336-R338 PolarHBondContact OD1-N 3.01Å; D336-R338 VanDerWaalsContact OD2-CB 3.27Å; D336-R338 WeakPolarHBondContact OD2-CB 3.42Å; D336-R338 WeakPolarHBondContact OD2-CD 3.37Å; D336-R338 VanDerWaalsContact OD2-CG 3.22Å; D336-R338 WeakPolarHBondContact OD2-CG 3.26Å; R338-R342 WeakPolarHBondContact O-CG 3.42Å; R338-R342 PolarHBondContact O-N 3.09Å
339	E	77.6	Confident	80.1	Confident	54 Å²	54	47 Å²	47	25%	0.252	21%	0.207	S	C	.	.	H	α-helix	trans	-83	-42.3	177.5	-61.3	-178.1	136.1	0	0	110.7	D336 R341 R342 L343	D336-E339 HydrophobicContact CB-CG 4.15Å; D336-E339 PolarHBondContact N-OE2 2.9Å; D336-E339 WeakPolarHBondContact O-CA 3.41Å; D336-E339 WeakPolarHBondContact O-CB 3.49Å; D336-E339 PolarHBondContact O-N 3.22Å; E339-R341 VanDerWaalsContact C-N 3.27Å; E339-R341 PolarHBondContact O-N 3.44Å; E339-R342 WeakPolarHBondContact O-CA 3.42Å; E339-R342 WeakPolarHBondContact O-CB 3.31Å; E339-R342 PolarHBondContact O-N 2.93Å; E339-L343 WeakPolarHBondContact O-CG 3.34Å; E339-L343 PolarHBondContact O-N 2.99Å
340	V	79.4	Confident	79.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54.2	-44.9	168.8	179.3	0	0	0	0	110.8	C335 D336 R342 L343 W344 L359 L373	C335-V340 HydrophobicContact CB-CG2 3.89Å; D336-V340 PolarHBondContact O-N 3.29Å; V340-R342 PolarHBondContact O-N 2.93Å; V340-L343 PolarHBondContact O-N 2.81Å; V340-W344 PolarHBondContact O-N 3.2Å; V340-L359 HydrophobicContact CG1-CD2 4.13Å; V340-L359 HydrophobicContact CG2-CD2 3.74Å; V340-L373 HydrophobicContact CB-CD2 4.5Å; V340-L373 HydrophobicContact CG1-CD2 4.12Å
341	R	80.9	Confident	78.7	Confident	113 Å²	113	54.2 Å²	54.2	43%	0.426	25%	0.25	S	C	.	.	H	α-helix	trans	-59.7	-43	172.8	176	169	176.6	170.6	-6.1	112.8	I337 E339 W344 T345 D371 L373	I337-R341 WeakPolarHBondContact O-CB 3.35Å; I337-R341 PolarHBondContact O-N 3.49Å; E339-R341 VanDerWaalsContact C-N 3.27Å; E339-R341 PolarHBondContact O-N 3.44Å; R341-W344 PolarHBondContact O-N 3.32Å; R341-T345 HydrophobicContact CG-CG2 4.47Å; R341-T345 WeakPolarHBondContact O-CG2 3.26Å; R341-T345 PolarHBondContact O-N 2.79Å; R341-T345 PolarHBondContact O-OG1 2.75Å; R341-T345 VanDerWaalsContact O-OG1 3.14Å; R341-D371 WeakPolarHBondContact CD-O 3.33Å; R341-D371 VanDerWaalsContact NH1-CB 3.25Å; R341-D371 PolarHBondContact NH1-O 2.65Å; R341-L373 HydrophobicContact CB-CD2 4.18Å
342	R	79.1	Confident	77.6	Confident	139 Å²	139	55.3 Å²	55.3	53%	0.525	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-48.2	176	-73.8	168.6	-178.7	165.4	0.2	110.9	R338 E339 V340 W344 T345 L346	R338-R342 WeakPolarHBondContact O-CG 3.42Å; R338-R342 PolarHBondContact O-N 3.09Å; E339-R342 WeakPolarHBondContact O-CA 3.42Å; E339-R342 WeakPolarHBondContact O-CB 3.31Å; E339-R342 PolarHBondContact O-N 2.93Å; V340-R342 PolarHBondContact O-N 2.93Å; R342-W344 PolarHBondContact O-N 2.73Å; R342-T345 WeakPolarHBondContact CA-OG1 3.45Å; R342-T345 PolarHBondContact O-N 2.91Å; R342-T345 PolarHBondContact O-OG1 3.03Å; R342-L346 WeakPolarHBondContact O-CG 3.24Å; R342-L346 PolarHBondContact O-N 2.85Å
343	L	79.9	Confident	76.3	Confident	4 Å²	4	59 Å²	59	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-47.9	178	-68.4	168.3	0	0	0	111.2	V272 L300 L314 L318 E339 V340 T345 L346 A347 W357	V272-L343 HydrophobicContact CG1-CD1 4.23Å; L300-L343 HydrophobicContact CD1-CD1 3.98Å; L300-L343 HydrophobicContact CD1-CD2 3.65Å; L300-L343 HydrophobicContact CD1-CG 4.4Å; L314-L343 HydrophobicContact CD2-CD2 3.73Å; L314-L343 HydrophobicContact CG-CD2 4.41Å; L318-L343 HydrophobicContact CD1-CD2 4.19Å; L318-L343 HydrophobicContact CD2-CD2 4.21Å; E339-L343 WeakPolarHBondContact O-CG 3.34Å; E339-L343 PolarHBondContact O-N 2.99Å; V340-L343 PolarHBondContact O-N 2.81Å; L343-T345 PolarHBondContact O-N 2.84Å; L343-L346 PolarHBondContact O-N 3.37Å; L343-L346 VanDerWaalsContact O-N 3.09Å; L343-A347 WeakPolarHBondContact O-CB 3.42Å; L343-A347 PolarHBondContact O-N 3.27Å; L343-W357 HydrophobicContact CB-CH2 4.29Å; L343-W357 HydrophobicContact CB-CZ3 4.42Å
344	W	78.4	Confident	75.3	Confident	56 Å²	56	64 Å²	64	21%	0.212	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-44.2	176.2	-179	-122.4	0	0	0	112.9	V340 R341 R342 L346 A347 T348 W357 P374	V340-W344 PolarHBondContact O-N 3.2Å; R341-W344 PolarHBondContact O-N 3.32Å; R342-W344 PolarHBondContact O-N 2.73Å; W344-L346 PolarHBondContact O-N 3.1Å; W344-L346 VanDerWaalsContact O-N 3.16Å; W344-A347 HydrophobicContact CE3-CB 4.48Å; W344-A347 PolarHBondContact O-N 2.88Å; W344-T348 HydrophobicContact CD2-CG2 3.87Å; W344-T348 HydrophobicContact CE3-CG2 4.15Å; W344-T348 HydrophobicContact CH2-CG2 3.8Å; W344-T348 HydrophobicContact CZ2-CG2 3.49Å; W344-T348 VanDerWaalsContact CZ2-CG2 3.49Å; W344-T348 HydrophobicContact CZ3-CG2 4.11Å; W344-T348 WeakPolarHBondContact O-CB 3.4Å; W344-T348 WeakPolarHBondContact O-CG2 3.5Å; W344-T348 PolarHBondContact O-N 2.85Å; W344-T348 PolarHBondContact O-OG1 3.48Å; W344-W357 AromaticContact CE3-CE2 3.92Å; W344-W357 HydrophobicContact CE3-CZ2 4.17Å; W344-W357 AromaticContact CE3-NE1 3.45Å; W344-W357 AromaticContact CZ3-NE1 3.47Å; W344-P374 HydrophobicContact CB-CG 4.42Å; W344-P374 HydrophobicContact CD2-CB 3.69Å; W344-P374 HydrophobicContact CD2-CG 3.81Å; W344-P374 HydrophobicContact CE3-CB 3.98Å; W344-P374 HydrophobicContact CE3-CG 4.09Å; W344-P374 HydrophobicContact CG-CB 4.21Å; W344-P374 HydrophobicContact CG-CG 3.95Å; W344-P374 HydrophobicContact CH2-CB 4.11Å; W344-P374 HydrophobicContact CZ2-CB 3.81Å; W344-P374 HydrophobicContact CZ3-CB 4.19Å
345	T	78.3	Confident	74.9	Confident	54 Å²	54	64.2 Å²	64.2	33%	0.331	30%	0.301	S	S	.	.	H	α-helix	trans	-67.7	-10.6	175.6	60	0	0	0	0	114.4	R341 R342 L343 T348 R349	R341-T345 HydrophobicContact CG-CG2 4.47Å; R341-T345 WeakPolarHBondContact O-CG2 3.26Å; R341-T345 PolarHBondContact O-N 2.79Å; R341-T345 PolarHBondContact O-OG1 2.75Å; R341-T345 VanDerWaalsContact O-OG1 3.14Å; R342-T345 WeakPolarHBondContact CA-OG1 3.45Å; R342-T345 PolarHBondContact O-N 2.91Å; R342-T345 PolarHBondContact O-OG1 3.03Å; L343-T345 PolarHBondContact O-N 2.84Å; T345-T348 WeakPolarHBondContact CA-OG1 3.25Å; T345-R349 WeakPolarHBondContact O-CD 3.38Å; T345-R349 VanDerWaalsContact O-CG 3.24Å; T345-R349 WeakPolarHBondContact O-CG 3.33Å; T345-R349 PolarHBondContact O-NE 2.78Å
346	L	78	Confident	74.8	Confident	13 Å²	13	67.4 Å²	67.4	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-97	-45.6	173.1	-76.9	166	0	0	0	111.2	Q311 L314 M315 L318 R342 L343 W344 T348 R349 M350	Q311-L346 HydrophobicContact CG-CD2 4.03Å; L314-L346 HydrophobicContact CD2-CD1 3.55Å; M315-L346 HydrophobicContact CE-CD2 4.1Å; L318-L346 HydrophobicContact CD1-CB 4.13Å; R342-L346 WeakPolarHBondContact O-CG 3.24Å; R342-L346 PolarHBondContact O-N 2.85Å; L343-L346 PolarHBondContact O-N 3.37Å; L343-L346 VanDerWaalsContact O-N 3.09Å; W344-L346 PolarHBondContact O-N 3.1Å; W344-L346 VanDerWaalsContact O-N 3.16Å; L346-T348 VanDerWaalsContact C-N 3.32Å; L346-T348 PolarHBondContact O-N 2.88Å; L346-R349 WeakPolarHBondContact O-CB 3.46Å; L346-R349 PolarHBondContact O-N 2.81Å; L346-M350 HydrophobicContact CB-CE 3.8Å; L346-M350 HydrophobicContact CD2-CE 4.11Å; L346-M350 VanDerWaalsContact O-CG 3.28Å; L346-M350 WeakPolarHBondContact O-CG 3.27Å; L346-M350 PolarHBondContact O-N 2.89Å
347	A	75.9	Confident	75.1	Confident	5 Å²	5	64.3 Å²	64.3	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-44.4	175.1	0	0	0	0	0	112.5	L343 W344 R349 M350 T351 L352 W357	L343-A347 WeakPolarHBondContact O-CB 3.42Å; L343-A347 PolarHBondContact O-N 3.27Å; W344-A347 HydrophobicContact CE3-CB 4.48Å; W344-A347 PolarHBondContact O-N 2.88Å; A347-R349 VanDerWaalsContact C-N 3.33Å; A347-R349 PolarHBondContact O-N 2.68Å; A347-M350 PolarHBondContact O-N 3.14Å; A347-M350 VanDerWaalsContact O-N 3.15Å; A347-T351 PolarHBondContact O-N 2.94Å; A347-L352 HydrophobicContact CB-CD1 3.97Å; A347-L352 PolarHBondContact O-N 3.43Å; A347-W357 HydrophobicContact CB-CZ2 4.22Å
348	T	74.1	Confident	75.7	Confident	70 Å²	70	63.1 Å²	63.1	43%	0.429	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.9	-34.3	174.9	46.9	0	0	0	0	113.2	W344 T345 L346 M350	W344-T348 HydrophobicContact CD2-CG2 3.87Å; W344-T348 HydrophobicContact CE3-CG2 4.15Å; W344-T348 HydrophobicContact CH2-CG2 3.8Å; W344-T348 HydrophobicContact CZ2-CG2 3.49Å; W344-T348 VanDerWaalsContact CZ2-CG2 3.49Å; W344-T348 HydrophobicContact CZ3-CG2 4.11Å; W344-T348 WeakPolarHBondContact O-CB 3.4Å; W344-T348 WeakPolarHBondContact O-CG2 3.5Å; W344-T348 PolarHBondContact O-N 2.85Å; W344-T348 PolarHBondContact O-OG1 3.48Å; T345-T348 WeakPolarHBondContact CA-OG1 3.25Å; L346-T348 VanDerWaalsContact C-N 3.32Å; L346-T348 PolarHBondContact O-N 2.88Å; T348-M350 VanDerWaalsContact C-N 3.33Å
349	R	75.3	Confident	76.2	Confident	185 Å²	185	55.3 Å²	55.3	70%	0.698	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-73.4	-23.5	174.4	-72	175.2	179.5	-174.5	-2.1	113.5	T345 L346 A347	T345-R349 WeakPolarHBondContact O-CD 3.38Å; T345-R349 VanDerWaalsContact O-CG 3.24Å; T345-R349 WeakPolarHBondContact O-CG 3.33Å; T345-R349 PolarHBondContact O-NE 2.78Å; L346-R349 WeakPolarHBondContact O-CB 3.46Å; L346-R349 PolarHBondContact O-N 2.81Å; A347-R349 VanDerWaalsContact C-N 3.33Å; A347-R349 PolarHBondContact O-N 2.68Å
350	M	69.5	Low	76.6	Confident	31 Å²	31	52.8 Å²	52.8	15%	0.153	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-88.8	-3.6	-179.5	-68.3	160.6	-163.7	0	0	113.2	M315 L318 L346 A347 T348 L352	M315-M350 HydrophobicContact CB-CE 3.68Å; M315-M350 HydrophobicContact CG-CE 3.44Å; M315-M350 VanDerWaalsContact CG-CE 3.44Å; M315-M350 HydrophobicContact SD-CE 3.87Å; L318-M350 HydrophobicContact CB-SD 4.02Å; L318-M350 HydrophobicContact CD1-CE 4.14Å; L318-M350 HydrophobicContact CD1-SD 4.18Å; L346-M350 HydrophobicContact CB-CE 3.8Å; L346-M350 HydrophobicContact CD2-CE 4.11Å; L346-M350 VanDerWaalsContact O-CG 3.28Å; L346-M350 WeakPolarHBondContact O-CG 3.27Å; L346-M350 PolarHBondContact O-N 2.89Å; A347-M350 PolarHBondContact O-N 3.14Å; A347-M350 VanDerWaalsContact O-N 3.15Å; T348-M350 VanDerWaalsContact C-N 3.33Å; M350-L352 HydrophobicContact CB-CD1 4.45Å; M350-L352 HydrophobicContact CB-CD2 4.5Å; M350-L352 HydrophobicContact CB-CG 3.91Å; M350-L352 PolarHBondContact O-N 3.44Å; M350-L352 HydrophobicContact SD-CD1 4.39Å
351	T	66.3	Low	76.9	Confident	122 Å²	122	53.4 Å²	53.4	75%	0.748	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	41.3	-171.4	58.8	0	0	0	0	112.7	A347	A347-T351 PolarHBondContact O-N 2.94Å
352	L	65.8	Low	77	Confident	23 Å²	23	50.5 Å²	50.5	12%	0.12	25%	0.252	C	S	.	.			trans	-64.3	152.6	170.1	-68.3	-180	0	0	0	110.1	R322 A347 M350 F355	R322-L352 HydrophobicContact CB-CD2 3.84Å; R322-L352 HydrophobicContact CG-CD2 4.12Å; A347-L352 HydrophobicContact CB-CD1 3.97Å; A347-L352 PolarHBondContact O-N 3.43Å; M350-L352 HydrophobicContact CB-CD1 4.45Å; M350-L352 HydrophobicContact CB-CD2 4.5Å; M350-L352 HydrophobicContact CB-CG 3.91Å; M350-L352 PolarHBondContact O-N 3.44Å; M350-L352 HydrophobicContact SD-CD1 4.39Å; L352-F355 HydrophobicContact CB-CE2 4.11Å; L352-F355 HydrophobicContact CD1-CE2 4.27Å
353	P	61	Low	77.2	Confident	77 Å²	77	45.6 Å²	45.6	50%	0.5	24%	0.235	S	C	.	.			trans	-60.4	154.6	171.4	28.2	-35.5	0	0	0	110.8	F355	P353-F355 HydrophobicContact CG-CE1 3.94Å; P353-F355 HydrophobicContact CG-CE2 4.35Å; P353-F355 HydrophobicContact CG-CZ 3.72Å; P353-F355 WeakPolarHBondContact O-CD2 3.4Å; P353-F355 PolarHBondContact O-N 3.49Å
354	E	65.9	Low	77.1	Confident	114 Å²	114	48 Å²	48	53%	0.533	25%	0.247	S	C	.	.			trans	-73.8	98.6	-178.5	-66.1	-156.5	148.1	0	0	112	W512	E354-W512 VanDerWaalsContact CD-CZ3 3.5Å; E354-W512 WeakPolarHBondContact OE1-CZ3 3.45Å; E354-W512 WeakPolarHBondContact OE2-CZ3 3.26Å
355	F	74.9	Confident	76.7	Confident	12 Å²	12	47.6 Å²	47.6	5%	0.053	25%	0.251	C	S	.	.			trans	-76.4	141.8	169.3	-53.9	-64.2	0	0	0	111.2	L321 V330 L352 P353 W357	L321-F355 HydrophobicContact CB-CE2 4.01Å; L321-F355 HydrophobicContact CB-CZ 3.81Å; L321-F355 HydrophobicContact CD1-CE2 4.35Å; V330-F355 HydrophobicContact CB-CB 4.18Å; V330-F355 HydrophobicContact CG2-CB 3.64Å; V330-F355 HydrophobicContact CG2-CD1 4.01Å; V330-F355 HydrophobicContact CG2-CD2 3.96Å; V330-F355 HydrophobicContact CG2-CG 3.6Å; L352-F355 HydrophobicContact CB-CE2 4.11Å; L352-F355 HydrophobicContact CD1-CE2 4.27Å; P353-F355 HydrophobicContact CG-CE1 3.94Å; P353-F355 HydrophobicContact CG-CE2 4.35Å; P353-F355 HydrophobicContact CG-CZ 3.72Å; P353-F355 WeakPolarHBondContact O-CD2 3.4Å; P353-F355 PolarHBondContact O-N 3.49Å; F355-W357 PolarHBondContact O-N 2.9Å; F355-W357 PolarHBondContact O-NE1 3.27Å
356	H	78.3	Confident	76.2	Confident	77 Å²	77	49.4 Å²	49.4	36%	0.356	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	113.8	164.9	-61.3	-49.7	0	0	0	109.6	W266 R328 G329 V330	W266-H356 HydrophobicContact CD2-CB 4.4Å; W266-H356 AromaticContact CE2-CD2 3.46Å; W266-H356 VanDerWaalsContact CE2-CD2 3.46Å; W266-H356 AromaticContact CE2-CG 3.85Å; W266-H356 HydrophobicContact CE3-CB 4.44Å; W266-H356 HydrophobicContact CH2-CB 3.64Å; W266-H356 HydrophobicContact CZ2-CB 3.55Å; W266-H356 AromaticContact CZ2-CD2 3.54Å; W266-H356 AromaticContact CZ2-CG 3.5Å; W266-H356 VanDerWaalsContact CZ2-CG 3.5Å; W266-H356 HydrophobicContact CZ3-CB 4.09Å; W266-H356 AromaticContact NE1-CD2 3.36Å; W266-H356 PolarHBondContact NE1-CD2 3.18Å; W266-H356 AromaticContact NE1-NE2 3.96Å; R328-H356 PolarHBondContact O-N 2.87Å; G329-H356 WeakPolarHBondContact CA-O 3.37Å; V330-H356 PolarHBondContact N-O 3.47Å
357	W	84.7	Confident	75.8	Confident	7 Å²	7	55 Å²	55	3%	0.027	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	136.2	-178.4	-66	80.9	0	0	0	111.6	V330 T332 L343 W344 A347 F355 P374 L377 L378	V330-W357 HydrophobicContact CB-CE3 4.37Å; V330-W357 HydrophobicContact CG1-CD2 4.42Å; V330-W357 HydrophobicContact CG1-CE3 3.82Å; V330-W357 HydrophobicContact CG1-CH2 4.23Å; V330-W357 HydrophobicContact CG1-CZ3 3.71Å; V330-W357 WeakPolarHBondContact O-CA 3.3Å; T332-W357 HydrophobicContact CG2-CE3 4.01Å; T332-W357 HydrophobicContact CG2-CZ3 4.04Å; L343-W357 HydrophobicContact CB-CH2 4.29Å; L343-W357 HydrophobicContact CB-CZ3 4.42Å; W344-W357 AromaticContact CE3-CE2 3.92Å; W344-W357 HydrophobicContact CE3-CZ2 4.17Å; W344-W357 AromaticContact CE3-NE1 3.45Å; W344-W357 AromaticContact CZ3-NE1 3.47Å; A347-W357 HydrophobicContact CB-CZ2 4.22Å; F355-W357 PolarHBondContact O-N 2.9Å; F355-W357 PolarHBondContact O-NE1 3.27Å; W357-P374 HydrophobicContact CB-CG 4.24Å; W357-P374 HydrophobicContact CG-CG 3.97Å; W357-L377 HydrophobicContact CB-CD1 3.5Å; W357-L378 PolarHBondContact O-N 3.38Å
358	V	89.4	Confident	75.7	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.1	177.2	-169.9	0	0	0	0	110.3	L257 W266 V330 V331 T332 G360 L378	L257-V358 HydrophobicContact CD1-CG1 3.63Å; W266-V358 HydrophobicContact CE3-CG2 4.13Å; W266-V358 HydrophobicContact CZ3-CG2 3.54Å; V330-V358 PolarHBondContact O-N 3.42Å; V331-V358 WeakPolarHBondContact CA-O 3.29Å; V331-V358 HydrophobicContact CG2-CB 4.4Å; T332-V358 PolarHBondContact N-O 3Å; T332-V358 PolarHBondContact OG1-O 3.14Å; V358-G360 PolarHBondContact O-N 3.49Å; V358-L378 HydrophobicContact CG1-CB 4.27Å; V358-L378 HydrophobicContact CG2-CB 4.42Å
359	L	88.7	Confident	75.8	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	113	166.6	-51.4	-174.7	0	0	0	108.5	T332 I337 V340 D361 Q363 L368 L377 L378 A379	T332-L359 WeakPolarHBondContact OG1-CD2 3.46Å; I337-L359 HydrophobicContact CD1-CD1 3.94Å; V340-L359 HydrophobicContact CG1-CD2 4.13Å; V340-L359 HydrophobicContact CG2-CD2 3.74Å; L359-D361 VanDerWaalsContact C-N 3.31Å; L359-Q363 HydrophobicContact CB-CG 4.49Å; L359-Q363 HydrophobicContact CD1-CG 3.84Å; L359-L368 HydrophobicContact CD1-CD2 4.39Å; L359-L377 HydrophobicContact CD2-CD1 4.1Å; L359-L377 HydrophobicContact CG-CD1 4.17Å; L359-L378 PolarHBondContact N-O 2.89Å; L359-A379 HydrophobicContact CD1-CB 3.91Å; L359-A379 HydrophobicContact CG-CB 4.41Å
360	G	85.3	Confident	75.8	Confident	1 Å²	1	54 Å²	54	1%	0.01	29%	0.291	C	S	.	.			trans	-81.1	-11.2	177.1	0	0	0	0	0	113.9	T332 V358 H380	T332-G360 PolarHBondContact O-N 3.07Å; V358-G360 PolarHBondContact O-N 3.49Å; G360-H380 PolarHBondContact O-CE1 3.34Å; G360-H380 PolarHBondContact O-NE2 2.57Å
361	D	84.9	Confident	76	Confident	14 Å²	14	57.4 Å²	57.4	8%	0.075	31%	0.309	C	S	.	.	S	Bend	trans	-94.3	141	179.1	-50.9	-46.8	0	0	0	111	W277 F333 G334 C335 L359 Q363	W277-D361 VanDerWaalsContact CE2-OD1 3.24Å; W277-D361 HydrophobicContact CZ2-CB 4.48Å; W277-D361 PolarHBondContact NE1-OD1 3Å; F333-D361 WeakPolarHBondContact CA-OD2 3.12Å; G334-D361 PolarHBondContact N-OD1 2.88Å; G334-D361 PolarHBondContact N-OD2 2.81Å; C335-D361 PolarHBondContact N-OD2 3.16Å; L359-D361 VanDerWaalsContact C-N 3.31Å; D361-Q363 WeakPolarHBondContact O-CG 3.49Å; D361-Q363 PolarHBondContact O-N 3.18Å; D361-Q363 PolarHBondContact O-NE2 2.88Å
362	S	84.3	Confident	76.2	Confident	51 Å²	51	53.5 Å²	53.5	36%	0.357	29%	0.293	S	S	.	.			trans	-69.2	113.6	179.7	-178.4	0	0	0	0	112	H380 G381	S362-H380 WeakPolarHBondContact CA-O 3.34Å; S362-G381 WeakPolarHBondContact OG-CA 3.4Å
363	Q	83.3	Confident	76.9	Confident	36 Å²	36	53.1 Å²	53.1	17%	0.168	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	161	-177.6	-54.8	-59.4	-53.7	0	0	112.8	L359 D361 L368 A379 H380 G381 M382	L359-Q363 HydrophobicContact CB-CG 4.49Å; L359-Q363 HydrophobicContact CD1-CG 3.84Å; D361-Q363 WeakPolarHBondContact O-CG 3.49Å; D361-Q363 PolarHBondContact O-N 3.18Å; D361-Q363 PolarHBondContact O-NE2 2.88Å; Q363-L368 HydrophobicContact CB-CD1 4Å; Q363-L368 HydrophobicContact CB-CD2 3.99Å; Q363-L368 HydrophobicContact CB-CG 4.03Å; Q363-L368 HydrophobicContact CG-CD2 4.03Å; Q363-A379 HydrophobicContact CG-CB 4.45Å; Q363-H380 PolarHBondContact N-O 3.09Å; Q363-G381 WeakPolarHBondContact O-CA 3.34Å; Q363-M382 PolarHBondContact O-N 2.64Å
364	N	76.3	Confident	77.8	Confident	54 Å²	54	49.6 Å²	49.6	29%	0.289	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.7	166.5	-179.4	4.5	0	0	0	109.7	A366 E367 L368	N364-A366 PolarHBondContact O-N 2.95Å; N364-A366 PolarHBondContact OD1-N 2.95Å; N364-E367 HydrophobicContact CB-CB 4.37Å; N364-E367 HydrophobicContact CB-CG 4.3Å; N364-E367 WeakPolarHBondContact CB-OE1 3.38Å; N364-E367 PolarHBondContact ND2-OE1 2.86Å; N364-E367 PolarHBondContact O-N 2.92Å; N364-L368 PolarHBondContact O-N 3.2Å
365	V	70.2	Confident	78.3	Confident	48 Å²	48	47.9 Å²	47.9	29%	0.291	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-37.6	-179.8	-173.9	0	0	0	0	112.2	E367 L368 M383 W470	V365-E367 PolarHBondContact O-N 3.42Å; V365-E367 VanDerWaalsContact O-N 3.16Å; V365-L368 PolarHBondContact O-N 2.86Å; V365-M383 HydrophobicContact CG2-CB 4.38Å; V365-M383 HydrophobicContact CG2-CG 4.29Å; V365-W470 HydrophobicContact CG2-CD2 4.47Å; V365-W470 HydrophobicContact CG2-CH2 3.19Å; V365-W470 HydrophobicContact CG2-CZ2 3.06Å; V365-W470 HydrophobicContact CG2-CZ3 3.94Å
366	A	67.8	Low	78.4	Confident	92 Å²	92	49 Å²	49	76%	0.76	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-14.8	-179.6	0	0	0	0	0	113.7	N364	N364-A366 PolarHBondContact O-N 2.95Å; N364-A366 PolarHBondContact OD1-N 2.95Å
367	E	69.8	Low	78.8	Confident	130 Å²	130	45.4 Å²	45.4	61%	0.607	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-16.4	-177.5	-67.5	162.5	-135.3	0	0	112.3	N364 V365 R369	N364-E367 HydrophobicContact CB-CB 4.37Å; N364-E367 HydrophobicContact CB-CG 4.3Å; N364-E367 WeakPolarHBondContact CB-OE1 3.38Å; N364-E367 PolarHBondContact ND2-OE1 2.86Å; N364-E367 PolarHBondContact O-N 2.92Å; V365-E367 PolarHBondContact O-N 3.42Å; V365-E367 VanDerWaalsContact O-N 3.16Å; E367-R369 PolarHBondContact O-N 3.08Å
368	L	73.8	Confident	78.9	Confident	15 Å²	15	45.5 Å²	45.5	8%	0.079	26%	0.262	C	S	.	.			trans	-73	84	-180	-78.3	179.2	0	0	0	113.1	I337 L359 Q363 N364 V365 A379 W470 W482	I337-L368 HydrophobicContact CD1-CD2 4.19Å; L359-L368 HydrophobicContact CD1-CD2 4.39Å; Q363-L368 HydrophobicContact CB-CD1 4Å; Q363-L368 HydrophobicContact CB-CD2 3.99Å; Q363-L368 HydrophobicContact CB-CG 4.03Å; Q363-L368 HydrophobicContact CG-CD2 4.03Å; N364-L368 PolarHBondContact O-N 3.2Å; V365-L368 PolarHBondContact O-N 2.86Å; L368-A379 HydrophobicContact CD1-CB 4.13Å; L368-W470 HydrophobicContact CD1-CE3 4.29Å; L368-W482 HydrophobicContact CD1-CD2 4.49Å; L368-W482 HydrophobicContact CD2-CZ2 3.97Å; L368-W482 PolarHBondContact O-NE1 3.18Å
369	R	76.4	Confident	78.9	Confident	185 Å²	185	45.5 Å²	45.5	70%	0.698	26%	0.262	S	S	*	.			trans	-67.2	154.5	169	-57.3	-173.9	-173.8	-151.7	-0.9	111.5	E367 L373 W482	E367-R369 PolarHBondContact O-N 3.08Å; R369-L373 WeakPolarHBondContact O-CD1 3.49Å; R369-W482 PolarHBondContact O-NE1 3.09Å
370	T	76.3	Confident	78.9	Confident	41 Å²	41	45.4 Å²	45.4	25%	0.252	26%	0.261	S	S	.	.			trans	-103.3	-14.7	-178.9	56.8	0	0	0	0	113.6	G372 L472 P480 W482	T370-G372 PolarHBondContact O-N 2.93Å; T370-G372 VanDerWaalsContact O-N 3.12Å; T370-L472 HydrophobicContact CG2-CD1 3.69Å; T370-P480 VanDerWaalsContact CB-O 3.28Å; T370-P480 WeakPolarHBondContact CB-O 3.43Å; T370-P480 VanDerWaalsContact CG2-O 3.29Å; T370-P480 WeakPolarHBondContact CG2-O 3.33Å; T370-P480 PolarHBondContact OG1-O 3.41Å; T370-W482 HydrophobicContact CG2-CG 4.44Å
371	D	73.4	Confident	78.9	Confident	102 Å²	102	45.3 Å²	45.3	55%	0.545	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	110.3	-174.7	-63.8	-51.1	0	0	0	113.6	R341	R341-D371 WeakPolarHBondContact CD-O 3.33Å; R341-D371 VanDerWaalsContact NH1-CB 3.25Å; R341-D371 PolarHBondContact NH1-O 2.65Å
372	G	70.5	Confident	78.8	Confident	39 Å²	39	47.6 Å²	47.6	40%	0.402	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	24.3	165.1	0	0	0	0	0	115.9	T370	T370-G372 PolarHBondContact O-N 2.93Å; T370-G372 VanDerWaalsContact O-N 3.12Å
373	L	80.4	Confident	78.1	Confident	16 Å²	16	51 Å²	51	8%	0.084	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-94.5	161.1	172.5	-67.8	172.4	0	0	0	111.5	I337 V340 R341 R369 L377 L472 W482	I337-L373 HydrophobicContact CD1-CD1 3.69Å; I337-L373 HydrophobicContact CD1-CD2 3.93Å; I337-L373 HydrophobicContact CD1-CG 4.48Å; I337-L373 HydrophobicContact CG1-CD1 3.88Å; I337-L373 HydrophobicContact CG1-CD2 4.15Å; V340-L373 HydrophobicContact CB-CD2 4.5Å; V340-L373 HydrophobicContact CG1-CD2 4.12Å; R341-L373 HydrophobicContact CB-CD2 4.18Å; R369-L373 WeakPolarHBondContact O-CD1 3.49Å; L373-L377 HydrophobicContact CB-CD2 4.05Å; L373-L377 HydrophobicContact CD1-CD2 3.97Å; L373-L377 HydrophobicContact CD2-CD2 4.15Å; L373-L377 HydrophobicContact CG-CD2 4.29Å; L373-L472 HydrophobicContact CB-CD2 3.58Å; L373-L472 HydrophobicContact CD1-CD2 4.5Å; L373-W482 HydrophobicContact CD1-CZ2 4.01Å
374	P	79.6	Confident	77.4	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.019	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-66.6	137.4	173.5	15.4	-17.9	0	0	0	112	W344 W357 L377 L472	W344-P374 HydrophobicContact CB-CG 4.42Å; W344-P374 HydrophobicContact CD2-CB 3.69Å; W344-P374 HydrophobicContact CD2-CG 3.81Å; W344-P374 HydrophobicContact CE3-CB 3.98Å; W344-P374 HydrophobicContact CE3-CG 4.09Å; W344-P374 HydrophobicContact CG-CB 4.21Å; W344-P374 HydrophobicContact CG-CG 3.95Å; W344-P374 HydrophobicContact CH2-CB 4.11Å; W344-P374 HydrophobicContact CZ2-CB 3.81Å; W344-P374 HydrophobicContact CZ3-CB 4.19Å; W357-P374 HydrophobicContact CB-CG 4.24Å; W357-P374 HydrophobicContact CG-CG 3.97Å; P374-L377 HydrophobicContact CG-CB 4.18Å; P374-L377 WeakPolarHBondContact O-CB 3.48Å; P374-L377 PolarHBondContact O-N 2.85Å; P374-L472 WeakPolarHBondContact O-CD2 3.49Å
375	L	76.5	Confident	77.3	Confident	78 Å²	78	54.7 Å²	54.7	41%	0.408	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	145.3	165.9	-65.4	176.1	0	0	0	109.6	L377 L472 L474 P480	L375-L377 PolarHBondContact O-N 2.97Å; L375-L472 HydrophobicContact CD2-CG 4.47Å; L375-L474 HydrophobicContact CD1-CD1 4.08Å; L375-L474 HydrophobicContact CD1-CD2 4.18Å; L375-L474 HydrophobicContact CD1-CG 4.01Å; L375-L474 HydrophobicContact CD2-CD2 3.87Å; L375-L474 HydrophobicContact CD2-CG 4.09Å; L375-P480 HydrophobicContact CD2-CB 4.45Å
376	G	76.8	Confident	77.9	Confident	36 Å²	36	53.6 Å²	53.6	37%	0.371	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-0.1	-173	0	0	0	0	0	115	L378 L472	G376-L378 PolarHBondContact O-N 2.93Å; G376-L472 PolarHBondContact N-O 2.87Å
377	L	85.5	Confident	78.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	30%	0.3	C	S	.	.			trans	-53.1	124.3	170.5	175.4	65.2	0	0	0	110	W357 L359 L373 P374 L375 S471 L472 W482	W357-L377 HydrophobicContact CB-CD1 3.5Å; L359-L377 HydrophobicContact CD2-CD1 4.1Å; L359-L377 HydrophobicContact CG-CD1 4.17Å; L373-L377 HydrophobicContact CB-CD2 4.05Å; L373-L377 HydrophobicContact CD1-CD2 3.97Å; L373-L377 HydrophobicContact CD2-CD2 4.15Å; L373-L377 HydrophobicContact CG-CD2 4.29Å; P374-L377 HydrophobicContact CG-CB 4.18Å; P374-L377 WeakPolarHBondContact O-CB 3.48Å; P374-L377 PolarHBondContact O-N 2.85Å; L375-L377 PolarHBondContact O-N 2.97Å; L377-S471 WeakPolarHBondContact O-CA 3.37Å; L377-L472 HydrophobicContact CB-CB 4.3Å; L377-L472 PolarHBondContact O-N 2.69Å; L377-W482 HydrophobicContact CB-CH2 4.4Å; L377-W482 HydrophobicContact CD2-CH2 3.65Å; L377-W482 HydrophobicContact CD2-CZ2 4.1Å; L377-W482 HydrophobicContact CG-CH2 3.85Å; L377-W482 WeakPolarHBondContact O-CZ3 3.45Å
378	L	88.2	Confident	79.5	Confident	9 Å²	9	47.8 Å²	47.8	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.7	173.5	-61.9	-169.2	0	0	0	111.2	W266 W357 V358 L359 G376 W470 L485	W266-L378 HydrophobicContact CH2-CD1 3.67Å; W266-L378 HydrophobicContact CH2-CG 4.25Å; W266-L378 HydrophobicContact CZ3-CD1 3.74Å; W357-L378 PolarHBondContact O-N 3.38Å; V358-L378 HydrophobicContact CG1-CB 4.27Å; V358-L378 HydrophobicContact CG2-CB 4.42Å; L359-L378 PolarHBondContact N-O 2.89Å; G376-L378 PolarHBondContact O-N 2.93Å; L378-W470 WeakPolarHBondContact CA-O 3.46Å; L378-L485 HydrophobicContact CD2-CD1 3.77Å
379	A	88.4	Confident	80.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.8	171.4	0	0	0	0	0	109.9	L359 Q363 L368 I469 W470 W482	L359-A379 HydrophobicContact CD1-CB 3.91Å; L359-A379 HydrophobicContact CG-CB 4.41Å; Q363-A379 HydrophobicContact CG-CB 4.45Å; L368-A379 HydrophobicContact CD1-CB 4.13Å; A379-I469 WeakPolarHBondContact O-CA 3.23Å; A379-W470 PolarHBondContact N-O 3.23Å; A379-W470 PolarHBondContact O-N 3.48Å; A379-W482 HydrophobicContact CB-CE3 4.47Å; A379-W482 HydrophobicContact CB-CH2 3.67Å; A379-W482 HydrophobicContact CB-CZ3 3.61Å
380	H	88.5	Confident	80.8	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	154.4	173.8	63.6	47.6	0	0	0	111.2	L256 G360 S362 Q363 H467 Y468 I469	L256-H380 HydrophobicContact CD2-CB 3.93Å; L256-H380 WeakPolarHBondContact CD2-CD2 3.39Å; G360-H380 PolarHBondContact O-CE1 3.34Å; G360-H380 PolarHBondContact O-NE2 2.57Å; S362-H380 WeakPolarHBondContact CA-O 3.34Å; Q363-H380 PolarHBondContact N-O 3.09Å; H380-H467 AromaticContact CG-NE2 3.91Å; H380-H467 AromaticContact ND1-NE2 3.67Å; H380-Y468 VanDerWaalsContact CA-O 3.27Å; H380-Y468 WeakPolarHBondContact CA-O 3.2Å; H380-I469 HydrophobicContact CB-CG1 4.06Å
381	G	86.5	Confident	81.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.6	-161.2	179.3	0	0	0	0	0	114.2	S362 Q363 H467 Y468 W470	S362-G381 WeakPolarHBondContact OG-CA 3.4Å; Q363-G381 WeakPolarHBondContact O-CA 3.34Å; G381-H467 WeakPolarHBondContact CA-NE2 3.49Å; G381-H467 PolarHBondContact N-NE2 2.91Å; G381-H467 VanDerWaalsContact N-NE2 3.2Å; G381-H467 CarbonylContact O-C 3.57Å; G381-H467 VanDerWaalsContact O-CA 3.29Å; G381-H467 WeakPolarHBondContact O-CA 3.02Å; G381-Y468 PolarHBondContact N-O 3.37Å; G381-Y468 PolarHBondContact O-N 2.91Å; G381-W470 VanDerWaalsContact N-CZ3 3.34Å; G381-W470 VanDerWaalsContact O-CH2 3.3Å; G381-W470 WeakPolarHBondContact O-CH2 3.44Å
382	M	82	Confident	82.4	Confident	61 Å²	61	38.4 Å²	38.4	30%	0.3	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.4	-172.9	-65	177.2	-73.6	0	0	111.2	A250 Q363 G384 A465	A250-M382 HydrophobicContact CB-CE 4.23Å; A250-M382 HydrophobicContact CB-SD 4.07Å; Q363-M382 PolarHBondContact O-N 2.64Å; M382-G384 VanDerWaalsContact C-N 3.34Å; M382-A465 HydrophobicContact CG-CB 4.19Å; M382-A465 HydrophobicContact SD-CB 3.69Å
383	M	69	Low	83.5	Confident	123 Å²	123	38.6 Å²	38.6	61%	0.606	23%	0.233	S	C	*	.	S	Bend	trans	-84.2	-8.4	-177.4	-164.8	166.1	179.4	0	0	113.9	V365 Y468	V365-M383 HydrophobicContact CG2-CB 4.38Å; V365-M383 HydrophobicContact CG2-CG 4.29Å; M383-Y468 HydrophobicContact CB-CD2 4.01Å; M383-Y468 HydrophobicContact CB-CE2 3.95Å; M383-Y468 HydrophobicContact SD-CD2 4.42Å; M383-Y468 HydrophobicContact SD-CE2 4.01Å
384	G	69.8	Low	84.1	Confident	54 Å²	54	37.8 Å²	37.8	56%	0.557	23%	0.229	S	C	*	.			trans	149.6	163.6	179.3	0	0	0	0	0	111.5	M382	M382-G384 VanDerWaalsContact C-N 3.34Å
385	S	73.2	Confident	84.7	Confident	114 Å²	114	37.7 Å²	37.7	80%	0.797	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-79.9	130	169.5	55.3	0	0	0	0	110.3
386	P	82.8	Confident	85.6	Confident	25 Å²	25	34 Å²	34	16%	0.162	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-69.8	155.2	178.8	30.4	-36.4	0	0	0	112.4	T248 H390 Y391	T248-P386 HydrophobicContact CG2-CG 3.83Å; P386-H390 HydrophobicContact CB-CB 4.17Å; P386-Y391 HydrophobicContact CB-CE2 4.49Å; P386-Y391 HydrophobicContact CG-CE2 3.87Å; P386-Y391 WeakPolarHBondContact CG-OH 3.33Å
387	S	85.8	Confident	86.4	Confident	50 Å²	50	33.1 Å²	33.1	35%	0.35	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-71.6	163.2	177.6	71.5	0	0	0	0	112	D389 H390 Y391	S387-D389 PolarHBondContact O-N 3.21Å; S387-H390 WeakPolarHBondContact O-CB 3.37Å; S387-H390 PolarHBondContact O-N 2.67Å; S387-H390 PolarHBondContact OG-CD2 3.47Å; S387-H390 PolarHBondContact OG-N 3.04Å; S387-Y391 WeakPolarHBondContact O-CD2 3.49Å
388	L	86.2	Confident	86.8	Confident	49 Å²	49	33.1 Å²	33.1	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-60.4	-36.4	176.6	-59.8	179.9	0	0	0	111.7	V55 F127 M246 H390 Y391 V392	V55-L388 HydrophobicContact CG1-CD1 4.34Å; V55-L388 HydrophobicContact CG2-CD1 4.02Å; F127-L388 HydrophobicContact CB-CD1 3.94Å; F127-L388 HydrophobicContact CD2-CB 3.68Å; F127-L388 HydrophobicContact CD2-CD1 3.89Å; F127-L388 HydrophobicContact CD2-CG 4.45Å; F127-L388 HydrophobicContact CE2-CB 3.77Å; F127-L388 HydrophobicContact CG-CD1 3.97Å; M246-L388 HydrophobicContact CB-CD2 4.26Å; M246-L388 HydrophobicContact SD-CD2 3.93Å; L388-H390 VanDerWaalsContact C-N 3.32Å; L388-H390 PolarHBondContact O-N 2.89Å; L388-Y391 PolarHBondContact O-N 2.96Å; L388-V392 PolarHBondContact O-N 3.28Å
389	D	88.1	Confident	87.1	Confident	73 Å²	73	32.7 Å²	32.7	39%	0.39	19%	0.193	S	C	.	.	H	α-helix	trans	-66.2	-31	179.4	-52	-71.1	0	0	0	113	S132 S387 Y391 V392 Q393	S132-D389 VanDerWaalsContact CB-OD1 3.23Å; S132-D389 WeakPolarHBondContact CB-OD1 3.49Å; S132-D389 PolarHBondContact OG-OD1 3.35Å; S387-D389 PolarHBondContact O-N 3.21Å; D389-Y391 VanDerWaalsContact C-N 3.33Å; D389-Y391 PolarHBondContact O-N 3.01Å; D389-V392 WeakPolarHBondContact O-CB 3.22Å; D389-V392 PolarHBondContact O-N 2.92Å; D389-V392 VanDerWaalsContact O-N 3.13Å; D389-Q393 PolarHBondContact O-N 3.4Å
390	H	90.3	Very high	87.3	Confident	64 Å²	64	32.9 Å²	32.9	30%	0.296	20%	0.195	S	C	.	.	H	α-helix	trans	-61.7	-41.5	174.5	-70.6	-161.3	0	0	0	111	P386 S387 L388 V392 Q393 D394 Q448	P386-H390 HydrophobicContact CB-CB 4.17Å; S387-H390 WeakPolarHBondContact O-CB 3.37Å; S387-H390 PolarHBondContact O-N 2.67Å; S387-H390 PolarHBondContact OG-CD2 3.47Å; S387-H390 PolarHBondContact OG-N 3.04Å; L388-H390 VanDerWaalsContact C-N 3.32Å; L388-H390 PolarHBondContact O-N 2.89Å; H390-V392 VanDerWaalsContact C-N 3.31Å; H390-V392 PolarHBondContact O-N 3.16Å; H390-Q393 PolarHBondContact O-N 3.25Å; H390-D394 WeakPolarHBondContact O-CB 3.41Å; H390-D394 PolarHBondContact O-N 3.31Å; H390-Q448 HydrophobicContact CB-CB 3.79Å; H390-Q448 PolarHBondContact ND1-O 3.21Å
391	Y	90.6	Very high	87.6	Confident	10 Å²	10	36.2 Å²	36.2	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-32.2	174.9	-60.2	-88	0	0	0	112.3	M244 M246 R247 T248 P386 S387 L388 D389 S395	M244-Y391 HydrophobicContact CE-CD1 3.87Å; M246-Y391 HydrophobicContact CB-CD2 4.04Å; M246-Y391 HydrophobicContact CB-CE2 4.17Å; M246-Y391 HydrophobicContact CB-CG 4.22Å; M246-Y391 HydrophobicContact CG-CD2 4.25Å; M246-Y391 HydrophobicContact CG-CG 4.16Å; M246-Y391 PolarHBondContact O-OH 2.99Å; R247-Y391 WeakPolarHBondContact CA-OH 3.46Å; R247-Y391 PolarHBondContact N-OH 3.46Å; T248-Y391 PolarHBondContact N-OH 3.06Å; P386-Y391 HydrophobicContact CB-CE2 4.49Å; P386-Y391 HydrophobicContact CG-CE2 3.87Å; P386-Y391 WeakPolarHBondContact CG-OH 3.33Å; S387-Y391 WeakPolarHBondContact O-CD2 3.49Å; L388-Y391 PolarHBondContact O-N 2.96Å; D389-Y391 VanDerWaalsContact C-N 3.33Å; D389-Y391 PolarHBondContact O-N 3.01Å; Y391-S395 VanDerWaalsContact O-CB 3.32Å; Y391-S395 WeakPolarHBondContact O-CB 3.21Å; Y391-S395 PolarHBondContact O-N 2.8Å; Y391-S395 PolarHBondContact O-OG 3.11Å
392	V	91.8	Very high	87.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.5	-46.6	174.7	-178.9	0	0	0	0	110.8	F127 V133 F203 L388 D389 H390 S395 L396	F127-V392 HydrophobicContact CE2-CG2 3.86Å; F127-V392 HydrophobicContact CZ-CG2 3.63Å; V133-V392 HydrophobicContact CB-CG1 4.34Å; V133-V392 HydrophobicContact CG2-CG1 3.48Å; V133-V392 VanDerWaalsContact CG2-CG1 3.48Å; F203-V392 HydrophobicContact CE1-CG1 4.31Å; F203-V392 HydrophobicContact CE1-CG2 3.94Å; F203-V392 HydrophobicContact CZ-CG1 4.01Å; F203-V392 HydrophobicContact CZ-CG2 4.43Å; L388-V392 PolarHBondContact O-N 3.28Å; D389-V392 WeakPolarHBondContact O-CB 3.22Å; D389-V392 PolarHBondContact O-N 2.92Å; D389-V392 VanDerWaalsContact O-N 3.13Å; H390-V392 VanDerWaalsContact C-N 3.31Å; H390-V392 PolarHBondContact O-N 3.16Å; V392-S395 PolarHBondContact O-N 3.08Å; V392-L396 PolarHBondContact O-N 2.93Å; V392-L396 VanDerWaalsContact O-N 3.13Å
393	Q	92.7	Very high	88.5	Confident	42 Å²	42	33.5 Å²	33.5	20%	0.196	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-49	176.5	-178.9	175.1	-31.6	0	0	111.1	A136 L140 D389 H390 S395 L396 E397	A136-Q393 HydrophobicContact CB-CB 3.95Å; A136-Q393 HydrophobicContact CB-CG 4.19Å; L140-Q393 HydrophobicContact CD2-CG 4.46Å; D389-Q393 PolarHBondContact O-N 3.4Å; H390-Q393 PolarHBondContact O-N 3.25Å; Q393-S395 VanDerWaalsContact C-N 3.31Å; Q393-S395 PolarHBondContact O-N 3.17Å; Q393-L396 PolarHBondContact O-N 3.42Å; Q393-L396 VanDerWaalsContact O-N 3.15Å; Q393-E397 VanDerWaalsContact O-CB 3.3Å; Q393-E397 WeakPolarHBondContact O-CB 3.26Å; Q393-E397 PolarHBondContact O-N 2.98Å
394	D	93.6	Very high	89.5	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-40.1	178.5	-71	-12.7	0	0	0	111.9	M244 H390 L396 E397 F398 F445 G447 Q448 S449 I452	M244-D394 HydrophobicContact CE-CB 3.83Å; H390-D394 WeakPolarHBondContact O-CB 3.41Å; H390-D394 PolarHBondContact O-N 3.31Å; D394-L396 VanDerWaalsContact C-N 3.33Å; D394-L396 PolarHBondContact O-N 3.39Å; D394-E397 PolarHBondContact O-N 3.43Å; D394-F398 VanDerWaalsContact O-CB 3.31Å; D394-F398 WeakPolarHBondContact O-CB 3.44Å; D394-F398 PolarHBondContact O-N 2.83Å; D394-F445 WeakPolarHBondContact O-CZ 3.3Å; D394-G447 VanDerWaalsContact OD1-CA 3.22Å; D394-G447 WeakPolarHBondContact OD1-CA 3.38Å; D394-Q448 PolarHBondContact OD1-N 2.93Å; D394-Q448 PolarHBondContact OD2-N 3.28Å; D394-S449 WeakPolarHBondContact OD2-CB 3.37Å; D394-S449 PolarHBondContact OD2-N 3.48Å; D394-S449 PolarHBondContact OD2-OG 3.43Å; D394-I452 HydrophobicContact CB-CD1 4.1Å; D394-I452 HydrophobicContact CB-CG1 4.1Å
395	S	93.3	Very high	90.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-37.8	176.9	-59.9	0	0	0	0	112.6	V227 M244 Y391 V392 Q393 V399	V227-S395 VanDerWaalsContact CG2-OG 3.25Å; V227-S395 WeakPolarHBondContact CG2-OG 3.49Å; M244-S395 PolarHBondContact SD-OG 3.38Å; Y391-S395 VanDerWaalsContact O-CB 3.32Å; Y391-S395 WeakPolarHBondContact O-CB 3.21Å; Y391-S395 PolarHBondContact O-N 2.8Å; Y391-S395 PolarHBondContact O-OG 3.11Å; V392-S395 PolarHBondContact O-N 3.08Å; Q393-S395 VanDerWaalsContact C-N 3.31Å; Q393-S395 PolarHBondContact O-N 3.17Å; S395-V399 PolarHBondContact O-N 2.92Å
396	L	94	Very high	91.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-75.9	-35	176.6	-172.3	61.4	0	0	0	111.9	V45 A136 A137 L140 L152 I154 L201 V392 Q393 D394 V399 A400	V45-L396 HydrophobicContact CB-CD1 4.32Å; V45-L396 HydrophobicContact CG1-CD1 3.99Å; V45-L396 HydrophobicContact CG2-CD1 4.36Å; A136-L396 HydrophobicContact CB-CD2 3.93Å; A137-L396 HydrophobicContact CB-CD2 3.96Å; L140-L396 HydrophobicContact CD1-CB 3.9Å; L140-L396 HydrophobicContact CD1-CD2 3.89Å; L140-L396 HydrophobicContact CD1-CG 3.71Å; L152-L396 HydrophobicContact CD1-CD1 4.22Å; L152-L396 HydrophobicContact CD1-CG 4.39Å; L152-L396 HydrophobicContact CD2-CD1 4.17Å; L152-L396 HydrophobicContact CD2-CD2 4.25Å; L152-L396 HydrophobicContact CD2-CG 4.49Å; I154-L396 HydrophobicContact CD1-CD1 3.98Å; I154-L396 HydrophobicContact CD1-CD2 4.04Å; L201-L396 HydrophobicContact CD2-CB 4.32Å; L201-L396 HydrophobicContact CD2-CD1 4.45Å; V392-L396 PolarHBondContact O-N 2.93Å; V392-L396 VanDerWaalsContact O-N 3.13Å; Q393-L396 PolarHBondContact O-N 3.42Å; Q393-L396 VanDerWaalsContact O-N 3.15Å; D394-L396 VanDerWaalsContact C-N 3.33Å; D394-L396 PolarHBondContact O-N 3.39Å; L396-V399 PolarHBondContact O-N 3.31Å; L396-A400 WeakPolarHBondContact O-CB 3.4Å; L396-A400 PolarHBondContact O-N 3.1Å
397	E	94.4	Very high	91.9	Very high	19 Å²	19	21.5 Å²	21.5	9%	0.089	12%	0.116	C	C	.	.	H	α-helix	trans	-68.6	-34.6	176.8	-168.5	162.5	170	0	0	112.1	L140 L145 Q393 D394 A400 R401 F445	L140-E397 HydrophobicContact CD1-CB 4.03Å; L140-E397 HydrophobicContact CD2-CB 3.67Å; L140-E397 VanDerWaalsContact CD2-CD 3.48Å; L140-E397 HydrophobicContact CD2-CG 3.59Å; L140-E397 VanDerWaalsContact CD2-OE2 3.27Å; L140-E397 WeakPolarHBondContact CD2-OE2 3.33Å; L145-E397 HydrophobicContact CD1-CG 3.79Å; Q393-E397 VanDerWaalsContact O-CB 3.3Å; Q393-E397 WeakPolarHBondContact O-CB 3.26Å; Q393-E397 PolarHBondContact O-N 2.98Å; D394-E397 PolarHBondContact O-N 3.43Å; E397-A400 PolarHBondContact O-N 2.87Å; E397-R401 VanDerWaalsContact CD-NH1 3.31Å; E397-R401 VanDerWaalsContact CG-NH1 3.34Å; E397-R401 WeakPolarHBondContact O-CB 3.42Å; E397-R401 PolarHBondContact O-N 3.42Å; E397-R401 IonicContact OE1-CZ 2.84Å; E397-R401 IonicContact OE1-NH1 3.62Å; E397-R401 PolarHBondContact OE1-NH1 3.42Å; E397-R401 IonicContact OE1-NH2 3.36Å; E397-R401 PolarHBondContact OE1-NH2 2.88Å; E397-F445 HydrophobicContact CB-CE2 4.31Å; E397-F445 HydrophobicContact CB-CZ 4.13Å; E397-F445 HydrophobicContact CG-CE2 4.15Å; E397-F445 HydrophobicContact CG-CZ 4.28Å
398	F	94.3	Very high	92	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.5	-48.7	170.3	-176.8	-95	0	0	0	111.6	D394 A402 L440 T443 F445 I452 I461	D394-F398 VanDerWaalsContact O-CB 3.31Å; D394-F398 WeakPolarHBondContact O-CB 3.44Å; D394-F398 PolarHBondContact O-N 2.83Å; F398-A402 WeakPolarHBondContact O-CB 3.28Å; F398-A402 PolarHBondContact O-N 3.44Å; F398-L440 HydrophobicContact CD1-CD2 3.58Å; F398-L440 HydrophobicContact CE1-CB 4.01Å; F398-L440 HydrophobicContact CE1-CD2 3.5Å; F398-L440 HydrophobicContact CE1-CG 4.36Å; F398-L440 HydrophobicContact CZ-CB 4.44Å; F398-L440 WeakPolarHBondContact CZ-O 3.48Å; F398-T443 WeakPolarHBondContact CE2-OG1 3.48Å; F398-F445 HydrophobicContact CB-CE1 3.77Å; F398-F445 HydrophobicContact CB-CZ 4.1Å; F398-F445 AromaticContact CD2-CE1 3.94Å; F398-F445 HydrophobicContact CD2-CE1 3.94Å; F398-F445 HydrophobicContact CG-CE1 4.34Å; F398-I452 HydrophobicContact CD2-CG2 3.87Å; F398-I452 HydrophobicContact CE2-CG2 4.39Å; F398-I461 HydrophobicContact CD1-CD1 3.83Å; F398-I461 HydrophobicContact CE1-CD1 3.43Å; F398-I461 VanDerWaalsContact CE1-CD1 3.43Å; F398-I461 HydrophobicContact CE1-CG1 4.17Å; F398-I461 HydrophobicContact CE2-CD1 4.21Å; F398-I461 HydrophobicContact CE2-CG1 4.29Å; F398-I461 HydrophobicContact CE2-CG2 4.37Å; F398-I461 HydrophobicContact CG-CD1 4.36Å; F398-I461 HydrophobicContact CZ-CD1 3.64Å; F398-I461 HydrophobicContact CZ-CG1 3.85Å
399	V	94.1	Very high	92.2	Very high	1 Å²	1	31 Å²	31	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-46.8	174.1	173.6	0	0	0	0	111.4	V45 A199 V225 S395 L396 R401 A402 V403 L440	V45-V399 HydrophobicContact CG1-CG1 4.43Å; V45-V399 HydrophobicContact CG2-CG1 4Å; A199-V399 HydrophobicContact CB-CG1 3.71Å; V225-V399 HydrophobicContact CG2-CG2 3.78Å; S395-V399 PolarHBondContact O-N 2.92Å; L396-V399 PolarHBondContact O-N 3.31Å; V399-R401 PolarHBondContact O-N 3.03Å; V399-A402 PolarHBondContact O-N 3.41Å; V399-V403 HydrophobicContact CG1-CG2 4.45Å; V399-V403 WeakPolarHBondContact O-CG2 3.45Å; V399-V403 PolarHBondContact O-N 3.26Å; V399-L440 HydrophobicContact CG2-CD2 4.36Å
400	A	93.4	Very high	92.1	Very high	5 Å²	5	30.2 Å²	30.2	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-44	-179.3	0	0	0	0	0	112.5	L146 L152 L396 E397 G404	L146-A400 WeakPolarHBondContact CD2-O 3.47Å; L152-A400 HydrophobicContact CD1-CB 3.94Å; L396-A400 WeakPolarHBondContact O-CB 3.4Å; L396-A400 PolarHBondContact O-N 3.1Å; E397-A400 PolarHBondContact O-N 2.87Å; A400-G404 PolarHBondContact O-N 3.47Å
401	R	94.2	Very high	91.9	Very high	70 Å²	70	27.9 Å²	27.9	26%	0.264	14%	0.14	S	C	.	.	H	α-helix	trans	-65.7	-41.3	176.1	-76.4	-167.1	172.2	99.6	17.2	112.4	E397 V399 G404 S405 T443	E397-R401 VanDerWaalsContact CD-NH1 3.31Å; E397-R401 VanDerWaalsContact CG-NH1 3.34Å; E397-R401 WeakPolarHBondContact O-CB 3.42Å; E397-R401 PolarHBondContact O-N 3.42Å; E397-R401 IonicContact OE1-CZ 2.84Å; E397-R401 IonicContact OE1-NH1 3.62Å; E397-R401 PolarHBondContact OE1-NH1 3.42Å; E397-R401 IonicContact OE1-NH2 3.36Å; E397-R401 PolarHBondContact OE1-NH2 2.88Å; V399-R401 PolarHBondContact O-N 3.03Å; R401-G404 PolarHBondContact O-N 2.99Å; R401-S405 PolarHBondContact O-N 3.15Å; R401-S405 PolarHBondContact O-OG 3.02Å; R401-T443 HydrophobicContact CB-CG2 4.18Å
402	A	93.3	Very high	91.7	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-45.8	178.9	0	0	0	0	0	112	F398 V399 G404 A406 F439 L440 T443	F398-A402 WeakPolarHBondContact O-CB 3.28Å; F398-A402 PolarHBondContact O-N 3.44Å; V399-A402 PolarHBondContact O-N 3.41Å; A402-G404 VanDerWaalsContact C-N 3.35Å; A402-A406 VanDerWaalsContact O-CB 3.27Å; A402-A406 WeakPolarHBondContact O-CB 3.42Å; A402-A406 PolarHBondContact O-N 2.84Å; A402-F439 HydrophobicContact CB-CB 4.15Å; A402-L440 HydrophobicContact CB-CB 4.42Å; A402-L440 HydrophobicContact CB-CD2 3.44Å; A402-L440 VanDerWaalsContact CB-CD2 3.44Å; A402-L440 HydrophobicContact CB-CG 3.69Å; A402-T443 HydrophobicContact CB-CG2 3.9Å
403	V	93	Very high	91.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-40.3	174.8	177.4	0	0	0	0	111.1	V43 V399 A406 A407 L415 L436	V43-V403 HydrophobicContact CG1-CG1 3.98Å; V399-V403 HydrophobicContact CG1-CG2 4.45Å; V399-V403 WeakPolarHBondContact O-CG2 3.45Å; V399-V403 PolarHBondContact O-N 3.26Å; V403-A406 PolarHBondContact O-N 3.4Å; V403-A407 WeakPolarHBondContact O-CB 3.39Å; V403-A407 PolarHBondContact O-N 3.33Å; V403-L415 HydrophobicContact CG1-CD2 4.07Å; V403-L436 HydrophobicContact CB-CD2 4.44Å; V403-L436 HydrophobicContact CG2-CD2 3.96Å
404	G	91.9	Very high	91.2	Very high	7 Å²	7	31.2 Å²	31.2	7%	0.072	16%	0.161	C	C	.	.	H	α-helix	trans	-60.1	-47.9	177.2	0	0	0	0	0	113.3	A400 R401 A402 A407 Q408	A400-G404 PolarHBondContact O-N 3.47Å; R401-G404 PolarHBondContact O-N 2.99Å; A402-G404 VanDerWaalsContact C-N 3.35Å; G404-A407 PolarHBondContact O-N 3.24Å; G404-Q408 PolarHBondContact O-N 2.61Å
405	S	92.9	Very high	90.8	Very high	57 Å²	57	31.6 Å²	31.6	40%	0.399	16%	0.163	S	C	.	.	H	α-helix	trans	-64.2	-46.9	175	-62.8	0	0	0	0	112.1	R401 A407 Q408 E409	R401-S405 PolarHBondContact O-N 3.15Å; R401-S405 PolarHBondContact O-OG 3.02Å; S405-A407 VanDerWaalsContact C-N 3.27Å; S405-A407 PolarHBondContact O-N 2.69Å; S405-Q408 WeakPolarHBondContact O-CB 3.34Å; S405-Q408 PolarHBondContact O-N 3.16Å; S405-E409 PolarHBondContact O-N 3.38Å
406	A	91.6	Very high	90.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.4	-38.4	178.6	0	0	0	0	0	112.3	A402 V403 Q408 E409 N410 A414 F435 L436 F439	A402-A406 VanDerWaalsContact O-CB 3.27Å; A402-A406 WeakPolarHBondContact O-CB 3.42Å; A402-A406 PolarHBondContact O-N 2.84Å; V403-A406 PolarHBondContact O-N 3.4Å; A406-Q408 VanDerWaalsContact C-N 3.25Å; A406-Q408 PolarHBondContact O-N 3.24Å; A406-E409 PolarHBondContact O-N 3.31Å; A406-N410 CarbonylContact O-C 3.52Å; A406-N410 PolarHBondContact O-N 2.8Å; A406-A414 VanDerWaalsContact C-CB 3.4Å; A406-A414 HydrophobicContact CB-CB 3.63Å; A406-F435 HydrophobicContact CB-CD1 4.47Å; A406-F435 HydrophobicContact CB-CE1 3.97Å; A406-L436 HydrophobicContact CB-CD2 3.62Å; A406-F439 HydrophobicContact CB-CB 4.44Å; A406-F439 HydrophobicContact CB-CD1 4.23Å; A406-F439 HydrophobicContact CB-CD2 3.48Å; A406-F439 VanDerWaalsContact CB-CD2 3.48Å; A406-F439 HydrophobicContact CB-CE1 4.41Å; A406-F439 HydrophobicContact CB-CE2 3.71Å; A406-F439 HydrophobicContact CB-CG 3.78Å; A406-F439 HydrophobicContact CB-CZ 4.17Å
407	A	90.2	Very high	89.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.7	-18.9	178.5	0	0	0	0	0	113.9	P147 V403 G404 S405 A414 L415	P147-A407 HydrophobicContact CG-CB 4.19Å; V403-A407 WeakPolarHBondContact O-CB 3.39Å; V403-A407 PolarHBondContact O-N 3.33Å; G404-A407 PolarHBondContact O-N 3.24Å; S405-A407 VanDerWaalsContact C-N 3.27Å; S405-A407 PolarHBondContact O-N 2.69Å; A407-A414 HydrophobicContact CB-CB 3.94Å; A407-A414 VanDerWaalsContact N-CB 3.33Å; A407-L415 HydrophobicContact CB-CD1 4.09Å; A407-L415 HydrophobicContact CB-CD2 3.74Å; A407-L415 HydrophobicContact CB-CG 3.84Å
408	Q	89.1	Confident	88.6	Confident	151 Å²	151	36.7 Å²	36.7	71%	0.706	20%	0.204	S	C	*	.	H	α-helix	trans	-84.1	-29.6	174.8	-168.6	167.9	2.4	0	0	112.4	G404 S405 A406	G404-Q408 PolarHBondContact O-N 2.61Å; S405-Q408 WeakPolarHBondContact O-CB 3.34Å; S405-Q408 PolarHBondContact O-N 3.16Å; A406-Q408 VanDerWaalsContact C-N 3.25Å; A406-Q408 PolarHBondContact O-N 3.24Å
409	E	88.6	Confident	87.8	Confident	148 Å²	148	38 Å²	38	69%	0.692	21%	0.212	S	C	*	.	H	α-helix	trans	-81	-48.9	170.9	-73.7	-171.7	-154.1	0	0	112.7	S405 A406 F439	S405-E409 PolarHBondContact O-N 3.38Å; A406-E409 PolarHBondContact O-N 3.31Å; E409-F439 HydrophobicContact CB-CZ 4.33Å; E409-F439 HydrophobicContact CG-CE1 4.4Å; E409-F439 HydrophobicContact CG-CZ 4.38Å; E409-F439 WeakPolarHBondContact OE2-CZ 3.29Å
410	N	87.3	Confident	87.1	Confident	55 Å²	55	41.8 Å²	41.8	29%	0.294	24%	0.235	S	C	.	.			trans	-145.8	93.3	-179.3	-169.8	-14.9	0	0	0	111.9	A406 T412 M413 A414 F435	A406-N410 CarbonylContact O-C 3.52Å; A406-N410 PolarHBondContact O-N 2.8Å; N410-T412 VanDerWaalsContact C-N 3.27Å; N410-T412 PolarHBondContact O-N 2.83Å; N410-T412 PolarHBondContact OD1-N 2.92Å; N410-T412 PolarHBondContact OD1-OG1 3.43Å; N410-M413 HydrophobicContact CB-CB 4.36Å; N410-M413 VanDerWaalsContact ND2-CG 3.34Å; N410-M413 WeakPolarHBondContact ND2-CG 3.4Å; N410-M413 PolarHBondContact O-N 3.09Å; N410-M413 PolarHBondContact OD1-N 2.84Å; N410-A414 WeakPolarHBondContact O-CB 3.45Å; N410-A414 PolarHBondContact O-N 2.97Å; N410-A414 VanDerWaalsContact O-N 3.1Å; N410-F435 HydrophobicContact CB-CE1 4.09Å; N410-F435 HydrophobicContact CB-CZ 3.69Å
411	P	86.5	Confident	86.5	Confident	16 Å²	16	44.4 Å²	44.4	10%	0.104	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-23.7	-175.5	25.2	-34.1	0	0	0	113.8	L415	P411-L415 HydrophobicContact CB-CD1 4.22Å; P411-L415 VanDerWaalsContact O-CB 3.28Å; P411-L415 WeakPolarHBondContact O-CB 3.29Å; P411-L415 WeakPolarHBondContact O-CG 3.14Å; P411-L415 PolarHBondContact O-N 3.15Å
412	T	86.6	Confident	85.9	Confident	59 Å²	59	43 Å²	43	36%	0.362	25%	0.249	S	C	.	.	H	α-helix	trans	-74.6	-44.6	177.4	58.6	0	0	0	0	111.4	V35 N410 I416	V35-T412 HydrophobicContact CG2-CG2 3.76Å; N410-T412 VanDerWaalsContact C-N 3.27Å; N410-T412 PolarHBondContact O-N 2.83Å; N410-T412 PolarHBondContact OD1-N 2.92Å; N410-T412 PolarHBondContact OD1-OG1 3.43Å; T412-I416 HydrophobicContact CG2-CD1 4.36Å; T412-I416 VanDerWaalsContact O-CB 3.26Å; T412-I416 WeakPolarHBondContact O-CB 3.4Å; T412-I416 WeakPolarHBondContact O-CG1 3.44Å; T412-I416 PolarHBondContact O-N 3.32Å
413	M	85.9	Confident	85.3	Confident	61 Å²	61	50.7 Å²	50.7	30%	0.3	29%	0.287	S	S	.	.	H	α-helix	trans	-74.3	-24.8	179.6	-70.5	-63.3	-69.2	0	0	113.9	N410 S432 F435	N410-M413 HydrophobicContact CB-CB 4.36Å; N410-M413 VanDerWaalsContact ND2-CG 3.34Å; N410-M413 WeakPolarHBondContact ND2-CG 3.4Å; N410-M413 PolarHBondContact O-N 3.09Å; N410-M413 PolarHBondContact OD1-N 2.84Å; M413-S432 VanDerWaalsContact O-CB 3.29Å; M413-S432 WeakPolarHBondContact O-CB 3.3Å; M413-F435 HydrophobicContact CB-CD1 3.59Å; M413-F435 HydrophobicContact CB-CE1 3.79Å; M413-F435 HydrophobicContact CB-CG 4.06Å; M413-F435 HydrophobicContact CB-CZ 4.41Å; M413-F435 HydrophobicContact CE-CB 4.34Å
414	A	86.4	Confident	84.2	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.017	31%	0.312	C	S	.	.	H	α-helix	trans	-89	-36.8	-179.5	0	0	0	0	0	114.3	A406 A407 N410 F435 L436	A406-A414 VanDerWaalsContact C-CB 3.4Å; A406-A414 HydrophobicContact CB-CB 3.63Å; A407-A414 HydrophobicContact CB-CB 3.94Å; A407-A414 VanDerWaalsContact N-CB 3.33Å; N410-A414 WeakPolarHBondContact O-CB 3.45Å; N410-A414 PolarHBondContact O-N 2.97Å; N410-A414 VanDerWaalsContact O-N 3.1Å; A414-F435 HydrophobicContact CB-CE1 4.28Å; A414-L436 HydrophobicContact CB-CD2 4.33Å
415	L	86.5	Confident	82.7	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	35%	0.347	C	S	.	.	H	α-helix	trans	-104.2	-21.5	-170.4	-56.3	175.4	0	0	0	113.9	V35 I39 V43 L150 V403 A407 P411	V35-L415 HydrophobicContact CG1-CB 4.02Å; V35-L415 HydrophobicContact CG1-CD1 4.1Å; I39-L415 HydrophobicContact CD1-CB 3.81Å; I39-L415 HydrophobicContact CD1-CD1 3.83Å; I39-L415 HydrophobicContact CD1-CG 4.28Å; I39-L415 WeakPolarHBondContact CG2-O 3.28Å; V43-L415 HydrophobicContact CG2-CD2 3.97Å; L150-L415 HydrophobicContact CD1-CD1 4.04Å; L150-L415 HydrophobicContact CD1-CD2 3.86Å; V403-L415 HydrophobicContact CG1-CD2 4.07Å; A407-L415 HydrophobicContact CB-CD1 4.09Å; A407-L415 HydrophobicContact CB-CD2 3.74Å; A407-L415 HydrophobicContact CB-CG 3.84Å; P411-L415 HydrophobicContact CB-CD1 4.22Å; P411-L415 VanDerWaalsContact O-CB 3.28Å; P411-L415 WeakPolarHBondContact O-CB 3.29Å; P411-L415 WeakPolarHBondContact O-CG 3.14Å; P411-L415 PolarHBondContact O-N 3.15Å
416	I	84.1	Confident	81.1	Confident	42 Å²	42	65.1 Å²	65.1	22%	0.215	37%	0.366	C	S	.	.	S	Bend	trans	-89	120.9	175.6	-53.2	176.5	0	0	0	107.8	V35 T412 G418	V35-I416 HydrophobicContact CG1-CG1 4.23Å; T412-I416 HydrophobicContact CG2-CD1 4.36Å; T412-I416 VanDerWaalsContact O-CB 3.26Å; T412-I416 WeakPolarHBondContact O-CB 3.4Å; T412-I416 WeakPolarHBondContact O-CG1 3.44Å; T412-I416 PolarHBondContact O-N 3.32Å; I416-G418 PolarHBondContact O-N 2.91Å
417	P	78.2	Confident	79.5	Confident	32 Å²	32	74.6 Å²	74.6	21%	0.208	41%	0.41	C	S	.	.			trans	-65.8	131.7	178.7	27.2	-34.6	0	0	0	110.6	T419 T420	P417-T419 VanDerWaalsContact C-N 3.33Å; P417-T419 PolarHBondContact O-N 2.86Å; P417-T420 HydrophobicContact CB-CG2 4.33Å; P417-T420 HydrophobicContact CG-CG2 3.78Å
418	G	71.5	Confident	77.9	Confident	51 Å²	51	78.5 Å²	78.5	53%	0.526	44%	0.437	S	S	.	.	S	Bend	trans	-70	-26.3	-178.8	0	0	0	0	0	114.3	I416 S432	I416-G418 PolarHBondContact O-N 2.91Å; G418-S432 VanDerWaalsContact CA-OG 3.31Å; G418-S432 WeakPolarHBondContact CA-OG 3.45Å; G418-S432 PolarHBondContact N-OG 2.87Å
419	T	77.9	Confident	76.4	Confident	28 Å²	28	80.1 Å²	80.1	17%	0.172	45%	0.451	C	S	.	.			trans	-133.6	124.3	175.9	57.6	0	0	0	0	110.5	L220 P417	L220-T419 VanDerWaalsContact O-CG2 3.3Å; L220-T419 WeakPolarHBondContact O-CG2 3.24Å; L220-T419 PolarHBondContact O-OG1 3.12Å; P417-T419 VanDerWaalsContact C-N 3.33Å; P417-T419 PolarHBondContact O-N 2.86Å
420	T	79.9	Confident	75.4	Confident	80 Å²	80	74.2 Å²	74.2	49%	0.491	43%	0.43	S	S	.	.	S	Bend	trans	-116.3	2	169.6	58.8	0	0	0	0	112.6	P417	P417-T420 HydrophobicContact CB-CG2 4.33Å; P417-T420 HydrophobicContact CG-CG2 3.78Å
421	N	80	Confident	75.1	Confident	60 Å²	60	72.6 Å²	72.6	32%	0.321	42%	0.423	S	S	.	.			trans	-142.6	129	177.2	177.2	11	0	0	0	107.7	M423 D424	N421-M423 PolarHBondContact O-N 3.08Å; N421-M423 PolarHBondContact OD1-N 3Å; N421-D424 HydrophobicContact CB-CB 4.33Å; N421-D424 WeakPolarHBondContact CB-OD2 3.37Å; N421-D424 VanDerWaalsContact ND2-CG 3.3Å; N421-D424 PolarHBondContact ND2-OD2 2.98Å; N421-D424 PolarHBondContact O-N 2.96Å
422	C	82.9	Confident	75.1	Confident	42 Å²	42	72.6 Å²	72.6	28%	0.284	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.6	177.8	-68.6	0	0	0	0	113.7	C189 L220	C189-C422 WeakPolarHBondContact CA-SG 3.43Å; C189-C422 HydrophobicContact CB-CB 3.92Å; C189-C422 WeakPolarHBondContact CB-SG 3.33Å; C189-C422 WeakPolarHBondContact SG-CB 3.49Å; C189-C422 CovalentContact SG-SG 2.03Å; C189-C422 PolarHBondContact SG-SG 3.23Å; L220-C422 HydrophobicContact CD2-CB 4.21Å; L220-C422 VanDerWaalsContact CD2-SG 3.54Å
423	M	79.6	Confident	75.1	Confident	161 Å²	161	69.9 Å²	69.9	79%	0.793	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-17.1	-179.8	-52.8	-56.8	-67.7	0	0	113.3	N421 A425	N421-M423 PolarHBondContact O-N 3.08Å; N421-M423 PolarHBondContact OD1-N 3Å; M423-A425 PolarHBondContact O-N 2.85Å
424	D	70.3	Confident	75.2	Confident	103 Å²	103	70 Å²	70	55%	0.551	41%	0.406	S	S	*	.			trans	-94.5	77.2	-175.5	-70.4	-41	0	0	0	111.7	N421 Q426	N421-D424 HydrophobicContact CB-CB 4.33Å; N421-D424 WeakPolarHBondContact CB-OD2 3.37Å; N421-D424 VanDerWaalsContact ND2-CG 3.3Å; N421-D424 PolarHBondContact ND2-OD2 2.98Å; N421-D424 PolarHBondContact O-N 2.96Å; D424-Q426 VanDerWaalsContact C-N 3.27Å; D424-Q426 PolarHBondContact O-N 2.84Å
425	A	60.5	Low	75.4	Confident	98 Å²	98	71.4 Å²	71.4	81%	0.81	41%	0.413	S	S	*	.			trans	-73.9	70	179.1	0	0	0	0	0	113	M423 Q427	M423-A425 PolarHBondContact O-N 2.85Å; A425-Q427 PolarHBondContact O-N 2.71Å
426	Q	59.1	Low	75.7	Confident	170 Å²	170	71.2 Å²	71.2	79%	0.794	41%	0.411	S	S	*	.			trans	-83	96.6	-171.9	-163	162.2	34.7	0	0	113.2	D424 S428	D424-Q426 VanDerWaalsContact C-N 3.27Å; D424-Q426 PolarHBondContact O-N 2.84Å; Q426-S428 PolarHBondContact O-N 2.96Å
427	Q	57.6	Low	76	Confident	200 Å²	200	69.6 Å²	69.6	94%	0.935	40%	0.404	S	S	*	.			trans	-69.2	96.1	175.8	-70.6	-177.6	-18.8	0	0	112	A425	A425-Q427 PolarHBondContact O-N 2.71Å
428	S	58.4	Low	76.6	Confident	81 Å²	81	74.8 Å²	74.8	57%	0.566	42%	0.42	S	S	*	.			trans	-108.1	157.5	169.3	54.6	0	0	0	0	110.9	Q426 G430	Q426-S428 PolarHBondContact O-N 2.96Å; S428-G430 VanDerWaalsContact C-N 3.27Å; S428-G430 PolarHBondContact O-N 2.96Å
429	N	56.4	Low	77.6	Confident	185 Å²	185	73.5 Å²	73.5	99%	0.989	40%	0.4	S	S	*	.	S	Bend	trans	-73.5	81	176.7	-77.6	-9.4	0	0	0	110.9
430	G	67.1	Low	78.3	Confident	25 Å²	25	72.3 Å²	72.3	26%	0.258	39%	0.392	S	S	.	.	S	Bend	trans	102.4	116.2	-177.9	0	0	0	0	0	112	S428	S428-G430 VanDerWaalsContact C-N 3.27Å; S428-G430 PolarHBondContact O-N 2.96Å
431	S	81.1	Confident	78.8	Confident	20 Å²	20	70.5 Å²	70.5	14%	0.14	39%	0.385	C	S	.	.			trans	-84	159.3	174.5	64.8	0	0	0	0	111.4	Q221 G433 E434 F435	Q221-S431 PolarHBondContact OE1-OG 3.28Å; S431-G433 PolarHBondContact O-N 3.25Å; S431-E434 PolarHBondContact O-N 3.23Å; S431-E434 WeakPolarHBondContact OG-CB 3.4Å; S431-E434 PolarHBondContact OG-N 3.32Å; S431-F435 PolarHBondContact O-N 2.79Å
432	S	86.3	Confident	79.3	Confident	17 Å²	17	74 Å²	74	12%	0.119	40%	0.404	C	S	.	.	H	α-helix	trans	-59.9	-34.8	172.4	61.3	0	0	0	0	111.7	M413 G418 F435 L436	M413-S432 VanDerWaalsContact O-CB 3.29Å; M413-S432 WeakPolarHBondContact O-CB 3.3Å; G418-S432 VanDerWaalsContact CA-OG 3.31Å; G418-S432 WeakPolarHBondContact CA-OG 3.45Å; G418-S432 PolarHBondContact N-OG 2.87Å; S432-F435 WeakPolarHBondContact O-CB 3.32Å; S432-F435 PolarHBondContact O-N 2.8Å; S432-L436 WeakPolarHBondContact O-CB 3.4Å; S432-L436 VanDerWaalsContact O-CG 3.32Å; S432-L436 WeakPolarHBondContact O-CG 3.44Å; S432-L436 PolarHBondContact O-N 2.85Å
433	G	87.5	Confident	79.7	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-70.2	-39	176.5	0	0	0	0	0	113.5	Q221 S431 F435 L436 A437	Q221-G433 VanDerWaalsContact O-CA 3.3Å; Q221-G433 WeakPolarHBondContact O-CA 3.36Å; S431-G433 PolarHBondContact O-N 3.25Å; G433-F435 VanDerWaalsContact C-N 3.32Å; G433-L436 PolarHBondContact O-N 3.33Å; G433-A437 VanDerWaalsContact O-CB 3.26Å; G433-A437 WeakPolarHBondContact O-CB 3.07Å; G433-A437 PolarHBondContact O-N 3.46Å
434	E	88.4	Confident	80.2	Confident	63 Å²	63	67.6 Å²	67.6	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-68.5	-33.5	174	-156.1	-128.4	141.1	0	0	111.6	S431 R438	S431-E434 PolarHBondContact O-N 3.23Å; S431-E434 WeakPolarHBondContact OG-CB 3.4Å; S431-E434 PolarHBondContact OG-N 3.32Å; E434-R438 WeakPolarHBondContact O-CG 3.44Å; E434-R438 IonicContact OE1-CZ 3.02Å; E434-R438 IonicContact OE1-NE 3.74Å; E434-R438 PolarHBondContact OE1-NE 3.07Å; E434-R438 IonicContact OE1-NH2 3.52Å; E434-R438 PolarHBondContact OE1-NH2 3.48Å; E434-R438 IonicContact OE2-NH2 3.85Å; E434-R438 PolarHBondContact OE2-NH2 3.28Å; E434-R438 VanDerWaalsContact OE2-NH2 3.16Å
435	F	90.5	Very high	81.3	Confident	33 Å²	33	63.3 Å²	63.3	15%	0.145	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-54.3	169.4	-176.6	-110.7	0	0	0	110.9	A406 N410 M413 A414 S431 S432 G433 A437 R438 F439	A406-F435 HydrophobicContact CB-CD1 4.47Å; A406-F435 HydrophobicContact CB-CE1 3.97Å; N410-F435 HydrophobicContact CB-CE1 4.09Å; N410-F435 HydrophobicContact CB-CZ 3.69Å; M413-F435 HydrophobicContact CB-CD1 3.59Å; M413-F435 HydrophobicContact CB-CE1 3.79Å; M413-F435 HydrophobicContact CB-CG 4.06Å; M413-F435 HydrophobicContact CB-CZ 4.41Å; M413-F435 HydrophobicContact CE-CB 4.34Å; A414-F435 HydrophobicContact CB-CE1 4.28Å; S431-F435 PolarHBondContact O-N 2.79Å; S432-F435 WeakPolarHBondContact O-CB 3.32Å; S432-F435 PolarHBondContact O-N 2.8Å; G433-F435 VanDerWaalsContact C-N 3.32Å; F435-A437 VanDerWaalsContact C-N 3.34Å; F435-A437 PolarHBondContact O-N 3.32Å; F435-R438 WeakPolarHBondContact O-CB 3.44Å; F435-R438 PolarHBondContact O-N 2.85Å; F435-F439 HydrophobicContact CD1-CE2 4.13Å; F435-F439 HydrophobicContact CD2-CE2 4.15Å; F435-F439 AromaticContact CE1-CE2 3.72Å; F435-F439 HydrophobicContact CE1-CE2 3.72Å; F435-F439 HydrophobicContact CE1-CZ 4.41Å; F435-F439 AromaticContact CE2-CE2 3.72Å; F435-F439 HydrophobicContact CE2-CE2 3.72Å; F435-F439 HydrophobicContact CE2-CZ 4.24Å; F435-F439 HydrophobicContact CG-CE2 4.33Å; F435-F439 AromaticContact CZ-CE2 3.48Å; F435-F439 HydrophobicContact CZ-CE2 3.48Å; F435-F439 VanDerWaalsContact CZ-CE2 3.48Å; F435-F439 AromaticContact CZ-CZ 3.89Å; F435-F439 HydrophobicContact CZ-CZ 3.89Å; F435-F439 VanDerWaalsContact O-CD2 3.29Å; F435-F439 WeakPolarHBondContact O-CD2 3.21Å
436	L	91.9	Very high	82.6	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-36.3	178.8	-73.4	171.7	0	0	0	113.4	S198 P223 V403 A406 A414 S432 G433 R438 F439 L440	S198-L436 WeakPolarHBondContact O-CD1 3.42Å; P223-L436 HydrophobicContact CG-CB 4.33Å; V403-L436 HydrophobicContact CB-CD2 4.44Å; V403-L436 HydrophobicContact CG2-CD2 3.96Å; A406-L436 HydrophobicContact CB-CD2 3.62Å; A414-L436 HydrophobicContact CB-CD2 4.33Å; S432-L436 WeakPolarHBondContact O-CB 3.4Å; S432-L436 VanDerWaalsContact O-CG 3.32Å; S432-L436 WeakPolarHBondContact O-CG 3.44Å; S432-L436 PolarHBondContact O-N 2.85Å; G433-L436 PolarHBondContact O-N 3.33Å; L436-R438 PolarHBondContact O-N 2.99Å; L436-F439 PolarHBondContact O-N 2.8Å; L436-L440 PolarHBondContact O-N 3.47Å
437	A	90.7	Very high	83.9	Confident	8 Å²	8	53.5 Å²	53.5	7%	0.066	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-30.4	177.8	0	0	0	0	0	113.2	L240 F242 G433 F435 L440 A441	L240-A437 HydrophobicContact CD2-CB 3.75Å; F242-A437 HydrophobicContact CE2-CB 4.44Å; G433-A437 VanDerWaalsContact O-CB 3.26Å; G433-A437 WeakPolarHBondContact O-CB 3.07Å; G433-A437 PolarHBondContact O-N 3.46Å; F435-A437 VanDerWaalsContact C-N 3.34Å; F435-A437 PolarHBondContact O-N 3.32Å; A437-L440 PolarHBondContact O-N 2.95Å; A437-A441 WeakPolarHBondContact O-CB 3.34Å; A437-A441 PolarHBondContact O-N 3.22Å
438	R	90.9	Very high	85.4	Confident	142 Å²	142	48.7 Å²	48.7	54%	0.536	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-34.4	174.2	-62.2	164.9	-169	176.6	4.1	111.8	E434 F435 L436 N442	E434-R438 WeakPolarHBondContact O-CG 3.44Å; E434-R438 IonicContact OE1-CZ 3.02Å; E434-R438 IonicContact OE1-NE 3.74Å; E434-R438 PolarHBondContact OE1-NE 3.07Å; E434-R438 IonicContact OE1-NH2 3.52Å; E434-R438 PolarHBondContact OE1-NH2 3.48Å; E434-R438 IonicContact OE2-NH2 3.85Å; E434-R438 PolarHBondContact OE2-NH2 3.28Å; E434-R438 VanDerWaalsContact OE2-NH2 3.16Å; F435-R438 WeakPolarHBondContact O-CB 3.44Å; F435-R438 PolarHBondContact O-N 2.85Å; L436-R438 PolarHBondContact O-N 2.99Å; R438-N442 PolarHBondContact O-N 3.28Å
439	F	92.9	Very high	86.8	Confident	23 Å²	23	45 Å²	45	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-74.5	-43.1	173.3	-66.1	-87	0	0	0	111.7	A402 A406 E409 F435 L436 A441 N442 T443	A402-F439 HydrophobicContact CB-CB 4.15Å; A406-F439 HydrophobicContact CB-CB 4.44Å; A406-F439 HydrophobicContact CB-CD1 4.23Å; A406-F439 HydrophobicContact CB-CD2 3.48Å; A406-F439 VanDerWaalsContact CB-CD2 3.48Å; A406-F439 HydrophobicContact CB-CE1 4.41Å; A406-F439 HydrophobicContact CB-CE2 3.71Å; A406-F439 HydrophobicContact CB-CG 3.78Å; A406-F439 HydrophobicContact CB-CZ 4.17Å; E409-F439 HydrophobicContact CB-CZ 4.33Å; E409-F439 HydrophobicContact CG-CE1 4.4Å; E409-F439 HydrophobicContact CG-CZ 4.38Å; E409-F439 WeakPolarHBondContact OE2-CZ 3.29Å; F435-F439 HydrophobicContact CD1-CE2 4.13Å; F435-F439 HydrophobicContact CD2-CE2 4.15Å; F435-F439 AromaticContact CE1-CE2 3.72Å; F435-F439 HydrophobicContact CE1-CE2 3.72Å; F435-F439 HydrophobicContact CE1-CZ 4.41Å; F435-F439 AromaticContact CE2-CE2 3.72Å; F435-F439 HydrophobicContact CE2-CE2 3.72Å; F435-F439 HydrophobicContact CE2-CZ 4.24Å; F435-F439 HydrophobicContact CG-CE2 4.33Å; F435-F439 AromaticContact CZ-CE2 3.48Å; F435-F439 HydrophobicContact CZ-CE2 3.48Å; F435-F439 VanDerWaalsContact CZ-CE2 3.48Å; F435-F439 AromaticContact CZ-CZ 3.89Å; F435-F439 HydrophobicContact CZ-CZ 3.89Å; F435-F439 VanDerWaalsContact O-CD2 3.29Å; F435-F439 WeakPolarHBondContact O-CD2 3.21Å; L436-F439 PolarHBondContact O-N 2.8Å; F439-A441 VanDerWaalsContact C-N 3.29Å; F439-A441 PolarHBondContact O-N 2.9Å; F439-N442 CarbonylContact O-C 3.54Å; F439-N442 WeakPolarHBondContact O-CA 3.49Å; F439-N442 PolarHBondContact O-N 3.35Å; F439-T443 PolarHBondContact O-N 2.87Å; F439-T443 PolarHBondContact O-OG1 2.87Å
440	L	92.1	Very high	88.2	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-55.8	-42.9	173.8	-70.9	164.2	0	0	0	111.5	P223 F242 F398 V399 A402 L436 A437 N442 T443	P223-L440 HydrophobicContact CB-CD1 3.65Å; P223-L440 HydrophobicContact CG-CD1 3.95Å; F242-L440 HydrophobicContact CD2-CB 4.46Å; F242-L440 HydrophobicContact CD2-CD1 4.29Å; F242-L440 HydrophobicContact CE1-CB 4.29Å; F242-L440 HydrophobicContact CE2-CB 3.73Å; F242-L440 HydrophobicContact CE2-CD1 3.79Å; F242-L440 HydrophobicContact CE2-CG 4.38Å; F242-L440 HydrophobicContact CZ-CB 3.63Å; F398-L440 HydrophobicContact CD1-CD2 3.58Å; F398-L440 HydrophobicContact CE1-CB 4.01Å; F398-L440 HydrophobicContact CE1-CD2 3.5Å; F398-L440 HydrophobicContact CE1-CG 4.36Å; F398-L440 HydrophobicContact CZ-CB 4.44Å; F398-L440 WeakPolarHBondContact CZ-O 3.48Å; V399-L440 HydrophobicContact CG2-CD2 4.36Å; A402-L440 HydrophobicContact CB-CB 4.42Å; A402-L440 HydrophobicContact CB-CD2 3.44Å; A402-L440 VanDerWaalsContact CB-CD2 3.44Å; A402-L440 HydrophobicContact CB-CG 3.69Å; L436-L440 PolarHBondContact O-N 3.47Å; A437-L440 PolarHBondContact O-N 2.95Å; L440-N442 PolarHBondContact O-N 2.9Å; L440-T443 WeakPolarHBondContact CA-OG1 3.26Å; L440-T443 PolarHBondContact O-N 3.05Å; L440-T443 PolarHBondContact O-OG1 3.49Å
441	A	89.9	Confident	89.2	Confident	41 Å²	41	35.8 Å²	35.8	34%	0.339	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.1	176.2	0	0	0	0	0	114.6	F242 A437 F439 K454	F242-A441 HydrophobicContact CE1-CB 4.43Å; A437-A441 WeakPolarHBondContact O-CB 3.34Å; A437-A441 PolarHBondContact O-N 3.22Å; F439-A441 VanDerWaalsContact C-N 3.29Å; F439-A441 PolarHBondContact O-N 2.9Å; A441-K454 HydrophobicContact CB-CD 4.46Å
442	N	90.9	Very high	89.7	Confident	134 Å²	134	34.8 Å²	34.8	72%	0.717	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-14	-179.2	-163.9	28	0	0	0	113.2	R438 F439 L440 S444	R438-N442 PolarHBondContact O-N 3.28Å; F439-N442 CarbonylContact O-C 3.54Å; F439-N442 WeakPolarHBondContact O-CA 3.49Å; F439-N442 PolarHBondContact O-N 3.35Å; L440-N442 PolarHBondContact O-N 2.9Å; N442-S444 PolarHBondContact O-N 2.95Å
443	T	91.1	Very high	89.9	Confident	16 Å²	16	34.8 Å²	34.8	10%	0.098	18%	0.18	C	C	.	.			trans	-68.8	130.6	177.9	32.4	0	0	0	0	112.3	F398 R401 A402 F439 L440	F398-T443 WeakPolarHBondContact CE2-OG1 3.48Å; R401-T443 HydrophobicContact CB-CG2 4.18Å; A402-T443 HydrophobicContact CB-CG2 3.9Å; F439-T443 PolarHBondContact O-N 2.87Å; F439-T443 PolarHBondContact O-OG1 2.87Å; L440-T443 WeakPolarHBondContact CA-OG1 3.26Å; L440-T443 PolarHBondContact O-N 3.05Å; L440-T443 PolarHBondContact O-OG1 3.49Å
444	S	91.6	Very high	90	Very high	52 Å²	52	37 Å²	37	36%	0.364	19%	0.189	S	C	.	.			trans	-147.9	145.2	167.3	55.4	0	0	0	0	110.7	N442 I452	N442-S444 PolarHBondContact O-N 2.95Å; S444-I452 CarbonylContact C-O 3.56Å; S444-I452 WeakPolarHBondContact CA-O 3.43Å; S444-I452 WeakPolarHBondContact CB-O 3.49Å
445	F	91.8	Very high	89.8	Confident	14 Å²	14	37.4 Å²	37.4	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	166.2	-173.4	61.9	-90.1	0	0	0	112.1	D394 E397 F398 F451 I452	D394-F445 WeakPolarHBondContact O-CZ 3.3Å; E397-F445 HydrophobicContact CB-CE2 4.31Å; E397-F445 HydrophobicContact CB-CZ 4.13Å; E397-F445 HydrophobicContact CG-CE2 4.15Å; E397-F445 HydrophobicContact CG-CZ 4.28Å; F398-F445 HydrophobicContact CB-CE1 3.77Å; F398-F445 HydrophobicContact CB-CZ 4.1Å; F398-F445 AromaticContact CD2-CE1 3.94Å; F398-F445 HydrophobicContact CD2-CE1 3.94Å; F398-F445 HydrophobicContact CG-CE1 4.34Å; F445-F451 CarbonylContact O-C 3.56Å; F445-F451 WeakPolarHBondContact O-CA 3.4Å; F445-F451 VanDerWaalsContact O-CD2 3.28Å; F445-F451 WeakPolarHBondContact O-CD2 3.32Å; F445-I452 HydrophobicContact CD1-CB 4.24Å; F445-I452 HydrophobicContact CD2-CB 4.42Å; F445-I452 HydrophobicContact CD2-CG1 4.29Å; F445-I452 HydrophobicContact CE1-CB 3.91Å; F445-I452 HydrophobicContact CE1-CG1 4.32Å; F445-I452 HydrophobicContact CE1-CG2 3.93Å; F445-I452 HydrophobicContact CE2-CB 4.13Å; F445-I452 HydrophobicContact CE2-CG1 3.72Å; F445-I452 HydrophobicContact CG-CB 4.48Å; F445-I452 HydrophobicContact CZ-CB 3.86Å; F445-I452 HydrophobicContact CZ-CG1 3.73Å; F445-I452 HydrophobicContact CZ-CG2 4.04Å; F445-I452 PolarHBondContact N-O 3.37Å; F445-I452 VanDerWaalsContact N-O 3.07Å; F445-I452 PolarHBondContact O-N 3.49Å
446	E	88.4	Confident	89.1	Confident	53 Å²	53	41 Å²	41	25%	0.248	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	113.2	168.5	-151.2	106.1	125.1	0	0	109.6	F451 H466 R487 R489	E446-F451 WeakPolarHBondContact OE2-CD2 3.33Å; E446-H466 WeakPolarHBondContact CG-NE2 3.35Å; E446-H466 IonicContact OE1-NE2 2.66Å; E446-R487 WeakPolarHBondContact OE1-CD 3.47Å; E446-R487 IonicContact OE1-CZ 3.03Å; E446-R487 IonicContact OE1-NE 3.76Å; E446-R487 IonicContact OE1-NH1 3.77Å; E446-R487 PolarHBondContact OE1-NH1 2.94Å; E446-R489 IonicContact OE1-CZ 3.55Å; E446-R489 IonicContact OE1-NH2 3.7Å; E446-R489 PolarHBondContact OE1-NH2 2.04Å; E446-R489 IonicContact OE2-CZ 3.31Å; E446-R489 IonicContact OE2-NE 2.69Å; E446-R489 PolarHBondContact OE2-NE 2.8Å; E446-R489 IonicContact OE2-NH2 3.82Å; E446-R489 PolarHBondContact OE2-NH2 3.36Å
447	G	87.4	Confident	88.3	Confident	9 Å²	9	50 Å²	50	9%	0.093	26%	0.262	C	S	.	.			trans	-98.4	-166.9	177.5	0	0	0	0	0	112.8	D394 G450 H466	D394-G447 VanDerWaalsContact OD1-CA 3.22Å; D394-G447 WeakPolarHBondContact OD1-CA 3.38Å; G447-G450 WeakPolarHBondContact CA-O 3.39Å; G447-G450 PolarHBondContact N-O 2.84Å; G447-H466 PolarHBondContact O-CE1 3Å; G447-H466 VanDerWaalsContact O-CE1 3.27Å
448	Q	87.6	Confident	87.9	Confident	98 Å²	98	51.1 Å²	51.1	46%	0.458	27%	0.269	S	S	.	.	S	Bend	trans	-84.7	-22.1	176.5	-63.4	-67.6	-3.8	0	0	113	H390 D394	H390-Q448 HydrophobicContact CB-CB 3.79Å; H390-Q448 PolarHBondContact ND1-O 3.21Å; D394-Q448 PolarHBondContact OD1-N 2.93Å; D394-Q448 PolarHBondContact OD2-N 3.28Å
449	S	87.3	Confident	87.5	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.021	25%	0.254	C	S	.	.	S	Bend	trans	-87.4	-35.1	173.2	67.8	0	0	0	0	112.9	T248 D394 I452 S463	T248-S449 WeakPolarHBondContact CG2-O 3.28Å; D394-S449 WeakPolarHBondContact OD2-CB 3.37Å; D394-S449 PolarHBondContact OD2-N 3.48Å; D394-S449 PolarHBondContact OD2-OG 3.43Å; S449-I452 WeakPolarHBondContact OG-CD1 3.37Å; S449-S463 PolarHBondContact OG-OG 3.47Å
450	G	86.3	Confident	87.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-170.7	-172.2	0	0	0	0	0	112.3	G447 I452 S463 E464 H466	G447-G450 WeakPolarHBondContact CA-O 3.39Å; G447-G450 PolarHBondContact N-O 2.84Å; G450-I452 PolarHBondContact O-N 2.86Å; G450-S463 VanDerWaalsContact CA-OG 3.32Å; G450-S463 WeakPolarHBondContact CA-OG 3.06Å; G450-S463 PolarHBondContact N-OG 2.9Å; G450-E464 CarbonylContact C-O 3.55Å; G450-E464 WeakPolarHBondContact CA-O 3.48Å; G450-H466 VanDerWaalsContact CA-CE1 3.49Å; G450-H466 WeakPolarHBondContact CA-CE1 3.18Å
451	F	88.4	Confident	87.1	Confident	17 Å²	17	46.3 Å²	46.3	8%	0.075	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	110.3	168.9	177.7	-97	0	0	0	109.5	F445 E446 E464 R489 R490	F445-F451 CarbonylContact O-C 3.56Å; F445-F451 WeakPolarHBondContact O-CA 3.4Å; F445-F451 VanDerWaalsContact O-CD2 3.28Å; F445-F451 WeakPolarHBondContact O-CD2 3.32Å; E446-F451 WeakPolarHBondContact OE2-CD2 3.33Å; F451-E464 HydrophobicContact CB-CB 4.18Å; F451-E464 HydrophobicContact CD1-CG 4.47Å; F451-E464 PolarHBondContact N-O 2.98Å; F451-E464 PolarHBondContact O-N 3.43Å; F451-R489 HydrophobicContact CD1-CG 4.39Å; F451-R489 HydrophobicContact CD2-CG 4.3Å; F451-R489 HydrophobicContact CG-CG 4.17Å; F451-R490 HydrophobicContact CD1-CG 4.19Å; F451-R490 HydrophobicContact CE1-CG 3.69Å; F451-R490 HydrophobicContact CZ-CG 4.32Å
452	I	91.2	Very high	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.9	-176	-53.9	-52.2	0	0	0	109.6	M244 D394 F398 S444 F445 S449 G450 I461 I462 S463	M244-I452 HydrophobicContact CE-CD1 3.71Å; D394-I452 HydrophobicContact CB-CD1 4.1Å; D394-I452 HydrophobicContact CB-CG1 4.1Å; F398-I452 HydrophobicContact CD2-CG2 3.87Å; F398-I452 HydrophobicContact CE2-CG2 4.39Å; S444-I452 CarbonylContact C-O 3.56Å; S444-I452 WeakPolarHBondContact CA-O 3.43Å; S444-I452 WeakPolarHBondContact CB-O 3.49Å; F445-I452 HydrophobicContact CD1-CB 4.24Å; F445-I452 HydrophobicContact CD2-CB 4.42Å; F445-I452 HydrophobicContact CD2-CG1 4.29Å; F445-I452 HydrophobicContact CE1-CB 3.91Å; F445-I452 HydrophobicContact CE1-CG1 4.32Å; F445-I452 HydrophobicContact CE1-CG2 3.93Å; F445-I452 HydrophobicContact CE2-CB 4.13Å; F445-I452 HydrophobicContact CE2-CG1 3.72Å; F445-I452 HydrophobicContact CG-CB 4.48Å; F445-I452 HydrophobicContact CZ-CB 3.86Å; F445-I452 HydrophobicContact CZ-CG1 3.73Å; F445-I452 HydrophobicContact CZ-CG2 4.04Å; F445-I452 PolarHBondContact N-O 3.37Å; F445-I452 VanDerWaalsContact N-O 3.07Å; F445-I452 PolarHBondContact O-N 3.49Å; S449-I452 WeakPolarHBondContact OG-CD1 3.37Å; G450-I452 PolarHBondContact O-N 2.86Å; I452-I461 HydrophobicContact CG2-CG2 3.55Å; I452-I462 WeakPolarHBondContact CA-O 3.34Å; I452-S463 WeakPolarHBondContact CD1-OG 3.46Å
453	S	90.3	Very high	87	Confident	16 Å²	16	39.9 Å²	39.9	11%	0.112	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	160.4	171.2	64.5	0	0	0	0	112.6	I461 I462	S453-I461 WeakPolarHBondContact O-CA 3.1Å; S453-I462 PolarHBondContact N-O 3.46Å; S453-I462 WeakPolarHBondContact O-CG1 3.48Å; S453-I462 PolarHBondContact O-N 3.25Å
454	K	89.4	Confident	86.8	Confident	48 Å²	48	41 Å²	41	21%	0.209	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.1	175	-179	-96.5	178.3	-143.5	0	109.9	A441 S456 S458	A441-K454 HydrophobicContact CB-CD 4.46Å; K454-S456 PolarHBondContact NZ-O 3.48Å; K454-S458 WeakPolarHBondContact CE-O 3.49Å; K454-S458 PolarHBondContact NZ-O 3.45Å
455	E	85	Confident	86.3	Confident	72 Å²	72	39.1 Å²	39.1	34%	0.336	21%	0.205	S	C	.	.			trans	-63.4	136.4	179.2	173.9	170.7	-115	0	0	111	Q457 S458 N460 I462	E455-Q457 VanDerWaalsContact C-N 3.34Å; E455-Q457 PolarHBondContact O-N 3.27Å; E455-S458 WeakPolarHBondContact CB-OG 3.47Å; E455-S458 WeakPolarHBondContact OE2-CB 3.32Å; E455-S458 PolarHBondContact OE2-OG 2.86Å; E455-N460 HydrophobicContact CB-CB 4.28Å; E455-N460 PolarHBondContact N-O 2.86Å; E455-N460 PolarHBondContact OE2-ND2 3.27Å; E455-N460 VanDerWaalsContact OE2-ND2 3.1Å; E455-I462 HydrophobicContact CB-CG2 4.28Å
456	S	76.8	Confident	85.8	Confident	107 Å²	107	40.6 Å²	40.6	75%	0.748	21%	0.212	S	C	*	.	S	Bend	trans	-59.3	-40.1	-166.6	57	0	0	0	0	114	K454	K454-S456 PolarHBondContact NZ-O 3.48Å
457	Q	74.8	Confident	85.6	Confident	192 Å²	192	38.1 Å²	38.1	90%	0.897	20%	0.2	S	C	*	.	S	Bend	trans	-96.9	-20.2	-172.2	-65.8	-179.1	-7.4	0	0	115.2	E455	E455-Q457 VanDerWaalsContact C-N 3.34Å; E455-Q457 PolarHBondContact O-N 3.27Å
458	S	81	Confident	85.6	Confident	32 Å²	32	39 Å²	39	22%	0.224	20%	0.201	C	C	.	.	S	Bend	trans	-114.3	-170.2	-174.9	74	0	0	0	0	112	K454 E455 N460	K454-S458 WeakPolarHBondContact CE-O 3.49Å; K454-S458 PolarHBondContact NZ-O 3.45Å; E455-S458 WeakPolarHBondContact CB-OG 3.47Å; E455-S458 WeakPolarHBondContact OE2-CB 3.32Å; E455-S458 PolarHBondContact OE2-OG 2.86Å; S458-N460 VanDerWaalsContact OG-CB 3.25Å; S458-N460 WeakPolarHBondContact OG-CB 3.5Å; S458-N460 PolarHBondContact OG-N 3.24Å; S458-N460 PolarHBondContact OG-ND2 2.86Å
459	Q	83.9	Confident	85.7	Confident	47 Å²	47	34.4 Å²	34.4	22%	0.22	18%	0.18	C	C	.	.	S	Bend	trans	-105.4	22.3	162.5	-58.4	-65.4	9.8	0	0	112.1	F242 Q243	F242-Q459 WeakPolarHBondContact CA-O 3.28Å; F242-Q459 HydrophobicContact CD1-CB 4.34Å; Q243-Q459 PolarHBondContact N-O 2.94Å; Q243-Q459 VanDerWaalsContact N-O 3.14Å
460	N	87.7	Confident	85.7	Confident	17 Å²	17	34.7 Å²	34.7	9%	0.091	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	139.9	173.2	-64.8	-32.7	0	0	0	110.4	E231 Q243 E455 S458	E231-N460 PolarHBondContact OE1-ND2 3.29Å; Q243-N460 CarbonylContact O-C 3.52Å; Q243-N460 WeakPolarHBondContact O-CA 3.47Å; E455-N460 HydrophobicContact CB-CB 4.28Å; E455-N460 PolarHBondContact N-O 2.86Å; E455-N460 PolarHBondContact OE2-ND2 3.27Å; E455-N460 VanDerWaalsContact OE2-ND2 3.1Å; S458-N460 VanDerWaalsContact OG-CB 3.25Å; S458-N460 WeakPolarHBondContact OG-CB 3.5Å; S458-N460 PolarHBondContact OG-N 3.24Å; S458-N460 PolarHBondContact OG-ND2 2.86Å
461	I	89.2	Confident	85.8	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117	166.5	-58.8	168.8	0	0	0	106.4	V225 F242 Q243 M244 F398 I452 S453	V225-I461 HydrophobicContact CG1-CD1 3.98Å; F242-I461 HydrophobicContact CB-CD1 3.9Å; F242-I461 HydrophobicContact CB-CG1 4.29Å; Q243-I461 PolarHBondContact O-N 2.7Å; M244-I461 HydrophobicContact CB-CB 4.02Å; M244-I461 HydrophobicContact CB-CD1 4.39Å; M244-I461 HydrophobicContact CB-CG2 4.44Å; M244-I461 HydrophobicContact CG-CB 4.21Å; M244-I461 HydrophobicContact CG-CG2 4.15Å; M244-I461 HydrophobicContact SD-CB 4.37Å; M244-I461 HydrophobicContact SD-CG2 3.76Å; F398-I461 HydrophobicContact CD1-CD1 3.83Å; F398-I461 HydrophobicContact CE1-CD1 3.43Å; F398-I461 VanDerWaalsContact CE1-CD1 3.43Å; F398-I461 HydrophobicContact CE1-CG1 4.17Å; F398-I461 HydrophobicContact CE2-CD1 4.21Å; F398-I461 HydrophobicContact CE2-CG1 4.29Å; F398-I461 HydrophobicContact CE2-CG2 4.37Å; F398-I461 HydrophobicContact CG-CD1 4.36Å; F398-I461 HydrophobicContact CZ-CD1 3.64Å; F398-I461 HydrophobicContact CZ-CG1 3.85Å; I452-I461 HydrophobicContact CG2-CG2 3.55Å; S453-I461 WeakPolarHBondContact O-CA 3.1Å
462	I	88.8	Confident	85.6	Confident	40 Å²	40	34.4 Å²	34.4	21%	0.205	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	144.5	176.2	56.9	168.8	0	0	0	110.2	V249 I452 S453 E455	V249-I462 HydrophobicContact CG2-CB 4.3Å; V249-I462 HydrophobicContact CG2-CG2 4.33Å; I452-I462 WeakPolarHBondContact CA-O 3.34Å; S453-I462 PolarHBondContact N-O 3.46Å; S453-I462 WeakPolarHBondContact O-CG1 3.48Å; S453-I462 PolarHBondContact O-N 3.25Å; E455-I462 HydrophobicContact CB-CG2 4.28Å
463	S	88.8	Confident	85.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	102.9	168.8	-175.4	0	0	0	0	107.9	T248 V249 S449 G450 I452 A465	T248-S463 CarbonylContact C-O 3.6Å; T248-S463 VanDerWaalsContact CA-O 3.23Å; T248-S463 WeakPolarHBondContact CA-O 3.5Å; V249-S463 PolarHBondContact N-O 2.97Å; S449-S463 PolarHBondContact OG-OG 3.47Å; G450-S463 VanDerWaalsContact CA-OG 3.32Å; G450-S463 WeakPolarHBondContact CA-OG 3.06Å; G450-S463 PolarHBondContact N-OG 2.9Å; I452-S463 WeakPolarHBondContact CD1-OG 3.46Å; S463-A465 PolarHBondContact O-N 3.42Å
464	E	86.3	Confident	84.6	Confident	40 Å²	40	40.4 Å²	40.4	19%	0.187	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	123.4	171.4	-67.9	-178.7	-165.2	0	0	108	G450 F451 R490	G450-E464 CarbonylContact C-O 3.55Å; G450-E464 WeakPolarHBondContact CA-O 3.48Å; F451-E464 HydrophobicContact CB-CB 4.18Å; F451-E464 HydrophobicContact CD1-CG 4.47Å; F451-E464 PolarHBondContact N-O 2.98Å; F451-E464 PolarHBondContact O-N 3.43Å; E464-R490 PolarHBondContact OE2-N 3.34Å
465	A	81.9	Confident	83.8	Confident	11 Å²	11	41.5 Å²	41.5	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	145	-177.5	0	0	0	0	0	111.7	T248 V249 M382 S463 H467	T248-A465 HydrophobicContact CG2-CB 4.41Å; V249-A465 WeakPolarHBondContact O-CB 3.22Å; V249-A465 PolarHBondContact O-N 3.46Å; M382-A465 HydrophobicContact CG-CB 4.19Å; M382-A465 HydrophobicContact SD-CB 3.69Å; S463-A465 PolarHBondContact O-N 3.42Å; A465-H467 PolarHBondContact O-N 3.05Å
466	H	81.3	Confident	83	Confident	46 Å²	46	44.6 Å²	44.6	21%	0.213	24%	0.244	C	C	.	.			trans	-66.3	81.2	168	-74.1	115.7	0	0	0	110.8	E446 G447 G450 Y468	E446-H466 WeakPolarHBondContact CG-NE2 3.35Å; E446-H466 IonicContact OE1-NE2 2.66Å; G447-H466 PolarHBondContact O-CE1 3Å; G447-H466 VanDerWaalsContact O-CE1 3.27Å; G450-H466 VanDerWaalsContact CA-CE1 3.49Å; G450-H466 WeakPolarHBondContact CA-CE1 3.18Å; H466-Y468 HydrophobicContact CB-CD2 4.5Å; H466-Y468 HydrophobicContact CB-CE2 3.72Å; H466-Y468 WeakPolarHBondContact O-CD2 3.12Å
467	H	85	Confident	82.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	115.2	-179.9	-161.8	118.6	0	0	0	109.1	A251 L256 H380 G381 A465 R487 W488	A251-H467 HydrophobicContact CB-CB 3.99Å; L256-H467 WeakPolarHBondContact CD1-CD2 3.26Å; L256-H467 WeakPolarHBondContact CD1-NE2 3.46Å; H380-H467 AromaticContact CG-NE2 3.91Å; H380-H467 AromaticContact ND1-NE2 3.67Å; G381-H467 WeakPolarHBondContact CA-NE2 3.49Å; G381-H467 PolarHBondContact N-NE2 2.91Å; G381-H467 VanDerWaalsContact N-NE2 3.2Å; G381-H467 CarbonylContact O-C 3.57Å; G381-H467 VanDerWaalsContact O-CA 3.29Å; G381-H467 WeakPolarHBondContact O-CA 3.02Å; A465-H467 PolarHBondContact O-N 3.05Å; H467-R487 WeakPolarHBondContact O-CA 3.39Å; H467-W488 HydrophobicContact CB-CB 4.26Å; H467-W488 PolarHBondContact O-N 2.9Å
468	Y	87.4	Confident	82.6	Confident	27 Å²	27	39.8 Å²	39.8	11%	0.106	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	166.3	-173.7	-63.4	-73.2	0	0	0	111.6	H380 G381 M383 H466 W470 R484 G486 R487	H380-Y468 VanDerWaalsContact CA-O 3.27Å; H380-Y468 WeakPolarHBondContact CA-O 3.2Å; G381-Y468 PolarHBondContact N-O 3.37Å; G381-Y468 PolarHBondContact O-N 2.91Å; M383-Y468 HydrophobicContact CB-CD2 4.01Å; M383-Y468 HydrophobicContact CB-CE2 3.95Å; M383-Y468 HydrophobicContact SD-CD2 4.42Å; M383-Y468 HydrophobicContact SD-CE2 4.01Å; H466-Y468 HydrophobicContact CB-CD2 4.5Å; H466-Y468 HydrophobicContact CB-CE2 3.72Å; H466-Y468 WeakPolarHBondContact O-CD2 3.12Å; Y468-W470 VanDerWaalsContact CB-CZ2 3.43Å; Y468-W470 HydrophobicContact CD2-CZ2 4.04Å; Y468-W470 HydrophobicContact CG-CZ2 4.16Å; Y468-R484 HydrophobicContact CD1-CG 4.18Å; Y468-R484 HydrophobicContact CG-CG 4.44Å; Y468-G486 WeakPolarHBondContact CA-O 3.41Å; Y468-R487 HydrophobicContact CD1-CB 3.69Å; Y468-R487 HydrophobicContact CE1-CB 3.92Å
469	I	88.9	Confident	82.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	172.1	-62.4	125.8	0	0	0	108	L256 L260 A379 H380 L485 G486 V493	L256-I469 HydrophobicContact CD2-CG1 4.38Å; L260-I469 HydrophobicContact CD1-CG1 4.31Å; L260-I469 HydrophobicContact CD2-CD1 4Å; L260-I469 HydrophobicContact CD2-CG1 4.14Å; L260-I469 HydrophobicContact CD2-CG2 4.18Å; A379-I469 WeakPolarHBondContact O-CA 3.23Å; H380-I469 HydrophobicContact CB-CG1 4.06Å; I469-L485 HydrophobicContact CG2-CB 4.4Å; I469-L485 HydrophobicContact CG2-CD1 4.47Å; I469-L485 PolarHBondContact O-N 3.35Å; I469-G486 PolarHBondContact N-O 2.91Å; I469-V493 HydrophobicContact CD1-CB 4.34Å; I469-V493 HydrophobicContact CD1-CG1 3.55Å; I469-V493 HydrophobicContact CD1-CG2 3.86Å
470	W	87.4	Confident	82.3	Confident	10 Å²	10	44.4 Å²	44.4	4%	0.038	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	155.1	177.9	-55.6	-87.1	0	0	0	111.1	V365 L368 L378 A379 G381 Y468 W482 T483	V365-W470 HydrophobicContact CG2-CD2 4.47Å; V365-W470 HydrophobicContact CG2-CH2 3.19Å; V365-W470 HydrophobicContact CG2-CZ2 3.06Å; V365-W470 HydrophobicContact CG2-CZ3 3.94Å; L368-W470 HydrophobicContact CD1-CE3 4.29Å; L378-W470 WeakPolarHBondContact CA-O 3.46Å; A379-W470 PolarHBondContact N-O 3.23Å; A379-W470 PolarHBondContact O-N 3.48Å; G381-W470 VanDerWaalsContact N-CZ3 3.34Å; G381-W470 VanDerWaalsContact O-CH2 3.3Å; G381-W470 WeakPolarHBondContact O-CH2 3.44Å; Y468-W470 VanDerWaalsContact CB-CZ2 3.43Å; Y468-W470 HydrophobicContact CD2-CZ2 4.04Å; Y468-W470 HydrophobicContact CG-CZ2 4.16Å; W470-W482 HydrophobicContact CB-CB 4.46Å; W470-W482 HydrophobicContact CB-CE3 3.71Å; W470-W482 HydrophobicContact CB-CZ3 4.33Å; W470-T483 CarbonylContact C-O 3.43Å; W470-T483 VanDerWaalsContact CA-O 3.26Å; W470-T483 WeakPolarHBondContact CA-O 3.5Å
471	S	87.4	Confident	82	Confident	10 Å²	10	45.2 Å²	45.2	7%	0.07	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.4	171.1	172.9	0	0	0	0	108.9	L377 Q473 T483	L377-S471 WeakPolarHBondContact O-CA 3.37Å; S471-Q473 PolarHBondContact O-N 2.89Å; S471-T483 PolarHBondContact N-O 3.16Å; S471-T483 PolarHBondContact O-N 3.17Å
472	L	85.3	Confident	81.8	Confident	1 Å²	1	47 Å²	47	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	108.1	173.1	-169.9	70	0	0	0	109.1	T370 L373 P374 L375 G376 L377 P480 T481 W482	T370-L472 HydrophobicContact CG2-CD1 3.69Å; L373-L472 HydrophobicContact CB-CD2 3.58Å; L373-L472 HydrophobicContact CD1-CD2 4.5Å; P374-L472 WeakPolarHBondContact O-CD2 3.49Å; L375-L472 HydrophobicContact CD2-CG 4.47Å; G376-L472 PolarHBondContact N-O 2.87Å; L377-L472 HydrophobicContact CB-CB 4.3Å; L377-L472 PolarHBondContact O-N 2.69Å; L472-P480 HydrophobicContact CD1-CB 4.25Å; L472-P480 HydrophobicContact CG-CB 4.46Å; L472-T481 WeakPolarHBondContact CA-O 3.37Å; L472-W482 HydrophobicContact CB-CD2 4.36Å; L472-W482 HydrophobicContact CB-CE3 4.08Å; L472-W482 HydrophobicContact CB-CH2 4.23Å; L472-W482 HydrophobicContact CB-CZ2 4.45Å; L472-W482 HydrophobicContact CB-CZ3 4.02Å; L472-W482 HydrophobicContact CD1-CD2 4.01Å; L472-W482 HydrophobicContact CD1-CG 4.21Å; L472-W482 HydrophobicContact CD1-CZ2 4.48Å
473	Q	82.1	Confident	81.7	Confident	41 Å²	41	47.2 Å²	47.2	19%	0.192	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	-178	179.8	-56.3	-173.6	39.7	0	0	110.1	S471 P480 T481	S471-Q473 PolarHBondContact O-N 2.89Å; Q473-P480 CarbonylContact O-C 3.49Å; Q473-P480 VanDerWaalsContact O-CA 3.3Å; Q473-P480 WeakPolarHBondContact O-CA 3.03Å; Q473-T481 PolarHBondContact N-O 2.93Å; Q473-T481 PolarHBondContact O-N 3.25Å
474	L	78.5	Confident	81.5	Confident	100 Å²	100	52.2 Å²	52.2	52%	0.524	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.5	170.9	-63.8	175.2	0	0	0	109.2	L375 Q479 P480	L375-L474 HydrophobicContact CD1-CD1 4.08Å; L375-L474 HydrophobicContact CD1-CD2 4.18Å; L375-L474 HydrophobicContact CD1-CG 4.01Å; L375-L474 HydrophobicContact CD2-CD2 3.87Å; L375-L474 HydrophobicContact CD2-CG 4.09Å; L474-Q479 WeakPolarHBondContact CA-O 3.38Å; L474-P480 HydrophobicContact CD2-CB 4.49Å
475	D	72.4	Confident	81.4	Confident	72 Å²	72	50.8 Å²	50.8	39%	0.385	28%	0.277	S	S	.	.			trans	-61.8	163.5	168.5	-114.1	39.4	0	0	0	110.9	L477 G478 Q479 T481	D475-L477 PolarHBondContact O-N 3.42Å; D475-G478 PolarHBondContact O-N 3.33Å; D475-Q479 PolarHBondContact N-O 3.27Å; D475-T481 HydrophobicContact CB-CG2 3.86Å; D475-T481 VanDerWaalsContact CG-CG2 3.49Å; D475-T481 WeakPolarHBondContact OD1-CB 3.46Å; D475-T481 WeakPolarHBondContact OD1-CG2 3.34Å; D475-T481 PolarHBondContact OD1-OG1 3.39Å
476	P	67.5	Low	81.6	Confident	136 Å²	136	50.2 Å²	50.2	88%	0.883	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-14.1	175.1	-25.9	35.6	0	0	0	115.3
477	L	72.6	Confident	81.8	Confident	147 Å²	147	51.6 Å²	51.6	77%	0.77	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	8.2	174.7	-61	176.2	0	0	0	113.7	D475 Q479	D475-L477 PolarHBondContact O-N 3.42Å; L477-Q479 VanDerWaalsContact C-N 3.34Å; L477-Q479 PolarHBondContact O-N 3.05Å
478	G	72.3	Confident	81.7	Confident	51 Å²	51	52.6 Å²	52.6	53%	0.526	28%	0.28	S	S	.	.	S	Bend	trans	74.8	15.5	178	0	0	0	0	0	115.3	D475	D475-G478 PolarHBondContact O-N 3.33Å
479	Q	75.6	Confident	81.4	Confident	127 Å²	127	54.4 Å²	54.4	59%	0.593	29%	0.286	S	S	*	.			trans	-97.6	143.3	178.3	-61.8	-171.8	7.9	0	0	111	L474 D475 L477 T481	L474-Q479 WeakPolarHBondContact CA-O 3.38Å; D475-Q479 PolarHBondContact N-O 3.27Å; L477-Q479 VanDerWaalsContact C-N 3.34Å; L477-Q479 PolarHBondContact O-N 3.05Å; Q479-T481 PolarHBondContact O-N 2.86Å
480	P	81.2	Confident	80.6	Confident	50 Å²	50	62.4 Å²	62.4	33%	0.325	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.1	178.8	29.3	-33.7	0	0	0	111.3	T370 L375 L472 Q473 L474	T370-P480 VanDerWaalsContact CB-O 3.28Å; T370-P480 WeakPolarHBondContact CB-O 3.43Å; T370-P480 VanDerWaalsContact CG2-O 3.29Å; T370-P480 WeakPolarHBondContact CG2-O 3.33Å; T370-P480 PolarHBondContact OG1-O 3.41Å; L375-P480 HydrophobicContact CD2-CB 4.45Å; L472-P480 HydrophobicContact CD1-CB 4.25Å; L472-P480 HydrophobicContact CG-CB 4.46Å; Q473-P480 CarbonylContact O-C 3.49Å; Q473-P480 VanDerWaalsContact O-CA 3.3Å; Q473-P480 WeakPolarHBondContact O-CA 3.03Å; L474-P480 HydrophobicContact CD2-CB 4.49Å
481	T	83.1	Confident	80	Confident	34 Å²	34	62.7 Å²	62.7	21%	0.209	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	151.5	-175.8	57.5	0	0	0	0	112	L472 Q473 D475 Q479 T483	L472-T481 WeakPolarHBondContact CA-O 3.37Å; Q473-T481 PolarHBondContact N-O 2.93Å; Q473-T481 PolarHBondContact O-N 3.25Å; D475-T481 HydrophobicContact CB-CG2 3.86Å; D475-T481 VanDerWaalsContact CG-CG2 3.49Å; D475-T481 WeakPolarHBondContact OD1-CB 3.46Å; D475-T481 WeakPolarHBondContact OD1-CG2 3.34Å; D475-T481 PolarHBondContact OD1-OG1 3.39Å; Q479-T481 PolarHBondContact O-N 2.86Å; T481-T483 PolarHBondContact O-N 3.01Å
482	W	84.8	Confident	79.5	Confident	42 Å²	42	70.3 Å²	70.3	16%	0.159	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	91	-180	-77.2	110.6	0	0	0	111.3	L368 R369 T370 L373 L377 A379 W470 L472	L368-W482 HydrophobicContact CD1-CD2 4.49Å; L368-W482 HydrophobicContact CD2-CZ2 3.97Å; L368-W482 PolarHBondContact O-NE1 3.18Å; R369-W482 PolarHBondContact O-NE1 3.09Å; T370-W482 HydrophobicContact CG2-CG 4.44Å; L373-W482 HydrophobicContact CD1-CZ2 4.01Å; L377-W482 HydrophobicContact CB-CH2 4.4Å; L377-W482 HydrophobicContact CD2-CH2 3.65Å; L377-W482 HydrophobicContact CD2-CZ2 4.1Å; L377-W482 HydrophobicContact CG-CH2 3.85Å; L377-W482 WeakPolarHBondContact O-CZ3 3.45Å; A379-W482 HydrophobicContact CB-CE3 4.47Å; A379-W482 HydrophobicContact CB-CH2 3.67Å; A379-W482 HydrophobicContact CB-CZ3 3.61Å; W470-W482 HydrophobicContact CB-CB 4.46Å; W470-W482 HydrophobicContact CB-CE3 3.71Å; W470-W482 HydrophobicContact CB-CZ3 4.33Å; L472-W482 HydrophobicContact CB-CD2 4.36Å; L472-W482 HydrophobicContact CB-CE3 4.08Å; L472-W482 HydrophobicContact CB-CH2 4.23Å; L472-W482 HydrophobicContact CB-CZ2 4.45Å; L472-W482 HydrophobicContact CB-CZ3 4.02Å; L472-W482 HydrophobicContact CD1-CD2 4.01Å; L472-W482 HydrophobicContact CD1-CG 4.21Å; L472-W482 HydrophobicContact CD1-CZ2 4.48Å
483	T	85.1	Confident	79.4	Confident	44 Å²	44	70.9 Å²	70.9	27%	0.27	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.9	177.2	-40.6	0	0	0	0	110.6	W470 S471 T481 L485	W470-T483 CarbonylContact C-O 3.43Å; W470-T483 VanDerWaalsContact CA-O 3.26Å; W470-T483 WeakPolarHBondContact CA-O 3.5Å; S471-T483 PolarHBondContact N-O 3.16Å; S471-T483 PolarHBondContact O-N 3.17Å; T481-T483 PolarHBondContact O-N 3.01Å; T483-L485 PolarHBondContact O-N 2.97Å
484	R	85	Confident	79.3	Confident	106 Å²	106	72.2 Å²	72.2	40%	0.4	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.7	175.2	-168	-177.4	82	-170.2	1	110	Y468 D496 A499	Y468-R484 HydrophobicContact CD1-CG 4.18Å; Y468-R484 HydrophobicContact CG-CG 4.44Å; R484-D496 IonicContact CZ-OD2 2.7Å; R484-D496 IonicContact NE-OD2 2.69Å; R484-D496 PolarHBondContact NE-OD2 2.87Å; R484-D496 IonicContact NH2-OD1 2.64Å; R484-D496 IonicContact NH2-OD2 3.06Å; R484-D496 PolarHBondContact NH2-OD2 3.42Å; R484-A499 VanDerWaalsContact O-CB 3.26Å; R484-A499 WeakPolarHBondContact O-CB 3.49Å
485	L	84	Confident	79.2	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.047	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-26.8	178.8	-65.3	-170.3	0	0	0	113.7	L378 I469 T483 M495 D496 A499	L378-L485 HydrophobicContact CD2-CD1 3.77Å; I469-L485 HydrophobicContact CG2-CB 4.4Å; I469-L485 HydrophobicContact CG2-CD1 4.47Å; I469-L485 PolarHBondContact O-N 3.35Å; T483-L485 PolarHBondContact O-N 2.97Å; L485-M495 HydrophobicContact CB-CE 3.99Å; L485-M495 WeakPolarHBondContact O-CE 3.22Å; L485-D496 PolarHBondContact O-N 3.45Å; L485-A499 WeakPolarHBondContact CD2-O 3.42Å
486	G	85.9	Confident	79.2	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-171.1	-174.3	0	0	0	0	0	113.6	Y468 I469 L494	Y468-G486 WeakPolarHBondContact CA-O 3.41Å; I469-G486 PolarHBondContact N-O 2.91Å; G486-L494 CarbonylContact C-O 3.59Å; G486-L494 WeakPolarHBondContact CA-O 3.26Å
487	R	85.8	Confident	78.2	Confident	75 Å²	75	72.7 Å²	72.7	28%	0.283	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.8	-178	61.8	-177.4	152.8	-160.9	-16.5	112.4	E446 H467 Y468 L494	E446-R487 WeakPolarHBondContact OE1-CD 3.47Å; E446-R487 IonicContact OE1-CZ 3.03Å; E446-R487 IonicContact OE1-NE 3.76Å; E446-R487 IonicContact OE1-NH1 3.77Å; E446-R487 PolarHBondContact OE1-NH1 2.94Å; H467-R487 WeakPolarHBondContact O-CA 3.39Å; Y468-R487 HydrophobicContact CD1-CB 3.69Å; Y468-R487 HydrophobicContact CE1-CB 3.92Å; R487-L494 HydrophobicContact CG-CB 4.14Å; R487-L494 PolarHBondContact N-O 2.9Å; R487-L494 PolarHBondContact O-N 2.81Å
488	W	84.4	Confident	77.1	Confident	21 Å²	21	69.1 Å²	69.1	8%	0.08	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	142.2	165	-176.8	-104.7	0	0	0	110.5	A251 Q255 L256 Y259 H467 G491 R492 V493	A251-W488 HydrophobicContact CB-CB 4.44Å; A251-W488 HydrophobicContact CB-CD2 4.43Å; A251-W488 HydrophobicContact CB-CG 3.87Å; Q255-W488 HydrophobicContact CB-CH2 4.24Å; Q255-W488 HydrophobicContact CB-CZ2 4.39Å; Q255-W488 HydrophobicContact CG-CH2 4.05Å; Q255-W488 HydrophobicContact CG-CZ2 4.38Å; L256-W488 HydrophobicContact CB-CD2 4.28Å; L256-W488 HydrophobicContact CB-CE3 3.95Å; L256-W488 HydrophobicContact CB-CH2 4.23Å; L256-W488 HydrophobicContact CB-CZ3 3.96Å; L256-W488 HydrophobicContact CD1-CB 3.79Å; L256-W488 HydrophobicContact CD1-CD2 3.93Å; L256-W488 HydrophobicContact CD1-CE3 3.99Å; L256-W488 HydrophobicContact CD1-CG 3.92Å; L256-W488 HydrophobicContact CG-CD2 4.15Å; L256-W488 HydrophobicContact CG-CE3 3.72Å; L256-W488 HydrophobicContact CG-CZ3 4.15Å; Y259-W488 AromaticContact CD2-CH2 3.83Å; Y259-W488 HydrophobicContact CD2-CH2 3.83Å; Y259-W488 AromaticContact CD2-CZ3 3.95Å; Y259-W488 HydrophobicContact CD2-CZ3 3.95Å; Y259-W488 HydrophobicContact CE2-CH2 4.36Å; Y259-W488 HydrophobicContact CG-CZ3 4.3Å; H467-W488 HydrophobicContact CB-CB 4.26Å; H467-W488 PolarHBondContact O-N 2.9Å; W488-G491 VanDerWaalsContact CH2-C 3.44Å; W488-G491 VanDerWaalsContact CZ2-CA 3.43Å; W488-R492 WeakPolarHBondContact CA-O 3.26Å; W488-R492 VanDerWaalsContact CE3-C 3.45Å; W488-R492 VanDerWaalsContact CE3-O 3.3Å; W488-V493 HydrophobicContact CE3-CG2 3.87Å; W488-V493 HydrophobicContact CZ3-CG2 4.17Å
489	R	79.1	Confident	75.7	Confident	65 Å²	65	67.6 Å²	67.6	25%	0.245	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	131.4	169.9	-171.7	-172.1	-74.2	160.1	-4	109.9	E446 F451 G491 R492 L494	E446-R489 IonicContact OE1-CZ 3.55Å; E446-R489 IonicContact OE1-NH2 3.7Å; E446-R489 PolarHBondContact OE1-NH2 2.04Å; E446-R489 IonicContact OE2-CZ 3.31Å; E446-R489 IonicContact OE2-NE 2.69Å; E446-R489 PolarHBondContact OE2-NE 2.8Å; E446-R489 IonicContact OE2-NH2 3.82Å; E446-R489 PolarHBondContact OE2-NH2 3.36Å; F451-R489 HydrophobicContact CD1-CG 4.39Å; F451-R489 HydrophobicContact CD2-CG 4.3Å; F451-R489 HydrophobicContact CG-CG 4.17Å; R489-G491 VanDerWaalsContact C-N 3.28Å; R489-G491 PolarHBondContact O-N 2.84Å; R489-G491 VanDerWaalsContact O-N 3.12Å; R489-R492 PolarHBondContact N-O 2.84Å; R489-R492 PolarHBondContact O-N 3.33Å; R489-L494 HydrophobicContact CB-CD1 3.9Å
490	R	73.8	Confident	74.2	Confident	170 Å²	170	67 Å²	67	64%	0.642	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	45	170.8	-62.6	179	79.1	174.9	6.6	114.6	F451 E464	F451-R490 HydrophobicContact CD1-CG 4.19Å; F451-R490 HydrophobicContact CE1-CG 3.69Å; F451-R490 HydrophobicContact CZ-CG 4.32Å; E464-R490 PolarHBondContact OE2-N 3.34Å
491	G	73.6	Confident	72.2	Confident	16 Å²	16	66.3 Å²	66.3	17%	0.165	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	81	14.2	176.2	0	0	0	0	0	115.9	Y259 W488 R489	Y259-G491 WeakPolarHBondContact CE2-O 3.5Å; Y259-G491 VanDerWaalsContact CZ-O 3.29Å; W488-G491 VanDerWaalsContact CH2-C 3.44Å; W488-G491 VanDerWaalsContact CZ2-CA 3.43Å; R489-G491 VanDerWaalsContact C-N 3.28Å; R489-G491 PolarHBondContact O-N 2.84Å; R489-G491 VanDerWaalsContact O-N 3.12Å
492	R	78.1	Confident	69.7	Low	170 Å²	170	69.3 Å²	69.3	64%	0.642	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	160.3	175.9	-61.8	-174.5	-175.3	-176.2	1.8	111.8	Y259 W488 R489	Y259-R492 HydrophobicContact CE1-CG 4.45Å; W488-R492 WeakPolarHBondContact CA-O 3.26Å; W488-R492 VanDerWaalsContact CE3-C 3.45Å; W488-R492 VanDerWaalsContact CE3-O 3.3Å; R489-R492 PolarHBondContact N-O 2.84Å; R489-R492 PolarHBondContact O-N 3.33Å
493	V	82.4	Confident	67.1	Low	13 Å²	13	75.4 Å²	75.4	8%	0.079	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.9	168.2	177.4	0	0	0	0	109.6	L260 M263 I469 W488 M495	L260-V493 HydrophobicContact CD2-CG2 4.14Å; L260-V493 HydrophobicContact CG-CG2 4.48Å; M263-V493 HydrophobicContact CE-CB 3.64Å; M263-V493 HydrophobicContact CE-CG1 3.62Å; M263-V493 HydrophobicContact CE-CG2 4.5Å; M263-V493 HydrophobicContact SD-CB 4.38Å; I469-V493 HydrophobicContact CD1-CB 4.34Å; I469-V493 HydrophobicContact CD1-CG1 3.55Å; I469-V493 HydrophobicContact CD1-CG2 3.86Å; W488-V493 HydrophobicContact CE3-CG2 3.87Å; W488-V493 HydrophobicContact CZ3-CG2 4.17Å; V493-M495 HydrophobicContact CG1-SD 3.68Å
494	L	79.8	Confident	64.5	Low	69 Å²	69	81.6 Å²	81.6	36%	0.361	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.6	169.1	-66.6	173.5	0	0	0	108.6	G486 R487 R489	G486-L494 CarbonylContact C-O 3.59Å; G486-L494 WeakPolarHBondContact CA-O 3.26Å; R487-L494 HydrophobicContact CG-CB 4.14Å; R487-L494 PolarHBondContact N-O 2.9Å; R487-L494 PolarHBondContact O-N 2.81Å; R489-L494 HydrophobicContact CB-CD1 3.9Å
495	M	76.8	Confident	61.8	Low	79 Å²	79	80.2 Å²	80.2	39%	0.389	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144.1	178.5	-56.7	-56.9	-67.3	0	0	111.1	M263 L485 V493 W500	M263-M495 HydrophobicContact CE-CG 4.07Å; M263-M495 HydrophobicContact CE-SD 3.68Å; L485-M495 HydrophobicContact CB-CE 3.99Å; L485-M495 WeakPolarHBondContact O-CE 3.22Å; V493-M495 HydrophobicContact CG1-SD 3.68Å; M495-W500 HydrophobicContact CE-CG 4.39Å; M495-W500 VanDerWaalsContact CE-NE1 3.28Å
496	D	71.9	Confident	59.3	Low	34 Å²	34	86 Å²	86	18%	0.182	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-82.4	132	173.4	-76.7	-16.9	0	0	0	110.5	R484 L485 G498 A499	R484-D496 IonicContact CZ-OD2 2.7Å; R484-D496 IonicContact NE-OD2 2.69Å; R484-D496 PolarHBondContact NE-OD2 2.87Å; R484-D496 IonicContact NH2-OD1 2.64Å; R484-D496 IonicContact NH2-OD2 3.06Å; R484-D496 PolarHBondContact NH2-OD2 3.42Å; L485-D496 PolarHBondContact O-N 3.45Å; D496-G498 PolarHBondContact O-N 3.2Å; D496-A499 HydrophobicContact CB-CB 3.83Å; D496-A499 WeakPolarHBondContact O-CB 3.35Å; D496-A499 PolarHBondContact O-N 2.96Å
497	Q	47.8	Very low	56.5	Low	204 Å²	204	89.1 Å²	89.1	95%	0.953	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	130.9	179.7	-70.1	179	-21.6	0	0	110.8	A499	Q497-A499 PolarHBondContact O-N 2.99Å
498	G	49	Very low	53.9	Low	73 Å²	73	91.2 Å²	91.2	75%	0.753	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-10.2	-177.7	0	0	0	0	0	115.8	D496 W500	D496-G498 PolarHBondContact O-N 3.2Å; G498-W500 VanDerWaalsContact C-N 3.34Å
499	A	43.2	Very low	51.2	Low	19 Å²	19	93 Å²	93	16%	0.157	54%	0.539	C	S	.	.			trans	-79.6	-14.2	-179.4	0	0	0	0	0	114.3	R484 L485 D496 Q497	R484-A499 VanDerWaalsContact O-CB 3.26Å; R484-A499 WeakPolarHBondContact O-CB 3.49Å; L485-A499 WeakPolarHBondContact CD2-O 3.42Å; D496-A499 HydrophobicContact CB-CB 3.83Å; D496-A499 WeakPolarHBondContact O-CB 3.35Å; D496-A499 PolarHBondContact O-N 2.96Å; Q497-A499 PolarHBondContact O-N 2.99Å
500	W	43.6	Very low	49	Very low	113 Å²	113	92.5 Å²	92.5	43%	0.428	56%	0.555	S	S	.	*	S	Bend	trans	-86.5	122.3	167.3	-111	54.2	0	0	0	109	N264 M495 G498 S502 R513	N264-W500 WeakPolarHBondContact OD1-CZ2 3.44Å; M495-W500 HydrophobicContact CE-CG 4.39Å; M495-W500 VanDerWaalsContact CE-NE1 3.28Å; G498-W500 VanDerWaalsContact C-N 3.34Å; W500-S502 PolarHBondContact O-N 3.3Å; W500-R513 VanDerWaalsContact CE2-NH2 3.26Å; W500-R513 VanDerWaalsContact CH2-NH2 3.34Å
501	P	38.9	Very low	47	Very low	36 Å²	36	90.2 Å²	90.2	23%	0.234	56%	0.555	C	S	.	*			trans	-65.3	100.2	-175.4	20.3	-30.2	0	0	0	112.2	H503 R513	P501-H503 VanDerWaalsContact C-N 3.32Å; P501-R513 PolarHBondContact O-NH1 2.94Å
502	S	30.5	Very low	45.3	Very low	98 Å²	98	97.2 Å²	97.2	69%	0.685	58%	0.577	S	S	*	*			trans	-99.4	45.6	163.1	59.8	0	0	0	0	109.3	W500 Q504	W500-S502 PolarHBondContact O-N 3.3Å; S502-Q504 PolarHBondContact O-N 3.13Å
503	H	29.9	Very low	43.3	Very low	169 Å²	169	94 Å²	94	78%	0.782	57%	0.565	S	S	*	*			trans	-70.2	120.8	-171	-118.2	-72.8	0	0	0	111.9	P501	P501-H503 VanDerWaalsContact C-N 3.32Å
504	Q	31.4	Very low	41.1	Very low	174 Å²	174	101.7 Å²	101.7	81%	0.813	59%	0.592	S	S	*	*			trans	-66.2	138.6	150.8	-66	169.4	-25	0	0	108	S502	S502-Q504 PolarHBondContact O-N 3.13Å
505	G	27.3	Very low	39	Very low	77 Å²	77	103.6 Å²	103.6	79%	0.794	61%	0.611	S	S	*	*			trans	167.5	121.7	178.9	0	0	0	0	0	111.7
506	S	32	Very low	37.2	Very low	131 Å²	131	104.3 Å²	104.3	92%	0.916	63%	0.63	S	S	*	*			trans	-95.8	120.6	170.3	-173.9	0	0	0	0	109
507	G	26.3	Very low	36.2	Very low	66 Å²	66	108 Å²	108	68%	0.68	64%	0.641	S	S	*	*			trans	-178.5	137.7	-180	0	0	0	0	0	112.2	G509	G507-G509 PolarHBondContact O-N 3.45Å; G507-G509 VanDerWaalsContact O-N 3.08Å
508	S	31.3	Very low	37.3	Very low	119 Å²	119	102.3 Å²	102.3	83%	0.832	62%	0.617	S	S	*	*			trans	-78.3	91	-179.6	174.2	0	0	0	0	111.5
509	G	27.6	Very low	38.9	Very low	57 Å²	57	102.8 Å²	102.8	59%	0.588	60%	0.6	S	S	*	*	S	Bend	trans	-145.8	154.8	169.8	0	0	0	0	0	111.1	G507 D511	G507-G509 PolarHBondContact O-N 3.45Å; G507-G509 VanDerWaalsContact O-N 3.08Å; G509-D511 PolarHBondContact O-N 3.03Å; G509-D511 VanDerWaalsContact O-N 3.1Å
510	G	34.6	Very low	41	Very low	56 Å²	56	102.1 Å²	102.1	58%	0.577	59%	0.593	S	S	*	*			trans	-75.6	94.1	178.9	0	0	0	0	0	111.9	W512	G510-W512 PolarHBondContact O-N 3.25Å; G510-W512 PolarHBondContact O-NE1 3.16Å
511	D	31.4	Very low	43.3	Very low	122 Å²	122	98.9 Å²	98.9	65%	0.652	58%	0.581	S	S	*	*			trans	-82	111.2	179.9	-95.1	-21.8	0	0	0	112.9	G509 R513	G509-D511 PolarHBondContact O-N 3.03Å; G509-D511 VanDerWaalsContact O-N 3.1Å; D511-R513 PolarHBondContact O-N 2.61Å
512	W	36.7	Very low	46	Very low	163 Å²	163	97.1 Å²	97.1	62%	0.617	57%	0.57	S	S	*	*	S	Bend	trans	-73.2	41.6	-171.8	-51.3	111.9	0	0	0	115.5	E354 G510	E354-W512 VanDerWaalsContact CD-CZ3 3.5Å; E354-W512 WeakPolarHBondContact OE1-CZ3 3.45Å; E354-W512 WeakPolarHBondContact OE2-CZ3 3.26Å; G510-W512 PolarHBondContact O-N 3.25Å; G510-W512 PolarHBondContact O-NE1 3.16Å
513	R	36.2	Very low	49.1	Very low	102 Å²	102	92.5 Å²	92.5	39%	0.385	54%	0.537	S	S	.	.			trans	-138.7	28.8	-170.2	-143.6	169.5	-142.8	-128.4	-12.3	115.6	W500 P501 D511	W500-R513 VanDerWaalsContact CE2-NH2 3.26Å; W500-R513 VanDerWaalsContact CH2-NH2 3.34Å; P501-R513 PolarHBondContact O-NH1 2.94Å; D511-R513 PolarHBondContact O-N 2.61Å
514	R	37	Very low	52.3	Low	175 Å²	175	84.4 Å²	84.4	66%	0.66	50%	0.5	S	S	*	.			trans	-134.4	73.8	-176.1	-58.3	-172.2	-164.8	-174.3	7.3	114.6	A516	R514-A516 VanDerWaalsContact C-N 3.31Å; R514-A516 PolarHBondContact O-N 3.25Å
515	S	35.6	Very low	55.2	Low	108 Å²	108	76.6 Å²	76.6	76%	0.755	46%	0.464	S	S	*	.	S	Bend	trans	-71.2	98.8	137.6	-83.4	0	0	0	0	107	R517	S515-R517 PolarHBondContact O-N 2.87Å
516	A	39.6	Very low	58.4	Low	95 Å²	95	75.1 Å²	75.1	79%	0.785	44%	0.439	S	S	*	.			trans	27.1	82.4	174.5	0	0	0	0	0	116.1	R514 L518	R514-A516 VanDerWaalsContact C-N 3.31Å; R514-A516 PolarHBondContact O-N 3.25Å; A516-L518 PolarHBondContact O-N 2.97Å; A516-L518 VanDerWaalsContact O-N 3.16Å
517	R	51	Low	61.2	Low	110 Å²	110	69.4 Å²	69.4	42%	0.415	40%	0.398	S	S	.	.			trans	-53.9	125.4	157	-84	-165.1	-178.8	167.5	-2.2	107.4	S515 H519	S515-R517 PolarHBondContact O-N 2.87Å; R517-H519 PolarHBondContact O-N 2.63Å
518	L	70.1	Confident	64.3	Low	86 Å²	86	69.9 Å²	69.9	45%	0.45	38%	0.382	S	S	.	.			trans	-55.6	121.7	175	-176.3	60.4	0	0	0	107.8	A516 M520 F598 T599 L888	A516-L518 PolarHBondContact O-N 2.97Å; A516-L518 VanDerWaalsContact O-N 3.16Å; L518-M520 HydrophobicContact CD2-CE 3.48Å; L518-M520 VanDerWaalsContact CD2-CE 3.48Å; L518-M520 HydrophobicContact CG-CE 3.83Å; L518-F598 HydrophobicContact CB-CB 4.04Å; L518-F598 HydrophobicContact CG-CB 4.38Å; L518-F598 WeakPolarHBondContact O-CA 3.45Å; L518-F598 VanDerWaalsContact O-CB 3.25Å; L518-F598 WeakPolarHBondContact O-CB 3.34Å; L518-T599 PolarHBondContact O-N 2.91Å; L518-L888 HydrophobicContact CD2-CD1 4.08Å; L518-L888 HydrophobicContact CD2-CD2 4.13Å
519	H	82.8	Confident	67.2	Low	83 Å²	83	64.2 Å²	64.2	38%	0.384	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121	-174	-176.5	56.2	0	0	0	110.9	R517 T599 D601	R517-H519 PolarHBondContact O-N 2.63Å; H519-T599 WeakPolarHBondContact CA-O 3.29Å; H519-T599 PolarHBondContact ND1-O 3.41Å; H519-T599 PolarHBondContact ND1-OG1 2.97Å; H519-D601 IonicContact CE1-OD1 2.68Å; H519-D601 PolarHBondContact CE1-OD1 3.45Å; H519-D601 VanDerWaalsContact CE1-OD1 3.31Å; H519-D601 IonicContact NE2-OD1 2.92Å; H519-D601 IonicContact NE2-OD2 2.76Å
520	M	88.4	Confident	70.4	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.02	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.1	-172.2	-58.2	-167.3	-162.7	0	0	112	L518 V522 F598 T599 F600 D601 H631 L632 L888 F892	L518-M520 HydrophobicContact CD2-CE 3.48Å; L518-M520 VanDerWaalsContact CD2-CE 3.48Å; L518-M520 HydrophobicContact CG-CE 3.83Å; M520-V522 HydrophobicContact CB-CG2 4.31Å; M520-F598 HydrophobicContact CB-CD2 4.49Å; M520-F598 HydrophobicContact CE-CB 4.12Å; M520-F598 HydrophobicContact CE-CD1 3.98Å; M520-F598 HydrophobicContact CE-CD2 4.09Å; M520-F598 HydrophobicContact CE-CE1 4.41Å; M520-F598 HydrophobicContact CE-CG 3.83Å; M520-F598 HydrophobicContact CG-CD2 4.14Å; M520-F598 HydrophobicContact SD-CD2 4.06Å; M520-F598 HydrophobicContact SD-CE2 4.1Å; M520-F598 HydrophobicContact SD-CG 4.41Å; M520-F598 HydrophobicContact SD-CZ 4.48Å; M520-T599 PolarHBondContact N-O 3.2Å; M520-F600 HydrophobicContact CB-CB 4.47Å; M520-F600 CarbonylContact O-C 3.54Å; M520-F600 WeakPolarHBondContact O-CA 3.35Å; M520-D601 PolarHBondContact O-N 3.15Å; M520-H631 HydrophobicContact CB-CB 4.32Å; M520-L632 HydrophobicContact SD-CB 4.45Å; M520-L632 HydrophobicContact SD-CD2 4.28Å; M520-L888 HydrophobicContact CE-CD1 3.69Å; M520-F892 HydrophobicContact CE-CE2 4.28Å; M520-F892 HydrophobicContact CE-CZ 4.07Å; M520-F892 HydrophobicContact SD-CZ 4.33Å
521	R	91.1	Very high	73.2	Confident	45 Å²	45	58.8 Å²	58.8	17%	0.17	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119	160.7	-66.3	-180	-53	-65.3	-8.8	107.8	F563 D601 Y603 G628 A629 H631	R521-F563 VanDerWaalsContact CD-CD2 3.49Å; R521-F563 HydrophobicContact CG-CD2 4.27Å; R521-F563 HydrophobicContact CG-CE2 4.08Å; R521-F563 HydrophobicContact CG-CZ 4.4Å; R521-D601 WeakPolarHBondContact CA-O 3.44Å; R521-Y603 HydrophobicContact CB-CE1 4.42Å; R521-G628 PolarHBondContact NH2-O 3.32Å; R521-A629 PolarHBondContact NE-O 2.7Å; R521-A629 PolarHBondContact NH2-O 2.91Å; R521-H631 PolarHBondContact NH1-CE1 3.21Å; R521-H631 PolarHBondContact NH1-NE2 2.88Å; R521-H631 PolarHBondContact NH2-CD2 3Å; R521-H631 PolarHBondContact NH2-NE2 2.64Å; R521-H631 PolarHBondContact O-N 3.09Å
522	V	95.6	Very high	76.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.2	-177.7	-175	0	0	0	0	108.4	M520 L589 F600 D601 L602 Y603 L632 V634	M520-V522 HydrophobicContact CB-CG2 4.31Å; V522-L589 HydrophobicContact CB-CD2 4.3Å; V522-L589 HydrophobicContact CG1-CD1 4.42Å; V522-L589 HydrophobicContact CG1-CD2 3.83Å; V522-L589 HydrophobicContact CG2-CD1 4.18Å; V522-L589 HydrophobicContact CG2-CD2 4.33Å; V522-F600 HydrophobicContact CG2-CB 3.64Å; V522-F600 HydrophobicContact CG2-CD2 4.2Å; V522-F600 HydrophobicContact CG2-CG 4.15Å; V522-D601 PolarHBondContact N-O 2.92Å; V522-L602 HydrophobicContact CB-CD1 4.08Å; V522-L602 HydrophobicContact CG1-CD1 4.03Å; V522-Y603 VanDerWaalsContact O-CD1 3.24Å; V522-Y603 WeakPolarHBondContact O-CD1 3.4Å; V522-Y603 PolarHBondContact O-N 3.27Å; V522-L632 WeakPolarHBondContact CA-O 3.5Å; V522-L632 HydrophobicContact CG1-CB 4.41Å; V522-L632 HydrophobicContact CG1-CD2 4.45Å; V522-L632 HydrophobicContact CG2-CB 4.15Å; V522-L632 HydrophobicContact CG2-CD2 4.08Å; V522-V634 HydrophobicContact CG1-CB 4.19Å; V522-V634 HydrophobicContact CG1-CG2 3.85Å
523	V	95.7	Very high	78.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.6	173	68	0	0	0	0	110.4	Y603 V605 L621 A630 L632 A633 V634	V523-Y603 CarbonylContact C-O 3.56Å; V523-Y603 WeakPolarHBondContact CA-O 3.42Å; V523-Y603 HydrophobicContact CB-CD1 4.38Å; V523-Y603 HydrophobicContact CB-CE1 3.74Å; V523-Y603 HydrophobicContact CB-CE2 4.15Å; V523-Y603 HydrophobicContact CG2-CD2 4.23Å; V523-Y603 HydrophobicContact CG2-CE1 4.21Å; V523-Y603 HydrophobicContact CG2-CE2 3.7Å; V523-V605 HydrophobicContact CG2-CB 3.78Å; V523-V605 HydrophobicContact CG2-CG2 4.37Å; V523-L621 HydrophobicContact CB-CD2 4.44Å; V523-L621 HydrophobicContact CG1-CD2 3.94Å; V523-L621 HydrophobicContact CG2-CD2 3.81Å; V523-A630 HydrophobicContact CB-CB 3.81Å; V523-A630 HydrophobicContact CG1-CB 3.56Å; V523-L632 PolarHBondContact N-O 2.66Å; V523-A633 HydrophobicContact CG1-CB 3.65Å; V523-A633 WeakPolarHBondContact O-CA 3.33Å; V523-V634 PolarHBondContact O-N 3.28Å
524	T	95.8	Very high	81.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	170.7	176.9	-159.3	0	0	0	0	111.9	V531 L602 Y603 I604 V605 V634	T524-V531 HydrophobicContact CG2-CG1 4.28Å; T524-V531 WeakPolarHBondContact OG1-CG2 3.12Å; T524-L602 HydrophobicContact CG2-CD1 3.9Å; T524-L602 HydrophobicContact CG2-CG 4.38Å; T524-Y603 PolarHBondContact N-O 3.47Å; T524-I604 HydrophobicContact CG2-CG1 4.29Å; T524-I604 WeakPolarHBondContact O-CA 3.39Å; T524-V605 PolarHBondContact O-N 3.32Å; T524-V634 WeakPolarHBondContact CB-O 3.33Å; T524-V634 PolarHBondContact OG1-O 2.97Å
525	L	94.1	Very high	84.1	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.052	23%	0.234	C	C	.	.			trans	-133.7	136.1	176.4	179	65.9	0	0	0	108.1	E527 V531 V605 G608 Y610 L621 T635	L525-E527 HydrophobicContact CD2-CG 4.28Å; L525-E527 HydrophobicContact CG-CG 4.31Å; L525-E527 PolarHBondContact O-N 2.9Å; L525-V531 WeakPolarHBondContact O-CB 3.3Å; L525-V605 HydrophobicContact CB-CG1 4.25Å; L525-V605 HydrophobicContact CD1-CG1 3.67Å; L525-G608 VanDerWaalsContact CD1-C 3.47Å; L525-G608 WeakPolarHBondContact CD1-O 3.42Å; L525-Y610 HydrophobicContact CD2-CD1 3.74Å; L525-Y610 HydrophobicContact CD2-CD2 4.11Å; L525-Y610 HydrophobicContact CD2-CE1 3.64Å; L525-Y610 HydrophobicContact CD2-CE2 4.02Å; L525-Y610 HydrophobicContact CD2-CG 3.99Å; L525-L621 HydrophobicContact CB-CD2 4.47Å; L525-T635 HydrophobicContact CB-CG2 3.98Å; L525-T635 PolarHBondContact O-OG1 2.61Å
526	V	92.9	Very high	86.6	Confident	45 Å²	45	40.7 Å²	40.7	27%	0.273	21%	0.206	S	C	.	.			trans	-78.6	100.9	-178.1	-170.9	0	0	0	0	109.8	T533 I604	V526-T533 HydrophobicContact CB-CG2 4.42Å; V526-T533 HydrophobicContact CG1-CG2 3.97Å; V526-T533 HydrophobicContact CG2-CG2 3.52Å; V526-I604 HydrophobicContact CG2-CD1 3.82Å; V526-I604 HydrophobicContact CG2-CG1 4.1Å; V526-I604 HydrophobicContact CG2-CG2 3.95Å
527	E	90.8	Very high	88.7	Confident	11 Å²	11	39 Å²	39	5%	0.051	18%	0.184	C	C	.	.			trans	-143.9	122.1	178.1	-82.6	-69.2	-173.6	0	0	110	L525 F530 V531 T830 L853	L525-E527 HydrophobicContact CD2-CG 4.28Å; L525-E527 HydrophobicContact CG-CG 4.31Å; L525-E527 PolarHBondContact O-N 2.9Å; E527-F530 WeakPolarHBondContact O-CA 3.08Å; E527-F530 PolarHBondContact O-N 3.45Å; E527-V531 CarbonylContact C-O 3.44Å; E527-V531 PolarHBondContact N-O 3.24Å; E527-V531 VanDerWaalsContact N-O 3.16Å; E527-V531 PolarHBondContact O-N 3.23Å; E527-T830 VanDerWaalsContact CD-OG1 3.3Å; E527-T830 VanDerWaalsContact OE1-CB 3.22Å; E527-T830 WeakPolarHBondContact OE1-CB 3.03Å; E527-T830 PolarHBondContact OE1-OG1 2.71Å; E527-T830 WeakPolarHBondContact OE2-CB 3.41Å; E527-T830 PolarHBondContact OE2-OG1 2.93Å; E527-L853 HydrophobicContact CB-CD2 4.33Å; E527-L853 HydrophobicContact CG-CD2 4.34Å
528	H	91.3	Very high	89.9	Confident	76 Å²	76	37.9 Å²	37.9	35%	0.352	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	139.3	-175.7	-52.6	140.7	0	0	0	111.1	V531 F532 Y856	H528-V531 PolarHBondContact CD2-O 3.05Å; H528-F532 HydrophobicContact CB-CD1 4.44Å; H528-F532 HydrophobicContact CB-CE1 3.94Å; H528-F532 HydrophobicContact CB-CZ 4.26Å; H528-F532 AromaticContact CD2-CD1 3.12Å; H528-F532 WeakPolarHBondContact CD2-CD1 3.26Å; H528-F532 AromaticContact CD2-CE1 3.52Å; H528-F532 AromaticContact CD2-CG 3.66Å; H528-F532 AromaticContact CG-CD1 3.83Å; H528-F532 AromaticContact CG-CE1 3.74Å; H528-F532 AromaticContact NE2-CD1 3.51Å; H528-Y856 HydrophobicContact CB-CD1 4.12Å; H528-Y856 HydrophobicContact CB-CE1 3.71Å
529	P	92.5	Very high	90	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.8	16.1	4.2	38.4	-35	0	0	0	114.1	F532 Y584 Y856 W912 Y913	P529-F532 HydrophobicContact CB-CE2 4.03Å; P529-F532 HydrophobicContact CB-CZ 3.88Å; P529-F532 WeakPolarHBondContact O-CE2 3.02Å; P529-Y584 PolarHBondContact O-N 3.47Å; P529-Y856 HydrophobicContact CB-CD1 4.19Å; P529-Y856 HydrophobicContact CB-CD2 3.72Å; P529-Y856 HydrophobicContact CB-CE1 4.15Å; P529-Y856 HydrophobicContact CB-CE2 3.68Å; P529-Y856 HydrophobicContact CB-CG 3.99Å; P529-Y856 HydrophobicContact CG-CD1 4.32Å; P529-Y856 HydrophobicContact CG-CD2 3.73Å; P529-Y856 HydrophobicContact CG-CE2 4.23Å; P529-Y856 HydrophobicContact CG-CG 3.79Å; P529-W912 HydrophobicContact CB-CB 4.47Å; P529-Y913 HydrophobicContact CG-CD2 4.07Å; P529-Y913 HydrophobicContact CG-CE1 4.08Å; P529-Y913 HydrophobicContact CG-CE2 3.5Å; P529-Y913 VanDerWaalsContact CG-CE2 3.5Å; P529-Y913 VanDerWaalsContact CG-CZ 3.5Å
530	F	94.5	Very high	89.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-40.3	-174	-69.8	-81.6	0	0	0	112.5	E527 G583 Y584 C585 F653 F654 A852 L853 Y878 Y913	E527-F530 WeakPolarHBondContact O-CA 3.08Å; E527-F530 PolarHBondContact O-N 3.45Å; F530-G583 CarbonylContact O-C 3.49Å; F530-G583 VanDerWaalsContact O-C 3.32Å; F530-G583 WeakPolarHBondContact O-CA 3.35Å; F530-Y584 AromaticContact CD1-CD1 3.99Å; F530-Y584 HydrophobicContact CD1-CD1 3.99Å; F530-Y584 HydrophobicContact CD1-CG 4.1Å; F530-Y584 HydrophobicContact CE1-CD1 4.05Å; F530-Y584 HydrophobicContact CE1-CG 4.18Å; F530-Y584 PolarHBondContact O-N 3.25Å; F530-Y584 VanDerWaalsContact O-N 3.15Å; F530-C585 HydrophobicContact CB-CB 4.5Å; F530-C585 WeakPolarHBondContact O-CB 3.32Å; F530-C585 PolarHBondContact O-N 3.29Å; F530-F653 HydrophobicContact CE1-CE2 4.38Å; F530-F654 HydrophobicContact CE1-CD2 4.01Å; F530-F654 HydrophobicContact CE1-CE2 4.33Å; F530-F654 HydrophobicContact CE1-CG 4.17Å; F530-F654 HydrophobicContact CZ-CD1 4.15Å; F530-F654 HydrophobicContact CZ-CD2 4.13Å; F530-F654 HydrophobicContact CZ-CE1 4.18Å; F530-F654 HydrophobicContact CZ-CE2 4.14Å; F530-F654 HydrophobicContact CZ-CG 4.14Å; F530-F654 HydrophobicContact CZ-CZ 4.17Å; F530-A852 HydrophobicContact CE2-CB 4.31Å; F530-A852 HydrophobicContact CZ-CB 4.42Å; F530-L853 HydrophobicContact CD2-CD1 4.25Å; F530-L853 HydrophobicContact CE2-CD1 3.99Å; F530-Y878 HydrophobicContact CD2-CE2 4.45Å; F530-Y878 AromaticContact CE1-CD2 3.98Å; F530-Y878 HydrophobicContact CE1-CD2 3.98Å; F530-Y878 HydrophobicContact CE1-CE2 4.09Å; F530-Y878 HydrophobicContact CE2-CD2 4.37Å; F530-Y878 AromaticContact CE2-CE2 3.67Å; F530-Y878 HydrophobicContact CE2-CE2 3.67Å; F530-Y878 AromaticContact CZ-CD2 3.82Å; F530-Y878 HydrophobicContact CZ-CD2 3.82Å; F530-Y878 AromaticContact CZ-CE2 3.46Å; F530-Y878 HydrophobicContact CZ-CE2 3.46Å; F530-Y878 VanDerWaalsContact CZ-CE2 3.46Å; F530-Y913 WeakPolarHBondContact CE2-OH 3.45Å; F530-Y913 HydrophobicContact CZ-CE2 4.4Å; F530-Y913 WeakPolarHBondContact CZ-OH 3.27Å
531	V	95.2	Very high	89.1	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.238	C	C	.	.			trans	-144.7	118.9	177.6	-174.9	0	0	0	0	109.3	T524 L525 E527 H528 C585 I586	T524-V531 HydrophobicContact CG2-CG1 4.28Å; T524-V531 WeakPolarHBondContact OG1-CG2 3.12Å; L525-V531 WeakPolarHBondContact O-CB 3.3Å; E527-V531 CarbonylContact C-O 3.44Å; E527-V531 PolarHBondContact N-O 3.24Å; E527-V531 VanDerWaalsContact N-O 3.16Å; E527-V531 PolarHBondContact O-N 3.23Å; H528-V531 PolarHBondContact CD2-O 3.05Å; V531-C585 HydrophobicContact CG2-CB 3.95Å; V531-I586 HydrophobicContact CG1-CD1 4.39Å; V531-I586 HydrophobicContact CG2-CD1 4.31Å
532	F	92.9	Very high	88.8	Confident	26 Å²	26	42.2 Å²	42.2	11%	0.114	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	157	169.3	-59	-96.8	0	0	0	109.5	H528 P529 C581 Y582 W912	H528-F532 HydrophobicContact CB-CD1 4.44Å; H528-F532 HydrophobicContact CB-CE1 3.94Å; H528-F532 HydrophobicContact CB-CZ 4.26Å; H528-F532 AromaticContact CD2-CD1 3.12Å; H528-F532 WeakPolarHBondContact CD2-CD1 3.26Å; H528-F532 AromaticContact CD2-CE1 3.52Å; H528-F532 AromaticContact CD2-CG 3.66Å; H528-F532 AromaticContact CG-CD1 3.83Å; H528-F532 AromaticContact CG-CE1 3.74Å; H528-F532 AromaticContact NE2-CD1 3.51Å; P529-F532 HydrophobicContact CB-CE2 4.03Å; P529-F532 HydrophobicContact CB-CZ 3.88Å; P529-F532 WeakPolarHBondContact O-CE2 3.02Å; F532-C581 WeakPolarHBondContact O-CA 3.47Å; F532-Y582 HydrophobicContact CB-CD1 4.3Å; F532-Y582 HydrophobicContact CB-CD2 3.81Å; F532-Y582 HydrophobicContact CB-CE1 3.9Å; F532-Y582 HydrophobicContact CB-CE2 3.38Å; F532-Y582 HydrophobicContact CB-CG 4.27Å; F532-Y582 VanDerWaalsContact CB-CZ 3.43Å; F532-Y582 HydrophobicContact CD1-CE2 4.35Å; F532-Y582 AromaticContact CD2-CD2 3.92Å; F532-Y582 HydrophobicContact CD2-CD2 3.92Å; F532-Y582 AromaticContact CD2-CE2 3.76Å; F532-Y582 HydrophobicContact CD2-CE2 3.76Å; F532-Y582 HydrophobicContact CG-CD2 4.12Å; F532-Y582 AromaticContact CG-CE2 3.6Å; F532-Y582 HydrophobicContact CG-CE2 3.6Å; F532-Y582 PolarHBondContact N-O 3.18Å; F532-Y582 PolarHBondContact O-N 3.42Å; F532-Y582 VanDerWaalsContact O-N 3.12Å; F532-W912 HydrophobicContact CD2-CE3 4.46Å; F532-W912 HydrophobicContact CD2-CZ3 4.17Å; F532-W912 AromaticContact CE2-CE3 3.77Å; F532-W912 HydrophobicContact CE2-CE3 3.77Å; F532-W912 AromaticContact CE2-CZ3 3.87Å; F532-W912 HydrophobicContact CE2-CZ3 3.87Å
533	T	93.3	Very high	88	Confident	47 Å²	47	47.3 Å²	47.3	29%	0.288	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.8	173.3	51.4	0	0	0	0	111.7	V526 C580 I604	V526-T533 HydrophobicContact CB-CG2 4.42Å; V526-T533 HydrophobicContact CG1-CG2 3.97Å; V526-T533 HydrophobicContact CG2-CG2 3.52Å; T533-C580 WeakPolarHBondContact CA-O 3.3Å; T533-I604 HydrophobicContact CG2-CD1 3.75Å
534	R	91.9	Very high	87.2	Confident	85 Å²	85	50.4 Å²	50.4	32%	0.321	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	148.6	167.2	-172.2	-177.2	70.2	103	-2.8	109	D537 K579 C580 Y582	R534-D537 IonicContact CZ-OD1 2.61Å; R534-D537 IonicContact CZ-OD2 2.77Å; R534-D537 VanDerWaalsContact NH1-CG 3.3Å; R534-D537 IonicContact NH1-OD1 2.61Å; R534-D537 PolarHBondContact NH1-OD1 3.02Å; R534-D537 IonicContact NH1-OD2 2.68Å; R534-D537 PolarHBondContact NH1-OD2 3.41Å; R534-D537 IonicContact NH2-OD1 2.71Å; R534-D537 IonicContact NH2-OD2 3.52Å; R534-D537 PolarHBondContact NH2-OD2 2.98Å; R534-K579 CarbonylContact O-C 3.59Å; R534-K579 WeakPolarHBondContact O-CA 3.21Å; R534-C580 HydrophobicContact CB-CB 4.43Å; R534-C580 PolarHBondContact N-O 3.3Å; R534-C580 PolarHBondContact O-N 3.23Å; R534-Y582 HydrophobicContact CB-CE1 4.09Å
535	E	91.2	Very high	86.6	Confident	105 Å²	105	51.8 Å²	51.8	49%	0.491	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	153	168.6	-52.8	-51.3	142.4	0	0	110.8	K579	E535-K579 IonicContact OE1-NZ 2.71Å; E535-K579 PolarHBondContact OE1-NZ 2.83Å; E535-K579 IonicContact OE2-NZ 3.92Å; E535-K579 PolarHBondContact OE2-NZ 3.38Å
536	V	88.1	Confident	86.4	Confident	26 Å²	26	54.5 Å²	54.5	16%	0.158	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-66.6	151.8	175.7	-73.9	0	0	0	0	112.4	L547 T575 K578	V536-L547 HydrophobicContact CG1-CD1 4.1Å; V536-T575 HydrophobicContact CG2-CG2 4.49Å; V536-K578 HydrophobicContact CG1-CB 3.83Å; V536-K578 HydrophobicContact CG2-CB 4.19Å
537	D	83.3	Confident	86.2	Confident	60 Å²	60	54.5 Å²	54.5	32%	0.321	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-71.1	169.7	171.1	-63.4	-59.1	0	0	0	111.2	R534 D539 G540 M541 P543	R534-D537 IonicContact CZ-OD1 2.61Å; R534-D537 IonicContact CZ-OD2 2.77Å; R534-D537 VanDerWaalsContact NH1-CG 3.3Å; R534-D537 IonicContact NH1-OD1 2.61Å; R534-D537 PolarHBondContact NH1-OD1 3.02Å; R534-D537 IonicContact NH1-OD2 2.68Å; R534-D537 PolarHBondContact NH1-OD2 3.41Å; R534-D537 IonicContact NH2-OD1 2.71Å; R534-D537 IonicContact NH2-OD2 3.52Å; R534-D537 PolarHBondContact NH2-OD2 2.98Å; D537-D539 PolarHBondContact O-N 3.37Å; D537-G540 WeakPolarHBondContact O-CA 3.42Å; D537-G540 PolarHBondContact O-N 3.21Å; D537-M541 PolarHBondContact N-O 3.13Å; D537-P543 WeakPolarHBondContact OD2-CD 3.43Å; D537-P543 VanDerWaalsContact OD2-CG 3.29Å; D537-P543 WeakPolarHBondContact OD2-CG 3.38Å
538	G	76.1	Confident	86.2	Confident	86 Å²	86	54 Å²	54	89%	0.887	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-27.9	-171.8	0	0	0	0	0	115.5	G540	G538-G540 VanDerWaalsContact C-N 3.25Å; G538-G540 PolarHBondContact O-N 3.44Å
539	D	72.7	Confident	86.2	Confident	152 Å²	152	50.5 Å²	50.5	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	1.9	176.4	-53.9	-59.6	0	0	0	113.5	D537 M541	D537-D539 PolarHBondContact O-N 3.37Å; D539-M541 VanDerWaalsContact C-N 3.29Å; D539-M541 PolarHBondContact O-N 2.8Å
540	G	73.1	Confident	86.2	Confident	11 Å²	11	52 Å²	52	11%	0.113	31%	0.312	C	S	.	.	S	Bend	trans	73.3	17	-178.5	0	0	0	0	0	114.8	D537 G538	D537-G540 WeakPolarHBondContact O-CA 3.42Å; D537-G540 PolarHBondContact O-N 3.21Å; G538-G540 VanDerWaalsContact C-N 3.25Å; G538-G540 PolarHBondContact O-N 3.44Å
541	M	79.4	Confident	85.7	Confident	119 Å²	119	52.4 Å²	52.4	59%	0.586	32%	0.315	S	S	*	.			trans	-111.7	162.4	-173.8	-70.8	-70.2	-73.3	0	0	112.3	D537 D539	D537-M541 PolarHBondContact N-O 3.13Å; D539-M541 VanDerWaalsContact C-N 3.29Å; D539-M541 PolarHBondContact O-N 2.8Å
542	C	83.9	Confident	85.3	Confident	27 Å²	27	58.5 Å²	58.5	18%	0.182	35%	0.346	C	S	.	.			trans	-115.8	100.9	174	-62.9	0	0	0	0	110.4	A544 G545 C580	C542-A544 VanDerWaalsContact C-N 3.26Å; C542-G545 VanDerWaalsContact CB-O 3.31Å; C542-G545 WeakPolarHBondContact CB-O 3.22Å; C542-C580 VanDerWaalsContact CA-SG 3.51Å; C542-C580 HydrophobicContact CB-CB 3.83Å; C542-C580 WeakPolarHBondContact CB-SG 3.21Å; C542-C580 WeakPolarHBondContact SG-CA 3.36Å; C542-C580 WeakPolarHBondContact SG-CB 3.49Å; C542-C580 CovalentContact SG-SG 2.04Å; C542-C580 PolarHBondContact SG-SG 2.91Å
543	P	79.1	Confident	84.8	Confident	107 Å²	107	59.1 Å²	59.1	70%	0.695	35%	0.353	S	S	*	.	S	Bend	trans	-76.7	-12.6	173.5	31.3	-35.8	0	0	0	113.2	D537	D537-P543 WeakPolarHBondContact OD2-CD 3.43Å; D537-P543 VanDerWaalsContact OD2-CG 3.29Å; D537-P543 WeakPolarHBondContact OD2-CG 3.38Å
544	A	78.6	Confident	84.2	Confident	65 Å²	65	60.4 Å²	60.4	54%	0.537	36%	0.358	S	S	.	.	S	Bend	trans	-145.8	132.6	172.4	0	0	0	0	0	109.3	C542	C542-A544 VanDerWaalsContact C-N 3.26Å
545	G	83.9	Confident	83.7	Confident	30 Å²	30	61.8 Å²	61.8	31%	0.309	37%	0.368	S	S	.	.	S	Bend	trans	77.9	162.3	-167.4	0	0	0	0	0	112.9	C542 C581	C542-G545 VanDerWaalsContact CB-O 3.31Å; C542-G545 WeakPolarHBondContact CB-O 3.22Å; G545-C581 CarbonylContact C-O 3.54Å; G545-C581 WeakPolarHBondContact CA-O 3.31Å
546	Q	89.1	Confident	83.3	Confident	66 Å²	66	58.9 Å²	58.9	31%	0.308	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	143.9	-178	176.7	60.5	-18.4	0	0	111.1	C548 C581 I586 F600 L602	Q546-C548 PolarHBondContact O-N 2.75Å; Q546-C581 PolarHBondContact N-O 3.01Å; Q546-C581 PolarHBondContact O-N 2.71Å; Q546-I586 HydrophobicContact CB-CG2 4.18Å; Q546-F600 HydrophobicContact CG-CE2 3.85Å; Q546-F600 HydrophobicContact CG-CZ 4.2Å; Q546-L602 HydrophobicContact CG-CD2 4.38Å
547	L	89.4	Confident	83	Confident	46 Å²	46	61.4 Å²	61.4	24%	0.241	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	126.2	173.6	-179.5	67	0	0	0	110	V536 L566 K578	V536-L547 HydrophobicContact CG1-CD1 4.1Å; L547-L566 HydrophobicContact CD2-CD1 4.33Å; L547-K578 HydrophobicContact CD1-CB 4.06Å; L547-K578 HydrophobicContact CD1-CG 4.32Å
548	C	91.3	Very high	83.1	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.2	175	59.4	0	0	0	0	111.3	Q546 K579 C581 L602	Q546-C548 PolarHBondContact O-N 2.75Å; C548-K579 PolarHBondContact N-O 3.45Å; C548-K579 PolarHBondContact O-N 3Å; C548-K579 VanDerWaalsContact O-O 3.08Å; C548-K579 PolarHBondContact SG-O 3.48Å; C548-K579 VanDerWaalsContact SG-O 3.34Å; C548-C581 HydrophobicContact CB-CB 3.77Å; C548-C581 WeakPolarHBondContact CB-SG 3.25Å; C548-C581 WeakPolarHBondContact SG-CB 3.41Å; C548-C581 PolarHBondContact SG-N 3.06Å; C548-C581 VanDerWaalsContact SG-N 3.36Å; C548-C581 CovalentContact SG-SG 2.04Å; C548-C581 PolarHBondContact SG-SG 2.74Å; C548-L602 VanDerWaalsContact CA-O 3.28Å; C548-L602 WeakPolarHBondContact CA-O 3.3Å; C548-L602 HydrophobicContact CB-CB 4.05Å; C548-L602 HydrophobicContact CB-CD2 3.86Å; C548-L602 HydrophobicContact CB-CG 3.74Å
549	L	91.3	Very high	83.5	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.2	173.7	-63.3	-174.5	0	0	0	111.4	P551 L562 F563 L566 V573 L577 K578 L602 Y603 I604	L549-P551 WeakPolarHBondContact O-CD 3.45Å; L549-L562 HydrophobicContact CD1-CB 4.17Å; L549-F563 HydrophobicContact CD1-CD1 3.95Å; L549-F563 HydrophobicContact CD1-CE1 3.77Å; L549-F563 HydrophobicContact CD1-CZ 4.45Å; L549-F563 HydrophobicContact CG-CE1 4.44Å; L549-L566 HydrophobicContact CD1-CD2 4.39Å; L549-L566 HydrophobicContact CD2-CD1 4.34Å; L549-V573 HydrophobicContact CD2-CG1 4.01Å; L549-L577 WeakPolarHBondContact CA-O 3.37Å; L549-L577 WeakPolarHBondContact CD2-O 3.48Å; L549-K578 HydrophobicContact CD2-CG 4.18Å; L549-L602 PolarHBondContact N-O 3.33Å; L549-Y603 CarbonylContact O-C 3.21Å; L549-Y603 VanDerWaalsContact O-CA 3.26Å; L549-Y603 WeakPolarHBondContact O-CA 3.35Å; L549-Y603 WeakPolarHBondContact O-CB 3.2Å; L549-I604 PolarHBondContact O-N 3.41Å
550	D	91.6	Very high	84	Confident	30 Å²	30	55.8 Å²	55.8	16%	0.16	32%	0.322	C	S	.	.			trans	-106.5	92.2	165.9	-169	-6.4	0	0	0	108.1	L552 L577 K579 I604	D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 VanDerWaalsContact OD1-CD2 3.3Å; D550-L552 WeakPolarHBondContact OD1-CD2 3.37Å; D550-L577 PolarHBondContact N-O 2.71Å; D550-L577 WeakPolarHBondContact O-CD2 3.22Å; D550-K579 HydrophobicContact CB-CD 4.13Å; D550-K579 HydrophobicContact CB-CG 4.45Å; D550-K579 WeakPolarHBondContact OD2-CE 3.2Å; D550-I604 HydrophobicContact CB-CD1 4.15Å
551	P	85.3	Confident	84.4	Confident	10 Å²	10	56.6 Å²	56.6	7%	0.065	33%	0.331	C	S	.	.			trans	-79.1	-17.4	-170	32.5	-36.7	0	0	0	113.4	L549 T553 L559 L562 Y603 I604	L549-P551 WeakPolarHBondContact O-CD 3.45Å; P551-T553 HydrophobicContact CB-CG2 4.35Å; P551-T553 WeakPolarHBondContact O-CG2 3.35Å; P551-T553 PolarHBondContact O-N 2.64Å; P551-L559 HydrophobicContact CB-CD1 3.98Å; P551-L559 HydrophobicContact CG-CD1 4.15Å; P551-L562 HydrophobicContact CB-CD1 4Å; P551-Y603 HydrophobicContact CG-CD2 4.2Å; P551-I604 WeakPolarHBondContact CD-O 3.45Å; P551-I604 WeakPolarHBondContact CG-O 3.47Å
552	L	85.8	Confident	84.6	Confident	127 Å²	127	51.7 Å²	51.7	67%	0.665	31%	0.307	S	S	*	.			trans	50.2	20	-174.5	-56.8	174.5	0	0	0	114.9	D550	D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 VanDerWaalsContact OD1-CD2 3.3Å; D550-L552 WeakPolarHBondContact OD1-CD2 3.37Å
553	T	83.3	Confident	84.5	Confident	40 Å²	40	51 Å²	51	25%	0.245	30%	0.301	C	S	.	.			trans	-147.6	151.4	-178.6	-171.9	0	0	0	0	112.1	P551 E555 V558	P551-T553 HydrophobicContact CB-CG2 4.35Å; P551-T553 WeakPolarHBondContact O-CG2 3.35Å; P551-T553 PolarHBondContact O-N 2.64Å; T553-E555 PolarHBondContact OG1-N 2.93Å; T553-V558 HydrophobicContact CG2-CB 4.08Å; T553-V558 HydrophobicContact CG2-CG1 3.98Å
554	N	78.9	Confident	84.6	Confident	74 Å²	74	53.5 Å²	53.5	40%	0.396	30%	0.303	S	S	.	.			trans	-101.7	9.1	176.8	-52.8	-55.2	0	0	0	112.2	T556 G606 D607	N554-T556 PolarHBondContact O-N 2.79Å; N554-G606 WeakPolarHBondContact OD1-CA 3.21Å; N554-D607 PolarHBondContact OD1-N 3.27Å
555	E	83.3	Confident	84.5	Confident	114 Å²	114	56 Å²	56	53%	0.533	30%	0.302	S	S	.	.			trans	-82.2	107	178.5	-70.4	-162.1	176.4	0	0	111.6	T553 S557 V558 L559	T553-E555 PolarHBondContact OG1-N 2.93Å; E555-S557 PolarHBondContact O-N 3.26Å; E555-S557 VanDerWaalsContact O-N 3.13Å; E555-V558 HydrophobicContact CB-CB 4.19Å; E555-V558 HydrophobicContact CB-CG2 3.85Å; E555-V558 PolarHBondContact O-N 2.76Å; E555-L559 PolarHBondContact O-N 2.57Å
556	T	82.1	Confident	84.1	Confident	44 Å²	44	56.5 Å²	56.5	27%	0.27	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-21	-177.4	69.6	0	0	0	0	113.6	N554 K560 A629	N554-T556 PolarHBondContact O-N 2.79Å; T556-K560 WeakPolarHBondContact O-CB 3.39Å; T556-K560 WeakPolarHBondContact O-CD 3.06Å; T556-K560 WeakPolarHBondContact O-CG 3.24Å; T556-K560 PolarHBondContact O-N 3.38Å; T556-K560 VanDerWaalsContact O-N 3.14Å; T556-A629 HydrophobicContact CG2-CB 3.81Å
557	S	82.6	Confident	83	Confident	78 Å²	78	57.6 Å²	57.6	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-66.2	-52.6	169.3	42.8	0	0	0	0	112	E555 K560 G561	E555-S557 PolarHBondContact O-N 3.26Å; E555-S557 VanDerWaalsContact O-N 3.13Å; S557-K560 PolarHBondContact O-N 3.44Å; S557-G561 PolarHBondContact O-N 3.45Å; S557-G561 VanDerWaalsContact O-N 3.07Å
558	V	84.6	Confident	81.7	Confident	64 Å²	64	57 Å²	57	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-44.8	178.8	-178.2	0	0	0	0	110.1	T553 E555 K560 G561 L562	T553-V558 HydrophobicContact CG2-CB 4.08Å; T553-V558 HydrophobicContact CG2-CG1 3.98Å; E555-V558 HydrophobicContact CB-CB 4.19Å; E555-V558 HydrophobicContact CB-CG2 3.85Å; E555-V558 PolarHBondContact O-N 2.76Å; V558-K560 PolarHBondContact O-N 2.9Å; V558-G561 CarbonylContact O-C 3.59Å; V558-G561 WeakPolarHBondContact O-CA 3.32Å; V558-G561 PolarHBondContact O-N 3.23Å; V558-L562 HydrophobicContact CG1-CD1 4.49Å; V558-L562 PolarHBondContact O-N 3.24Å
559	L	85.1	Confident	79.6	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-58.6	-45.8	177.7	-175.5	67.7	0	0	0	112.3	P551 E555 G561 L562 F563 Y603 A629	P551-L559 HydrophobicContact CB-CD1 3.98Å; P551-L559 HydrophobicContact CG-CD1 4.15Å; E555-L559 PolarHBondContact O-N 2.57Å; L559-G561 VanDerWaalsContact C-N 3.3Å; L559-G561 PolarHBondContact O-N 2.8Å; L559-L562 PolarHBondContact O-N 3.31Å; L559-F563 HydrophobicContact CD1-CD2 4.28Å; L559-F563 HydrophobicContact CD1-CE2 3.58Å; L559-F563 HydrophobicContact CD1-CZ 4.1Å; L559-F563 HydrophobicContact CD2-CE2 4.14Å; L559-F563 HydrophobicContact CG-CD2 4.06Å; L559-F563 HydrophobicContact CG-CE2 3.58Å; L559-F563 WeakPolarHBondContact O-CD2 3.49Å; L559-F563 PolarHBondContact O-N 3.38Å; L559-F563 VanDerWaalsContact O-N 3.1Å; L559-Y603 HydrophobicContact CD1-CD2 3.87Å; L559-Y603 HydrophobicContact CD1-CE2 4.13Å; L559-Y603 HydrophobicContact CD1-CG 4.21Å; L559-Y603 HydrophobicContact CD2-CD2 4.21Å; L559-Y603 HydrophobicContact CD2-CE1 4.3Å; L559-Y603 HydrophobicContact CD2-CE2 3.6Å; L559-A629 HydrophobicContact CD2-CB 4.09Å
560	K	82.8	Confident	77.9	Confident	111 Å²	111	72.5 Å²	72.5	48%	0.483	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-39.4	173.3	-76.4	169.2	-175.7	175	0	111.9	T556 S557 V558 L562 F563 Q564	T556-K560 WeakPolarHBondContact O-CB 3.39Å; T556-K560 WeakPolarHBondContact O-CD 3.06Å; T556-K560 WeakPolarHBondContact O-CG 3.24Å; T556-K560 PolarHBondContact O-N 3.38Å; T556-K560 VanDerWaalsContact O-N 3.14Å; S557-K560 PolarHBondContact O-N 3.44Å; V558-K560 PolarHBondContact O-N 2.9Å; K560-L562 VanDerWaalsContact C-N 3.34Å; K560-L562 PolarHBondContact O-N 3.43Å; K560-F563 PolarHBondContact O-N 3.32Å; K560-Q564 WeakPolarHBondContact O-CB 3.15Å; K560-Q564 PolarHBondContact O-N 3.34Å
561	G	81.2	Confident	76.2	Confident	28 Å²	28	72.3 Å²	72.3	29%	0.289	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-33.6	174.2	0	0	0	0	0	113.8	S557 V558 L559 K565	S557-G561 PolarHBondContact O-N 3.45Å; S557-G561 VanDerWaalsContact O-N 3.07Å; V558-G561 CarbonylContact O-C 3.59Å; V558-G561 WeakPolarHBondContact O-CA 3.32Å; V558-G561 PolarHBondContact O-N 3.23Å; L559-G561 VanDerWaalsContact C-N 3.3Å; L559-G561 PolarHBondContact O-N 2.8Å; G561-K565 WeakPolarHBondContact O-CB 3.5Å; G561-K565 VanDerWaalsContact O-CG 3.27Å; G561-K565 WeakPolarHBondContact O-CG 3.47Å; G561-K565 PolarHBondContact O-N 2.87Å; G561-K565 VanDerWaalsContact O-N 3.12Å
562	L	84.1	Confident	75.2	Confident	15 Å²	15	75.3 Å²	75.3	8%	0.079	43%	0.426	C	S	.	.	H	α-helix	trans	-68.9	-48.7	174.2	-70.5	171.6	0	0	0	111.4	L549 P551 V558 L559 K560 Q564 K565 L566 V573 L577	L549-L562 HydrophobicContact CD1-CB 4.17Å; P551-L562 HydrophobicContact CB-CD1 4Å; V558-L562 HydrophobicContact CG1-CD1 4.49Å; V558-L562 PolarHBondContact O-N 3.24Å; L559-L562 PolarHBondContact O-N 3.31Å; K560-L562 VanDerWaalsContact C-N 3.34Å; K560-L562 PolarHBondContact O-N 3.43Å; L562-Q564 VanDerWaalsContact C-N 3.33Å; L562-Q564 PolarHBondContact O-N 3.43Å; L562-K565 WeakPolarHBondContact O-CB 3.16Å; L562-K565 PolarHBondContact O-N 2.68Å; L562-K565 VanDerWaalsContact O-N 3.13Å; L562-L566 PolarHBondContact O-N 2.98Å; L562-V573 HydrophobicContact CD2-CG1 4.27Å; L562-V573 WeakPolarHBondContact O-CG2 3.07Å; L562-L577 HydrophobicContact CD1-CD1 4.46Å; L562-L577 HydrophobicContact CD2-CD1 3.91Å
563	F	81.8	Confident	74.8	Confident	14 Å²	14	69.6 Å²	69.6	6%	0.061	40%	0.396	C	S	.	.	H	α-helix	trans	-60.9	-40.4	175.8	-69.3	-58.8	0	0	0	112.5	R521 L549 L559 K560 K565 L566 A567 D601 Y603	R521-F563 VanDerWaalsContact CD-CD2 3.49Å; R521-F563 HydrophobicContact CG-CD2 4.27Å; R521-F563 HydrophobicContact CG-CE2 4.08Å; R521-F563 HydrophobicContact CG-CZ 4.4Å; L549-F563 HydrophobicContact CD1-CD1 3.95Å; L549-F563 HydrophobicContact CD1-CE1 3.77Å; L549-F563 HydrophobicContact CD1-CZ 4.45Å; L549-F563 HydrophobicContact CG-CE1 4.44Å; L559-F563 HydrophobicContact CD1-CD2 4.28Å; L559-F563 HydrophobicContact CD1-CE2 3.58Å; L559-F563 HydrophobicContact CD1-CZ 4.1Å; L559-F563 HydrophobicContact CD2-CE2 4.14Å; L559-F563 HydrophobicContact CG-CD2 4.06Å; L559-F563 HydrophobicContact CG-CE2 3.58Å; L559-F563 WeakPolarHBondContact O-CD2 3.49Å; L559-F563 PolarHBondContact O-N 3.38Å; L559-F563 VanDerWaalsContact O-N 3.1Å; K560-F563 PolarHBondContact O-N 3.32Å; F563-K565 VanDerWaalsContact C-N 3.29Å; F563-K565 PolarHBondContact O-N 3.25Å; F563-L566 HydrophobicContact CD1-CD2 4.49Å; F563-L566 WeakPolarHBondContact O-CB 3.41Å; F563-L566 PolarHBondContact O-N 3.37Å; F563-L566 VanDerWaalsContact O-N 3.13Å; F563-A567 PolarHBondContact O-N 3.06Å; F563-D601 HydrophobicContact CD1-CB 3.81Å; F563-D601 VanDerWaalsContact CD1-OD2 3.29Å; F563-D601 WeakPolarHBondContact CD1-OD2 3.47Å; F563-D601 HydrophobicContact CE1-CB 3.61Å; F563-D601 HydrophobicContact CZ-CB 4.43Å; F563-Y603 HydrophobicContact CE2-CD1 4.18Å; F563-Y603 AromaticContact CZ-CD1 3.64Å; F563-Y603 HydrophobicContact CZ-CD1 3.64Å; F563-Y603 HydrophobicContact CZ-CE1 4.37Å; F563-Y603 AromaticContact CZ-CG 3.94Å; F563-Y603 HydrophobicContact CZ-CG 3.94Å
564	Q	79.8	Confident	74.7	Confident	158 Å²	158	71 Å²	71	74%	0.738	41%	0.405	S	S	*	.	H	α-helix	trans	-67.6	-27.9	176.6	-164.8	168.8	12.5	0	0	113.1	K560 L562	K560-Q564 WeakPolarHBondContact O-CB 3.15Å; K560-Q564 PolarHBondContact O-N 3.34Å; L562-Q564 VanDerWaalsContact C-N 3.33Å; L562-Q564 PolarHBondContact O-N 3.43Å
565	K	77.6	Confident	74.8	Confident	118 Å²	118	71.4 Å²	71.4	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-77.1	-27.6	170.5	-77.7	174.7	-179.3	-178.7	0	113.6	G561 L562 F563 S572 V573	G561-K565 WeakPolarHBondContact O-CB 3.5Å; G561-K565 VanDerWaalsContact O-CG 3.27Å; G561-K565 WeakPolarHBondContact O-CG 3.47Å; G561-K565 PolarHBondContact O-N 2.87Å; G561-K565 VanDerWaalsContact O-N 3.12Å; L562-K565 WeakPolarHBondContact O-CB 3.16Å; L562-K565 PolarHBondContact O-N 2.68Å; L562-K565 VanDerWaalsContact O-N 3.13Å; F563-K565 VanDerWaalsContact C-N 3.29Å; F563-K565 PolarHBondContact O-N 3.25Å; K565-S572 WeakPolarHBondContact CB-OG 3.19Å; K565-S572 PolarHBondContact O-N 2.85Å; K565-S572 PolarHBondContact O-OG 2.98Å; K565-V573 HydrophobicContact CB-CG2 3.91Å
566	L	74.4	Confident	74.7	Confident	40 Å²	40	73.6 Å²	73.6	21%	0.209	42%	0.421	C	S	.	.	H	α-helix	trans	-71.2	-44.9	175.7	-167.1	73	0	0	0	110.9	L547 L549 L562 F563 G568 V573	L547-L566 HydrophobicContact CD2-CD1 4.33Å; L549-L566 HydrophobicContact CD1-CD2 4.39Å; L549-L566 HydrophobicContact CD2-CD1 4.34Å; L562-L566 PolarHBondContact O-N 2.98Å; F563-L566 HydrophobicContact CD1-CD2 4.49Å; F563-L566 WeakPolarHBondContact O-CB 3.41Å; F563-L566 PolarHBondContact O-N 3.37Å; F563-L566 VanDerWaalsContact O-N 3.13Å; L566-G568 PolarHBondContact O-N 3.3Å; L566-V573 HydrophobicContact CB-CG2 4.07Å; L566-V573 HydrophobicContact CD1-CB 4.43Å; L566-V573 HydrophobicContact CD1-CG2 4.14Å
567	A	65.9	Low	74.9	Confident	89 Å²	89	73.1 Å²	73.1	74%	0.736	42%	0.417	S	S	*	.	S	Bend	trans	-73.2	-5.2	177.4	0	0	0	0	0	114.6	F563	F563-A567 PolarHBondContact O-N 3.06Å
568	G	63.3	Low	75.2	Confident	33 Å²	33	70.6 Å²	70.6	34%	0.34	40%	0.396	S	S	.	.	S	Bend	trans	-76.7	149.7	175.7	0	0	0	0	0	112.5	L566 N570 G571	L566-G568 PolarHBondContact O-N 3.3Å; G568-N570 PolarHBondContact O-N 3.44Å; G568-G571 PolarHBondContact O-N 3.37Å
569	H	45.8	Very low	75.5	Confident	178 Å²	178	68.9 Å²	68.9	82%	0.824	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-25.8	-172.8	-118.6	55.9	0	0	0	116.2
570	N	55.6	Low	75.9	Confident	151 Å²	151	68.6 Å²	68.6	81%	0.807	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	14.1	-178	-63	5.9	0	0	0	113.7	G568 S572	G568-N570 PolarHBondContact O-N 3.44Å; N570-S572 VanDerWaalsContact C-N 3.26Å; N570-S572 PolarHBondContact O-N 3.31Å; N570-S572 VanDerWaalsContact O-N 3.09Å
571	G	57.7	Low	76.5	Confident	26 Å²	26	63.3 Å²	63.3	27%	0.268	36%	0.359	S	S	.	.			trans	56.1	33.2	170.3	0	0	0	0	0	115.8	G568 V573 K578	G568-G571 PolarHBondContact O-N 3.37Å; G571-V573 PolarHBondContact O-N 2.98Å; G571-K578 PolarHBondContact O-NZ 3.38Å
572	S	63.1	Low	77.1	Confident	74 Å²	74	65.8 Å²	65.8	52%	0.517	36%	0.36	S	S	.	.			trans	-66.6	17.2	-156.8	63.2	0	0	0	0	118.5	K565 N570	K565-S572 WeakPolarHBondContact CB-OG 3.19Å; K565-S572 PolarHBondContact O-N 2.85Å; K565-S572 PolarHBondContact O-OG 2.98Å; N570-S572 VanDerWaalsContact C-N 3.26Å; N570-S572 PolarHBondContact O-N 3.31Å; N570-S572 VanDerWaalsContact O-N 3.09Å
573	V	77.6	Confident	77.6	Confident	7 Å²	7	65 Å²	65	4%	0.042	36%	0.356	C	S	.	.	S	Bend	trans	-79	133.2	172.5	177.9	0	0	0	0	109.6	L549 L562 K565 L566 G571 L577 K578	L549-V573 HydrophobicContact CD2-CG1 4.01Å; L562-V573 HydrophobicContact CD2-CG1 4.27Å; L562-V573 WeakPolarHBondContact O-CG2 3.07Å; K565-V573 HydrophobicContact CB-CG2 3.91Å; L566-V573 HydrophobicContact CB-CG2 4.07Å; L566-V573 HydrophobicContact CD1-CB 4.43Å; L566-V573 HydrophobicContact CD1-CG2 4.14Å; G571-V573 PolarHBondContact O-N 2.98Å; V573-L577 HydrophobicContact CG1-CB 4.07Å; V573-L577 HydrophobicContact CG1-CD1 4.48Å; V573-K578 HydrophobicContact CG1-CG 4.36Å; V573-K578 WeakPolarHBondContact O-CE 3.45Å; V573-K578 PolarHBondContact O-NZ 2.87Å
574	P	81.3	Confident	78.2	Confident	68 Å²	68	64.5 Å²	64.5	44%	0.442	35%	0.354	S	S	.	.			trans	-52.1	144.5	175.2	-27.6	34.8	0	0	0	113.1	E576 L577	P574-E576 PolarHBondContact O-N 2.85Å; P574-L577 HydrophobicContact CB-CG 4.44Å; P574-L577 HydrophobicContact CG-CD1 4.38Å; P574-L577 PolarHBondContact O-N 2.76Å; P574-L577 VanDerWaalsContact O-N 3.17Å
575	T	80.4	Confident	79	Confident	83 Å²	83	57 Å²	57	51%	0.509	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-61.7	-32.2	176.9	40.7	0	0	0	0	112.6	V536 L577 K578	V536-T575 HydrophobicContact CG2-CG2 4.49Å; T575-L577 PolarHBondContact O-N 3.17Å; T575-K578 PolarHBondContact O-N 2.76Å
576	E	82	Confident	79.9	Confident	160 Å²	160	51.4 Å²	51.4	75%	0.748	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.2	-26.1	175.4	-62.1	172.8	177.9	0	0	113.8	P574	P574-E576 PolarHBondContact O-N 2.85Å
577	L	86.9	Confident	80.8	Confident	35 Å²	35	50.8 Å²	50.8	18%	0.183	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-99.2	4.4	178.9	-52.8	179.6	0	0	0	112.7	L549 D550 L562 V573 P574 T575	L549-L577 WeakPolarHBondContact CA-O 3.37Å; L549-L577 WeakPolarHBondContact CD2-O 3.48Å; D550-L577 PolarHBondContact N-O 2.71Å; D550-L577 WeakPolarHBondContact O-CD2 3.22Å; L562-L577 HydrophobicContact CD1-CD1 4.46Å; L562-L577 HydrophobicContact CD2-CD1 3.91Å; V573-L577 HydrophobicContact CG1-CB 4.07Å; V573-L577 HydrophobicContact CG1-CD1 4.48Å; P574-L577 HydrophobicContact CB-CG 4.44Å; P574-L577 HydrophobicContact CG-CD1 4.38Å; P574-L577 PolarHBondContact O-N 2.76Å; P574-L577 VanDerWaalsContact O-N 3.17Å; T575-L577 PolarHBondContact O-N 3.17Å
578	K	88.4	Confident	82.3	Confident	25 Å²	25	46.5 Å²	46.5	11%	0.109	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.1	-180	-69.8	175.3	178.7	164.5	0	109.9	V536 L547 L549 G571 V573 T575	V536-K578 HydrophobicContact CG1-CB 3.83Å; V536-K578 HydrophobicContact CG2-CB 4.19Å; L547-K578 HydrophobicContact CD1-CB 4.06Å; L547-K578 HydrophobicContact CD1-CG 4.32Å; L549-K578 HydrophobicContact CD2-CG 4.18Å; G571-K578 PolarHBondContact O-NZ 3.38Å; V573-K578 HydrophobicContact CG1-CG 4.36Å; V573-K578 WeakPolarHBondContact O-CE 3.45Å; V573-K578 PolarHBondContact O-NZ 2.87Å; T575-K578 PolarHBondContact O-N 2.76Å
579	K	91.5	Very high	83.8	Confident	27 Å²	27	45 Å²	45	12%	0.117	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	162.7	174.5	-61.5	-172.3	-170.7	-75.2	0	110.4	R534 E535 C548 D550 I604	R534-K579 CarbonylContact O-C 3.59Å; R534-K579 WeakPolarHBondContact O-CA 3.21Å; E535-K579 IonicContact OE1-NZ 2.71Å; E535-K579 PolarHBondContact OE1-NZ 2.83Å; E535-K579 IonicContact OE2-NZ 3.92Å; E535-K579 PolarHBondContact OE2-NZ 3.38Å; C548-K579 PolarHBondContact N-O 3.45Å; C548-K579 PolarHBondContact O-N 3Å; C548-K579 VanDerWaalsContact O-O 3.08Å; C548-K579 PolarHBondContact SG-O 3.48Å; C548-K579 VanDerWaalsContact SG-O 3.34Å; D550-K579 HydrophobicContact CB-CD 4.13Å; D550-K579 HydrophobicContact CB-CG 4.45Å; D550-K579 WeakPolarHBondContact OD2-CE 3.2Å; K579-I604 HydrophobicContact CD-CD1 4.46Å
580	C	92.7	Very high	86	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	112.4	172.1	-55	0	0	0	0	108.9	T533 R534 C542	T533-C580 WeakPolarHBondContact CA-O 3.3Å; R534-C580 HydrophobicContact CB-CB 4.43Å; R534-C580 PolarHBondContact N-O 3.3Å; R534-C580 PolarHBondContact O-N 3.23Å; C542-C580 VanDerWaalsContact CA-SG 3.51Å; C542-C580 HydrophobicContact CB-CB 3.83Å; C542-C580 WeakPolarHBondContact CB-SG 3.21Å; C542-C580 WeakPolarHBondContact SG-CA 3.36Å; C542-C580 WeakPolarHBondContact SG-CB 3.49Å; C542-C580 CovalentContact SG-SG 2.04Å; C542-C580 PolarHBondContact SG-SG 2.91Å
581	C	94.6	Very high	87.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136.1	177.8	-73.1	0	0	0	0	110.5	F532 G545 Q546 C548 I586 L602	F532-C581 WeakPolarHBondContact O-CA 3.47Å; G545-C581 CarbonylContact C-O 3.54Å; G545-C581 WeakPolarHBondContact CA-O 3.31Å; Q546-C581 PolarHBondContact N-O 3.01Å; Q546-C581 PolarHBondContact O-N 2.71Å; C548-C581 HydrophobicContact CB-CB 3.77Å; C548-C581 WeakPolarHBondContact CB-SG 3.25Å; C548-C581 WeakPolarHBondContact SG-CB 3.41Å; C548-C581 PolarHBondContact SG-N 3.06Å; C548-C581 VanDerWaalsContact SG-N 3.36Å; C548-C581 CovalentContact SG-SG 2.04Å; C548-C581 PolarHBondContact SG-SG 2.74Å; C581-I586 HydrophobicContact CB-CD1 4.38Å; C581-I586 HydrophobicContact CB-CG1 4.42Å; C581-L602 HydrophobicContact CB-CD2 3.75Å
582	Y	94.7	Very high	89.4	Confident	80 Å²	80	34.2 Å²	34.2	31%	0.314	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	162.1	175.9	60	-88.2	0	0	0	110.7	F532 R534 W912	F532-Y582 HydrophobicContact CB-CD1 4.3Å; F532-Y582 HydrophobicContact CB-CD2 3.81Å; F532-Y582 HydrophobicContact CB-CE1 3.9Å; F532-Y582 HydrophobicContact CB-CE2 3.38Å; F532-Y582 HydrophobicContact CB-CG 4.27Å; F532-Y582 VanDerWaalsContact CB-CZ 3.43Å; F532-Y582 HydrophobicContact CD1-CE2 4.35Å; F532-Y582 AromaticContact CD2-CD2 3.92Å; F532-Y582 HydrophobicContact CD2-CD2 3.92Å; F532-Y582 AromaticContact CD2-CE2 3.76Å; F532-Y582 HydrophobicContact CD2-CE2 3.76Å; F532-Y582 HydrophobicContact CG-CD2 4.12Å; F532-Y582 AromaticContact CG-CE2 3.6Å; F532-Y582 HydrophobicContact CG-CE2 3.6Å; F532-Y582 PolarHBondContact N-O 3.18Å; F532-Y582 PolarHBondContact O-N 3.42Å; F532-Y582 VanDerWaalsContact O-N 3.12Å; R534-Y582 HydrophobicContact CB-CE1 4.09Å; Y582-W912 AromaticContact CD2-CH2 3.77Å; Y582-W912 HydrophobicContact CD2-CH2 3.77Å; Y582-W912 AromaticContact CD2-CZ3 3.99Å; Y582-W912 HydrophobicContact CD2-CZ3 3.99Å; Y582-W912 HydrophobicContact CE2-CZ3 4.38Å
583	G	94.3	Very high	90.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	140.9	-178.6	179.4	0	0	0	0	0	112.9	F530 C585 I586 D587 W912	F530-G583 CarbonylContact O-C 3.49Å; F530-G583 VanDerWaalsContact O-C 3.32Å; F530-G583 WeakPolarHBondContact O-CA 3.35Å; G583-C585 VanDerWaalsContact C-N 3.25Å; G583-C585 PolarHBondContact O-N 3.35Å; G583-I586 PolarHBondContact O-N 3.35Å; G583-D587 PolarHBondContact O-N 3.09Å; G583-W912 VanDerWaalsContact C-CE2 3.47Å; G583-W912 VanDerWaalsContact CA-CZ2 3.45Å
584	Y	95.1	Very high	91.2	Very high	3 Å²	3	37.2 Å²	37.2	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-51.2	-43.4	-178.5	-171.8	-71.9	0	0	0	112.8	P529 F530 I586 L588 F653 F654 M905 L908 H909 W912	P529-Y584 PolarHBondContact O-N 3.47Å; F530-Y584 AromaticContact CD1-CD1 3.99Å; F530-Y584 HydrophobicContact CD1-CD1 3.99Å; F530-Y584 HydrophobicContact CD1-CG 4.1Å; F530-Y584 HydrophobicContact CE1-CD1 4.05Å; F530-Y584 HydrophobicContact CE1-CG 4.18Å; F530-Y584 PolarHBondContact O-N 3.25Å; F530-Y584 VanDerWaalsContact O-N 3.15Å; Y584-I586 VanDerWaalsContact C-N 3.35Å; Y584-L588 WeakPolarHBondContact O-CB 3.4Å; Y584-L588 PolarHBondContact O-N 3.28Å; Y584-F653 HydrophobicContact CD1-CE2 4.19Å; Y584-F653 AromaticContact CE1-CD2 3.78Å; Y584-F653 HydrophobicContact CE1-CD2 3.78Å; Y584-F653 AromaticContact CE1-CE2 3.89Å; Y584-F653 HydrophobicContact CE1-CE2 3.89Å; Y584-F654 HydrophobicContact CE1-CD2 4.42Å; Y584-F654 HydrophobicContact CE2-CD2 4.31Å; Y584-F654 HydrophobicContact CE2-CE2 4.36Å; Y584-F654 AromaticContact CZ-CD2 3.99Å; Y584-M905 PolarHBondContact OH-O 3.06Å; Y584-L908 HydrophobicContact CD1-CD1 4.48Å; Y584-L908 HydrophobicContact CD2-CB 3.75Å; Y584-L908 HydrophobicContact CE1-CD1 4.23Å; Y584-L908 HydrophobicContact CE2-CB 3.43Å; Y584-L908 VanDerWaalsContact CE2-CB 3.43Å; Y584-L908 HydrophobicContact CG-CB 4.42Å; Y584-H909 HydrophobicContact CE2-CB 4.22Å; Y584-W912 VanDerWaalsContact CA-CD1 3.49Å; Y584-W912 AromaticContact CD2-CD1 3.99Å
585	C	96.1	Very high	91.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-76.4	-21.5	-178.8	-79.3	0	0	0	0	113.5	F530 V531 G583 L589 V634 T635	F530-C585 HydrophobicContact CB-CB 4.5Å; F530-C585 WeakPolarHBondContact O-CB 3.32Å; F530-C585 PolarHBondContact O-N 3.29Å; V531-C585 HydrophobicContact CG2-CB 3.95Å; G583-C585 VanDerWaalsContact C-N 3.25Å; G583-C585 PolarHBondContact O-N 3.35Å; C585-L589 WeakPolarHBondContact O-CB 3.48Å; C585-L589 PolarHBondContact O-N 3.42Å; C585-V634 HydrophobicContact CB-CG1 4.08Å; C585-V634 WeakPolarHBondContact O-CG1 3.3Å; C585-T635 VanDerWaalsContact SG-C 3.52Å; C585-T635 VanDerWaalsContact SG-CA 3.59Å
586	I	95.6	Very high	91.6	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-83.1	-45.6	178	-51.2	-51.6	0	0	0	110.1	V531 Q546 C581 G583 Y584 L588 L589 E590 L602	V531-I586 HydrophobicContact CG1-CD1 4.39Å; V531-I586 HydrophobicContact CG2-CD1 4.31Å; Q546-I586 HydrophobicContact CB-CG2 4.18Å; C581-I586 HydrophobicContact CB-CD1 4.38Å; C581-I586 HydrophobicContact CB-CG1 4.42Å; G583-I586 PolarHBondContact O-N 3.35Å; Y584-I586 VanDerWaalsContact C-N 3.35Å; I586-L588 PolarHBondContact O-N 3.3Å; I586-L589 PolarHBondContact O-N 3.23Å; I586-L589 VanDerWaalsContact O-N 3.08Å; I586-E590 WeakPolarHBondContact O-CG 3.41Å; I586-E590 PolarHBondContact O-N 3.01Å; I586-L602 HydrophobicContact CD1-CD2 3.81Å
587	D	95.1	Very high	91.5	Very high	26 Å²	26	30.6 Å²	30.6	14%	0.139	16%	0.157	C	C	.	.	H	α-helix	trans	-54.2	-42.4	171.5	-68.4	-8.9	0	0	0	111.6	G583 K591 L908 K911 W912	G583-D587 PolarHBondContact O-N 3.09Å; D587-K591 WeakPolarHBondContact O-CB 3.29Å; D587-K591 PolarHBondContact O-N 3.42Å; D587-L908 HydrophobicContact CB-CD1 4.37Å; D587-L908 HydrophobicContact CB-CD2 3.6Å; D587-L908 VanDerWaalsContact OD2-CD2 3.32Å; D587-L908 WeakPolarHBondContact OD2-CD2 3.16Å; D587-K911 IonicContact OD1-NZ 2.96Å; D587-K911 PolarHBondContact OD1-NZ 3Å; D587-K911 WeakPolarHBondContact OD2-CD 3.45Å; D587-K911 WeakPolarHBondContact OD2-CE 3.35Å; D587-K911 IonicContact OD2-NZ 2.96Å; D587-K911 PolarHBondContact OD2-NZ 3.46Å; D587-W912 PolarHBondContact OD2-NE1 3.24Å
588	L	95.8	Very high	91.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.4	-39.5	177.7	177.3	59.1	0	0	0	112.1	Y584 I586 K591 L592 F653 Y899 F904 M905 L908	Y584-L588 WeakPolarHBondContact O-CB 3.4Å; Y584-L588 PolarHBondContact O-N 3.28Å; I586-L588 PolarHBondContact O-N 3.3Å; L588-K591 PolarHBondContact O-N 3Å; L588-L592 HydrophobicContact CD1-CD1 4.22Å; L588-L592 HydrophobicContact CD1-CG 4.33Å; L588-L592 HydrophobicContact CG-CD1 4.17Å; L588-L592 WeakPolarHBondContact O-CB 3.45Å; L588-L592 VanDerWaalsContact O-CG 3.29Å; L588-L592 WeakPolarHBondContact O-CG 3.27Å; L588-L592 PolarHBondContact O-N 3.06Å; L588-F653 HydrophobicContact CD2-CB 4.07Å; L588-F653 HydrophobicContact CD2-CD1 4.24Å; L588-F653 HydrophobicContact CD2-CD2 3.87Å; L588-F653 HydrophobicContact CD2-CE2 4.35Å; L588-F653 HydrophobicContact CD2-CG 3.82Å; L588-Y899 HydrophobicContact CD1-CD2 3.76Å; L588-Y899 HydrophobicContact CD1-CE2 4.05Å; L588-F904 HydrophobicContact CD1-CE1 4.4Å; L588-M905 HydrophobicContact CD1-CE 3.57Å; L588-M905 HydrophobicContact CD1-SD 4.35Å; L588-M905 HydrophobicContact CD2-CE 4.12Å; L588-L908 HydrophobicContact CB-CD1 4.12Å
589	L	95.6	Very high	91.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.1	-42.5	176.9	173	60.7	0	0	0	111.8	V522 C585 I586 L592 A593 F598 F600 L602 L632 V634	V522-L589 HydrophobicContact CB-CD2 4.3Å; V522-L589 HydrophobicContact CG1-CD1 4.42Å; V522-L589 HydrophobicContact CG1-CD2 3.83Å; V522-L589 HydrophobicContact CG2-CD1 4.18Å; V522-L589 HydrophobicContact CG2-CD2 4.33Å; C585-L589 WeakPolarHBondContact O-CB 3.48Å; C585-L589 PolarHBondContact O-N 3.42Å; I586-L589 PolarHBondContact O-N 3.23Å; I586-L589 VanDerWaalsContact O-N 3.08Å; L589-L592 PolarHBondContact O-N 2.76Å; L589-A593 WeakPolarHBondContact O-CB 3.42Å; L589-A593 PolarHBondContact O-N 2.7Å; L589-F598 HydrophobicContact CD1-CE2 4.19Å; L589-F598 HydrophobicContact CD1-CZ 4Å; L589-F600 HydrophobicContact CD1-CD1 4.35Å; L589-F600 HydrophobicContact CD1-CE1 4.41Å; L589-F600 HydrophobicContact CD1-CG 4.47Å; L589-F600 HydrophobicContact CD2-CD2 3.75Å; L589-F600 HydrophobicContact CD2-CE1 4.42Å; L589-F600 HydrophobicContact CD2-CE2 3.41Å; L589-F600 VanDerWaalsContact CD2-CE2 3.41Å; L589-F600 HydrophobicContact CD2-CG 4.38Å; L589-F600 HydrophobicContact CD2-CZ 3.8Å; L589-F600 HydrophobicContact CG-CD1 4.31Å; L589-F600 HydrophobicContact CG-CD2 4.25Å; L589-F600 HydrophobicContact CG-CE1 3.94Å; L589-F600 HydrophobicContact CG-CE2 3.86Å; L589-F600 HydrophobicContact CG-CG 4.46Å; L589-F600 HydrophobicContact CG-CZ 3.7Å; L589-L602 HydrophobicContact CD2-CD1 4.23Å; L589-L632 HydrophobicContact CD1-CD2 4.05Å; L589-V634 HydrophobicContact CB-CG1 4.41Å; L589-V634 HydrophobicContact CD1-CG2 4.28Å
590	E	92.4	Very high	91.2	Very high	76 Å²	76	30.2 Å²	30.2	36%	0.355	16%	0.158	S	C	.	.	H	α-helix	trans	-58.4	-48.4	173.5	-73.1	172.7	-168.4	0	0	110.4	I586 L592 A593 E594 F600	I586-E590 WeakPolarHBondContact O-CG 3.41Å; I586-E590 PolarHBondContact O-N 3.01Å; E590-L592 PolarHBondContact O-N 3.2Å; E590-A593 WeakPolarHBondContact O-CB 3.34Å; E590-A593 PolarHBondContact O-N 3.44Å; E590-A593 VanDerWaalsContact O-N 3.11Å; E590-E594 PolarHBondContact O-N 2.86Å; E590-F600 HydrophobicContact CG-CZ 4.3Å
591	K	92.4	Very high	91.1	Very high	54 Å²	54	32 Å²	32	24%	0.235	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-39.5	179.5	-174.2	50.4	-178.8	153.3	0	113.4	D587 L588 A593 E594 D595 Y899 F904	D587-K591 WeakPolarHBondContact O-CB 3.29Å; D587-K591 PolarHBondContact O-N 3.42Å; L588-K591 PolarHBondContact O-N 3Å; K591-A593 VanDerWaalsContact C-N 3.34Å; K591-E594 IonicContact NZ-OE2 3.75Å; K591-E594 PolarHBondContact O-N 2.78Å; K591-D595 WeakPolarHBondContact CE-OD2 3.43Å; K591-D595 IonicContact NZ-OD1 3.99Å; K591-D595 PolarHBondContact NZ-OD1 2.93Å; K591-D595 IonicContact NZ-OD2 2.78Å; K591-D595 PolarHBondContact NZ-OD2 3.44Å; K591-D595 PolarHBondContact O-N 2.82Å; K591-D595 VanDerWaalsContact O-N 3.15Å; K591-Y899 HydrophobicContact CG-CE1 4.3Å; K591-Y899 HydrophobicContact CG-CE2 3.99Å; K591-Y899 PolarHBondContact O-OH 3.01Å; K591-F904 HydrophobicContact CB-CE1 4.05Å; K591-F904 HydrophobicContact CB-CZ 3.75Å; K591-F904 HydrophobicContact CG-CE1 3.95Å; K591-F904 HydrophobicContact CG-CE2 4.21Å; K591-F904 HydrophobicContact CG-CZ 3.72Å
592	L	92.9	Very high	91.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-35	173	-72.8	168.9	0	0	0	112.6	L588 L589 E590 I596 F598 I880 F892 L895 V896 Y899	L588-L592 HydrophobicContact CD1-CD1 4.22Å; L588-L592 HydrophobicContact CD1-CG 4.33Å; L588-L592 HydrophobicContact CG-CD1 4.17Å; L588-L592 WeakPolarHBondContact O-CB 3.45Å; L588-L592 VanDerWaalsContact O-CG 3.29Å; L588-L592 WeakPolarHBondContact O-CG 3.27Å; L588-L592 PolarHBondContact O-N 3.06Å; L589-L592 PolarHBondContact O-N 2.76Å; E590-L592 PolarHBondContact O-N 3.2Å; L592-I596 WeakPolarHBondContact O-CB 3.47Å; L592-I596 WeakPolarHBondContact O-CG1 3.37Å; L592-I596 PolarHBondContact O-N 2.73Å; L592-I596 VanDerWaalsContact O-N 3.14Å; L592-F598 HydrophobicContact CB-CE1 4.39Å; L592-F598 WeakPolarHBondContact O-CE1 3.32Å; L592-I880 HydrophobicContact CD1-CD1 3.41Å; L592-I880 VanDerWaalsContact CD1-CD1 3.41Å; L592-F892 HydrophobicContact CB-CE1 4.17Å; L592-F892 HydrophobicContact CD1-CD1 4.01Å; L592-F892 HydrophobicContact CD1-CE1 4.21Å; L592-F892 HydrophobicContact CD2-CD1 4.04Å; L592-F892 HydrophobicContact CG-CD1 4.42Å; L592-L895 HydrophobicContact CD2-CB 4Å; L592-L895 HydrophobicContact CD2-CD1 4.46Å; L592-V896 HydrophobicContact CD2-CG2 4.47Å; L592-Y899 HydrophobicContact CD2-CD2 4.42Å; L592-Y899 HydrophobicContact CD2-CE2 3.48Å; L592-Y899 VanDerWaalsContact CD2-CE2 3.48Å; L592-Y899 HydrophobicContact CG-CE2 3.87Å
593	A	89.9	Confident	91	Very high	11 Å²	11	28.5 Å²	28.5	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-68.9	-36.9	176.9	0	0	0	0	0	112.1	L589 E590 K591 G597 F598 F600	L589-A593 WeakPolarHBondContact O-CB 3.42Å; L589-A593 PolarHBondContact O-N 2.7Å; E590-A593 WeakPolarHBondContact O-CB 3.34Å; E590-A593 PolarHBondContact O-N 3.44Å; E590-A593 VanDerWaalsContact O-N 3.11Å; K591-A593 VanDerWaalsContact C-N 3.34Å; A593-G597 VanDerWaalsContact O-CA 3.26Å; A593-G597 WeakPolarHBondContact O-CA 3.5Å; A593-G597 PolarHBondContact O-N 2.91Å; A593-F598 HydrophobicContact CB-CD1 4.44Å; A593-F598 HydrophobicContact CB-CD2 4.21Å; A593-F598 HydrophobicContact CB-CE1 4.15Å; A593-F598 HydrophobicContact CB-CE2 3.9Å; A593-F598 HydrophobicContact CB-CG 4.46Å; A593-F598 HydrophobicContact CB-CZ 3.86Å; A593-F598 PolarHBondContact O-N 3.18Å; A593-F600 HydrophobicContact CB-CD1 3.83Å; A593-F600 HydrophobicContact CB-CE1 3.71Å
594	E	86.9	Confident	91.1	Very high	132 Å²	132	29.1 Å²	29.1	62%	0.617	16%	0.157	S	C	*	.	H	α-helix	trans	-62	-55	172.1	-70.4	-178.1	160.8	0	0	112.2	E590 K591 I596 G597	E590-E594 PolarHBondContact O-N 2.86Å; K591-E594 IonicContact NZ-OE2 3.75Å; K591-E594 PolarHBondContact O-N 2.78Å; E594-I596 PolarHBondContact O-N 2.04Å; E594-G597 PolarHBondContact O-N 3.48Å
595	D	86.6	Confident	91	Very high	76 Å²	76	29.1 Å²	29.1	41%	0.406	16%	0.157	S	C	.	.	H	α-helix	trans	-75.4	-25.6	-170.2	-68.2	-20.5	0	0	0	113.6	K591 L895 Y899	K591-D595 WeakPolarHBondContact CE-OD2 3.43Å; K591-D595 IonicContact NZ-OD1 3.99Å; K591-D595 PolarHBondContact NZ-OD1 2.93Å; K591-D595 IonicContact NZ-OD2 2.78Å; K591-D595 PolarHBondContact NZ-OD2 3.44Å; K591-D595 PolarHBondContact O-N 2.82Å; K591-D595 VanDerWaalsContact O-N 3.15Å; D595-L895 HydrophobicContact CB-CD1 4.49Å; D595-L895 HydrophobicContact CB-CD2 4.46Å; D595-Y899 VanDerWaalsContact OD2-CE1 3.28Å; D595-Y899 WeakPolarHBondContact OD2-CE1 3.45Å; D595-Y899 PolarHBondContact OD2-OH 2.8Å
596	I	85.1	Confident	90.7	Very high	56 Å²	56	30 Å²	30	29%	0.287	17%	0.167	S	C	.	.	H	α-helix	trans	-92.5	-23.4	173.9	-60.5	174.1	0	0	0	111.7	L592 E594 F598 F892 L895	L592-I596 WeakPolarHBondContact O-CB 3.47Å; L592-I596 WeakPolarHBondContact O-CG1 3.37Å; L592-I596 PolarHBondContact O-N 2.73Å; L592-I596 VanDerWaalsContact O-N 3.14Å; E594-I596 PolarHBondContact O-N 2.04Å; I596-F598 HydrophobicContact CB-CD1 3.81Å; I596-F598 HydrophobicContact CB-CE1 4.22Å; I596-F598 HydrophobicContact CD1-CD1 4.48Å; I596-F598 HydrophobicContact CD1-CE1 4.19Å; I596-F598 HydrophobicContact CG2-CD1 3.81Å; I596-F892 HydrophobicContact CD1-CD1 3.62Å; I596-F892 HydrophobicContact CD1-CE1 3.47Å; I596-F892 VanDerWaalsContact CD1-CE1 3.47Å; I596-F892 HydrophobicContact CD1-CE2 4.44Å; I596-F892 HydrophobicContact CD1-CG 4.18Å; I596-F892 HydrophobicContact CD1-CZ 3.91Å; I596-L895 HydrophobicContact CD1-CD1 3.72Å; I596-L895 HydrophobicContact CG1-CD1 3.35Å
597	G	79.9	Confident	90.3	Very high	41 Å²	41	32.1 Å²	32.1	42%	0.423	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	25	179.4	0	0	0	0	0	115.7	A593 E594	A593-G597 VanDerWaalsContact O-CA 3.26Å; A593-G597 WeakPolarHBondContact O-CA 3.5Å; A593-G597 PolarHBondContact O-N 2.91Å; E594-G597 PolarHBondContact O-N 3.48Å
598	F	84	Confident	90.1	Very high	8 Å²	8	32.7 Å²	32.7	4%	0.035	19%	0.19	C	C	.	.			trans	-92.2	161.3	176.1	73.3	-97	0	0	0	112.4	L518 M520 L589 L592 A593 I596 F600 L632 F892	L518-F598 HydrophobicContact CB-CB 4.04Å; L518-F598 HydrophobicContact CG-CB 4.38Å; L518-F598 WeakPolarHBondContact O-CA 3.45Å; L518-F598 VanDerWaalsContact O-CB 3.25Å; L518-F598 WeakPolarHBondContact O-CB 3.34Å; M520-F598 HydrophobicContact CB-CD2 4.49Å; M520-F598 HydrophobicContact CE-CB 4.12Å; M520-F598 HydrophobicContact CE-CD1 3.98Å; M520-F598 HydrophobicContact CE-CD2 4.09Å; M520-F598 HydrophobicContact CE-CE1 4.41Å; M520-F598 HydrophobicContact CE-CG 3.83Å; M520-F598 HydrophobicContact CG-CD2 4.14Å; M520-F598 HydrophobicContact SD-CD2 4.06Å; M520-F598 HydrophobicContact SD-CE2 4.1Å; M520-F598 HydrophobicContact SD-CG 4.41Å; M520-F598 HydrophobicContact SD-CZ 4.48Å; L589-F598 HydrophobicContact CD1-CE2 4.19Å; L589-F598 HydrophobicContact CD1-CZ 4Å; L592-F598 HydrophobicContact CB-CE1 4.39Å; L592-F598 WeakPolarHBondContact O-CE1 3.32Å; A593-F598 HydrophobicContact CB-CD1 4.44Å; A593-F598 HydrophobicContact CB-CD2 4.21Å; A593-F598 HydrophobicContact CB-CE1 4.15Å; A593-F598 HydrophobicContact CB-CE2 3.9Å; A593-F598 HydrophobicContact CB-CG 4.46Å; A593-F598 HydrophobicContact CB-CZ 3.86Å; A593-F598 PolarHBondContact O-N 3.18Å; I596-F598 HydrophobicContact CB-CD1 3.81Å; I596-F598 HydrophobicContact CB-CE1 4.22Å; I596-F598 HydrophobicContact CD1-CD1 4.48Å; I596-F598 HydrophobicContact CD1-CE1 4.19Å; I596-F598 HydrophobicContact CG2-CD1 3.81Å; F598-F600 HydrophobicContact CD2-CB 4.31Å; F598-F600 HydrophobicContact CD2-CD1 4.35Å; F598-F600 HydrophobicContact CE2-CB 4.07Å; F598-F600 AromaticContact CE2-CD1 3.87Å; F598-F600 HydrophobicContact CE2-CD1 3.87Å; F598-F600 HydrophobicContact CE2-CG 4.31Å; F598-L632 HydrophobicContact CZ-CD2 4.47Å; F598-F892 HydrophobicContact CD1-CZ 4.45Å; F598-F892 AromaticContact CE1-CE1 3.77Å; F598-F892 HydrophobicContact CE1-CE1 3.77Å; F598-F892 AromaticContact CE1-CZ 3.73Å; F598-F892 HydrophobicContact CE1-CZ 3.73Å; F598-F892 HydrophobicContact CZ-CE1 4.15Å; F598-F892 HydrophobicContact CZ-CZ 4.1Å
599	T	85.7	Confident	89.8	Confident	50 Å²	50	35.4 Å²	35.4	31%	0.307	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	153.1	166.6	54.2	0	0	0	0	110.4	L518 H519 M520	L518-T599 PolarHBondContact O-N 2.91Å; H519-T599 WeakPolarHBondContact CA-O 3.29Å; H519-T599 PolarHBondContact ND1-O 3.41Å; H519-T599 PolarHBondContact ND1-OG1 2.97Å; M520-T599 PolarHBondContact N-O 3.2Å
600	F	90.8	Very high	89.6	Confident	21 Å²	21	35.6 Å²	35.6	9%	0.092	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145.1	-177.9	64.3	-86.9	0	0	0	114.3	M520 V522 Q546 L589 E590 A593 F598 L602	M520-F600 HydrophobicContact CB-CB 4.47Å; M520-F600 CarbonylContact O-C 3.54Å; M520-F600 WeakPolarHBondContact O-CA 3.35Å; V522-F600 HydrophobicContact CG2-CB 3.64Å; V522-F600 HydrophobicContact CG2-CD2 4.2Å; V522-F600 HydrophobicContact CG2-CG 4.15Å; Q546-F600 HydrophobicContact CG-CE2 3.85Å; Q546-F600 HydrophobicContact CG-CZ 4.2Å; L589-F600 HydrophobicContact CD1-CD1 4.35Å; L589-F600 HydrophobicContact CD1-CE1 4.41Å; L589-F600 HydrophobicContact CD1-CG 4.47Å; L589-F600 HydrophobicContact CD2-CD2 3.75Å; L589-F600 HydrophobicContact CD2-CE1 4.42Å; L589-F600 HydrophobicContact CD2-CE2 3.41Å; L589-F600 VanDerWaalsContact CD2-CE2 3.41Å; L589-F600 HydrophobicContact CD2-CG 4.38Å; L589-F600 HydrophobicContact CD2-CZ 3.8Å; L589-F600 HydrophobicContact CG-CD1 4.31Å; L589-F600 HydrophobicContact CG-CD2 4.25Å; L589-F600 HydrophobicContact CG-CE1 3.94Å; L589-F600 HydrophobicContact CG-CE2 3.86Å; L589-F600 HydrophobicContact CG-CG 4.46Å; L589-F600 HydrophobicContact CG-CZ 3.7Å; E590-F600 HydrophobicContact CG-CZ 4.3Å; A593-F600 HydrophobicContact CB-CD1 3.83Å; A593-F600 HydrophobicContact CB-CE1 3.71Å; F598-F600 HydrophobicContact CD2-CB 4.31Å; F598-F600 HydrophobicContact CD2-CD1 4.35Å; F598-F600 HydrophobicContact CE2-CB 4.07Å; F598-F600 AromaticContact CE2-CD1 3.87Å; F598-F600 HydrophobicContact CE2-CD1 3.87Å; F598-F600 HydrophobicContact CE2-CG 4.31Å; F600-L602 HydrophobicContact CD2-CB 4.25Å; F600-L602 HydrophobicContact CE2-CB 4.31Å
601	D	90.6	Very high	89.5	Confident	38 Å²	38	32 Å²	32	20%	0.203	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.7	164.5	-77.8	6	0	0	0	108	H519 M520 R521 V522 F563	H519-D601 IonicContact CE1-OD1 2.68Å; H519-D601 PolarHBondContact CE1-OD1 3.45Å; H519-D601 VanDerWaalsContact CE1-OD1 3.31Å; H519-D601 IonicContact NE2-OD1 2.92Å; H519-D601 IonicContact NE2-OD2 2.76Å; M520-D601 PolarHBondContact O-N 3.15Å; R521-D601 WeakPolarHBondContact CA-O 3.44Å; V522-D601 PolarHBondContact N-O 2.92Å; F563-D601 HydrophobicContact CD1-CB 3.81Å; F563-D601 VanDerWaalsContact CD1-OD2 3.29Å; F563-D601 WeakPolarHBondContact CD1-OD2 3.47Å; F563-D601 HydrophobicContact CE1-CB 3.61Å; F563-D601 HydrophobicContact CZ-CB 4.43Å
602	L	93.1	Very high	89.3	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138.1	-175.5	-176.4	60.9	0	0	0	111.1	V522 T524 Q546 C548 L549 C581 I586 L589 F600	V522-L602 HydrophobicContact CB-CD1 4.08Å; V522-L602 HydrophobicContact CG1-CD1 4.03Å; T524-L602 HydrophobicContact CG2-CD1 3.9Å; T524-L602 HydrophobicContact CG2-CG 4.38Å; Q546-L602 HydrophobicContact CG-CD2 4.38Å; C548-L602 VanDerWaalsContact CA-O 3.28Å; C548-L602 WeakPolarHBondContact CA-O 3.3Å; C548-L602 HydrophobicContact CB-CB 4.05Å; C548-L602 HydrophobicContact CB-CD2 3.86Å; C548-L602 HydrophobicContact CB-CG 3.74Å; L549-L602 PolarHBondContact N-O 3.33Å; C581-L602 HydrophobicContact CB-CD2 3.75Å; I586-L602 HydrophobicContact CD1-CD2 3.81Å; L589-L602 HydrophobicContact CD2-CD1 4.23Å; F600-L602 HydrophobicContact CD2-CB 4.25Å; F600-L602 HydrophobicContact CE2-CB 4.31Å
603	Y	94.3	Very high	89.1	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.008	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.7	172	75	-75.1	0	0	0	113.7	R521 V522 V523 T524 L549 P551 L559 F563 D624 A629 A630	R521-Y603 HydrophobicContact CB-CE1 4.42Å; V522-Y603 VanDerWaalsContact O-CD1 3.24Å; V522-Y603 WeakPolarHBondContact O-CD1 3.4Å; V522-Y603 PolarHBondContact O-N 3.27Å; V523-Y603 CarbonylContact C-O 3.56Å; V523-Y603 WeakPolarHBondContact CA-O 3.42Å; V523-Y603 HydrophobicContact CB-CD1 4.38Å; V523-Y603 HydrophobicContact CB-CE1 3.74Å; V523-Y603 HydrophobicContact CB-CE2 4.15Å; V523-Y603 HydrophobicContact CG2-CD2 4.23Å; V523-Y603 HydrophobicContact CG2-CE1 4.21Å; V523-Y603 HydrophobicContact CG2-CE2 3.7Å; T524-Y603 PolarHBondContact N-O 3.47Å; L549-Y603 CarbonylContact O-C 3.21Å; L549-Y603 VanDerWaalsContact O-CA 3.26Å; L549-Y603 WeakPolarHBondContact O-CA 3.35Å; L549-Y603 WeakPolarHBondContact O-CB 3.2Å; P551-Y603 HydrophobicContact CG-CD2 4.2Å; L559-Y603 HydrophobicContact CD1-CD2 3.87Å; L559-Y603 HydrophobicContact CD1-CE2 4.13Å; L559-Y603 HydrophobicContact CD1-CG 4.21Å; L559-Y603 HydrophobicContact CD2-CD2 4.21Å; L559-Y603 HydrophobicContact CD2-CE1 4.3Å; L559-Y603 HydrophobicContact CD2-CE2 3.6Å; F563-Y603 HydrophobicContact CE2-CD1 4.18Å; F563-Y603 AromaticContact CZ-CD1 3.64Å; F563-Y603 HydrophobicContact CZ-CD1 3.64Å; F563-Y603 HydrophobicContact CZ-CE1 4.37Å; F563-Y603 AromaticContact CZ-CG 3.94Å; F563-Y603 HydrophobicContact CZ-CG 3.94Å; Y603-D624 WeakPolarHBondContact CE2-OD2 3.02Å; Y603-D624 PolarHBondContact OH-OD2 3.16Å; Y603-A629 WeakPolarHBondContact OH-CB 3.12Å; Y603-A630 HydrophobicContact CE1-CB 4.31Å; Y603-A630 PolarHBondContact OH-N 3.03Å
604	I	94.6	Very high	88.9	Confident	12 Å²	12	39.2 Å²	39.2	6%	0.062	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	137.4	177.2	-58.5	165.6	0	0	0	109.1	T524 V526 T533 L549 D550 P551 K579 G606	T524-I604 HydrophobicContact CG2-CG1 4.29Å; T524-I604 WeakPolarHBondContact O-CA 3.39Å; V526-I604 HydrophobicContact CG2-CD1 3.82Å; V526-I604 HydrophobicContact CG2-CG1 4.1Å; V526-I604 HydrophobicContact CG2-CG2 3.95Å; T533-I604 HydrophobicContact CG2-CD1 3.75Å; L549-I604 PolarHBondContact O-N 3.41Å; D550-I604 HydrophobicContact CB-CD1 4.15Å; P551-I604 WeakPolarHBondContact CD-O 3.45Å; P551-I604 WeakPolarHBondContact CG-O 3.47Å; K579-I604 HydrophobicContact CD-CD1 4.46Å; I604-G606 PolarHBondContact O-N 3.38Å
605	V	94	Very high	88.9	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.018	23%	0.228	C	C	.	.			trans	-64.5	126.7	179.6	63.9	0	0	0	0	112.2	V523 T524 L525 D607 G608 L621	V523-V605 HydrophobicContact CG2-CB 3.78Å; V523-V605 HydrophobicContact CG2-CG2 4.37Å; T524-V605 PolarHBondContact O-N 3.32Å; L525-V605 HydrophobicContact CB-CG1 4.25Å; L525-V605 HydrophobicContact CD1-CG1 3.67Å; V605-D607 VanDerWaalsContact C-N 3.3Å; V605-D607 PolarHBondContact O-N 3.44Å; V605-G608 PolarHBondContact O-N 3.12Å; V605-G608 VanDerWaalsContact O-N 3.09Å; V605-L621 HydrophobicContact CB-CD2 3.9Å; V605-L621 HydrophobicContact CG1-CD2 3.92Å; V605-L621 HydrophobicContact CG2-CD2 4.35Å
606	G	89.1	Confident	88.8	Confident	20 Å²	20	40.1 Å²	40.1	21%	0.206	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.6	-166.9	0	0	0	0	0	116.7	N554 I604	N554-G606 WeakPolarHBondContact OD1-CA 3.21Å; I604-G606 PolarHBondContact O-N 3.38Å
607	D	87.9	Confident	89.1	Confident	45 Å²	45	45.3 Å²	45.3	24%	0.241	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-5.3	173.1	75.3	-3.8	0	0	0	114	N554 V605 K609 G620	N554-D607 PolarHBondContact OD1-N 3.27Å; V605-D607 VanDerWaalsContact C-N 3.3Å; V605-D607 PolarHBondContact O-N 3.44Å; D607-K609 HydrophobicContact CB-CG 4.41Å; D607-K609 WeakPolarHBondContact O-CG 3.3Å; D607-K609 WeakPolarHBondContact OD1-CB 3.28Å; D607-K609 PolarHBondContact OD1-N 2.76Å; D607-G620 VanDerWaalsContact OD1-CA 3.31Å; D607-G620 WeakPolarHBondContact OD1-CA 3.48Å; D607-G620 PolarHBondContact OD2-N 2.91Å
608	G	89.7	Confident	89.7	Confident	38 Å²	38	45.1 Å²	45.1	39%	0.392	24%	0.237	S	C	.	.			trans	70.1	23	-177.7	0	0	0	0	0	115.2	L525 V605	L525-G608 VanDerWaalsContact CD1-C 3.47Å; L525-G608 WeakPolarHBondContact CD1-O 3.42Å; V605-G608 PolarHBondContact O-N 3.12Å; V605-G608 VanDerWaalsContact O-N 3.09Å
609	K	91.3	Very high	90.1	Very high	57 Å²	57	46.3 Å²	46.3	25%	0.248	25%	0.245	C	C	.	.			trans	-121.8	149.9	-173.1	-50.3	-176.8	-164.8	171.7	0	114.9	D607 G611 G620 L621 E804	D607-K609 HydrophobicContact CB-CG 4.41Å; D607-K609 WeakPolarHBondContact O-CG 3.3Å; D607-K609 WeakPolarHBondContact OD1-CB 3.28Å; D607-K609 PolarHBondContact OD1-N 2.76Å; K609-G611 PolarHBondContact O-N 2.87Å; K609-G620 WeakPolarHBondContact O-CA 3.47Å; K609-L621 PolarHBondContact O-N 2.92Å; K609-L621 VanDerWaalsContact O-N 3.17Å; K609-E804 HydrophobicContact CD-CB 4.18Å; K609-E804 VanDerWaalsContact CD-CD 3.5Å; K609-E804 HydrophobicContact CD-CG 4.43Å; K609-E804 WeakPolarHBondContact CD-OE2 3.45Å; K609-E804 IonicContact NZ-OE1 2.73Å; K609-E804 PolarHBondContact NZ-OE1 2.66Å; K609-E804 IonicContact NZ-OE2 2.7Å; K609-E804 PolarHBondContact NZ-OE2 3.29Å
610	Y	91	Very high	90.4	Very high	3 Å²	3	44.1 Å²	44.1	1%	0.012	23%	0.232	C	C	.	.			trans	-62.6	-29.8	167.2	-61.4	-78.7	0	0	0	113.7	L525 L621 S636 F637 M849	L525-Y610 HydrophobicContact CD2-CD1 3.74Å; L525-Y610 HydrophobicContact CD2-CD2 4.11Å; L525-Y610 HydrophobicContact CD2-CE1 3.64Å; L525-Y610 HydrophobicContact CD2-CE2 4.02Å; L525-Y610 HydrophobicContact CD2-CG 3.99Å; Y610-L621 HydrophobicContact CD1-CD1 4.33Å; Y610-S636 WeakPolarHBondContact CE1-O 3.47Å; Y610-S636 PolarHBondContact OH-OG 3.14Å; Y610-F637 HydrophobicContact CD1-CD2 4.46Å; Y610-F637 WeakPolarHBondContact O-CE2 3.36Å; Y610-M849 HydrophobicContact CE2-CE 3.79Å
611	G	88.8	Confident	90.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.			trans	100	130.1	179.9	0	0	0	0	0	114.1	K609 T619 R643	K609-G611 PolarHBondContact O-N 2.87Å; G611-T619 WeakPolarHBondContact CA-O 3.25Å; G611-R643 PolarHBondContact O-NE 3.39Å; G611-R643 PolarHBondContact O-NH2 3.15Å
612	G	89	Confident	90.7	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.01	22%	0.218	C	C	.	.			trans	-142.2	166.4	175.4	0	0	0	0	0	111.3	W618 T619	G612-W618 VanDerWaalsContact C-CE3 3.43Å; G612-T619 PolarHBondContact N-OG1 3.33Å; G612-T619 PolarHBondContact O-N 2.84Å; G612-T619 VanDerWaalsContact O-N 3.16Å; G612-T619 PolarHBondContact O-OG1 2.93Å; G612-T619 VanDerWaalsContact O-OG1 3.12Å
613	Y	89.4	Confident	90.7	Very high	135 Å²	135	41.5 Å²	41.5	53%	0.529	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114.5	-179.7	-166.7	-112.1	0	0	0	110.9	G616 W618	Y613-G616 VanDerWaalsContact CE2-C 3.45Å; Y613-G616 VanDerWaalsContact CE2-O 3.31Å; Y613-G616 WeakPolarHBondContact CE2-O 3.41Å; Y613-G616 WeakPolarHBondContact OH-CA 3.34Å; Y613-G616 PolarHBondContact OH-O 3.06Å; Y613-W618 AromaticContact CD2-CD1 3.87Å; Y613-W618 HydrophobicContact CD2-CD2 4.07Å; Y613-W618 AromaticContact CD2-CE2 3.82Å; Y613-W618 HydrophobicContact CD2-CG 4.12Å; Y613-W618 HydrophobicContact CD2-CZ2 4.42Å; Y613-W618 AromaticContact CD2-NE1 3.66Å
614	K	85.1	Confident	90.6	Very high	81 Å²	81	42 Å²	42	35%	0.352	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.7	-178.6	-55.3	-74.8	-175.1	172.5	0	109.4	G616 R617 E804 E808	K614-G616 PolarHBondContact O-N 3.47Å; K614-R617 PolarHBondContact N-O 3.17Å; K614-R617 PolarHBondContact O-N 3.11Å; K614-E804 HydrophobicContact CD-CG 4.48Å; K614-E804 HydrophobicContact CG-CG 4.38Å; K614-E808 IonicContact NZ-OE2 2.64Å
615	N	86.4	Confident	90.5	Very high	176 Å²	176	41.6 Å²	41.6	94%	0.941	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	34.4	174.5	-56.1	-7.2	0	0	0	114.8
616	G	85.6	Confident	90.5	Very high	52 Å²	52	45.6 Å²	45.6	54%	0.536	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	-5.9	-179.8	0	0	0	0	0	116	Y613 K614	Y613-G616 VanDerWaalsContact CE2-C 3.45Å; Y613-G616 VanDerWaalsContact CE2-O 3.31Å; Y613-G616 WeakPolarHBondContact CE2-O 3.41Å; Y613-G616 WeakPolarHBondContact OH-CA 3.34Å; Y613-G616 PolarHBondContact OH-O 3.06Å; K614-G616 PolarHBondContact O-N 3.47Å
617	R	90.9	Very high	90.5	Very high	164 Å²	164	46.9 Å²	46.9	62%	0.619	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	157.5	-175.5	-178.5	171.5	170.8	178.1	-2.8	111.7	K614	K614-R617 PolarHBondContact N-O 3.17Å; K614-R617 PolarHBondContact O-N 3.11Å
618	W	91.9	Very high	90.5	Very high	38 Å²	38	46.2 Å²	46.2	14%	0.144	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135	168.9	-71.5	97.7	0	0	0	111.7	G612 Y613 V622 L626 A642 R643 V646	G612-W618 VanDerWaalsContact C-CE3 3.43Å; Y613-W618 AromaticContact CD2-CD1 3.87Å; Y613-W618 HydrophobicContact CD2-CD2 4.07Å; Y613-W618 AromaticContact CD2-CE2 3.82Å; Y613-W618 HydrophobicContact CD2-CG 4.12Å; Y613-W618 HydrophobicContact CD2-CZ2 4.42Å; Y613-W618 AromaticContact CD2-NE1 3.66Å; W618-V622 HydrophobicContact CB-CB 4.25Å; W618-V622 HydrophobicContact CB-CG1 3.9Å; W618-V622 HydrophobicContact CD2-CB 4.38Å; W618-V622 HydrophobicContact CD2-CG1 3.64Å; W618-V622 HydrophobicContact CE3-CB 4.01Å; W618-V622 HydrophobicContact CE3-CG1 3.67Å; W618-V622 HydrophobicContact CE3-CG2 4.23Å; W618-V622 HydrophobicContact CG-CG1 3.76Å; W618-V622 HydrophobicContact CZ3-CG1 4.37Å; W618-L626 HydrophobicContact CB-CD1 4.01Å; W618-L626 VanDerWaalsContact CD1-CD1 3.42Å; W618-L626 HydrophobicContact CG-CD1 3.82Å; W618-A642 HydrophobicContact CH2-CB 4.38Å; W618-A642 WeakPolarHBondContact CH2-O 3.34Å; W618-A642 WeakPolarHBondContact CZ2-O 3.44Å; W618-R643 HydrophobicContact CZ3-CG 4.34Å; W618-V646 HydrophobicContact CD2-CG2 4.49Å; W618-V646 HydrophobicContact CZ2-CG1 4.35Å; W618-V646 HydrophobicContact CZ2-CG2 3.88Å
619	T	92.2	Very high	90.4	Very high	33 Å²	33	44.5 Å²	44.5	20%	0.202	23%	0.234	C	C	.	.			trans	-94	178.2	173.3	54.7	0	0	0	0	111.8	G611 G612 G623 E804	G611-T619 WeakPolarHBondContact CA-O 3.25Å; G612-T619 PolarHBondContact N-OG1 3.33Å; G612-T619 PolarHBondContact O-N 2.84Å; G612-T619 VanDerWaalsContact O-N 3.16Å; G612-T619 PolarHBondContact O-OG1 2.93Å; G612-T619 VanDerWaalsContact O-OG1 3.12Å; T619-G623 PolarHBondContact O-N 2.68Å; T619-E804 WeakPolarHBondContact CB-OE2 3.25Å; T619-E804 WeakPolarHBondContact CG2-OE2 3.5Å; T619-E804 PolarHBondContact OG1-OE2 2.78Å
620	G	92	Very high	90.5	Very high	4 Å²	4	41.8 Å²	41.8	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	54.8	-152	169.8	0	0	0	0	0	116.3	D607 K609 V622 G623 D624	D607-G620 VanDerWaalsContact OD1-CA 3.31Å; D607-G620 WeakPolarHBondContact OD1-CA 3.48Å; D607-G620 PolarHBondContact OD2-N 2.91Å; K609-G620 WeakPolarHBondContact O-CA 3.47Å; G620-V622 PolarHBondContact O-N 2.88Å; G620-V622 VanDerWaalsContact O-N 3.12Å; G620-G623 WeakPolarHBondContact O-CA 3.47Å; G620-G623 PolarHBondContact O-N 3.44Å; G620-D624 PolarHBondContact O-N 3.23Å
621	L	94.1	Very high	90.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-50.5	-38.7	-178.9	-54.1	170.2	0	0	0	112.9	V523 L525 V605 K609 Y610 D624 L625 T635 F637	V523-L621 HydrophobicContact CB-CD2 4.44Å; V523-L621 HydrophobicContact CG1-CD2 3.94Å; V523-L621 HydrophobicContact CG2-CD2 3.81Å; L525-L621 HydrophobicContact CB-CD2 4.47Å; V605-L621 HydrophobicContact CB-CD2 3.9Å; V605-L621 HydrophobicContact CG1-CD2 3.92Å; V605-L621 HydrophobicContact CG2-CD2 4.35Å; K609-L621 PolarHBondContact O-N 2.92Å; K609-L621 VanDerWaalsContact O-N 3.17Å; Y610-L621 HydrophobicContact CD1-CD1 4.33Å; L621-D624 PolarHBondContact O-N 2.99Å; L621-L625 WeakPolarHBondContact O-CG 3.03Å; L621-L625 PolarHBondContact O-N 3.02Å; L621-T635 HydrophobicContact CD1-CG2 3.53Å; L621-F637 HydrophobicContact CB-CE2 4.3Å; L621-F637 HydrophobicContact CB-CZ 4.16Å; L621-F637 HydrophobicContact CD1-CD2 3.87Å; L621-F637 HydrophobicContact CD1-CE2 4.1Å; L621-F637 HydrophobicContact CD1-CG 4.16Å
622	V	94.6	Very high	90.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-42	176.6	-173.7	0	0	0	0	111.2	W618 G620 L626 F637 R643 V646 I647	W618-V622 HydrophobicContact CB-CB 4.25Å; W618-V622 HydrophobicContact CB-CG1 3.9Å; W618-V622 HydrophobicContact CD2-CB 4.38Å; W618-V622 HydrophobicContact CD2-CG1 3.64Å; W618-V622 HydrophobicContact CE3-CB 4.01Å; W618-V622 HydrophobicContact CE3-CG1 3.67Å; W618-V622 HydrophobicContact CE3-CG2 4.23Å; W618-V622 HydrophobicContact CG-CG1 3.76Å; W618-V622 HydrophobicContact CZ3-CG1 4.37Å; G620-V622 PolarHBondContact O-N 2.88Å; G620-V622 VanDerWaalsContact O-N 3.12Å; V622-L626 HydrophobicContact CG1-CD1 3.88Å; V622-L626 HydrophobicContact CG1-CG 4.38Å; V622-L626 WeakPolarHBondContact O-CB 3.38Å; V622-L626 VanDerWaalsContact O-CG 3.28Å; V622-L626 WeakPolarHBondContact O-CG 3.31Å; V622-L626 PolarHBondContact O-N 3.11Å; V622-F637 HydrophobicContact CG2-CE2 4.25Å; V622-F637 HydrophobicContact CG2-CZ 3.83Å; V622-R643 HydrophobicContact CG2-CG 4.1Å; V622-V646 HydrophobicContact CG1-CG2 3.87Å; V622-I647 HydrophobicContact CG1-CG2 4.45Å; V622-I647 HydrophobicContact CG2-CD1 4.28Å
623	G	92.5	Very high	91.2	Very high	7 Å²	7	45.2 Å²	45.2	7%	0.072	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-36.1	175.9	0	0	0	0	0	113.5	T619 G620 S627	T619-G623 PolarHBondContact O-N 2.68Å; G620-G623 WeakPolarHBondContact O-CA 3.47Å; G620-G623 PolarHBondContact O-N 3.44Å; G623-S627 VanDerWaalsContact O-CB 3.26Å; G623-S627 WeakPolarHBondContact O-CB 3.38Å; G623-S627 PolarHBondContact O-N 3.02Å; G623-S627 PolarHBondContact O-OG 3.4Å
624	D	92.4	Very high	91.5	Very high	13 Å²	13	38.8 Å²	38.8	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-74.5	-35	178.6	-84.7	11.9	0	0	0	112.9	Y603 G620 L621 S627 G628 A629 A630	Y603-D624 WeakPolarHBondContact CE2-OD2 3.02Å; Y603-D624 PolarHBondContact OH-OD2 3.16Å; G620-D624 PolarHBondContact O-N 3.23Å; L621-D624 PolarHBondContact O-N 2.99Å; D624-S627 PolarHBondContact O-OG 3.49Å; D624-G628 PolarHBondContact O-N 2.78Å; D624-A629 HydrophobicContact CB-CB 4.05Å; D624-A629 WeakPolarHBondContact O-CB 3.39Å; D624-A629 PolarHBondContact O-N 2.8Å; D624-A630 PolarHBondContact O-N 3.44Å; D624-A630 VanDerWaalsContact O-N 3.08Å
625	L	93.7	Very high	92	Very high	4 Å²	4	35 Å²	35	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-49.6	169.1	-72.2	172.9	0	0	0	111.4	L621 S627 G628 A630 A633 F637 I647 P883	L621-L625 WeakPolarHBondContact O-CG 3.03Å; L621-L625 PolarHBondContact O-N 3.02Å; L625-S627 VanDerWaalsContact C-N 3.29Å; L625-S627 PolarHBondContact O-N 3.37Å; L625-G628 PolarHBondContact O-N 3.08Å; L625-G628 VanDerWaalsContact O-N 3.12Å; L625-A630 HydrophobicContact CD2-CB 4.11Å; L625-A633 HydrophobicContact CD1-CB 3.83Å; L625-A633 HydrophobicContact CD2-CB 4.23Å; L625-A633 HydrophobicContact CG-CB 4.15Å; L625-F637 HydrophobicContact CD1-CE1 4.47Å; L625-I647 HydrophobicContact CB-CG2 4Å; L625-I647 HydrophobicContact CD1-CB 4.39Å; L625-I647 HydrophobicContact CD1-CD1 3.93Å; L625-I647 HydrophobicContact CD1-CG2 3.98Å; L625-P883 HydrophobicContact CD2-CG 4.33Å
626	L	92.7	Very high	92.4	Very high	86 Å²	86	26.6 Å²	26.6	45%	0.45	15%	0.152	S	C	.	.	H	α-helix	trans	-66.9	-25.8	-177.7	-74.7	176.2	0	0	0	114.1	W618 V622 V646 I647	W618-L626 HydrophobicContact CB-CD1 4.01Å; W618-L626 VanDerWaalsContact CD1-CD1 3.42Å; W618-L626 HydrophobicContact CG-CD1 3.82Å; V622-L626 HydrophobicContact CG1-CD1 3.88Å; V622-L626 HydrophobicContact CG1-CG 4.38Å; V622-L626 WeakPolarHBondContact O-CB 3.38Å; V622-L626 VanDerWaalsContact O-CG 3.28Å; V622-L626 WeakPolarHBondContact O-CG 3.31Å; V622-L626 PolarHBondContact O-N 3.11Å; L626-V646 HydrophobicContact CD1-CB 4.28Å; L626-V646 HydrophobicContact CD1-CG2 4.25Å; L626-V646 HydrophobicContact CD2-CB 4.34Å; L626-V646 WeakPolarHBondContact CD2-O 3.34Å; L626-I647 HydrophobicContact CD2-CG2 4.41Å; L626-I647 HydrophobicContact CG-CG2 4.38Å
627	S	89.3	Confident	92.8	Very high	47 Å²	47	24.1 Å²	24.1	33%	0.329	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-1.7	175.4	61.9	0	0	0	0	114	G623 D624 L625 A629	G623-S627 VanDerWaalsContact O-CB 3.26Å; G623-S627 WeakPolarHBondContact O-CB 3.38Å; G623-S627 PolarHBondContact O-N 3.02Å; G623-S627 PolarHBondContact O-OG 3.4Å; D624-S627 PolarHBondContact O-OG 3.49Å; L625-S627 VanDerWaalsContact C-N 3.29Å; L625-S627 PolarHBondContact O-N 3.37Å; S627-A629 PolarHBondContact O-N 3.33Å
628	G	88.6	Confident	92.9	Very high	32 Å²	32	16.3 Å²	16.3	33%	0.33	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	19.1	-173.9	0	0	0	0	0	113.6	R521 D624 L625	R521-G628 PolarHBondContact NH2-O 3.32Å; D624-G628 PolarHBondContact O-N 2.78Å; L625-G628 PolarHBondContact O-N 3.08Å; L625-G628 VanDerWaalsContact O-N 3.12Å
629	A	87.6	Confident	93	Very high	2 Å²	2	16.7 Å²	16.7	2%	0.017	10%	0.101	C	C	.	.	S	Bend	trans	-64.3	-49.7	170.8	0	0	0	0	0	109.3	R521 T556 L559 Y603 D624 S627	R521-A629 PolarHBondContact NE-O 2.7Å; R521-A629 PolarHBondContact NH2-O 2.91Å; T556-A629 HydrophobicContact CG2-CB 3.81Å; L559-A629 HydrophobicContact CD2-CB 4.09Å; Y603-A629 WeakPolarHBondContact OH-CB 3.12Å; D624-A629 HydrophobicContact CB-CB 4.05Å; D624-A629 WeakPolarHBondContact O-CB 3.39Å; D624-A629 PolarHBondContact O-N 2.8Å; S627-A629 PolarHBondContact O-N 3.33Å
630	A	92.3	Very high	92.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.099	C	C	.	.			trans	-99.8	158.5	170.5	0	0	0	0	0	112.5	V523 Y603 D624 L625	V523-A630 HydrophobicContact CB-CB 3.81Å; V523-A630 HydrophobicContact CG1-CB 3.56Å; Y603-A630 HydrophobicContact CE1-CB 4.31Å; Y603-A630 PolarHBondContact OH-N 3.03Å; D624-A630 PolarHBondContact O-N 3.44Å; D624-A630 VanDerWaalsContact O-N 3.08Å; L625-A630 HydrophobicContact CD2-CB 4.11Å
631	H	92.9	Very high	92.7	Very high	75 Å²	75	20 Å²	20	35%	0.347	12%	0.123	S	C	.	.	S	Bend	trans	-104.9	-15.6	165.2	-58.1	168.2	0	0	0	112	M520 R521 P883	M520-H631 HydrophobicContact CB-CB 4.32Å; R521-H631 PolarHBondContact NH1-CE1 3.21Å; R521-H631 PolarHBondContact NH1-NE2 2.88Å; R521-H631 PolarHBondContact NH2-CD2 3Å; R521-H631 PolarHBondContact NH2-NE2 2.64Å; R521-H631 PolarHBondContact O-N 3.09Å; H631-P883 VanDerWaalsContact O-CD 3.24Å; H631-P883 WeakPolarHBondContact O-CD 3.36Å
632	L	94.9	Very high	92.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	142.3	-174.2	-166.1	68.9	0	0	0	108.9	M520 V522 V523 L589 F598 V634 I880 G881 L882 F892	M520-L632 HydrophobicContact SD-CB 4.45Å; M520-L632 HydrophobicContact SD-CD2 4.28Å; V522-L632 WeakPolarHBondContact CA-O 3.5Å; V522-L632 HydrophobicContact CG1-CB 4.41Å; V522-L632 HydrophobicContact CG1-CD2 4.45Å; V522-L632 HydrophobicContact CG2-CB 4.15Å; V522-L632 HydrophobicContact CG2-CD2 4.08Å; V523-L632 PolarHBondContact N-O 2.66Å; L589-L632 HydrophobicContact CD1-CD2 4.05Å; F598-L632 HydrophobicContact CZ-CD2 4.47Å; L632-V634 HydrophobicContact CD2-CG2 3.79Å; L632-V634 HydrophobicContact CG-CG2 3.85Å; L632-I880 HydrophobicContact CD1-CG2 3.38Å; L632-I880 HydrophobicContact CG-CG2 3.9Å; L632-G881 CarbonylContact C-O 3.55Å; L632-L882 HydrophobicContact CD1-CD1 4.25Å; L632-L882 HydrophobicContact CD1-CD2 4.06Å; L632-L882 HydrophobicContact CD1-CG 3.79Å; L632-F892 HydrophobicContact CD1-CE2 4.12Å; L632-F892 HydrophobicContact CD1-CZ 4.17Å; L632-F892 HydrophobicContact CD2-CE1 4.43Å; L632-F892 HydrophobicContact CD2-CZ 4.11Å
633	A	96.5	Very high	92.4	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.8	173.4	0	0	0	0	0	110.5	V523 L625 F637 G881	V523-A633 HydrophobicContact CG1-CB 3.65Å; V523-A633 WeakPolarHBondContact O-CA 3.33Å; L625-A633 HydrophobicContact CD1-CB 3.83Å; L625-A633 HydrophobicContact CD2-CB 4.23Å; L625-A633 HydrophobicContact CG-CB 4.15Å; A633-F637 HydrophobicContact CB-CD1 4.42Å; A633-F637 HydrophobicContact CB-CE1 4.41Å; A633-G881 PolarHBondContact N-O 3.27Å; A633-G881 PolarHBondContact O-N 3Å
634	V	96.4	Very high	92.3	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	15%	0.153	C	C	.	.			trans	-131.1	105.6	-175.4	-168.7	0	0	0	0	110.5	V522 V523 T524 C585 L589 L632 I880	V522-V634 HydrophobicContact CG1-CB 4.19Å; V522-V634 HydrophobicContact CG1-CG2 3.85Å; V523-V634 PolarHBondContact O-N 3.28Å; T524-V634 WeakPolarHBondContact CB-O 3.33Å; T524-V634 PolarHBondContact OG1-O 2.97Å; C585-V634 HydrophobicContact CB-CG1 4.08Å; C585-V634 WeakPolarHBondContact O-CG1 3.3Å; L589-V634 HydrophobicContact CB-CG1 4.41Å; L589-V634 HydrophobicContact CD1-CG2 4.28Å; L632-V634 HydrophobicContact CD2-CG2 3.79Å; L632-V634 HydrophobicContact CG-CG2 3.85Å; V634-I880 HydrophobicContact CG1-CG1 4.31Å; V634-I880 HydrophobicContact CG2-CG1 4.28Å; V634-I880 HydrophobicContact CG2-CG2 4.01Å
635	T	94.9	Very high	92.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-167.6	-166.2	175.5	-175.1	0	0	0	0	107.9	L525 C585 L621 F637	L525-T635 HydrophobicContact CB-CG2 3.98Å; L525-T635 PolarHBondContact O-OG1 2.61Å; C585-T635 VanDerWaalsContact SG-C 3.52Å; C585-T635 VanDerWaalsContact SG-CA 3.59Å; L621-T635 HydrophobicContact CD1-CG2 3.53Å; T635-F637 HydrophobicContact CG2-CB 4.14Å; T635-F637 PolarHBondContact O-N 3.46Å
636	S	93.6	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-70.3	58.5	174	67.1	0	0	0	0	112.5	Y610 S638	Y610-S636 WeakPolarHBondContact CE1-O 3.47Å; Y610-S636 PolarHBondContact OH-OG 3.14Å; S636-S638 PolarHBondContact O-N 3.03Å
637	F	94.1	Very high	92.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.168	C	C	.	.			trans	-94.2	99.5	-166.1	-168.8	-151	0	0	0	112	Y610 L621 V622 L625 A633 T635 I639 I647 F649 Y878 G879	Y610-F637 HydrophobicContact CD1-CD2 4.46Å; Y610-F637 WeakPolarHBondContact O-CE2 3.36Å; L621-F637 HydrophobicContact CB-CE2 4.3Å; L621-F637 HydrophobicContact CB-CZ 4.16Å; L621-F637 HydrophobicContact CD1-CD2 3.87Å; L621-F637 HydrophobicContact CD1-CE2 4.1Å; L621-F637 HydrophobicContact CD1-CG 4.16Å; V622-F637 HydrophobicContact CG2-CE2 4.25Å; V622-F637 HydrophobicContact CG2-CZ 3.83Å; L625-F637 HydrophobicContact CD1-CE1 4.47Å; A633-F637 HydrophobicContact CB-CD1 4.42Å; A633-F637 HydrophobicContact CB-CE1 4.41Å; T635-F637 HydrophobicContact CG2-CB 4.14Å; T635-F637 PolarHBondContact O-N 3.46Å; F637-I639 PolarHBondContact O-N 2.94Å; F637-I647 HydrophobicContact CE1-CD1 3.54Å; F637-I647 HydrophobicContact CZ-CD1 3.59Å; F637-F649 HydrophobicContact CD1-CD1 4.48Å; F637-F649 AromaticContact CD1-CE1 3.51Å; F637-F649 HydrophobicContact CD1-CE1 3.51Å; F637-F649 HydrophobicContact CD1-CZ 4.06Å; F637-F649 AromaticContact CE1-CE1 3.65Å; F637-F649 HydrophobicContact CE1-CE1 3.65Å; F637-F649 AromaticContact CE1-CZ 3.75Å; F637-F649 HydrophobicContact CE1-CZ 3.75Å; F637-F649 HydrophobicContact CG-CE1 4.07Å; F637-F649 HydrophobicContact CZ-CE1 4.32Å; F637-F649 HydrophobicContact CZ-CZ 4.02Å; F637-Y878 WeakPolarHBondContact O-CA 3.38Å; F637-G879 PolarHBondContact O-N 2.92Å; F637-G879 VanDerWaalsContact O-N 3.16Å
638	S	93.6	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-69	123.8	-174	-13.5	0	0	0	0	112.7	S636 N640 R643 S806 D850 E876	S636-S638 PolarHBondContact O-N 3.03Å; S638-N640 PolarHBondContact O-N 3.47Å; S638-R643 PolarHBondContact O-NH1 2.8Å; S638-S806 PolarHBondContact OG-OG 3.38Å; S638-D850 PolarHBondContact OG-OD2 3.15Å; S638-E876 WeakPolarHBondContact CB-OE2 3.4Å
639	I	93.6	Very high	93.1	Very high	46 Å²	46	26.8 Å²	26.8	24%	0.236	15%	0.151	C	C	.	.			trans	-72.5	108.2	-179.3	-57.8	165.9	0	0	0	109.3	F637 F649 P652 G877	F637-I639 PolarHBondContact O-N 2.94Å; I639-F649 HydrophobicContact CB-CD1 4.5Å; I639-F649 HydrophobicContact CD1-CB 4.48Å; I639-F649 HydrophobicContact CG1-CB 4.23Å; I639-F649 HydrophobicContact CG1-CD1 3.64Å; I639-F649 HydrophobicContact CG1-CE1 4.04Å; I639-F649 HydrophobicContact CG1-CG 3.94Å; I639-F649 HydrophobicContact CG2-CD2 4.26Å; I639-F649 HydrophobicContact CG2-CG 4.27Å; I639-P652 HydrophobicContact CD1-CB 4Å; I639-G877 VanDerWaalsContact CG1-O 3.31Å; I639-G877 WeakPolarHBondContact CG1-O 3.37Å; I639-G877 PolarHBondContact N-O 2.92Å
640	N	89.7	Confident	93.5	Very high	29 Å²	29	27 Å²	27	16%	0.155	15%	0.153	C	C	.	.			trans	-121.2	137.1	-179.8	175.8	-17.2	0	0	0	109.9	S638 A642 R643 S644	S638-N640 PolarHBondContact O-N 3.47Å; N640-A642 PolarHBondContact O-N 3.24Å; N640-A642 PolarHBondContact OD1-N 3.04Å; N640-R643 HydrophobicContact CB-CG 4.45Å; N640-R643 WeakPolarHBondContact O-CA 3.46Å; N640-R643 PolarHBondContact O-N 2.85Å; N640-S644 PolarHBondContact O-N 3.23Å; N640-S644 PolarHBondContact O-OG 2.97Å; N640-S644 VanDerWaalsContact O-OG 3.11Å
641	S	88.5	Confident	93.7	Very high	78 Å²	78	28.4 Å²	28.4	55%	0.545	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-34.5	173.9	169.6	0	0	0	0	114.8	Q645	S641-Q645 WeakPolarHBondContact O-CG 3.36Å
642	A	89.3	Confident	93.8	Very high	38 Å²	38	27.7 Å²	27.7	31%	0.314	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-30.1	177.6	0	0	0	0	0	113.3	W618 N640	W618-A642 HydrophobicContact CH2-CB 4.38Å; W618-A642 WeakPolarHBondContact CH2-O 3.34Å; W618-A642 WeakPolarHBondContact CZ2-O 3.44Å; N640-A642 PolarHBondContact O-N 3.24Å; N640-A642 PolarHBondContact OD1-N 3.04Å
643	R	92.4	Very high	93.8	Very high	3 Å²	3	27.9 Å²	27.9	1%	0.011	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-42.2	175.5	-64.4	-179.7	176.2	145.1	-0.5	110.7	G611 W618 V622 S638 N640 Q645 V646 I647 F649	G611-R643 PolarHBondContact O-NE 3.39Å; G611-R643 PolarHBondContact O-NH2 3.15Å; W618-R643 HydrophobicContact CZ3-CG 4.34Å; V622-R643 HydrophobicContact CG2-CG 4.1Å; S638-R643 PolarHBondContact O-NH1 2.8Å; N640-R643 HydrophobicContact CB-CG 4.45Å; N640-R643 WeakPolarHBondContact O-CA 3.46Å; N640-R643 PolarHBondContact O-N 2.85Å; R643-Q645 PolarHBondContact O-N 3.38Å; R643-V646 VanDerWaalsContact O-CG2 3.29Å; R643-V646 WeakPolarHBondContact O-CG2 3.16Å; R643-V646 PolarHBondContact O-N 3.41Å; R643-I647 HydrophobicContact CB-CD1 4.41Å; R643-I647 HydrophobicContact CB-CG1 4.36Å; R643-I647 VanDerWaalsContact O-CG1 3.26Å; R643-I647 WeakPolarHBondContact O-CG1 3.49Å; R643-I647 PolarHBondContact O-N 2.79Å; R643-F649 HydrophobicContact CB-CE2 3.79Å; R643-F649 HydrophobicContact CB-CZ 4.01Å
644	S	92.1	Very high	93.7	Very high	55 Å²	55	29.1 Å²	29.1	39%	0.385	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.7	178.3	-48.3	0	0	0	0	115	N640 I647	N640-S644 PolarHBondContact O-N 3.23Å; N640-S644 PolarHBondContact O-OG 2.97Å; N640-S644 VanDerWaalsContact O-OG 3.11Å; S644-I647 WeakPolarHBondContact CA-O 3.38Å
645	Q	92.6	Very high	93.5	Very high	139 Å²	139	33.3 Å²	33.3	65%	0.65	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-16.2	170.5	-77.7	173.9	-3.8	0	0	113.4	S641 R643 Q884	S641-Q645 WeakPolarHBondContact O-CG 3.36Å; R643-Q645 PolarHBondContact O-N 3.38Å; Q645-Q884 PolarHBondContact O-NE2 3.01Å
646	V	93.6	Very high	93.4	Very high	32 Å²	32	33.7 Å²	33.7	19%	0.194	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-17.2	-173.2	-61	0	0	0	0	114	W618 V622 L626 R643	W618-V646 HydrophobicContact CD2-CG2 4.49Å; W618-V646 HydrophobicContact CZ2-CG1 4.35Å; W618-V646 HydrophobicContact CZ2-CG2 3.88Å; V622-V646 HydrophobicContact CG1-CG2 3.87Å; L626-V646 HydrophobicContact CD1-CB 4.28Å; L626-V646 HydrophobicContact CD1-CG2 4.25Å; L626-V646 HydrophobicContact CD2-CB 4.34Å; L626-V646 WeakPolarHBondContact CD2-O 3.34Å; R643-V646 VanDerWaalsContact O-CG2 3.29Å; R643-V646 WeakPolarHBondContact O-CG2 3.16Å; R643-V646 PolarHBondContact O-N 3.41Å
647	I	95.3	Very high	93.4	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.4	173.6	53.3	164.1	0	0	0	110.1	V622 L625 L626 F637 R643 S644 F649 L882	V622-I647 HydrophobicContact CG1-CG2 4.45Å; V622-I647 HydrophobicContact CG2-CD1 4.28Å; L625-I647 HydrophobicContact CB-CG2 4Å; L625-I647 HydrophobicContact CD1-CB 4.39Å; L625-I647 HydrophobicContact CD1-CD1 3.93Å; L625-I647 HydrophobicContact CD1-CG2 3.98Å; L626-I647 HydrophobicContact CD2-CG2 4.41Å; L626-I647 HydrophobicContact CG-CG2 4.38Å; F637-I647 HydrophobicContact CE1-CD1 3.54Å; F637-I647 HydrophobicContact CZ-CD1 3.59Å; R643-I647 HydrophobicContact CB-CD1 4.41Å; R643-I647 HydrophobicContact CB-CG1 4.36Å; R643-I647 VanDerWaalsContact O-CG1 3.26Å; R643-I647 WeakPolarHBondContact O-CG1 3.49Å; R643-I647 PolarHBondContact O-N 2.79Å; S644-I647 WeakPolarHBondContact CA-O 3.38Å; I647-F649 HydrophobicContact CD1-CE1 4.49Å; I647-F649 HydrophobicContact CD1-CE2 3.73Å; I647-F649 HydrophobicContact CD1-CZ 3.72Å; I647-F649 HydrophobicContact CG1-CD2 4.45Å; I647-F649 HydrophobicContact CG1-CE2 3.84Å; I647-F649 HydrophobicContact CG1-CZ 4.35Å; I647-L882 WeakPolarHBondContact CB-O 3.32Å
648	D	95.8	Very high	93.4	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.193	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	150.9	173.3	-69.9	-0.1	0	0	0	109.7	L882 Q884 N885 S886 T889	D648-L882 HydrophobicContact CB-CB 4.2Å; D648-L882 PolarHBondContact N-O 2.94Å; D648-L882 PolarHBondContact O-N 3.36Å; D648-Q884 WeakPolarHBondContact OD1-CA 3.46Å; D648-N885 VanDerWaalsContact CG-N 3.33Å; D648-N885 PolarHBondContact OD1-N 2.7Å; D648-N885 WeakPolarHBondContact OD2-CA 3.27Å; D648-N885 PolarHBondContact OD2-N 2.94Å; D648-S886 PolarHBondContact OD2-N 3.48Å; D648-T889 HydrophobicContact CB-CG2 4.03Å; D648-T889 PolarHBondContact OD2-OG1 3.42Å
649	F	96.4	Very high	93.3	Very high	28 Å²	28	34.6 Å²	34.6	12%	0.123	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.6	172.3	-78	-88.8	0	0	0	110.6	F637 I639 R643 I647 I880	F637-F649 HydrophobicContact CD1-CD1 4.48Å; F637-F649 AromaticContact CD1-CE1 3.51Å; F637-F649 HydrophobicContact CD1-CE1 3.51Å; F637-F649 HydrophobicContact CD1-CZ 4.06Å; F637-F649 AromaticContact CE1-CE1 3.65Å; F637-F649 HydrophobicContact CE1-CE1 3.65Å; F637-F649 AromaticContact CE1-CZ 3.75Å; F637-F649 HydrophobicContact CE1-CZ 3.75Å; F637-F649 HydrophobicContact CG-CE1 4.07Å; F637-F649 HydrophobicContact CZ-CE1 4.32Å; F637-F649 HydrophobicContact CZ-CZ 4.02Å; I639-F649 HydrophobicContact CB-CD1 4.5Å; I639-F649 HydrophobicContact CD1-CB 4.48Å; I639-F649 HydrophobicContact CG1-CB 4.23Å; I639-F649 HydrophobicContact CG1-CD1 3.64Å; I639-F649 HydrophobicContact CG1-CE1 4.04Å; I639-F649 HydrophobicContact CG1-CG 3.94Å; I639-F649 HydrophobicContact CG2-CD2 4.26Å; I639-F649 HydrophobicContact CG2-CG 4.27Å; R643-F649 HydrophobicContact CB-CE2 3.79Å; R643-F649 HydrophobicContact CB-CZ 4.01Å; I647-F649 HydrophobicContact CD1-CE1 4.49Å; I647-F649 HydrophobicContact CD1-CE2 3.73Å; I647-F649 HydrophobicContact CD1-CZ 3.72Å; I647-F649 HydrophobicContact CG1-CD2 4.45Å; I647-F649 HydrophobicContact CG1-CE2 3.84Å; I647-F649 HydrophobicContact CG1-CZ 4.35Å; F649-I880 WeakPolarHBondContact CA-O 3.39Å
650	T	96.1	Very high	93.3	Very high	7 Å²	7	32.5 Å²	32.5	4%	0.043	20%	0.198	C	C	.	.			trans	-70.9	173.2	168.3	63.5	0	0	0	0	112.3	I880 L882 F892 S893	T650-I880 HydrophobicContact CG2-CB 3.73Å; T650-I880 HydrophobicContact CG2-CG2 4.25Å; T650-I880 PolarHBondContact N-O 2.69Å; T650-I880 PolarHBondContact OG1-N 3.17Å; T650-L882 HydrophobicContact CG2-CD1 3.86Å; T650-F892 HydrophobicContact CG2-CB 3.63Å; T650-S893 VanDerWaalsContact CA-OG 3.25Å; T650-S893 WeakPolarHBondContact CA-OG 3.44Å
651	S	94.6	Very high	93.4	Very high	28 Å²	28	31.1 Å²	31.1	20%	0.196	19%	0.191	C	C	.	.	S	Bend	trans	-49	145.2	155.6	56.6	0	0	0	0	111.1	F653 S893 V896 S897	S651-F653 PolarHBondContact O-N 2.89Å; S651-S893 PolarHBondContact N-OG 3.41Å; S651-S893 VanDerWaalsContact N-OG 3.13Å; S651-S893 WeakPolarHBondContact OG-CA 3.27Å; S651-S893 PolarHBondContact OG-O 3.13Å; S651-V896 WeakPolarHBondContact OG-CG1 3.48Å; S651-S897 PolarHBondContact OG-OG 2.58Å
652	P	95.6	Very high	93.5	Very high	60 Å²	60	27.5 Å²	27.5	39%	0.39	17%	0.166	S	C	.	.			trans	-75.3	115.6	-174.6	27.6	-33.5	0	0	0	111.6	I639 Y878	I639-P652 HydrophobicContact CD1-CB 4Å; P652-Y878 CarbonylContact C-O 3.53Å; P652-Y878 VanDerWaalsContact CA-O 3.24Å; P652-Y878 WeakPolarHBondContact CA-O 3.32Å
653	F	94.9	Very high	93.4	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.022	16%	0.159	C	C	.	.	S	Bend	trans	-74.2	-31.3	179	68.3	-97.9	0	0	0	112	F530 Y584 L588 S651 Y878 I880 V896 M905	F530-F653 HydrophobicContact CE1-CE2 4.38Å; Y584-F653 HydrophobicContact CD1-CE2 4.19Å; Y584-F653 AromaticContact CE1-CD2 3.78Å; Y584-F653 HydrophobicContact CE1-CD2 3.78Å; Y584-F653 AromaticContact CE1-CE2 3.89Å; Y584-F653 HydrophobicContact CE1-CE2 3.89Å; L588-F653 HydrophobicContact CD2-CB 4.07Å; L588-F653 HydrophobicContact CD2-CD1 4.24Å; L588-F653 HydrophobicContact CD2-CD2 3.87Å; L588-F653 HydrophobicContact CD2-CE2 4.35Å; L588-F653 HydrophobicContact CD2-CG 3.82Å; S651-F653 PolarHBondContact O-N 2.89Å; F653-Y878 WeakPolarHBondContact CD1-O 3.43Å; F653-Y878 HydrophobicContact CZ-CG 4.48Å; F653-Y878 PolarHBondContact N-O 2.97Å; F653-I880 HydrophobicContact CD1-CG1 4.28Å; F653-I880 HydrophobicContact CE1-CG1 4.31Å; F653-V896 HydrophobicContact CB-CG1 3.7Å; F653-M905 HydrophobicContact CB-CE 3.73Å; F653-M905 HydrophobicContact CB-SD 4.14Å
654	F	94.5	Very high	92.7	Very high	26 Å²	26	29 Å²	29	11%	0.114	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146	178.3	-157.6	-86.6	0	0	0	110.8	F530 Y584 A852 G877 Y878 H909 Y913	F530-F654 HydrophobicContact CE1-CD2 4.01Å; F530-F654 HydrophobicContact CE1-CE2 4.33Å; F530-F654 HydrophobicContact CE1-CG 4.17Å; F530-F654 HydrophobicContact CZ-CD1 4.15Å; F530-F654 HydrophobicContact CZ-CD2 4.13Å; F530-F654 HydrophobicContact CZ-CE1 4.18Å; F530-F654 HydrophobicContact CZ-CE2 4.14Å; F530-F654 HydrophobicContact CZ-CG 4.14Å; F530-F654 HydrophobicContact CZ-CZ 4.17Å; Y584-F654 HydrophobicContact CE1-CD2 4.42Å; Y584-F654 HydrophobicContact CE2-CD2 4.31Å; Y584-F654 HydrophobicContact CE2-CE2 4.36Å; Y584-F654 AromaticContact CZ-CD2 3.99Å; F654-A852 HydrophobicContact CD1-CB 4.37Å; F654-A852 HydrophobicContact CE1-CB 3.63Å; F654-A852 HydrophobicContact CZ-CB 4.32Å; F654-G877 WeakPolarHBondContact O-CA 3.33Å; F654-Y878 HydrophobicContact CB-CD2 3.72Å; F654-Y878 HydrophobicContact CB-CG 4.28Å; F654-Y878 AromaticContact CD1-CD2 3.91Å; F654-Y878 HydrophobicContact CD1-CD2 3.91Å; F654-Y878 AromaticContact CD1-CE2 3.97Å; F654-Y878 HydrophobicContact CD1-CE2 3.97Å; F654-Y878 HydrophobicContact CG-CD2 4.04Å; F654-Y878 HydrophobicContact CG-CE2 4.48Å; F654-Y878 PolarHBondContact O-N 3.38Å; F654-H909 AromaticContact CE2-ND1 3.73Å; F654-H909 AromaticContact CZ-ND1 3.99Å; F654-Y913 HydrophobicContact CE2-CE2 4.15Å; F654-Y913 HydrophobicContact CZ-CE2 4.2Å; F654-Y913 AromaticContact CZ-CZ 3.96Å
655	S	92.5	Very high	91.7	Very high	88 Å²	88	31.3 Å²	31.3	62%	0.615	17%	0.167	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.1	177.8	-170.3	0	0	0	0	109.7
656	T	92.9	Very high	90.2	Very high	8 Å²	8	30.7 Å²	30.7	5%	0.049	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	-178.5	-177.6	-164.4	0	0	0	0	111	E876 Y878	T656-E876 CarbonylContact C-O 3.48Å; T656-E876 HydrophobicContact CG2-CB 4.11Å; T656-E876 WeakPolarHBondContact CG2-O 3.43Å; T656-E876 PolarHBondContact N-O 2.96Å; T656-E876 PolarHBondContact O-N 3.45Å; T656-E876 VanDerWaalsContact O-N 3.09Å; T656-Y878 HydrophobicContact CG2-CD1 4.04Å; T656-Y878 HydrophobicContact CG2-CE1 3.5Å; T656-Y878 VanDerWaalsContact CG2-CE1 3.5Å; T656-Y878 PolarHBondContact OG1-OH 2.92Å
657	S	93.4	Very high	88.4	Confident	13 Å²	13	33.3 Å²	33.3	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	165.9	172	48	0	0	0	0	108.6	D850 K851 P872 A874	S657-D850 CarbonylContact O-C 3.6Å; S657-K851 WeakPolarHBondContact O-CB 3.32Å; S657-K851 PolarHBondContact O-N 2.96Å; S657-P872 WeakPolarHBondContact OG-CB 3.29Å; S657-A874 VanDerWaalsContact CA-O 3.3Å; S657-A874 WeakPolarHBondContact CA-O 3.28Å
658	L	93.4	Very high	86.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.7	169.2	-63.9	-179.9	0	0	0	111.2	A807 Y810 D850 F873 A874	L658-A807 HydrophobicContact CD1-CB 4.42Å; L658-A807 HydrophobicContact CD2-CB 3.64Å; L658-Y810 HydrophobicContact CD1-CD1 3.45Å; L658-Y810 VanDerWaalsContact CD1-CD1 3.45Å; L658-Y810 HydrophobicContact CD1-CE1 4.24Å; L658-Y810 HydrophobicContact CD1-CG 3.72Å; L658-D850 VanDerWaalsContact CD2-OD1 3.24Å; L658-D850 WeakPolarHBondContact CD2-OD1 3.45Å; L658-F873 HydrophobicContact CB-CD2 3.93Å; L658-F873 HydrophobicContact CB-CE1 4.15Å; L658-F873 HydrophobicContact CB-CE2 3.5Å; L658-F873 HydrophobicContact CB-CG 4.43Å; L658-F873 HydrophobicContact CB-CZ 3.62Å; L658-F873 WeakPolarHBondContact CB-O 3.5Å; L658-F873 HydrophobicContact CD1-CD2 4.34Å; L658-F873 HydrophobicContact CD1-CE2 3.78Å; L658-F873 HydrophobicContact CG-CE2 4.29Å; L658-F873 PolarHBondContact N-O 3.48Å; L658-F873 WeakPolarHBondContact O-CD1 3.24Å; L658-F873 PolarHBondContact O-N 2.84Å; L658-A874 HydrophobicContact CB-CB 4.34Å; L658-A874 HydrophobicContact CD1-CB 3.77Å; L658-A874 HydrophobicContact CG-CB 3.91Å; L658-A874 PolarHBondContact N-O 3.46Å
659	G	92.6	Very high	84.9	Confident	6 Å²	6	35.8 Å²	35.8	6%	0.062	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	170.4	175.6	0	0	0	0	0	111.9	M849	G659-M849 PolarHBondContact N-O 3.08Å; G659-M849 PolarHBondContact O-N 3.06Å
660	I	93.4	Very high	83.6	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.3	178.1	-52.6	175.7	0	0	0	108.2	V662 L782 I785 L790 A846 F847 I848 T868 V869 F873	I660-V662 HydrophobicContact CG2-CG1 4.4Å; I660-L782 HydrophobicContact CG2-CD1 3.9Å; I660-I785 HydrophobicContact CD1-CB 4.37Å; I660-I785 HydrophobicContact CD1-CD1 4.22Å; I660-L790 HydrophobicContact CD1-CD1 3.93Å; I660-A846 HydrophobicContact CG2-CB 3.93Å; I660-F847 CarbonylContact C-O 3.56Å; I660-F847 WeakPolarHBondContact CA-O 3.33Å; I660-I848 HydrophobicContact CG1-CG1 4.33Å; I660-T868 CarbonylContact O-C 3.51Å; I660-T868 VanDerWaalsContact O-CA 3.29Å; I660-T868 WeakPolarHBondContact O-CA 3.5Å; I660-V869 HydrophobicContact CB-CG2 3.97Å; I660-V869 HydrophobicContact CG2-CG2 4Å; I660-V869 WeakPolarHBondContact O-CG2 3.49Å; I660-V869 PolarHBondContact O-N 2.9Å; I660-F873 HydrophobicContact CD1-CE1 4.3Å; I660-F873 HydrophobicContact CG1-CE1 4.09Å; I660-F873 HydrophobicContact CG1-CZ 4.45Å
661	L	92.1	Very high	82.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	133.2	174.7	-166.9	74.7	0	0	0	110.2	I834 L837 A846 F847 L854 V858 T866 T868	L661-I834 HydrophobicContact CD2-CG1 4.18Å; L661-L837 HydrophobicContact CB-CD2 4.13Å; L661-L837 HydrophobicContact CD2-CD2 3.62Å; L661-L837 HydrophobicContact CG-CD2 3.67Å; L661-A846 CarbonylContact O-C 3.55Å; L661-A846 WeakPolarHBondContact O-CA 3.38Å; L661-F847 HydrophobicContact CB-CB 4.45Å; L661-F847 PolarHBondContact N-O 2.95Å; L661-F847 PolarHBondContact O-N 2.81Å; L661-L854 HydrophobicContact CB-CD1 4.14Å; L661-L854 HydrophobicContact CB-CD2 3.96Å; L661-L854 HydrophobicContact CB-CG 4.5Å; L661-L854 HydrophobicContact CD1-CB 4.42Å; L661-L854 HydrophobicContact CD2-CD2 4.23Å; L661-V858 HydrophobicContact CD1-CG2 3.33Å; L661-T866 HydrophobicContact CD2-CG2 4.45Å; L661-T868 HydrophobicContact CD1-CG2 4.3Å
662	V	90.4	Very high	81.8	Confident	2 Å²	2	43 Å²	43	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.9	173.4	-63.3	0	0	0	0	110.6	I660 L782 A846 T866 L867 V869	I660-V662 HydrophobicContact CG2-CG1 4.4Å; V662-L782 HydrophobicContact CG1-CD1 4.02Å; V662-A846 HydrophobicContact CG1-CB 3.95Å; V662-T866 WeakPolarHBondContact O-CA 3.31Å; V662-L867 HydrophobicContact CG2-CD1 3.75Å; V662-L867 HydrophobicContact CG2-CG 4.41Å; V662-L867 PolarHBondContact N-O 3.09Å; V662-L867 PolarHBondContact O-N 2.82Å; V662-V869 HydrophobicContact CG1-CG2 3.79Å; V662-V869 HydrophobicContact CG2-CB 4.46Å; V662-V869 HydrophobicContact CG2-CG1 3.62Å; V662-V869 HydrophobicContact CG2-CG2 4.02Å
663	R	86.7	Confident	80.8	Confident	44 Å²	44	40.9 Å²	40.9	17%	0.166	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129	167.9	-175.1	155.7	169.9	98.2	-6.9	109.4	Q781 L837 D863 K865 T866	R663-Q781 PolarHBondContact O-NE2 3.47Å; R663-L837 HydrophobicContact CB-CG 4.29Å; R663-D863 IonicContact CZ-OD2 3.29Å; R663-D863 IonicContact NH1-OD2 2.67Å; R663-D863 PolarHBondContact NH1-OD2 3.22Å; R663-D863 IonicContact NH2-OD2 3.49Å; R663-D863 PolarHBondContact NH2-OD2 3.04Å; R663-K865 CarbonylContact C-O 3.54Å; R663-K865 VanDerWaalsContact CA-O 3.28Å; R663-K865 WeakPolarHBondContact CA-O 3.38Å; R663-K865 HydrophobicContact CG-CB 4.39Å; R663-T866 HydrophobicContact CB-CG2 4.35Å
664	T	78.6	Confident	80.1	Confident	28 Å²	28	42.9 Å²	42.9	17%	0.172	25%	0.254	C	S	.	.			trans	-63.1	154	173.1	60.7	0	0	0	0	109.9	K865 L867	T664-K865 PolarHBondContact N-O 3.39Å; T664-K865 PolarHBondContact OG1-O 2.96Å; T664-L867 HydrophobicContact CG2-CD2 3.46Å; T664-L867 VanDerWaalsContact CG2-CD2 3.46Å; T664-L867 HydrophobicContact CG2-CG 3.89Å
665	R	70.7	Confident	79.6	Confident	105 Å²	105	46 Å²	46	40%	0.396	27%	0.27	S	S	.	.			trans	-123.8	124.6	176.3	-74.4	175.8	172.4	147.8	-7.6	107.9	T667 D845	R665-T667 PolarHBondContact O-N 2.84Å; R665-D845 IonicContact CZ-OD1 3.08Å; R665-D845 IonicContact NH1-OD1 2.74Å; R665-D845 IonicContact NH2-OD1 3.36Å; R665-D845 PolarHBondContact NH2-OD1 2.8Å
666	D	61.3	Low	79.2	Confident	126 Å²	126	48.5 Å²	48.5	67%	0.674	27%	0.266	S	S	*	.			trans	-71.9	74.7	-179.8	-57.6	-51	0	0	0	110.2	A668 K865	D666-A668 PolarHBondContact O-N 3.13Å; D666-K865 IonicContact OD1-NZ 3.9Å; D666-K865 IonicContact OD2-NZ 3.61Å; D666-K865 PolarHBondContact OD2-NZ 3.42Å
667	T	55.4	Low	78.9	Confident	86 Å²	86	48.5 Å²	48.5	53%	0.528	27%	0.266	S	S	.	.			trans	-68.3	103.1	-177.9	55.5	0	0	0	0	110.1	R665 A669	R665-T667 PolarHBondContact O-N 2.84Å; T667-A669 PolarHBondContact O-N 3.15Å
668	A	56.3	Low	78.6	Confident	61 Å²	61	49 Å²	49	50%	0.504	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-53.1	133.7	169.3	0	0	0	0	0	109.7	D666	D666-A668 PolarHBondContact O-N 3.13Å
669	A	61.2	Low	78.4	Confident	29 Å²	29	54.4 Å²	54.4	24%	0.24	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-56.5	133.3	-179.9	0	0	0	0	0	110	T667 A673	T667-A669 PolarHBondContact O-N 3.15Å; A669-A673 HydrophobicContact CB-CB 4.06Å
670	P	69.6	Low	78.3	Confident	70 Å²	70	62.5 Å²	62.5	46%	0.455	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-62.6	151.5	-176.7	25.3	-33.7	0	0	0	110.5	G672 A673 W676	P670-G672 PolarHBondContact O-N 3.31Å; P670-A673 HydrophobicContact CG-CB 4.29Å; P670-A673 WeakPolarHBondContact O-CB 3.36Å; P670-A673 PolarHBondContact O-N 2.9Å; P670-W676 HydrophobicContact CG-CH2 3.53Å; P670-W676 HydrophobicContact CG-CZ2 3.38Å
671	I	77.4	Confident	78.3	Confident	111 Å²	111	64.6 Å²	64.6	57%	0.569	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.5	-169.9	-57.3	177.9	0	0	0	112.7	F674 G938	I671-F674 WeakPolarHBondContact O-CD1 3.48Å; I671-F674 WeakPolarHBondContact O-CE1 3.27Å; I671-G938 VanDerWaalsContact CG2-CA 3.43Å; I671-G938 WeakPolarHBondContact O-CA 3.45Å
672	G	74.8	Confident	78.2	Confident	33 Å²	33	69.3 Å²	69.3	34%	0.34	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.8	176.6	0	0	0	0	0	116.8	P670 F674 M675	P670-G672 PolarHBondContact O-N 3.31Å; G672-F674 PolarHBondContact O-N 2.94Å; G672-F674 VanDerWaalsContact O-N 3.15Å; G672-M675 WeakPolarHBondContact O-CB 3.23Å; G672-M675 PolarHBondContact O-N 3.48Å
673	A	75.8	Confident	78.3	Confident	15 Å²	15	73.6 Å²	73.6	12%	0.124	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-60.1	-27.9	-173	0	0	0	0	0	113.8	A669 P670 M675 W676	A669-A673 HydrophobicContact CB-CB 4.06Å; P670-A673 HydrophobicContact CG-CB 4.29Å; P670-A673 WeakPolarHBondContact O-CB 3.36Å; P670-A673 PolarHBondContact O-N 2.9Å; A673-M675 PolarHBondContact O-N 3.36Å; A673-M675 VanDerWaalsContact O-N 3.14Å; A673-W676 HydrophobicContact CB-CD2 4.16Å; A673-W676 HydrophobicContact CB-CE3 4.11Å; A673-W676 HydrophobicContact CB-CZ3 4.32Å; A673-W676 VanDerWaalsContact O-CB 3.31Å; A673-W676 WeakPolarHBondContact O-CB 3.43Å; A673-W676 PolarHBondContact O-N 3.46Å; A673-W676 VanDerWaalsContact O-N 3.07Å
674	F	79.2	Confident	78.5	Confident	48 Å²	48	75.8 Å²	75.8	21%	0.211	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-61.9	-18.4	174.6	71.8	-91	0	0	0	113.7	I671 G672 P677 Y765 L939 M942	I671-F674 WeakPolarHBondContact O-CD1 3.48Å; I671-F674 WeakPolarHBondContact O-CE1 3.27Å; G672-F674 PolarHBondContact O-N 2.94Å; G672-F674 VanDerWaalsContact O-N 3.15Å; F674-P677 WeakPolarHBondContact O-CD 3.3Å; F674-Y765 PolarHBondContact O-OH 3.06Å; F674-L939 HydrophobicContact CB-CD2 4.07Å; F674-L939 HydrophobicContact CB-CG 4.47Å; F674-L939 HydrophobicContact CD1-CD2 3.97Å; F674-L939 HydrophobicContact CD1-CG 4.42Å; F674-L939 HydrophobicContact CD2-CD2 3.59Å; F674-L939 HydrophobicContact CE1-CD2 4.33Å; F674-L939 HydrophobicContact CE2-CD2 3.98Å; F674-L939 HydrophobicContact CG-CD2 3.6Å; F674-L939 HydrophobicContact CG-CG 4.3Å; F674-L939 HydrophobicContact CZ-CD2 4.34Å; F674-M942 HydrophobicContact CZ-CG 4.01Å
675	M	83.9	Confident	79.2	Confident	91 Å²	91	76.2 Å²	76.2	45%	0.448	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-86	-19	175.9	-60.7	-173.1	68.7	0	0	113.2	G672 A673 L678 W683	G672-M675 WeakPolarHBondContact O-CB 3.23Å; G672-M675 PolarHBondContact O-N 3.48Å; A673-M675 PolarHBondContact O-N 3.36Å; A673-M675 VanDerWaalsContact O-N 3.14Å; M675-L678 PolarHBondContact O-N 3.3Å; M675-W683 PolarHBondContact O-NE1 2.93Å
676	W	83.7	Confident	80.2	Confident	140 Å²	140	72.3 Å²	72.3	53%	0.53	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.4	-176.7	-66.1	-6.4	0	0	0	116.4	P670 A673 L678 V772	P670-W676 HydrophobicContact CG-CH2 3.53Å; P670-W676 HydrophobicContact CG-CZ2 3.38Å; A673-W676 HydrophobicContact CB-CD2 4.16Å; A673-W676 HydrophobicContact CB-CE3 4.11Å; A673-W676 HydrophobicContact CB-CZ3 4.32Å; A673-W676 VanDerWaalsContact O-CB 3.31Å; A673-W676 WeakPolarHBondContact O-CB 3.43Å; A673-W676 PolarHBondContact O-N 3.46Å; A673-W676 VanDerWaalsContact O-N 3.07Å; W676-L678 PolarHBondContact O-N 3.01Å; W676-L678 VanDerWaalsContact O-N 3.09Å; W676-V772 HydrophobicContact CE3-CG1 4.45Å
677	P	86.6	Confident	81.7	Confident	8 Å²	8	71.7 Å²	71.7	5%	0.052	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.2	179.8	-26.9	36.7	0	0	0	115.4	F674 Y765 N768 L769	F674-P677 WeakPolarHBondContact O-CD 3.3Å; P677-Y765 HydrophobicContact CB-CD2 4.05Å; P677-Y765 HydrophobicContact CB-CE2 4.13Å; P677-Y765 HydrophobicContact CG-CE2 4.19Å; P677-N768 HydrophobicContact CB-CB 3.79Å; P677-N768 WeakPolarHBondContact O-CB 3.48Å; P677-N768 PolarHBondContact O-ND2 2.93Å; P677-L769 HydrophobicContact CB-CB 4.26Å; P677-L769 HydrophobicContact CG-CB 3.8Å; P677-L769 HydrophobicContact CG-CD1 3.78Å; P677-L769 HydrophobicContact CG-CG 4.38Å
678	L	87.1	Confident	83.5	Confident	24 Å²	24	71.1 Å²	71.1	13%	0.126	38%	0.375	C	S	.	.	S	Bend	trans	-134.7	125.2	176.3	-72.7	176.8	0	0	0	110.1	M675 W676 M682 W683 I686 Y765	M675-L678 PolarHBondContact O-N 3.3Å; W676-L678 PolarHBondContact O-N 3.01Å; W676-L678 VanDerWaalsContact O-N 3.09Å; L678-M682 HydrophobicContact CB-CB 4.35Å; L678-M682 HydrophobicContact CD2-CB 4.31Å; L678-W683 HydrophobicContact CB-CD2 4.48Å; L678-W683 HydrophobicContact CB-CZ2 4.15Å; L678-W683 HydrophobicContact CD1-CH2 4.34Å; L678-W683 HydrophobicContact CD1-CZ2 4.13Å; L678-W683 VanDerWaalsContact O-CD1 3.23Å; L678-W683 PolarHBondContact O-NE1 2.78Å; L678-I686 HydrophobicContact CD1-CD1 4.22Å; L678-Y765 HydrophobicContact CD1-CD2 3.96Å; L678-Y765 HydrophobicContact CG-CD2 4.18Å
679	H	89.4	Confident	85.3	Confident	115 Å²	115	69.8 Å²	69.8	53%	0.532	36%	0.361	S	S	.	.			trans	-59.5	148.6	174.6	-174	-104.1	0	0	0	111.2	S681 M682 W683	H679-S681 PolarHBondContact ND1-OG 3.33Å; H679-S681 PolarHBondContact O-N 3.32Å; H679-M682 WeakPolarHBondContact O-CA 3.47Å; H679-M682 WeakPolarHBondContact O-CB 3.19Å; H679-M682 PolarHBondContact O-N 2.97Å; H679-W683 PolarHBondContact O-N 3.35Å
680	W	90.2	Very high	86.8	Confident	175 Å²	175	68.5 Å²	68.5	66%	0.663	35%	0.35	S	S	*	.	H	α-helix	trans	-55.2	-31.5	-173.7	71.5	-96.1	0	0	0	113.9	M682 W683 L684	W680-M682 VanDerWaalsContact C-N 3.31Å; W680-M682 PolarHBondContact O-N 3.38Å; W680-W683 PolarHBondContact O-N 3.07Å; W680-L684 HydrophobicContact CZ3-CD2 4.02Å; W680-L684 PolarHBondContact O-N 2.88Å
681	S	93.2	Very high	87.8	Confident	45 Å²	45	67.6 Å²	67.6	32%	0.315	34%	0.34	S	S	.	.	H	α-helix	trans	-68.2	-25.8	175.4	61.4	0	0	0	0	113.9	H679 G685	H679-S681 PolarHBondContact ND1-OG 3.33Å; H679-S681 PolarHBondContact O-N 3.32Å; S681-G685 PolarHBondContact O-N 2.89Å
682	M	91.5	Very high	88.6	Confident	100 Å²	100	65.7 Å²	65.7	49%	0.493	33%	0.333	S	S	.	.	H	α-helix	trans	-74.4	-41.9	173.1	-61.4	-65.5	95.5	0	0	111	L678 H679 W680 L684 G685 I686	L678-M682 HydrophobicContact CB-CB 4.35Å; L678-M682 HydrophobicContact CD2-CB 4.31Å; H679-M682 WeakPolarHBondContact O-CA 3.47Å; H679-M682 WeakPolarHBondContact O-CB 3.19Å; H679-M682 PolarHBondContact O-N 2.97Å; W680-M682 VanDerWaalsContact C-N 3.31Å; W680-M682 PolarHBondContact O-N 3.38Å; M682-L684 VanDerWaalsContact C-N 3.33Å; M682-L684 PolarHBondContact O-N 2.89Å; M682-G685 PolarHBondContact O-N 3.31Å; M682-G685 VanDerWaalsContact O-N 3.16Å; M682-I686 WeakPolarHBondContact O-CG1 3.35Å; M682-I686 PolarHBondContact O-N 2.91Å
683	W	90.8	Very high	89.4	Confident	91 Å²	91	65 Å²	65	35%	0.345	32%	0.323	S	S	.	.	H	α-helix	trans	-58.4	-45.2	172.5	-68.3	106.5	0	0	0	111.6	M675 L678 H679 W680 I686 F687 Y765	M675-W683 PolarHBondContact O-NE1 2.93Å; L678-W683 HydrophobicContact CB-CD2 4.48Å; L678-W683 HydrophobicContact CB-CZ2 4.15Å; L678-W683 HydrophobicContact CD1-CH2 4.34Å; L678-W683 HydrophobicContact CD1-CZ2 4.13Å; L678-W683 VanDerWaalsContact O-CD1 3.23Å; L678-W683 PolarHBondContact O-NE1 2.78Å; H679-W683 PolarHBondContact O-N 3.35Å; W680-W683 PolarHBondContact O-N 3.07Å; W683-I686 PolarHBondContact O-N 3.43Å; W683-F687 PolarHBondContact O-N 2.87Å; W683-Y765 HydrophobicContact CH2-CD2 4.12Å; W683-Y765 AromaticContact CH2-CE2 3.89Å; W683-Y765 HydrophobicContact CH2-CE2 3.89Å; W683-Y765 HydrophobicContact CZ2-CD2 4.16Å; W683-Y765 AromaticContact CZ2-CE2 3.87Å; W683-Y765 HydrophobicContact CZ2-CE2 3.87Å
684	L	92.8	Very high	90.1	Very high	90 Å²	90	64.3 Å²	64.3	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-40.5	173.7	-178	59.9	0	0	0	112	W680 M682 F687 V688	W680-L684 HydrophobicContact CZ3-CD2 4.02Å; W680-L684 PolarHBondContact O-N 2.88Å; M682-L684 VanDerWaalsContact C-N 3.33Å; M682-L684 PolarHBondContact O-N 2.89Å; L684-F687 PolarHBondContact O-N 2.89Å; L684-V688 HydrophobicContact CD1-CG2 4.2Å; L684-V688 HydrophobicContact CG-CG2 4.49Å; L684-V688 WeakPolarHBondContact O-CG2 3.47Å; L684-V688 PolarHBondContact O-N 3.24Å
685	G	92.4	Very high	90.6	Very high	37 Å²	37	65 Å²	65	38%	0.381	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-44.1	175.8	0	0	0	0	0	113.4	S681 M682 V688 S689	S681-G685 PolarHBondContact O-N 2.89Å; M682-G685 PolarHBondContact O-N 3.31Å; M682-G685 VanDerWaalsContact O-N 3.16Å; G685-V688 PolarHBondContact O-N 3.35Å; G685-S689 WeakPolarHBondContact O-CB 3.33Å; G685-S689 PolarHBondContact O-N 2.68Å; G685-S689 PolarHBondContact O-OG 3.31Å
686	I	92.3	Very high	90.8	Very high	23 Å²	23	65 Å²	65	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-41.1	175.6	-66.6	162.9	0	0	0	110.9	L678 M682 W683 S689 L690 L732 C761	L678-I686 HydrophobicContact CD1-CD1 4.22Å; M682-I686 WeakPolarHBondContact O-CG1 3.35Å; M682-I686 PolarHBondContact O-N 2.91Å; W683-I686 PolarHBondContact O-N 3.43Å; I686-S689 PolarHBondContact O-OG 3.46Å; I686-L690 VanDerWaalsContact O-CB 3.3Å; I686-L690 WeakPolarHBondContact O-CB 3.22Å; I686-L690 PolarHBondContact O-N 3.28Å; I686-L732 HydrophobicContact CG2-CD1 4.13Å; I686-L732 HydrophobicContact CG2-CD2 3.78Å; I686-C761 HydrophobicContact CD1-CB 4.41Å
687	F	92.1	Very high	91	Very high	113 Å²	113	58.5 Å²	58.5	50%	0.496	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-46.5	175.9	179.8	-89.3	0	0	0	111.8	W683 L684 H691	W683-F687 PolarHBondContact O-N 2.87Å; L684-F687 PolarHBondContact O-N 2.89Å; F687-H691 AromaticContact CD2-CE1 3.88Å; F687-H691 AromaticContact CE1-CE1 3.84Å; F687-H691 AromaticContact CE1-ND1 3.87Å; F687-H691 AromaticContact CE2-CE1 3.4Å; F687-H691 VanDerWaalsContact CE2-CE1 3.4Å; F687-H691 WeakPolarHBondContact CE2-CE1 3.46Å; F687-H691 AromaticContact CZ-CE1 3.38Å; F687-H691 WeakPolarHBondContact CZ-CE1 3.42Å; F687-H691 AromaticContact CZ-ND1 3.89Å; F687-H691 PolarHBondContact O-N 3.44Å; F687-H691 PolarHBondContact O-ND1 2.97Å
688	V	93.7	Very high	90.8	Very high	75 Å²	75	58.5 Å²	58.5	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-66.5	-46.4	179	171.8	0	0	0	0	111.1	L684 G685 L690 H691 V692	L684-V688 HydrophobicContact CD1-CG2 4.2Å; L684-V688 HydrophobicContact CG-CG2 4.49Å; L684-V688 WeakPolarHBondContact O-CG2 3.47Å; L684-V688 PolarHBondContact O-N 3.24Å; G685-V688 PolarHBondContact O-N 3.35Å; V688-L690 VanDerWaalsContact C-N 3.33Å; V688-L690 PolarHBondContact O-N 3Å; V688-H691 PolarHBondContact O-N 3.48Å; V688-V692 HydrophobicContact CG1-CG2 4.24Å; V688-V692 WeakPolarHBondContact O-CG2 3.39Å; V688-V692 PolarHBondContact O-N 2.87Å
689	S	93.1	Very high	90.6	Very high	32 Å²	32	60.1 Å²	60.1	22%	0.224	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-37.7	-179.3	68.7	0	0	0	0	112.4	G685 I686 H691 V692 T693	G685-S689 WeakPolarHBondContact O-CB 3.33Å; G685-S689 PolarHBondContact O-N 2.68Å; G685-S689 PolarHBondContact O-OG 3.31Å; I686-S689 PolarHBondContact O-OG 3.46Å; S689-H691 PolarHBondContact O-N 3.36Å; S689-V692 PolarHBondContact O-N 3.26Å; S689-T693 WeakPolarHBondContact O-CB 3.5Å; S689-T693 PolarHBondContact O-N 3.1Å; S689-T693 PolarHBondContact O-OG1 3.31Å
690	L	93.1	Very high	90.4	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-46.4	174.8	-178.3	148.2	0	0	0	112.3	I686 V688 A694 L725 C728 Y729 L732 W754	I686-L690 VanDerWaalsContact O-CB 3.3Å; I686-L690 WeakPolarHBondContact O-CB 3.22Å; I686-L690 PolarHBondContact O-N 3.28Å; V688-L690 VanDerWaalsContact C-N 3.33Å; V688-L690 PolarHBondContact O-N 3Å; L690-A694 WeakPolarHBondContact O-CB 3.29Å; L690-A694 PolarHBondContact O-N 2.99Å; L690-L725 HydrophobicContact CD2-CD2 3.72Å; L690-C728 HydrophobicContact CD1-CB 4.29Å; L690-C728 HydrophobicContact CD2-CB 4.36Å; L690-C728 HydrophobicContact CG-CB 3.88Å; L690-Y729 HydrophobicContact CD1-CD1 3.43Å; L690-Y729 VanDerWaalsContact CD1-CD1 3.43Å; L690-Y729 HydrophobicContact CD1-CD2 4.25Å; L690-Y729 HydrophobicContact CD1-CE1 3.53Å; L690-Y729 HydrophobicContact CD1-CE2 4.33Å; L690-Y729 HydrophobicContact CD1-CG 3.82Å; L690-Y729 HydrophobicContact CD2-CD1 4.4Å; L690-Y729 HydrophobicContact CD2-CD2 3.92Å; L690-Y729 HydrophobicContact CD2-CE1 4.07Å; L690-Y729 HydrophobicContact CD2-CE2 3.54Å; L690-Y729 HydrophobicContact CD2-CG 4.33Å; L690-Y729 HydrophobicContact CG-CE1 4.48Å; L690-L732 HydrophobicContact CD1-CB 4.44Å; L690-L732 HydrophobicContact CD1-CD2 3.71Å; L690-W754 VanDerWaalsContact CA-CH2 3.41Å; L690-W754 HydrophobicContact CB-CH2 3.7Å; L690-W754 HydrophobicContact CB-CZ2 3.81Å; L690-W754 HydrophobicContact CD1-CZ2 4.05Å; L690-W754 HydrophobicContact CG-CH2 4.4Å; L690-W754 HydrophobicContact CG-CZ2 3.99Å
691	H	91.7	Very high	89.9	Confident	52 Å²	52	51.7 Å²	51.7	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-70	-40.6	-179.9	-72.8	81.5	0	0	0	111.6	F687 V688 S689 A694 V695 Y729	F687-H691 AromaticContact CD2-CE1 3.88Å; F687-H691 AromaticContact CE1-CE1 3.84Å; F687-H691 AromaticContact CE1-ND1 3.87Å; F687-H691 AromaticContact CE2-CE1 3.4Å; F687-H691 VanDerWaalsContact CE2-CE1 3.4Å; F687-H691 WeakPolarHBondContact CE2-CE1 3.46Å; F687-H691 AromaticContact CZ-CE1 3.38Å; F687-H691 WeakPolarHBondContact CZ-CE1 3.42Å; F687-H691 AromaticContact CZ-ND1 3.89Å; F687-H691 PolarHBondContact O-N 3.44Å; F687-H691 PolarHBondContact O-ND1 2.97Å; V688-H691 PolarHBondContact O-N 3.48Å; S689-H691 PolarHBondContact O-N 3.36Å; H691-A694 PolarHBondContact O-N 2.03Å; H691-V695 WeakPolarHBondContact O-CG2 3.37Å; H691-V695 PolarHBondContact O-N 3.34Å; H691-Y729 PolarHBondContact CE1-OH 2.96Å
692	V	93.2	Very high	89.1	Confident	70 Å²	70	55.1 Å²	55.1	42%	0.424	28%	0.277	S	S	.	.	H	α-helix	trans	-60.7	-47.1	175	169.9	0	0	0	0	111.1	V688 S689 A694 V695 F696	V688-V692 HydrophobicContact CG1-CG2 4.24Å; V688-V692 WeakPolarHBondContact O-CG2 3.39Å; V688-V692 PolarHBondContact O-N 2.87Å; S689-V692 PolarHBondContact O-N 3.26Å; V692-A694 PolarHBondContact O-N 3.47Å; V692-V695 PolarHBondContact O-N 2.86Å; V692-F696 HydrophobicContact CG1-CD2 3.68Å; V692-F696 HydrophobicContact CG1-CE2 3.56Å; V692-F696 VanDerWaalsContact O-CD2 3.29Å; V692-F696 WeakPolarHBondContact O-CD2 3.47Å; V692-F696 PolarHBondContact O-N 3.11Å
693	T	91.7	Very high	88.3	Confident	19 Å²	19	57.9 Å²	57.9	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-38.2	176.2	-71.2	0	0	0	0	112	S689 V695 F696 L697 L750 W754	S689-T693 WeakPolarHBondContact O-CB 3.5Å; S689-T693 PolarHBondContact O-N 3.1Å; S689-T693 PolarHBondContact O-OG1 3.31Å; T693-V695 PolarHBondContact O-N 3.31Å; T693-F696 PolarHBondContact O-N 3.4Å; T693-L697 HydrophobicContact CG2-CD1 4.13Å; T693-L697 HydrophobicContact CG2-CG 4.41Å; T693-L697 WeakPolarHBondContact O-CB 3.36Å; T693-L697 WeakPolarHBondContact O-CG 3.4Å; T693-L697 PolarHBondContact O-N 3.35Å; T693-L750 HydrophobicContact CG2-CD1 4.33Å; T693-L750 HydrophobicContact CG2-CD2 4.4Å; T693-L750 HydrophobicContact CG2-CG 4.2Å; T693-W754 HydrophobicContact CG2-CB 4.06Å; T693-W754 HydrophobicContact CG2-CD2 3.96Å; T693-W754 HydrophobicContact CG2-CE3 4.02Å; T693-W754 HydrophobicContact CG2-CG 3.96Å
694	A	90.3	Very high	87.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-38.8	174.5	0	0	0	0	0	112.6	L690 H691 V692 T698 F721 A724 L725	L690-A694 WeakPolarHBondContact O-CB 3.29Å; L690-A694 PolarHBondContact O-N 2.99Å; H691-A694 PolarHBondContact O-N 2.03Å; V692-A694 PolarHBondContact O-N 3.47Å; A694-T698 PolarHBondContact O-N 2.7Å; A694-T698 VanDerWaalsContact O-N 3.11Å; A694-T698 PolarHBondContact O-OG1 3.13Å; A694-F721 HydrophobicContact CB-CD2 4.31Å; A694-F721 HydrophobicContact CB-CE2 3.76Å; A694-A724 HydrophobicContact CB-CB 4.13Å; A694-A724 WeakPolarHBondContact O-CB 3.46Å; A694-L725 HydrophobicContact CB-CD2 3.57Å; A694-L725 HydrophobicContact CB-CG 3.93Å
695	V	89.5	Confident	85.8	Confident	62 Å²	62	54.6 Å²	54.6	38%	0.376	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-49.9	172.7	171.4	0	0	0	0	110.5	H691 V692 T693 L697 T698 L699 F721	H691-V695 WeakPolarHBondContact O-CG2 3.37Å; H691-V695 PolarHBondContact O-N 3.34Å; V692-V695 PolarHBondContact O-N 2.86Å; T693-V695 PolarHBondContact O-N 3.31Å; V695-L697 VanDerWaalsContact C-N 3.33Å; V695-L697 PolarHBondContact O-N 3.02Å; V695-T698 PolarHBondContact O-N 3.19Å; V695-T698 VanDerWaalsContact O-N 3.1Å; V695-T698 PolarHBondContact O-OG1 2.96Å; V695-L699 HydrophobicContact CG1-CD1 3.87Å; V695-L699 HydrophobicContact CG1-CG 4.28Å; V695-L699 WeakPolarHBondContact O-CG 3.26Å; V695-L699 PolarHBondContact O-N 2.81Å; V695-F721 HydrophobicContact CB-CE2 4.48Å; V695-F721 HydrophobicContact CG2-CD2 4.3Å; V695-F721 HydrophobicContact CG2-CE2 3.56Å; V695-F721 HydrophobicContact CG2-CZ 4.11Å
696	F	89.3	Confident	84.2	Confident	92 Å²	92	59.6 Å²	59.6	40%	0.404	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-37	178.9	-79.5	-62.7	0	0	0	113.1	V692 T693 L699 Y700 L750	V692-F696 HydrophobicContact CG1-CD2 3.68Å; V692-F696 HydrophobicContact CG1-CE2 3.56Å; V692-F696 VanDerWaalsContact O-CD2 3.29Å; V692-F696 WeakPolarHBondContact O-CD2 3.47Å; V692-F696 PolarHBondContact O-N 3.11Å; T693-F696 PolarHBondContact O-N 3.4Å; F696-L699 HydrophobicContact CD1-CD1 4.42Å; F696-L699 PolarHBondContact O-N 3.4Å; F696-Y700 HydrophobicContact CB-CE2 4.48Å; F696-Y700 HydrophobicContact CD1-CE1 4.5Å; F696-Y700 WeakPolarHBondContact O-CB 3.32Å; F696-Y700 VanDerWaalsContact O-CG 3.24Å; F696-Y700 PolarHBondContact O-N 2.84Å; F696-L750 HydrophobicContact CB-CD2 3.75Å
697	L	86.3	Confident	82.5	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-43.4	171.8	-75.3	170.9	0	0	0	111.9	T693 V695 Y700 E701 A724 G747 L750	T693-L697 HydrophobicContact CG2-CD1 4.13Å; T693-L697 HydrophobicContact CG2-CG 4.41Å; T693-L697 WeakPolarHBondContact O-CB 3.36Å; T693-L697 WeakPolarHBondContact O-CG 3.4Å; T693-L697 PolarHBondContact O-N 3.35Å; V695-L697 VanDerWaalsContact C-N 3.33Å; V695-L697 PolarHBondContact O-N 3.02Å; L697-Y700 PolarHBondContact O-N 3.08Å; L697-E701 PolarHBondContact O-N 3.04Å; L697-A724 HydrophobicContact CB-CB 4.47Å; L697-G747 WeakPolarHBondContact CD2-O 3.46Å; L697-L750 HydrophobicContact CD2-CB 4.13Å; L697-L750 HydrophobicContact CD2-CD2 3.86Å; L697-L750 HydrophobicContact CD2-CG 4.07Å; L697-L750 HydrophobicContact CG-CD2 3.84Å; L697-L750 HydrophobicContact CG-CG 4.31Å
698	T	83.9	Confident	80.7	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.1	46.6	0	0	0	0	113.4	A694 V695 E701 W702 F719 F721 A724	A694-T698 PolarHBondContact O-N 2.7Å; A694-T698 VanDerWaalsContact O-N 3.11Å; A694-T698 PolarHBondContact O-OG1 3.13Å; V695-T698 PolarHBondContact O-N 3.19Å; V695-T698 VanDerWaalsContact O-N 3.1Å; V695-T698 PolarHBondContact O-OG1 2.96Å; T698-E701 PolarHBondContact O-N 2.75Å; T698-W702 WeakPolarHBondContact O-CB 3.34Å; T698-W702 PolarHBondContact O-N 3.22Å; T698-F719 HydrophobicContact CG2-CD1 4.44Å; T698-F721 VanDerWaalsContact CG2-CA 3.46Å; T698-F721 HydrophobicContact CG2-CB 3.99Å; T698-F721 HydrophobicContact CG2-CD2 4.27Å; T698-A724 HydrophobicContact CG2-CB 3.8Å
699	L	83.3	Confident	78.6	Confident	59 Å²	59	61.4 Å²	61.4	31%	0.309	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-42.6	178.3	-67.4	174.1	0	0	0	111.2	V695 F696 E701 W702 H703	V695-L699 HydrophobicContact CG1-CD1 3.87Å; V695-L699 HydrophobicContact CG1-CG 4.28Å; V695-L699 WeakPolarHBondContact O-CG 3.26Å; V695-L699 PolarHBondContact O-N 2.81Å; F696-L699 HydrophobicContact CD1-CD1 4.42Å; F696-L699 PolarHBondContact O-N 3.4Å; L699-E701 VanDerWaalsContact C-N 3.33Å; L699-E701 PolarHBondContact O-N 3.13Å; L699-W702 PolarHBondContact O-N 3.36Å; L699-H703 WeakPolarHBondContact O-CB 3.37Å; L699-H703 PolarHBondContact O-CD2 3.08Å; L699-H703 VanDerWaalsContact O-CD2 3.26Å; L699-H703 PolarHBondContact O-N 2.75Å
700	Y	84.3	Confident	76.6	Confident	99 Å²	99	66.2 Å²	66.2	39%	0.388	35%	0.345	S	S	.	.	H	α-helix	trans	-69.6	-24.9	177	-66.1	-16.9	0	0	0	113.7	F696 L697 S704 C744 L750	F696-Y700 HydrophobicContact CB-CE2 4.48Å; F696-Y700 HydrophobicContact CD1-CE1 4.5Å; F696-Y700 WeakPolarHBondContact O-CB 3.32Å; F696-Y700 VanDerWaalsContact O-CG 3.24Å; F696-Y700 PolarHBondContact O-N 2.84Å; L697-Y700 PolarHBondContact O-N 3.08Å; Y700-S704 WeakPolarHBondContact O-CB 3.44Å; Y700-S704 PolarHBondContact O-N 3.4Å; Y700-C744 PolarHBondContact O-SG 3.49Å; Y700-C744 VanDerWaalsContact O-SG 3.38Å; Y700-L750 HydrophobicContact CD2-CD2 3.88Å; Y700-L750 HydrophobicContact CE2-CD2 3.78Å
701	E	80.1	Confident	74.4	Confident	13 Å²	13	77.6 Å²	77.6	6%	0.061	39%	0.388	C	S	.	.	H	α-helix	trans	-81	-36.9	169.1	-76.4	-153.7	-139.4	0	0	113.1	L697 T698 L699 F719 P742	L697-E701 PolarHBondContact O-N 3.04Å; T698-E701 PolarHBondContact O-N 2.75Å; L699-E701 VanDerWaalsContact C-N 3.33Å; L699-E701 PolarHBondContact O-N 3.13Å; E701-F719 HydrophobicContact CB-CD1 4.32Å; E701-F719 HydrophobicContact CG-CD1 4.21Å; E701-F719 WeakPolarHBondContact OE1-CD1 3.03Å; E701-F719 WeakPolarHBondContact OE1-CG 3.49Å; E701-F719 WeakPolarHBondContact OE2-CB 2.99Å; E701-P742 VanDerWaalsContact OE1-CA 3.23Å; E701-P742 WeakPolarHBondContact OE1-CA 3.31Å; E701-P742 WeakPolarHBondContact OE1-CB 3.31Å
702	W	75.6	Confident	72.1	Confident	117 Å²	117	78.5 Å²	78.5	44%	0.443	41%	0.411	S	S	.	.	H	α-helix	trans	-70.3	-37.9	176.8	-71.1	-6.5	0	0	0	113.1	T698 L699 M708 F719	T698-W702 WeakPolarHBondContact O-CB 3.34Å; T698-W702 PolarHBondContact O-N 3.22Å; L699-W702 PolarHBondContact O-N 3.36Å; W702-M708 WeakPolarHBondContact O-CE 2.99Å; W702-F719 PolarHBondContact NE1-O 3.1Å
703	H	74.7	Confident	69.8	Low	158 Å²	158	86.9 Å²	86.9	73%	0.731	44%	0.435	S	S	*	.	S	Bend	trans	-84.4	-7.5	178	-73.7	-75.7	0	0	0	114.3	L699	L699-H703 WeakPolarHBondContact O-CB 3.37Å; L699-H703 PolarHBondContact O-CD2 3.08Å; L699-H703 VanDerWaalsContact O-CD2 3.26Å; L699-H703 PolarHBondContact O-N 2.75Å
704	S	69.1	Low	67.6	Low	16 Å²	16	93 Å²	93	11%	0.112	47%	0.467	C	S	.	.	S	Bend	trans	-86.9	133.3	179.4	-174.7	0	0	0	0	112.3	Y700 F706 G707 M708 C744	Y700-S704 WeakPolarHBondContact O-CB 3.44Å; Y700-S704 PolarHBondContact O-N 3.4Å; S704-F706 PolarHBondContact O-N 3.38Å; S704-F706 VanDerWaalsContact O-N 3.1Å; S704-F706 PolarHBondContact OG-N 2.89Å; S704-G707 PolarHBondContact O-N 3.31Å; S704-M708 PolarHBondContact O-N 2.88Å; S704-C744 WeakPolarHBondContact OG-CB 3.21Å
705	P	62.8	Low	65.8	Low	97 Å²	97	100.1 Å²	100.1	63%	0.63	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-16	174.7	26.9	-35.3	0	0	0	113.5
706	F	57.7	Low	63.8	Low	141 Å²	141	104.6 Å²	104.6	62%	0.618	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-14.3	172.7	-60.1	-78.1	0	0	0	113.4	S704 K743	S704-F706 PolarHBondContact O-N 3.38Å; S704-F706 VanDerWaalsContact O-N 3.1Å; S704-F706 PolarHBondContact OG-N 2.89Å; F706-K743 WeakPolarHBondContact O-CD 3.47Å
707	G	56.4	Low	62	Low	21 Å²	21	110.5 Å²	110.5	22%	0.216	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-50.6	172.7	0	0	0	0	0	111.9	S704	S704-G707 PolarHBondContact O-N 3.31Å
708	M	55.4	Low	60.7	Low	129 Å²	129	114.9 Å²	114.9	64%	0.635	56%	0.562	S	S	*	*			trans	-111.3	89.5	179	-71	-159.1	-84	0	0	113	W702 S704	W702-M708 WeakPolarHBondContact O-CE 2.99Å; S704-M708 PolarHBondContact O-N 2.88Å
709	T	49	Very low	59.8	Low	99 Å²	99	115.4 Å²	115.4	61%	0.607	56%	0.564	S	S	*	*			trans	-84.6	122.7	168.4	45.1	0	0	0	0	111	R711	T709-R711 VanDerWaalsContact C-N 3.31Å; T709-R711 PolarHBondContact O-N 2.92Å; T709-R711 VanDerWaalsContact O-N 3.14Å
710	P	50.4	Low	59.4	Low	133 Å²	133	115.4 Å²	115.4	86%	0.864	57%	0.569	S	S	*	*	S	Bend	trans	-72.4	-6.6	-168	-23.3	35.1	0	0	0	117.7
711	R	47.2	Very low	59.3	Low	242 Å²	242	114.4 Å²	114.4	91%	0.913	57%	0.566	S	S	*	*	S	Bend	trans	-138.1	106.8	-173.6	-73.9	177.1	166.2	148.4	-5.1	110.4	T709	T709-R711 VanDerWaalsContact C-N 3.31Å; T709-R711 PolarHBondContact O-N 2.92Å; T709-R711 VanDerWaalsContact O-N 3.14Å
712	G	43.4	Very low	59.3	Low	70 Å²	70	118 Å²	118	72%	0.722	59%	0.593	S	S	*	*			trans	160.9	47.5	176.6	0	0	0	0	0	120	N714	G712-N714 PolarHBondContact O-N 3.39Å
713	R	45	Very low	59.6	Low	247 Å²	247	113.3 Å²	113.3	93%	0.932	58%	0.578	S	S	*	*	S	Bend	trans	27.5	62.3	150.5	-167.4	-180	158.8	95.4	-4.1	117.9
714	N	46.4	Very low	60	Low	146 Å²	146	105.8 Å²	105.8	78%	0.781	54%	0.544	S	S	*	.			trans	-165.7	75.6	161.5	-110.6	-30.7	0	0	0	112.7	G712 N716	G712-N714 PolarHBondContact O-N 3.39Å; N714-N716 VanDerWaalsContact C-N 3.3Å; N714-N716 PolarHBondContact O-N 2.97Å
715	R	52.7	Low	60.9	Low	150 Å²	150	106.5 Å²	106.5	57%	0.566	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-80	4.2	-166.4	-166.8	148.1	56.4	-179.6	-5.5	116.2	R717 F991	R715-R717 VanDerWaalsContact C-N 3.31Å; R715-R717 PolarHBondContact O-N 2.77Å; R715-F991 VanDerWaalsContact NH1-CE2 3.28Å; R715-F991 VanDerWaalsContact NH2-CE1 3.25Å; R715-F991 VanDerWaalsContact NH2-CE2 3.27Å; R715-F991 VanDerWaalsContact NH2-CZ 3.29Å
716	N	46.8	Very low	62	Low	156 Å²	156	105.6 Å²	105.6	83%	0.834	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-90.3	17.1	179.9	-63.5	8.8	0	0	0	113.8	N714	N714-N716 VanDerWaalsContact C-N 3.3Å; N714-N716 PolarHBondContact O-N 2.97Å
717	R	50.9	Low	63.3	Low	216 Å²	216	99.1 Å²	99.1	82%	0.815	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-136	41.3	-179.2	-68.6	-165.8	179	-159.6	3.6	114.1	R715	R715-R717 VanDerWaalsContact C-N 3.31Å; R715-R717 PolarHBondContact O-N 2.77Å
718	V	59.3	Low	64.8	Low	96 Å²	96	98.1 Å²	98.1	58%	0.582	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-71.9	138.4	161.8	-177.1	0	0	0	0	108.8	S720	V718-S720 PolarHBondContact O-N 2.93Å
719	F	65.9	Low	66.4	Low	19 Å²	19	95.6 Å²	95.6	8%	0.083	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-77.3	118.9	170.7	-165.7	-106.1	0	0	0	108.8	T698 E701 W702 A724	T698-F719 HydrophobicContact CG2-CD1 4.44Å; E701-F719 HydrophobicContact CB-CD1 4.32Å; E701-F719 HydrophobicContact CG-CD1 4.21Å; E701-F719 WeakPolarHBondContact OE1-CD1 3.03Å; E701-F719 WeakPolarHBondContact OE1-CG 3.49Å; E701-F719 WeakPolarHBondContact OE2-CB 2.99Å; W702-F719 PolarHBondContact NE1-O 3.1Å; F719-A724 HydrophobicContact CD1-CB 4.49Å; F719-A724 HydrophobicContact CE1-CB 3.59Å; F719-A724 HydrophobicContact CZ-CB 3.98Å
720	S	73.9	Confident	68.2	Low	58 Å²	58	91.2 Å²	91.2	41%	0.406	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-103.9	158.9	-178	173.1	0	0	0	0	110.7	V718 S722 S723 A724	V718-S720 PolarHBondContact O-N 2.93Å; S720-S722 PolarHBondContact O-N 2.94Å; S720-S722 PolarHBondContact OG-N 2.88Å; S720-S723 PolarHBondContact N-OG 3.27Å; S720-S723 WeakPolarHBondContact O-CA 3.29Å; S720-S723 PolarHBondContact O-N 3.36Å; S720-S723 PolarHBondContact O-OG 3.49Å; S720-A724 PolarHBondContact O-N 3.33Å
721	F	82.2	Confident	70	Confident	78 Å²	78	86.7 Å²	86.7	34%	0.342	42%	0.423	S	S	.	.	H	α-helix	trans	-55.4	-34.4	171.3	-176.8	-118.4	0	0	0	112.6	A694 V695 T698 S723 A724 L725	A694-F721 HydrophobicContact CB-CD2 4.31Å; A694-F721 HydrophobicContact CB-CE2 3.76Å; V695-F721 HydrophobicContact CB-CE2 4.48Å; V695-F721 HydrophobicContact CG2-CD2 4.3Å; V695-F721 HydrophobicContact CG2-CE2 3.56Å; V695-F721 HydrophobicContact CG2-CZ 4.11Å; T698-F721 VanDerWaalsContact CG2-CA 3.46Å; T698-F721 HydrophobicContact CG2-CB 3.99Å; T698-F721 HydrophobicContact CG2-CD2 4.27Å; F721-S723 PolarHBondContact O-N 3.07Å; F721-A724 PolarHBondContact O-N 3.05Å; F721-L725 HydrophobicContact CD1-CD1 3.93Å; F721-L725 HydrophobicContact CD1-CG 4.49Å; F721-L725 HydrophobicContact CD2-CG 4.47Å; F721-L725 HydrophobicContact CE1-CD1 3.48Å; F721-L725 VanDerWaalsContact CE1-CD1 3.48Å; F721-L725 HydrophobicContact CE1-CG 4.1Å; F721-L725 HydrophobicContact CE2-CD1 4.34Å; F721-L725 HydrophobicContact CE2-CD2 4.3Å; F721-L725 HydrophobicContact CE2-CG 4.05Å; F721-L725 HydrophobicContact CZ-CD1 3.71Å; F721-L725 HydrophobicContact CZ-CD2 4.03Å; F721-L725 HydrophobicContact CZ-CG 3.87Å; F721-L725 WeakPolarHBondContact O-CG 3.45Å; F721-L725 PolarHBondContact O-N 2.98Å
722	S	80.9	Confident	71.9	Confident	88 Å²	88	76.5 Å²	76.5	62%	0.615	39%	0.387	S	S	*	.	H	α-helix	trans	-61.1	-41.5	172	170.5	0	0	0	0	112.5	S720 N726	S720-S722 PolarHBondContact O-N 2.94Å; S720-S722 PolarHBondContact OG-N 2.88Å; S722-N726 WeakPolarHBondContact O-CB 3.35Å; S722-N726 PolarHBondContact O-N 3.46Å; S722-N726 VanDerWaalsContact O-N 3.09Å
723	S	80.4	Confident	73.9	Confident	20 Å²	20	79.8 Å²	79.8	14%	0.14	38%	0.381	C	S	.	.	H	α-helix	trans	-73	-33.5	174.2	43.5	0	0	0	0	112.9	S720 F721 N726 V727	S720-S723 PolarHBondContact N-OG 3.27Å; S720-S723 WeakPolarHBondContact O-CA 3.29Å; S720-S723 PolarHBondContact O-N 3.36Å; S720-S723 PolarHBondContact O-OG 3.49Å; F721-S723 PolarHBondContact O-N 3.07Å; S723-N726 PolarHBondContact O-N 2.68Å; S723-V727 VanDerWaalsContact O-CG2 3.32Å; S723-V727 WeakPolarHBondContact O-CG2 3.37Å; S723-V727 PolarHBondContact O-N 3.28Å
724	A	84.4	Confident	75.5	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-50.2	174.2	0	0	0	0	0	111.5	A694 L697 T698 F719 S720 F721 N726 V727 C728	A694-A724 HydrophobicContact CB-CB 4.13Å; A694-A724 WeakPolarHBondContact O-CB 3.46Å; L697-A724 HydrophobicContact CB-CB 4.47Å; T698-A724 HydrophobicContact CG2-CB 3.8Å; F719-A724 HydrophobicContact CD1-CB 4.49Å; F719-A724 HydrophobicContact CE1-CB 3.59Å; F719-A724 HydrophobicContact CZ-CB 3.98Å; S720-A724 PolarHBondContact O-N 3.33Å; F721-A724 PolarHBondContact O-N 3.05Å; A724-N726 VanDerWaalsContact C-N 3.35Å; A724-N726 PolarHBondContact O-N 2.61Å; A724-V727 PolarHBondContact O-N 2.72Å; A724-C728 PolarHBondContact O-N 3.31Å; A724-C728 PolarHBondContact O-SG 3.37Å; A724-C728 VanDerWaalsContact O-SG 3.36Å
725	L	87.1	Confident	77	Confident	30 Å²	30	72.6 Å²	72.6	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-57.3	-45.8	174.6	-75.5	172.8	0	0	0	111.8	L690 A694 F721 V727 C728 Y729	L690-L725 HydrophobicContact CD2-CD2 3.72Å; A694-L725 HydrophobicContact CB-CD2 3.57Å; A694-L725 HydrophobicContact CB-CG 3.93Å; F721-L725 HydrophobicContact CD1-CD1 3.93Å; F721-L725 HydrophobicContact CD1-CG 4.49Å; F721-L725 HydrophobicContact CD2-CG 4.47Å; F721-L725 HydrophobicContact CE1-CD1 3.48Å; F721-L725 VanDerWaalsContact CE1-CD1 3.48Å; F721-L725 HydrophobicContact CE1-CG 4.1Å; F721-L725 HydrophobicContact CE2-CD1 4.34Å; F721-L725 HydrophobicContact CE2-CD2 4.3Å; F721-L725 HydrophobicContact CE2-CG 4.05Å; F721-L725 HydrophobicContact CZ-CD1 3.71Å; F721-L725 HydrophobicContact CZ-CD2 4.03Å; F721-L725 HydrophobicContact CZ-CG 3.87Å; F721-L725 WeakPolarHBondContact O-CG 3.45Å; F721-L725 PolarHBondContact O-N 2.98Å; L725-V727 VanDerWaalsContact C-N 3.29Å; L725-V727 PolarHBondContact O-N 2.97Å; L725-C728 PolarHBondContact O-N 3.35Å; L725-Y729 HydrophobicContact CB-CD2 4.44Å; L725-Y729 HydrophobicContact CD2-CE2 4.43Å; L725-Y729 WeakPolarHBondContact O-CB 3.44Å; L725-Y729 VanDerWaalsContact O-CD2 3.31Å; L725-Y729 WeakPolarHBondContact O-CD2 3.42Å; L725-Y729 PolarHBondContact O-N 3.47Å
726	N	85.6	Confident	77.5	Confident	79 Å²	79	72.6 Å²	72.6	42%	0.422	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-36.7	178.3	-175	69.6	0	0	0	112.6	S722 S723 A724 A730	S722-N726 WeakPolarHBondContact O-CB 3.35Å; S722-N726 PolarHBondContact O-N 3.46Å; S722-N726 VanDerWaalsContact O-N 3.09Å; S723-N726 PolarHBondContact O-N 2.68Å; A724-N726 VanDerWaalsContact C-N 3.35Å; A724-N726 PolarHBondContact O-N 2.61Å; N726-A730 WeakPolarHBondContact O-CB 3.37Å; N726-A730 PolarHBondContact O-N 3.17Å
727	V	85.3	Confident	78.5	Confident	5 Å²	5	68.2 Å²	68.2	3%	0.03	36%	0.358	C	S	.	.	H	α-helix	trans	-69.1	-46.6	173.6	174.5	0	0	0	0	111.1	S723 A724 L725 Y729 A730 I731 I739 M751	S723-V727 VanDerWaalsContact O-CG2 3.32Å; S723-V727 WeakPolarHBondContact O-CG2 3.37Å; S723-V727 PolarHBondContact O-N 3.28Å; A724-V727 PolarHBondContact O-N 2.72Å; L725-V727 VanDerWaalsContact C-N 3.29Å; L725-V727 PolarHBondContact O-N 2.97Å; V727-Y729 PolarHBondContact O-N 3.39Å; V727-A730 PolarHBondContact O-N 3.35Å; V727-I731 HydrophobicContact CG1-CD1 3.81Å; V727-I731 WeakPolarHBondContact O-CG1 3.33Å; V727-I731 PolarHBondContact O-N 3.34Å; V727-I739 HydrophobicContact CG1-CG2 4.2Å; V727-I739 HydrophobicContact CG2-CB 4.42Å; V727-I739 HydrophobicContact CG2-CG1 4.23Å; V727-I739 HydrophobicContact CG2-CG2 3.91Å; V727-M751 HydrophobicContact CG1-SD 4.32Å
728	C	88.3	Confident	79	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-42.3	179	-64.3	0	0	0	0	112.6	L690 A724 L725 L732 W754	L690-C728 HydrophobicContact CD1-CB 4.29Å; L690-C728 HydrophobicContact CD2-CB 4.36Å; L690-C728 HydrophobicContact CG-CB 3.88Å; A724-C728 PolarHBondContact O-N 3.31Å; A724-C728 PolarHBondContact O-SG 3.37Å; A724-C728 VanDerWaalsContact O-SG 3.36Å; L725-C728 PolarHBondContact O-N 3.35Å; C728-L732 WeakPolarHBondContact O-CB 3.26Å; C728-L732 PolarHBondContact O-N 3.32Å; C728-W754 PolarHBondContact O-NE1 2.91Å
729	Y	89.1	Confident	79.5	Confident	76 Å²	76	61 Å²	61	30%	0.298	35%	0.346	S	S	.	.	H	α-helix	trans	-68.8	-39.7	175.4	-83.7	-63.6	0	0	0	112.9	L690 H691 L725 V727 I731 L732 F733	L690-Y729 HydrophobicContact CD1-CD1 3.43Å; L690-Y729 VanDerWaalsContact CD1-CD1 3.43Å; L690-Y729 HydrophobicContact CD1-CD2 4.25Å; L690-Y729 HydrophobicContact CD1-CE1 3.53Å; L690-Y729 HydrophobicContact CD1-CE2 4.33Å; L690-Y729 HydrophobicContact CD1-CG 3.82Å; L690-Y729 HydrophobicContact CD2-CD1 4.4Å; L690-Y729 HydrophobicContact CD2-CD2 3.92Å; L690-Y729 HydrophobicContact CD2-CE1 4.07Å; L690-Y729 HydrophobicContact CD2-CE2 3.54Å; L690-Y729 HydrophobicContact CD2-CG 4.33Å; L690-Y729 HydrophobicContact CG-CE1 4.48Å; H691-Y729 PolarHBondContact CE1-OH 2.96Å; L725-Y729 HydrophobicContact CB-CD2 4.44Å; L725-Y729 HydrophobicContact CD2-CE2 4.43Å; L725-Y729 WeakPolarHBondContact O-CB 3.44Å; L725-Y729 VanDerWaalsContact O-CD2 3.31Å; L725-Y729 WeakPolarHBondContact O-CD2 3.42Å; L725-Y729 PolarHBondContact O-N 3.47Å; V727-Y729 PolarHBondContact O-N 3.39Å; Y729-I731 VanDerWaalsContact C-N 3.31Å; Y729-I731 PolarHBondContact O-N 2.9Å; Y729-L732 PolarHBondContact O-N 3.36Å; Y729-F733 HydrophobicContact CD1-CD2 4.22Å; Y729-F733 AromaticContact CD1-CE2 3.63Å; Y729-F733 HydrophobicContact CD1-CE2 3.63Å; Y729-F733 HydrophobicContact CD1-CZ 4.49Å; Y729-F733 HydrophobicContact CE1-CE2 4.26Å; Y729-F733 WeakPolarHBondContact O-CD2 3.38Å; Y729-F733 PolarHBondContact O-N 3.21Å
730	A	87.2	Confident	79.7	Confident	7 Å²	7	65.6 Å²	65.6	6%	0.058	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-40.5	176.6	0	0	0	0	0	111.7	N726 V727 G734 R735 V737 I739	N726-A730 WeakPolarHBondContact O-CB 3.37Å; N726-A730 PolarHBondContact O-N 3.17Å; V727-A730 PolarHBondContact O-N 3.35Å; A730-G734 PolarHBondContact O-N 3.33Å; A730-G734 VanDerWaalsContact O-N 3.09Å; A730-R735 PolarHBondContact O-N 2.99Å; A730-V737 HydrophobicContact CB-CB 4.21Å; A730-V737 HydrophobicContact CB-CG2 4.27Å; A730-I739 HydrophobicContact CB-CD1 4.24Å; A730-I739 HydrophobicContact CB-CG1 4.41Å
731	I	87.7	Confident	79.6	Confident	37 Å²	37	67 Å²	67	19%	0.19	37%	0.373	C	S	.	.	H	α-helix	trans	-66.5	-46.7	174.8	-66.6	167.9	0	0	0	111	V727 Y729 F733 G734 M751 A755 C758	V727-I731 HydrophobicContact CG1-CD1 3.81Å; V727-I731 WeakPolarHBondContact O-CG1 3.33Å; V727-I731 PolarHBondContact O-N 3.34Å; Y729-I731 VanDerWaalsContact C-N 3.31Å; Y729-I731 PolarHBondContact O-N 2.9Å; I731-F733 VanDerWaalsContact C-N 3.33Å; I731-F733 PolarHBondContact O-N 2.91Å; I731-G734 PolarHBondContact O-N 2.62Å; I731-M751 HydrophobicContact CD1-CG 3.69Å; I731-M751 HydrophobicContact CD1-SD 4.37Å; I731-A755 HydrophobicContact CG2-CB 3.91Å; I731-C758 HydrophobicContact CG2-CB 4.11Å
732	L	88	Confident	79.2	Confident	29 Å²	29	63.4 Å²	63.4	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-38.4	-179.7	-179.1	63.4	0	0	0	113	I686 L690 C728 Y729 C758	I686-L732 HydrophobicContact CG2-CD1 4.13Å; I686-L732 HydrophobicContact CG2-CD2 3.78Å; L690-L732 HydrophobicContact CD1-CB 4.44Å; L690-L732 HydrophobicContact CD1-CD2 3.71Å; C728-L732 WeakPolarHBondContact O-CB 3.26Å; C728-L732 PolarHBondContact O-N 3.32Å; Y729-L732 PolarHBondContact O-N 3.36Å; L732-C758 HydrophobicContact CD1-CB 4.28Å
733	F	85.3	Confident	78.8	Confident	138 Å²	138	64.4 Å²	64.4	61%	0.605	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	8.4	179	-65	-56.6	0	0	0	114.3	Y729 I731 R735	Y729-F733 HydrophobicContact CD1-CD2 4.22Å; Y729-F733 AromaticContact CD1-CE2 3.63Å; Y729-F733 HydrophobicContact CD1-CE2 3.63Å; Y729-F733 HydrophobicContact CD1-CZ 4.49Å; Y729-F733 HydrophobicContact CE1-CE2 4.26Å; Y729-F733 WeakPolarHBondContact O-CD2 3.38Å; Y729-F733 PolarHBondContact O-N 3.21Å; I731-F733 VanDerWaalsContact C-N 3.33Å; I731-F733 PolarHBondContact O-N 2.91Å; F733-R735 HydrophobicContact CB-CG 4.4Å; F733-R735 PolarHBondContact O-N 3.45Å; F733-R735 VanDerWaalsContact O-N 3.14Å
734	G	78.1	Confident	78.8	Confident	62 Å²	62	63.5 Å²	63.5	64%	0.639	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	22.6	178.2	0	0	0	0	0	115.3	A730 I731	A730-G734 PolarHBondContact O-N 3.33Å; A730-G734 VanDerWaalsContact O-N 3.09Å; I731-G734 PolarHBondContact O-N 2.62Å
735	R	76.9	Confident	78.6	Confident	180 Å²	180	73.7 Å²	73.7	68%	0.679	38%	0.383	S	S	*	.			trans	-91.9	129.8	-174.9	-72.1	-170.9	174.1	-169	-1.6	112.1	A730 F733 V737	A730-R735 PolarHBondContact O-N 2.99Å; F733-R735 HydrophobicContact CB-CG 4.4Å; F733-R735 PolarHBondContact O-N 3.45Å; F733-R735 VanDerWaalsContact O-N 3.14Å; R735-V737 HydrophobicContact CB-CG2 4.01Å; R735-V737 PolarHBondContact O-N 2.82Å
736	T	64.4	Low	78.6	Confident	151 Å²	151	76 Å²	76	93%	0.926	40%	0.399	S	S	*	.			trans	-74.4	49.8	175.3	45.5	0	0	0	0	113.4
737	V	68.2	Low	78.5	Confident	64 Å²	64	72.3 Å²	72.3	39%	0.388	38%	0.379	S	S	.	.			trans	-66.4	152.6	171	-176.6	0	0	0	0	109.6	A730 R735 I739	A730-V737 HydrophobicContact CB-CB 4.21Å; A730-V737 HydrophobicContact CB-CG2 4.27Å; R735-V737 HydrophobicContact CB-CG2 4.01Å; R735-V737 PolarHBondContact O-N 2.82Å; V737-I739 VanDerWaalsContact C-N 3.27Å; V737-I739 PolarHBondContact O-N 2.96Å
738	A	61.1	Low	78.6	Confident	97 Å²	97	77.7 Å²	77.7	80%	0.802	40%	0.399	S	S	*	.			trans	-65.7	80.3	175.9	0	0	0	0	0	112.5
739	I	69	Low	78.6	Confident	63 Å²	63	82.8 Å²	82.8	32%	0.323	43%	0.425	S	S	.	.			trans	-67.4	134.5	179.2	-74.5	164.7	0	0	0	110.3	V727 A730 V737 P741	V727-I739 HydrophobicContact CG1-CG2 4.2Å; V727-I739 HydrophobicContact CG2-CB 4.42Å; V727-I739 HydrophobicContact CG2-CG1 4.23Å; V727-I739 HydrophobicContact CG2-CG2 3.91Å; A730-I739 HydrophobicContact CB-CD1 4.24Å; A730-I739 HydrophobicContact CB-CG1 4.41Å; V737-I739 VanDerWaalsContact C-N 3.27Å; V737-I739 PolarHBondContact O-N 2.96Å; I739-P741 WeakPolarHBondContact O-CD 3.05Å
740	K	71	Confident	78.6	Confident	115 Å²	115	80.8 Å²	80.8	50%	0.5	42%	0.42	S	S	.	.			trans	-89.1	107.3	162.5	-66.3	174.5	-174.1	169.3	0	106.7
741	P	70.5	Confident	78.6	Confident	87 Å²	87	82.1 Å²	82.1	57%	0.565	43%	0.425	S	S	*	.			trans	-74	146.2	-174.8	29.9	-35.4	0	0	0	111.3	I739	I739-P741 WeakPolarHBondContact O-CD 3.05Å
742	P	73.6	Confident	78.7	Confident	3 Å²	3	84.7 Å²	84.7	2%	0.019	44%	0.439	C	S	.	.			trans	-64	138.5	179.8	23.7	-31.8	0	0	0	112	E701 R748 M751	E701-P742 VanDerWaalsContact OE1-CA 3.23Å; E701-P742 WeakPolarHBondContact OE1-CA 3.31Å; E701-P742 WeakPolarHBondContact OE1-CB 3.31Å; P742-R748 HydrophobicContact CG-CG 3.98Å; P742-R748 WeakPolarHBondContact O-CG 3.25Å; P742-R748 PolarHBondContact O-NE 3.46Å; P742-M751 WeakPolarHBondContact CD-SD 3.46Å; P742-M751 HydrophobicContact CG-CB 4.3Å; P742-M751 HydrophobicContact CG-CE 4.35Å; P742-M751 HydrophobicContact CG-SD 3.92Å
743	K	73.1	Confident	78.8	Confident	109 Å²	109	87.9 Å²	87.9	47%	0.474	46%	0.456	S	S	.	.	S	Bend	trans	-78	-36.9	179.6	-67.7	-178.2	-176.2	172.1	0	112.8	F706	F706-K743 WeakPolarHBondContact O-CD 3.47Å
744	C	80.1	Confident	79.1	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.007	43%	0.429	C	S	.	.	S	Bend	trans	-78	141.8	-176.1	55.8	0	0	0	0	111.8	Y700 S704 T746 G747 R748	Y700-C744 PolarHBondContact O-SG 3.49Å; Y700-C744 VanDerWaalsContact O-SG 3.38Å; S704-C744 WeakPolarHBondContact OG-CB 3.21Å; C744-T746 VanDerWaalsContact C-N 3.29Å; C744-T746 PolarHBondContact O-N 2.92Å; C744-G747 PolarHBondContact O-N 2.85Å; C744-G747 PolarHBondContact SG-N 2.83Å; C744-G747 VanDerWaalsContact SG-N 3.42Å; C744-R748 WeakPolarHBondContact O-CG 3.35Å; C744-R748 PolarHBondContact O-N 2.9Å
745	W	81.3	Confident	79.7	Confident	215 Å²	215	80.2 Å²	80.2	81%	0.814	41%	0.41	S	S	*	.	H	α-helix	trans	-60.5	-38.3	178.6	-85.2	77.6	0	0	0	112.4	R748 L749	W745-R748 PolarHBondContact O-N 3.06Å; W745-L749 PolarHBondContact O-N 3.26Å
746	T	86.1	Confident	80.4	Confident	79 Å²	79	76.9 Å²	76.9	49%	0.485	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-42.6	174.2	46.5	0	0	0	0	112.5	C744 L749 L750	C744-T746 VanDerWaalsContact C-N 3.29Å; C744-T746 PolarHBondContact O-N 2.92Å; T746-L749 PolarHBondContact O-N 2.86Å; T746-L750 WeakPolarHBondContact O-CB 3.26Å; T746-L750 PolarHBondContact O-N 3.2Å
747	G	84.8	Confident	81.7	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-37.3	174.9	0	0	0	0	0	112.9	L697 C744 L750 M751	L697-G747 WeakPolarHBondContact CD2-O 3.46Å; C744-G747 PolarHBondContact O-N 2.85Å; C744-G747 PolarHBondContact SG-N 2.83Å; C744-G747 VanDerWaalsContact SG-N 3.42Å; G747-L750 PolarHBondContact O-N 2.63Å; G747-M751 VanDerWaalsContact O-CB 3.28Å; G747-M751 WeakPolarHBondContact O-CB 3.15Å; G747-M751 PolarHBondContact O-N 2.78Å
748	R	85.9	Confident	82.8	Confident	118 Å²	118	70.6 Å²	70.6	45%	0.445	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-43.2	172.8	-69.5	175.4	-178.2	-169.6	-1.3	112.2	P742 C744 W745 M751 N752	P742-R748 HydrophobicContact CG-CG 3.98Å; P742-R748 WeakPolarHBondContact O-CG 3.25Å; P742-R748 PolarHBondContact O-NE 3.46Å; C744-R748 WeakPolarHBondContact O-CG 3.35Å; C744-R748 PolarHBondContact O-N 2.9Å; W745-R748 PolarHBondContact O-N 3.06Å; R748-M751 PolarHBondContact O-N 2.9Å; R748-N752 VanDerWaalsContact O-CG 3.28Å; R748-N752 PolarHBondContact O-N 2.97Å; R748-N752 PolarHBondContact O-OD1 2.95Å
749	L	88.8	Confident	84.1	Confident	108 Å²	108	71.5 Å²	71.5	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-62.3	-47	175.3	-179.7	60.2	0	0	0	111.3	W745 T746 M751 N752 L753	W745-L749 PolarHBondContact O-N 3.26Å; T746-L749 PolarHBondContact O-N 2.86Å; L749-M751 VanDerWaalsContact C-N 3.33Å; L749-M751 PolarHBondContact O-N 3.19Å; L749-N752 PolarHBondContact O-N 3.26Å; L749-L753 HydrophobicContact CD1-CD1 4.31Å; L749-L753 HydrophobicContact CD1-CG 4.38Å; L749-L753 HydrophobicContact CG-CD1 4.13Å; L749-L753 WeakPolarHBondContact O-CG 3.42Å; L749-L753 PolarHBondContact O-N 3.49Å
750	L	89.8	Confident	85.2	Confident	34 Å²	34	75.3 Å²	75.3	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-39.9	176.2	-179.9	59.4	0	0	0	112.1	T693 F696 L697 Y700 T746 G747 L753 W754	T693-L750 HydrophobicContact CG2-CD1 4.33Å; T693-L750 HydrophobicContact CG2-CD2 4.4Å; T693-L750 HydrophobicContact CG2-CG 4.2Å; F696-L750 HydrophobicContact CB-CD2 3.75Å; L697-L750 HydrophobicContact CD2-CB 4.13Å; L697-L750 HydrophobicContact CD2-CD2 3.86Å; L697-L750 HydrophobicContact CD2-CG 4.07Å; L697-L750 HydrophobicContact CG-CD2 3.84Å; L697-L750 HydrophobicContact CG-CG 4.31Å; Y700-L750 HydrophobicContact CD2-CD2 3.88Å; Y700-L750 HydrophobicContact CE2-CD2 3.78Å; T746-L750 WeakPolarHBondContact O-CB 3.26Å; T746-L750 PolarHBondContact O-N 3.2Å; G747-L750 PolarHBondContact O-N 2.63Å; L750-L753 PolarHBondContact O-N 3.49Å; L750-W754 VanDerWaalsContact O-CB 3.31Å; L750-W754 WeakPolarHBondContact O-CB 3.28Å; L750-W754 PolarHBondContact O-N 3.44Å
751	M	86.9	Confident	86.1	Confident	35 Å²	35	70.8 Å²	70.8	17%	0.172	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-40.7	175.2	-174.1	-175.8	72.2	0	0	112.1	V727 I731 P742 G747 R748 L749 W754 A755	V727-M751 HydrophobicContact CG1-SD 4.32Å; I731-M751 HydrophobicContact CD1-CG 3.69Å; I731-M751 HydrophobicContact CD1-SD 4.37Å; P742-M751 WeakPolarHBondContact CD-SD 3.46Å; P742-M751 HydrophobicContact CG-CB 4.3Å; P742-M751 HydrophobicContact CG-CE 4.35Å; P742-M751 HydrophobicContact CG-SD 3.92Å; G747-M751 VanDerWaalsContact O-CB 3.28Å; G747-M751 WeakPolarHBondContact O-CB 3.15Å; G747-M751 PolarHBondContact O-N 2.78Å; R748-M751 PolarHBondContact O-N 2.9Å; L749-M751 VanDerWaalsContact C-N 3.33Å; L749-M751 PolarHBondContact O-N 3.19Å; M751-W754 PolarHBondContact O-N 3.13Å; M751-A755 WeakPolarHBondContact O-CB 3.47Å; M751-A755 PolarHBondContact O-N 2.94Å
752	N	89	Confident	87	Confident	90 Å²	90	70.7 Å²	70.7	48%	0.481	34%	0.342	S	S	.	.	H	α-helix	trans	-68.2	-41.4	176.6	-70.2	-2.1	0	0	0	111.8	R748 L749 A755 I756	R748-N752 VanDerWaalsContact O-CG 3.28Å; R748-N752 PolarHBondContact O-N 2.97Å; R748-N752 PolarHBondContact O-OD1 2.95Å; L749-N752 PolarHBondContact O-N 3.26Å; N752-A755 PolarHBondContact O-N 3.5Å; N752-I756 WeakPolarHBondContact O-CG1 3.46Å; N752-I756 PolarHBondContact O-N 2.89Å
753	L	91.4	Very high	87.8	Confident	97 Å²	97	74 Å²	74	51%	0.508	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-40	174.1	-69.2	170.6	0	0	0	111.6	L749 L750 I756 F757	L749-L753 HydrophobicContact CD1-CD1 4.31Å; L749-L753 HydrophobicContact CD1-CG 4.38Å; L749-L753 HydrophobicContact CG-CD1 4.13Å; L749-L753 WeakPolarHBondContact O-CG 3.42Å; L749-L753 PolarHBondContact O-N 3.49Å; L750-L753 PolarHBondContact O-N 3.49Å; L753-I756 PolarHBondContact O-N 3.38Å; L753-F757 PolarHBondContact O-N 3.36Å
754	W	91.6	Very high	88.6	Confident	10 Å²	10	70.9 Å²	70.9	4%	0.038	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-40.2	172.5	179.6	-109	0	0	0	112.2	L690 T693 C728 L750 M751 F757 C758	L690-W754 VanDerWaalsContact CA-CH2 3.41Å; L690-W754 HydrophobicContact CB-CH2 3.7Å; L690-W754 HydrophobicContact CB-CZ2 3.81Å; L690-W754 HydrophobicContact CD1-CZ2 4.05Å; L690-W754 HydrophobicContact CG-CH2 4.4Å; L690-W754 HydrophobicContact CG-CZ2 3.99Å; T693-W754 HydrophobicContact CG2-CB 4.06Å; T693-W754 HydrophobicContact CG2-CD2 3.96Å; T693-W754 HydrophobicContact CG2-CE3 4.02Å; T693-W754 HydrophobicContact CG2-CG 3.96Å; C728-W754 PolarHBondContact O-NE1 2.91Å; L750-W754 VanDerWaalsContact O-CB 3.31Å; L750-W754 WeakPolarHBondContact O-CB 3.28Å; L750-W754 PolarHBondContact O-N 3.44Å; M751-W754 PolarHBondContact O-N 3.13Å; W754-F757 AromaticContact CE3-CD1 3.82Å; W754-F757 HydrophobicContact CE3-CD1 3.82Å; W754-F757 HydrophobicContact CE3-CE1 4.46Å; W754-F757 AromaticContact CH2-CD1 3.98Å; W754-F757 HydrophobicContact CH2-CD1 3.98Å; W754-F757 AromaticContact CH2-CE1 3.94Å; W754-F757 HydrophobicContact CH2-CE1 3.94Å; W754-F757 AromaticContact CZ3-CD1 3.46Å; W754-F757 HydrophobicContact CZ3-CD1 3.46Å; W754-F757 VanDerWaalsContact CZ3-CD1 3.46Å; W754-F757 AromaticContact CZ3-CE1 3.65Å; W754-F757 HydrophobicContact CZ3-CE1 3.65Å; W754-F757 PolarHBondContact O-N 2.73Å; W754-C758 PolarHBondContact NE1-SG 2.98Å; W754-C758 VanDerWaalsContact NE1-SG 3.36Å; W754-C758 WeakPolarHBondContact O-CB 3.39Å; W754-C758 PolarHBondContact O-N 2.61Å; W754-C758 PolarHBondContact O-SG 2.76Å
755	A	89.9	Confident	89.1	Confident	28 Å²	28	73.2 Å²	73.2	23%	0.231	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-42.4	175.6	0	0	0	0	0	112.3	I731 M751 N752 F757 C758 L759	I731-A755 HydrophobicContact CG2-CB 3.91Å; M751-A755 WeakPolarHBondContact O-CB 3.47Å; M751-A755 PolarHBondContact O-N 2.94Å; N752-A755 PolarHBondContact O-N 3.5Å; A755-F757 PolarHBondContact O-N 3.35Å; A755-C758 PolarHBondContact O-N 3.19Å; A755-L759 WeakPolarHBondContact O-CB 3.33Å; A755-L759 VanDerWaalsContact O-CG 3.31Å; A755-L759 WeakPolarHBondContact O-CG 3.5Å; A755-L759 PolarHBondContact O-N 3.16Å
756	I	91.6	Very high	89.5	Confident	111 Å²	111	66.5 Å²	66.5	57%	0.569	35%	0.347	S	S	*	.	H	α-helix	trans	-61.4	-43.9	174.3	-66.7	164.3	0	0	0	110.8	N752 L753 L759 F760	N752-I756 WeakPolarHBondContact O-CG1 3.46Å; N752-I756 PolarHBondContact O-N 2.89Å; L753-I756 PolarHBondContact O-N 3.38Å; I756-L759 PolarHBondContact O-N 3.31Å; I756-F760 PolarHBondContact O-N 3.22Å
757	F	91.8	Very high	89.7	Confident	78 Å²	78	65.4 Å²	65.4	34%	0.342	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-44.4	174.7	175.4	-100	0	0	0	112.3	L753 W754 A755 F760 C761	L753-F757 PolarHBondContact O-N 3.36Å; W754-F757 AromaticContact CE3-CD1 3.82Å; W754-F757 HydrophobicContact CE3-CD1 3.82Å; W754-F757 HydrophobicContact CE3-CE1 4.46Å; W754-F757 AromaticContact CH2-CD1 3.98Å; W754-F757 HydrophobicContact CH2-CD1 3.98Å; W754-F757 AromaticContact CH2-CE1 3.94Å; W754-F757 HydrophobicContact CH2-CE1 3.94Å; W754-F757 AromaticContact CZ3-CD1 3.46Å; W754-F757 HydrophobicContact CZ3-CD1 3.46Å; W754-F757 VanDerWaalsContact CZ3-CD1 3.46Å; W754-F757 AromaticContact CZ3-CE1 3.65Å; W754-F757 HydrophobicContact CZ3-CE1 3.65Å; W754-F757 PolarHBondContact O-N 2.73Å; A755-F757 PolarHBondContact O-N 3.35Å; F757-F760 PolarHBondContact O-N 3.21Å; F757-C761 VanDerWaalsContact CZ-SG 3.54Å; F757-C761 PolarHBondContact O-N 2.71Å; F757-C761 PolarHBondContact O-SG 3.45Å
758	C	90.8	Very high	89.9	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.027	36%	0.363	C	S	.	.	H	α-helix	trans	-62.2	-43.4	176.5	-69.3	0	0	0	0	112.2	I731 L732 W754 A755 F760 C761 L762	I731-C758 HydrophobicContact CG2-CB 4.11Å; L732-C758 HydrophobicContact CD1-CB 4.28Å; W754-C758 PolarHBondContact NE1-SG 2.98Å; W754-C758 VanDerWaalsContact NE1-SG 3.36Å; W754-C758 WeakPolarHBondContact O-CB 3.39Å; W754-C758 PolarHBondContact O-N 2.61Å; W754-C758 PolarHBondContact O-SG 2.76Å; A755-C758 PolarHBondContact O-N 3.19Å; C758-F760 VanDerWaalsContact C-N 3.34Å; C758-F760 PolarHBondContact O-N 3.12Å; C758-C761 PolarHBondContact O-N 2.77Å; C758-L762 VanDerWaalsContact O-CB 3.27Å; C758-L762 WeakPolarHBondContact O-CB 3.42Å; C758-L762 PolarHBondContact O-N 3.36Å
759	L	89.9	Confident	89.8	Confident	117 Å²	117	65 Å²	65	61%	0.613	35%	0.352	S	S	*	.	H	α-helix	trans	-62	-41.2	175.7	-73.1	170.1	0	0	0	111.7	A755 I756 L762 S763	A755-L759 WeakPolarHBondContact O-CB 3.33Å; A755-L759 VanDerWaalsContact O-CG 3.31Å; A755-L759 WeakPolarHBondContact O-CG 3.5Å; A755-L759 PolarHBondContact O-N 3.16Å; I756-L759 PolarHBondContact O-N 3.31Å; L759-L762 PolarHBondContact O-N 3.18Å; L759-S763 VanDerWaalsContact O-CB 3.22Å; L759-S763 WeakPolarHBondContact O-CB 3.28Å; L759-S763 PolarHBondContact O-N 2.92Å
760	F	91.4	Very high	89.3	Confident	142 Å²	142	62.3 Å²	62.3	62%	0.623	35%	0.346	S	S	*	.	H	α-helix	trans	-64.2	-46.8	175.2	-177.9	-95.5	0	0	0	112.1	I756 F757 C758 S763 T764	I756-F760 PolarHBondContact O-N 3.22Å; F757-F760 PolarHBondContact O-N 3.21Å; C758-F760 VanDerWaalsContact C-N 3.34Å; C758-F760 PolarHBondContact O-N 3.12Å; F760-S763 PolarHBondContact O-N 3.15Å; F760-T764 WeakPolarHBondContact O-CB 3.48Å; F760-T764 PolarHBondContact O-N 3.31Å; F760-T764 PolarHBondContact O-OG1 3.28Å
761	C	90.1	Very high	88.9	Confident	20 Å²	20	64 Å²	64	14%	0.135	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-42.3	175.6	-71.4	0	0	0	0	112.7	I686 F757 C758 T764 Y765	I686-C761 HydrophobicContact CD1-CB 4.41Å; F757-C761 VanDerWaalsContact CZ-SG 3.54Å; F757-C761 PolarHBondContact O-N 2.71Å; F757-C761 PolarHBondContact O-SG 3.45Å; C758-C761 PolarHBondContact O-N 2.77Å; C761-T764 PolarHBondContact O-N 3.02Å; C761-Y765 WeakPolarHBondContact O-CB 3.28Å; C761-Y765 PolarHBondContact O-N 3.05Å
762	L	88.9	Confident	88.3	Confident	85 Å²	85	65.6 Å²	65.6	45%	0.445	38%	0.376	S	S	.	.	H	α-helix	trans	-65.1	-46.4	178	-179.2	61.6	0	0	0	111.4	C758 L759 T764 Y765 T766	C758-L762 VanDerWaalsContact O-CB 3.27Å; C758-L762 WeakPolarHBondContact O-CB 3.42Å; C758-L762 PolarHBondContact O-N 3.36Å; L759-L762 PolarHBondContact O-N 3.18Å; L762-T764 PolarHBondContact O-N 3.22Å; L762-Y765 PolarHBondContact O-N 3.41Å; L762-T766 PolarHBondContact O-N 3.02Å; L762-T766 PolarHBondContact O-OG1 3.26Å
763	S	89.8	Confident	87.5	Confident	74 Å²	74	64.8 Å²	64.8	52%	0.517	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-39.3	177.1	-172.3	0	0	0	0	112.3	L759 F760 T766 A767	L759-S763 VanDerWaalsContact O-CB 3.22Å; L759-S763 WeakPolarHBondContact O-CB 3.28Å; L759-S763 PolarHBondContact O-N 2.92Å; F760-S763 PolarHBondContact O-N 3.15Å; S763-T766 PolarHBondContact O-N 2.81Å; S763-T766 PolarHBondContact O-OG1 2.96Å; S763-T766 VanDerWaalsContact O-OG1 3.11Å; S763-A767 VanDerWaalsContact O-CB 3.25Å; S763-A767 WeakPolarHBondContact O-CB 3.4Å; S763-A767 PolarHBondContact O-N 3.3Å
764	T	91.4	Very high	86.4	Confident	43 Å²	43	65.9 Å²	65.9	26%	0.264	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-40.6	174.9	-55.1	0	0	0	0	111.2	F760 C761 L762 N768	F760-T764 WeakPolarHBondContact O-CB 3.48Å; F760-T764 PolarHBondContact O-N 3.31Å; F760-T764 PolarHBondContact O-OG1 3.28Å; C761-T764 PolarHBondContact O-N 3.02Å; L762-T764 PolarHBondContact O-N 3.22Å; T764-N768 VanDerWaalsContact O-CB 3.27Å; T764-N768 WeakPolarHBondContact O-CB 3.42Å; T764-N768 VanDerWaalsContact O-CG 3.22Å; T764-N768 PolarHBondContact O-N 3.23Å
765	Y	90.8	Very high	84.9	Confident	49 Å²	49	67.1 Å²	67.1	19%	0.192	40%	0.396	C	S	.	.	H	α-helix	trans	-64.2	-45.8	175.8	173.2	-95.7	0	0	0	112	F674 P677 L678 W683 C761 L762 L769	F674-Y765 PolarHBondContact O-OH 3.06Å; P677-Y765 HydrophobicContact CB-CD2 4.05Å; P677-Y765 HydrophobicContact CB-CE2 4.13Å; P677-Y765 HydrophobicContact CG-CE2 4.19Å; L678-Y765 HydrophobicContact CD1-CD2 3.96Å; L678-Y765 HydrophobicContact CG-CD2 4.18Å; W683-Y765 HydrophobicContact CH2-CD2 4.12Å; W683-Y765 AromaticContact CH2-CE2 3.89Å; W683-Y765 HydrophobicContact CH2-CE2 3.89Å; W683-Y765 HydrophobicContact CZ2-CD2 4.16Å; W683-Y765 AromaticContact CZ2-CE2 3.87Å; W683-Y765 HydrophobicContact CZ2-CE2 3.87Å; C761-Y765 WeakPolarHBondContact O-CB 3.28Å; C761-Y765 PolarHBondContact O-N 3.05Å; L762-Y765 PolarHBondContact O-N 3.41Å; Y765-L769 HydrophobicContact CE1-CD2 4.01Å; Y765-L769 WeakPolarHBondContact O-CB 3.37Å; Y765-L769 PolarHBondContact O-N 2.82Å
766	T	89.8	Confident	83.1	Confident	75 Å²	75	70.9 Å²	70.9	46%	0.46	41%	0.409	S	S	.	.	H	α-helix	trans	-68.5	-38.9	179.1	53.2	0	0	0	0	112.4	L762 S763 L769 A770	L762-T766 PolarHBondContact O-N 3.02Å; L762-T766 PolarHBondContact O-OG1 3.26Å; S763-T766 PolarHBondContact O-N 2.81Å; S763-T766 PolarHBondContact O-OG1 2.96Å; S763-T766 VanDerWaalsContact O-OG1 3.11Å; T766-L769 PolarHBondContact O-N 3.15Å; T766-A770 WeakPolarHBondContact O-CB 3.47Å; T766-A770 PolarHBondContact O-N 3.37Å
767	A	89.3	Confident	81.2	Confident	55 Å²	55	72 Å²	72	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-47.5	174.7	0	0	0	0	0	112.1	S763 L769 A770 A771	S763-A767 VanDerWaalsContact O-CB 3.25Å; S763-A767 WeakPolarHBondContact O-CB 3.4Å; S763-A767 PolarHBondContact O-N 3.3Å; A767-L769 VanDerWaalsContact C-N 3.34Å; A767-L769 PolarHBondContact O-N 2.89Å; A767-A770 PolarHBondContact O-N 3.2Å; A767-A771 WeakPolarHBondContact O-CB 3.32Å; A767-A771 PolarHBondContact O-N 3.48Å
768	N	88.9	Confident	79.5	Confident	68 Å²	68	73 Å²	73	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-37.6	176.8	-73.1	-0.1	0	0	0	112	P677 T764 A771 V772	P677-N768 HydrophobicContact CB-CB 3.79Å; P677-N768 WeakPolarHBondContact O-CB 3.48Å; P677-N768 PolarHBondContact O-ND2 2.93Å; T764-N768 VanDerWaalsContact O-CB 3.27Å; T764-N768 WeakPolarHBondContact O-CB 3.42Å; T764-N768 VanDerWaalsContact O-CG 3.22Å; T764-N768 PolarHBondContact O-N 3.23Å; N768-A771 PolarHBondContact O-N 3.07Å; N768-V772 WeakPolarHBondContact O-CB 3.38Å; N768-V772 VanDerWaalsContact O-CG2 3.28Å; N768-V772 WeakPolarHBondContact O-CG2 3.3Å; N768-V772 PolarHBondContact O-N 3.2Å
769	L	83.3	Confident	77.6	Confident	42 Å²	42	79.4 Å²	79.4	22%	0.22	45%	0.447	C	S	.	.	H	α-helix	trans	-64.3	-46.3	175.8	177.9	60.9	0	0	0	110.9	P677 Y765 T766 A767 A771 V772 M773	P677-L769 HydrophobicContact CB-CB 4.26Å; P677-L769 HydrophobicContact CG-CB 3.8Å; P677-L769 HydrophobicContact CG-CD1 3.78Å; P677-L769 HydrophobicContact CG-CG 4.38Å; Y765-L769 HydrophobicContact CE1-CD2 4.01Å; Y765-L769 WeakPolarHBondContact O-CB 3.37Å; Y765-L769 PolarHBondContact O-N 2.82Å; T766-L769 PolarHBondContact O-N 3.15Å; A767-L769 VanDerWaalsContact C-N 3.34Å; A767-L769 PolarHBondContact O-N 2.89Å; L769-A771 PolarHBondContact O-N 2.83Å; L769-V772 PolarHBondContact O-N 3.08Å; L769-M773 HydrophobicContact CD1-CG 4.02Å; L769-M773 HydrophobicContact CD1-SD 3.73Å; L769-M773 HydrophobicContact CD2-SD 4.39Å; L769-M773 HydrophobicContact CG-CG 4.41Å; L769-M773 HydrophobicContact CG-SD 3.74Å; L769-M773 WeakPolarHBondContact O-CB 3.5Å; L769-M773 VanDerWaalsContact O-CG 3.24Å; L769-M773 WeakPolarHBondContact O-CG 3.24Å; L769-M773 PolarHBondContact O-N 3.21Å
770	A	79.9	Confident	76.2	Confident	51 Å²	51	79.4 Å²	79.4	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-58.8	-46.7	175	0	0	0	0	0	111.6	T766 A767 V772 M773 V774	T766-A770 WeakPolarHBondContact O-CB 3.47Å; T766-A770 PolarHBondContact O-N 3.37Å; A767-A770 PolarHBondContact O-N 3.2Å; A770-V772 VanDerWaalsContact C-N 3.33Å; A770-V772 PolarHBondContact O-N 2.74Å; A770-M773 PolarHBondContact O-N 3.09Å; A770-V774 WeakPolarHBondContact O-CB 3.2Å; A770-V774 WeakPolarHBondContact O-CG2 3.47Å; A770-V774 PolarHBondContact O-N 3.13Å
771	A	80.9	Confident	75	Confident	69 Å²	69	74.2 Å²	74.2	57%	0.57	42%	0.422	S	S	*	.	H	α-helix	trans	-62.2	-36.5	177.1	0	0	0	0	0	113.3	A767 N768 L769 G775	A767-A771 WeakPolarHBondContact O-CB 3.32Å; A767-A771 PolarHBondContact O-N 3.48Å; N768-A771 PolarHBondContact O-N 3.07Å; L769-A771 PolarHBondContact O-N 2.83Å; A771-G775 PolarHBondContact O-N 3.13Å
772	V	74.4	Confident	74.4	Confident	70 Å²	70	73.3 Å²	73.3	42%	0.424	42%	0.415	S	S	.	.	H	α-helix	trans	-74.3	-29.9	175.6	169.6	0	0	0	0	112.3	W676 N768 L769 A770	W676-V772 HydrophobicContact CE3-CG1 4.45Å; N768-V772 WeakPolarHBondContact O-CB 3.38Å; N768-V772 VanDerWaalsContact O-CG2 3.28Å; N768-V772 WeakPolarHBondContact O-CG2 3.3Å; N768-V772 PolarHBondContact O-N 3.2Å; L769-V772 PolarHBondContact O-N 3.08Å; A770-V772 VanDerWaalsContact C-N 3.33Å; A770-V772 PolarHBondContact O-N 2.74Å
773	M	71.6	Confident	74	Confident	72 Å²	72	74 Å²	74	36%	0.355	43%	0.427	S	S	.	.	H	α-helix	trans	-79.4	-35.8	177	-71.8	176.9	55.5	0	0	113.1	L769 A770 G775 M931 F936	L769-M773 HydrophobicContact CD1-CG 4.02Å; L769-M773 HydrophobicContact CD1-SD 3.73Å; L769-M773 HydrophobicContact CD2-SD 4.39Å; L769-M773 HydrophobicContact CG-CG 4.41Å; L769-M773 HydrophobicContact CG-SD 3.74Å; L769-M773 WeakPolarHBondContact O-CB 3.5Å; L769-M773 VanDerWaalsContact O-CG 3.24Å; L769-M773 WeakPolarHBondContact O-CG 3.24Å; L769-M773 PolarHBondContact O-N 3.21Å; A770-M773 PolarHBondContact O-N 3.09Å; M773-G775 VanDerWaalsContact C-N 3.27Å; M773-M931 HydrophobicContact CB-CE 4.27Å; M773-M931 HydrophobicContact CE-CB 4.13Å; M773-M931 HydrophobicContact CE-CE 4.12Å; M773-M931 HydrophobicContact CE-CG 3.77Å; M773-M931 HydrophobicContact CE-SD 3.91Å; M773-M931 HydrophobicContact CG-CE 3.94Å; M773-F936 HydrophobicContact CE-CZ 4.46Å
774	V	68.6	Low	73.9	Confident	121 Å²	121	70.7 Å²	70.7	73%	0.733	41%	0.405	S	S	*	.	H	α-helix	trans	-73.9	-20.4	173.4	171.9	0	0	0	0	111.7	A770 E776	A770-V774 WeakPolarHBondContact O-CB 3.2Å; A770-V774 WeakPolarHBondContact O-CG2 3.47Å; A770-V774 PolarHBondContact O-N 3.13Å; V774-E776 VanDerWaalsContact C-N 3.32Å; V774-E776 PolarHBondContact O-N 3.1Å
775	G	59.8	Low	73.8	Confident	35 Å²	35	69.2 Å²	69.2	36%	0.361	40%	0.396	S	S	.	.	S	Bend	trans	-69.8	82.6	173.3	0	0	0	0	0	112.5	A771 M773 K777	A771-G775 PolarHBondContact O-N 3.13Å; M773-G775 VanDerWaalsContact C-N 3.27Å; G775-K777 PolarHBondContact O-N 2.88Å
776	E	52.4	Low	73.8	Confident	107 Å²	107	73.4 Å²	73.4	50%	0.5	42%	0.417	S	S	.	.			trans	-55	107.8	170.5	-67.7	-168.8	156.6	0	0	110.3	V774	V774-E776 VanDerWaalsContact C-N 3.32Å; V774-E776 PolarHBondContact O-N 3.1Å
777	K	51.2	Low	73.7	Confident	136 Å²	136	70.5 Å²	70.5	59%	0.591	40%	0.398	S	S	*	.			trans	-111	68.7	174.8	-68.7	-174.5	-175	-178.9	0	110.3	G775 Y779	G775-K777 PolarHBondContact O-N 2.88Å; K777-Y779 HydrophobicContact CB-CD2 4.15Å; K777-Y779 HydrophobicContact CB-CE1 4.33Å; K777-Y779 HydrophobicContact CB-CE2 3.72Å; K777-Y779 HydrophobicContact CD-CE1 4.17Å; K777-Y779 HydrophobicContact CD-CE2 4.45Å; K777-Y779 WeakPolarHBondContact CD-OH 3.47Å; K777-Y779 WeakPolarHBondContact O-CD2 3.4Å; K777-Y779 PolarHBondContact O-N 3.23Å
778	T	55.3	Low	73.6	Confident	98 Å²	98	71.6 Å²	71.6	60%	0.601	40%	0.401	S	S	*	.			trans	-61.2	87.9	150.8	36.4	0	0	0	0	107.9	E780	T778-E780 PolarHBondContact O-N 3.16Å
779	Y	52.9	Low	73.5	Confident	138 Å²	138	71.7 Å²	71.7	54%	0.541	40%	0.398	S	S	.	.			trans	-64.4	109	178.8	-69.5	-81.8	0	0	0	109.8	K777 Q781	K777-Y779 HydrophobicContact CB-CD2 4.15Å; K777-Y779 HydrophobicContact CB-CE1 4.33Å; K777-Y779 HydrophobicContact CB-CE2 3.72Å; K777-Y779 HydrophobicContact CD-CE1 4.17Å; K777-Y779 HydrophobicContact CD-CE2 4.45Å; K777-Y779 WeakPolarHBondContact CD-OH 3.47Å; K777-Y779 WeakPolarHBondContact O-CD2 3.4Å; K777-Y779 PolarHBondContact O-N 3.23Å; Y779-Q781 PolarHBondContact O-N 3.15Å
780	E	59.1	Low	73.7	Confident	117 Å²	117	69.7 Å²	69.7	55%	0.547	39%	0.387	S	S	.	.			trans	-53.4	123.4	167.3	-68.3	-176.1	-177	0	0	109.2	T778 L782 V869	T778-E780 PolarHBondContact O-N 3.16Å; E780-L782 PolarHBondContact O-N 3.29Å; E780-V869 HydrophobicContact CB-CG1 3.99Å; E780-V869 HydrophobicContact CG-CG1 3.93Å
781	Q	66.1	Low	74.1	Confident	34 Å²	34	69.9 Å²	69.9	16%	0.159	38%	0.38	C	S	.	.	S	Bend	trans	-73	-16.8	-175.8	-60.1	-160.5	50.4	0	0	112.9	R663 Y779 K789	R663-Q781 PolarHBondContact O-NE2 3.47Å; Y779-Q781 PolarHBondContact O-N 3.15Å; Q781-K789 PolarHBondContact O-NZ 3.32Å
782	L	78	Confident	74.3	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.375	C	S	.	.			trans	-142.9	139.3	-178.7	-71.6	168.9	0	0	0	108.8	I660 V662 E780 G784 D787 K789 L790 F797 A846 V869	I660-L782 HydrophobicContact CG2-CD1 3.9Å; V662-L782 HydrophobicContact CG1-CD1 4.02Å; E780-L782 PolarHBondContact O-N 3.29Å; L782-G784 VanDerWaalsContact C-N 3.35Å; L782-D787 WeakPolarHBondContact CA-OD2 3.38Å; L782-D787 HydrophobicContact CD2-CB 3.76Å; L782-K789 HydrophobicContact CD2-CB 4.05Å; L782-K789 HydrophobicContact CD2-CD 4.08Å; L782-L790 HydrophobicContact CD1-CD1 4.36Å; L782-L790 HydrophobicContact CD1-CD2 4.25Å; L782-L790 HydrophobicContact CD1-CG 4.47Å; L782-L790 HydrophobicContact CD2-CD1 4.24Å; L782-L790 HydrophobicContact CD2-CD2 4.25Å; L782-L790 HydrophobicContact CD2-CG 3.87Å; L782-F797 HydrophobicContact CD1-CE1 3.8Å; L782-F797 HydrophobicContact CD1-CZ 3.68Å; L782-F797 HydrophobicContact CD2-CE1 3.97Å; L782-F797 HydrophobicContact CD2-CZ 3.99Å; L782-F797 HydrophobicContact CG-CE1 4.17Å; L782-F797 HydrophobicContact CG-CZ 3.82Å; L782-A846 HydrophobicContact CD1-CB 3.73Å; L782-V869 HydrophobicContact CB-CG2 4.04Å
783	S	81.4	Confident	74.1	Confident	99 Å²	99	69.2 Å²	69.2	69%	0.692	36%	0.362	S	S	*	.	S	Bend	trans	-86.2	-3.1	173	-58.6	0	0	0	0	114.4	D787 G870	S783-D787 PolarHBondContact N-OD2 2.72Å; S783-G870 WeakPolarHBondContact O-CA 3.48Å
784	G	87.3	Confident	73.6	Confident	6 Å²	6	71.2 Å²	71.2	6%	0.062	38%	0.383	C	S	.	.	S	Bend	trans	137.3	-166	179.6	0	0	0	0	0	112.8	L782 H786 D787 L790	L782-G784 VanDerWaalsContact C-N 3.35Å; G784-H786 PolarHBondContact O-N 2.91Å; G784-D787 VanDerWaalsContact O-CB 3.32Å; G784-D787 WeakPolarHBondContact O-CB 3.49Å; G784-D787 PolarHBondContact O-N 2.85Å; G784-D787 VanDerWaalsContact O-N 3.09Å; G784-L790 WeakPolarHBondContact O-CD1 3.1Å
785	I	89.6	Confident	73.6	Confident	12 Å²	12	71.2 Å²	71.2	6%	0.062	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28	-173.2	-163.1	59.4	0	0	0	114.2	I660 D787 L790 F815 M818 I848 F873	I660-I785 HydrophobicContact CD1-CB 4.37Å; I660-I785 HydrophobicContact CD1-CD1 4.22Å; I785-D787 VanDerWaalsContact C-N 3.33Å; I785-L790 HydrophobicContact CD1-CD1 4.36Å; I785-F815 HydrophobicContact CG1-CE2 3.86Å; I785-F815 HydrophobicContact CG1-CZ 4.39Å; I785-M818 HydrophobicContact CD1-CE 3.62Å; I785-M818 HydrophobicContact CD1-SD 4.37Å; I785-M818 HydrophobicContact CG1-CE 4.33Å; I785-I848 HydrophobicContact CD1-CD1 4.22Å; I785-F873 HydrophobicContact CB-CD1 3.93Å; I785-F873 HydrophobicContact CB-CD2 4.45Å; I785-F873 HydrophobicContact CB-CE1 3.77Å; I785-F873 HydrophobicContact CB-CE2 4.3Å; I785-F873 HydrophobicContact CB-CG 4.28Å; I785-F873 HydrophobicContact CB-CZ 3.97Å; I785-F873 HydrophobicContact CD1-CE1 4.16Å; I785-F873 HydrophobicContact CD1-CE2 3.93Å; I785-F873 HydrophobicContact CD1-CZ 3.56Å; I785-F873 HydrophobicContact CG1-CD1 4.49Å; I785-F873 HydrophobicContact CG1-CD2 4.23Å; I785-F873 HydrophobicContact CG1-CE1 4.12Å; I785-F873 HydrophobicContact CG1-CE2 3.82Å; I785-F873 HydrophobicContact CG1-CZ 3.77Å; I785-F873 HydrophobicContact CG2-CD1 4.04Å; I785-F873 HydrophobicContact CG2-CD2 4.44Å; I785-F873 HydrophobicContact CG2-CE1 4.4Å; I785-F873 HydrophobicContact CG2-CG 4.08Å
786	H	89	Confident	74.6	Confident	137 Å²	137	71.9 Å²	71.9	63%	0.634	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	14.2	178.1	-63.2	-52.1	0	0	0	114.1	G784 H791 F815	G784-H786 PolarHBondContact O-N 2.91Å; H786-H791 AromaticContact ND1-NE2 3.68Å; H786-F815 AromaticContact CE1-CZ 3.72Å
787	D	89.3	Confident	76.4	Confident	14 Å²	14	67.8 Å²	67.8	8%	0.075	36%	0.362	C	S	.	.			trans	-65.4	131.5	175.4	-168.2	-59.1	0	0	0	110.4	L782 S783 G784 I785 K789 L790 H791	L782-D787 WeakPolarHBondContact CA-OD2 3.38Å; L782-D787 HydrophobicContact CD2-CB 3.76Å; S783-D787 PolarHBondContact N-OD2 2.72Å; G784-D787 VanDerWaalsContact O-CB 3.32Å; G784-D787 WeakPolarHBondContact O-CB 3.49Å; G784-D787 PolarHBondContact O-N 2.85Å; G784-D787 VanDerWaalsContact O-N 3.09Å; I785-D787 VanDerWaalsContact C-N 3.33Å; D787-K789 PolarHBondContact O-N 2.86Å; D787-K789 WeakPolarHBondContact OD1-CB 3.28Å; D787-K789 WeakPolarHBondContact OD1-CD 3.44Å; D787-K789 VanDerWaalsContact OD1-CG 3.27Å; D787-K789 WeakPolarHBondContact OD1-CG 3.14Å; D787-K789 PolarHBondContact OD1-N 2.89Å; D787-K789 IonicContact OD1-NZ 3.4Å; D787-K789 IonicContact OD2-NZ 2.81Å; D787-L790 PolarHBondContact O-N 3.4Å; D787-H791 PolarHBondContact O-N 3.31Å
788	P	87.1	Confident	78.3	Confident	77 Å²	77	64.4 Å²	64.4	50%	0.5	35%	0.346	S	S	.	.	H	α-helix	trans	-52.8	-23.1	177.6	-29.7	36.5	0	0	0	115.4	H792	P788-H792 WeakPolarHBondContact O-CB 3.49Å; P788-H792 PolarHBondContact O-N 3.45Å; P788-H792 PolarHBondContact O-ND1 2.82Å
789	K	86.3	Confident	80	Confident	70 Å²	70	59.8 Å²	59.8	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-69.4	-30.5	176.2	-64.7	163.9	-168.6	137.4	0	113.9	Q781 L782 D787 F797	Q781-K789 PolarHBondContact O-NZ 3.32Å; L782-K789 HydrophobicContact CD2-CB 4.05Å; L782-K789 HydrophobicContact CD2-CD 4.08Å; D787-K789 PolarHBondContact O-N 2.86Å; D787-K789 WeakPolarHBondContact OD1-CB 3.28Å; D787-K789 WeakPolarHBondContact OD1-CD 3.44Å; D787-K789 VanDerWaalsContact OD1-CG 3.27Å; D787-K789 WeakPolarHBondContact OD1-CG 3.14Å; D787-K789 PolarHBondContact OD1-N 2.89Å; D787-K789 IonicContact OD1-NZ 3.4Å; D787-K789 IonicContact OD2-NZ 2.81Å; K789-F797 HydrophobicContact CB-CB 4.48Å; K789-F797 HydrophobicContact CB-CD1 4.44Å; K789-F797 HydrophobicContact CB-CG 4.31Å
790	L	88.6	Confident	82	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-81.2	-39.8	176.7	-64.9	174.2	0	0	0	110.7	I660 L782 G784 I785 D787 F797 F799 M818	I660-L790 HydrophobicContact CD1-CD1 3.93Å; L782-L790 HydrophobicContact CD1-CD1 4.36Å; L782-L790 HydrophobicContact CD1-CD2 4.25Å; L782-L790 HydrophobicContact CD1-CG 4.47Å; L782-L790 HydrophobicContact CD2-CD1 4.24Å; L782-L790 HydrophobicContact CD2-CD2 4.25Å; L782-L790 HydrophobicContact CD2-CG 3.87Å; G784-L790 WeakPolarHBondContact O-CD1 3.1Å; I785-L790 HydrophobicContact CD1-CD1 4.36Å; D787-L790 PolarHBondContact O-N 3.4Å; L790-F797 HydrophobicContact CD2-CD1 4.08Å; L790-F797 HydrophobicContact CD2-CE1 3.83Å; L790-F799 HydrophobicContact CD2-CB 4.26Å; L790-F799 HydrophobicContact CD2-CD1 3.69Å; L790-F799 HydrophobicContact CD2-CD2 4.31Å; L790-F799 HydrophobicContact CD2-CE1 4.07Å; L790-F799 HydrophobicContact CD2-CG 3.83Å; L790-M818 HydrophobicContact CB-SD 3.89Å
791	H	86.9	Confident	83.7	Confident	56 Å²	56	47.6 Å²	47.6	26%	0.259	27%	0.265	S	S	.	.	H	α-helix	trans	-71.4	-30.9	176.5	-75.2	-70.2	0	0	0	113.6	H786 D787 P793 F815	H786-H791 AromaticContact ND1-NE2 3.68Å; D787-H791 PolarHBondContact O-N 3.31Å; H791-P793 VanDerWaalsContact C-CD 3.46Å; H791-P793 WeakPolarHBondContact O-CD 3.42Å; H791-F815 AromaticContact CE1-CD1 3.75Å; H791-F815 AromaticContact CE1-CE1 3.85Å
792	H	84.6	Confident	85.1	Confident	101 Å²	101	46.2 Å²	46.2	47%	0.468	26%	0.259	S	S	.	.			trans	-117.3	77.6	-179.7	-54.8	92.4	0	0	0	111.6	P788 S794 Q795	P788-H792 WeakPolarHBondContact O-CB 3.49Å; P788-H792 PolarHBondContact O-N 3.45Å; P788-H792 PolarHBondContact O-ND1 2.82Å; H792-S794 PolarHBondContact O-N 3.21Å; H792-Q795 PolarHBondContact O-N 3.19Å
793	P	70.9	Confident	85.7	Confident	23 Å²	23	52.2 Å²	52.2	15%	0.149	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.4	-8.5	-177.2	22.2	-32.7	0	0	0	115.3	H791 Q795 G796 Y821	H791-P793 VanDerWaalsContact C-CD 3.46Å; H791-P793 WeakPolarHBondContact O-CD 3.42Å; P793-Q795 PolarHBondContact O-N 2.86Å; P793-Q795 VanDerWaalsContact O-N 3.11Å; P793-G796 PolarHBondContact O-N 3.26Å; P793-Y821 HydrophobicContact CB-CD1 3.97Å; P793-Y821 HydrophobicContact CB-CD2 3.2Å; P793-Y821 HydrophobicContact CB-CE1 4.13Å; P793-Y821 HydrophobicContact CB-CE2 3.4Å; P793-Y821 HydrophobicContact CB-CG 3.52Å; P793-Y821 HydrophobicContact CG-CD2 3.72Å; P793-Y821 HydrophobicContact CG-CE2 4.38Å; P793-Y821 HydrophobicContact CG-CG 3.9Å
794	S	61.3	Low	86.2	Confident	114 Å²	114	48.5 Å²	48.5	80%	0.797	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-58.6	-15.7	171.1	52.5	0	0	0	0	113.9	H792 G796	H792-S794 PolarHBondContact O-N 3.21Å; S794-G796 PolarHBondContact O-N 2.78Å
795	Q	69.2	Low	86.4	Confident	122 Å²	122	48.2 Å²	48.2	57%	0.57	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-77.8	0	173.6	-58.9	-176	19	0	0	113.9	H792 P793 F797	H792-Q795 PolarHBondContact O-N 3.19Å; P793-Q795 PolarHBondContact O-N 2.86Å; P793-Q795 VanDerWaalsContact O-N 3.11Å; Q795-F797 VanDerWaalsContact C-N 3.33Å; Q795-F797 PolarHBondContact O-N 3.09Å
796	G	80.8	Confident	86.4	Confident	49 Å²	49	47.7 Å²	47.7	51%	0.505	25%	0.248	S	C	.	.			trans	80	9.1	176.1	0	0	0	0	0	115.2	P793 S794	P793-G796 PolarHBondContact O-N 3.26Å; S794-G796 PolarHBondContact O-N 2.78Å
797	F	89.3	Confident	86.6	Confident	20 Å²	20	41.2 Å²	41.2	9%	0.088	22%	0.218	C	C	.	.			trans	-79	118.7	-178.9	-170.2	-96	0	0	0	111.3	L782 K789 L790 Q795 F799 Y821 D845 A846	L782-F797 HydrophobicContact CD1-CE1 3.8Å; L782-F797 HydrophobicContact CD1-CZ 3.68Å; L782-F797 HydrophobicContact CD2-CE1 3.97Å; L782-F797 HydrophobicContact CD2-CZ 3.99Å; L782-F797 HydrophobicContact CG-CE1 4.17Å; L782-F797 HydrophobicContact CG-CZ 3.82Å; K789-F797 HydrophobicContact CB-CB 4.48Å; K789-F797 HydrophobicContact CB-CD1 4.44Å; K789-F797 HydrophobicContact CB-CG 4.31Å; L790-F797 HydrophobicContact CD2-CD1 4.08Å; L790-F797 HydrophobicContact CD2-CE1 3.83Å; Q795-F797 VanDerWaalsContact C-N 3.33Å; Q795-F797 PolarHBondContact O-N 3.09Å; F797-F799 AromaticContact CD1-CD1 3.99Å; F797-F799 HydrophobicContact CD1-CD1 3.99Å; F797-F799 HydrophobicContact CE1-CD1 4.48Å; F797-F799 WeakPolarHBondContact O-CD1 3.32Å; F797-Y821 PolarHBondContact O-OH 3.4Å; F797-D845 HydrophobicContact CD2-CB 3.85Å; F797-D845 HydrophobicContact CE1-CB 4.39Å; F797-D845 HydrophobicContact CE2-CB 3.48Å; F797-D845 VanDerWaalsContact CE2-CB 3.48Å; F797-D845 HydrophobicContact CG-CB 4.45Å; F797-D845 HydrophobicContact CZ-CB 3.76Å; F797-A846 HydrophobicContact CE1-CB 3.76Å; F797-A846 HydrophobicContact CZ-CB 3.81Å
798	R	91.1	Very high	86.7	Confident	66 Å²	66	41 Å²	41	25%	0.249	22%	0.216	C	C	.	.			trans	-99.3	126.2	-171.3	-61.3	158.1	-62.6	159.8	9.1	111.6	Y825 Q842 K843 D845 A846	R798-Y825 HydrophobicContact CG-CE1 4.41Å; R798-Q842 VanDerWaalsContact CZ-O 3.27Å; R798-Q842 PolarHBondContact NH1-O 3.09Å; R798-Q842 PolarHBondContact NH2-O 2.93Å; R798-K843 PolarHBondContact NH1-O 3.24Å; R798-K843 VanDerWaalsContact NH1-O 3.13Å; R798-D845 IonicContact CZ-OD2 3.16Å; R798-D845 VanDerWaalsContact CZ-OD2 3.24Å; R798-D845 PolarHBondContact N-OD2 2.82Å; R798-D845 IonicContact NE-OD2 2.71Å; R798-D845 PolarHBondContact NE-OD2 3.03Å; R798-D845 IonicContact NH2-OD1 3.15Å; R798-D845 PolarHBondContact NH2-OD1 3.17Å; R798-D845 IonicContact NH2-OD2 2.69Å; R798-D845 PolarHBondContact NH2-OD2 2.88Å; R798-D845 PolarHBondContact O-N 3.31Å; R798-A846 PolarHBondContact O-N 2.05Å
799	F	92.4	Very high	86.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	153.7	178.4	57.8	-86.3	0	0	0	111.9	L790 F797 M818 Y821 M822 A846 I848	L790-F799 HydrophobicContact CD2-CB 4.26Å; L790-F799 HydrophobicContact CD2-CD1 3.69Å; L790-F799 HydrophobicContact CD2-CD2 4.31Å; L790-F799 HydrophobicContact CD2-CE1 4.07Å; L790-F799 HydrophobicContact CD2-CG 3.83Å; F797-F799 AromaticContact CD1-CD1 3.99Å; F797-F799 HydrophobicContact CD1-CD1 3.99Å; F797-F799 HydrophobicContact CE1-CD1 4.48Å; F797-F799 WeakPolarHBondContact O-CD1 3.32Å; F799-M818 HydrophobicContact CE2-CG 3.41Å; F799-M818 VanDerWaalsContact CE2-CG 3.41Å; F799-M818 HydrophobicContact CE2-SD 4.28Å; F799-M818 HydrophobicContact CZ-CG 3.62Å; F799-Y821 HydrophobicContact CD1-CD1 4.19Å; F799-Y821 AromaticContact CD1-CE1 3.92Å; F799-Y821 HydrophobicContact CD1-CE1 3.92Å; F799-Y821 AromaticContact CE1-CD1 3.54Å; F799-Y821 HydrophobicContact CE1-CD1 3.54Å; F799-Y821 AromaticContact CE1-CE1 3.61Å; F799-Y821 HydrophobicContact CE1-CE1 3.61Å; F799-Y821 HydrophobicContact CE2-CD1 4.04Å; F799-Y821 AromaticContact CZ-CD1 3.45Å; F799-Y821 HydrophobicContact CZ-CD1 3.45Å; F799-Y821 VanDerWaalsContact CZ-CD1 3.45Å; F799-Y821 HydrophobicContact CZ-CE1 4.02Å; F799-Y821 HydrophobicContact CZ-CG 4.3Å; F799-M822 HydrophobicContact CD2-CB 4.1Å; F799-M822 HydrophobicContact CD2-CG 3.84Å; F799-M822 HydrophobicContact CD2-SD 4.12Å; F799-M822 HydrophobicContact CE2-CB 3.81Å; F799-M822 HydrophobicContact CE2-CG 4.06Å; F799-M822 HydrophobicContact CE2-SD 4.38Å; F799-A846 VanDerWaalsContact CA-O 3.3Å; F799-A846 WeakPolarHBondContact CA-O 3.38Å; F799-A846 HydrophobicContact CB-CB 4.25Å; F799-I848 HydrophobicContact CD2-CD1 4.37Å
800	A	94.3	Very high	87.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	165.5	-174.2	0	0	0	0	0	111.7	Y825 L844 F847 I848	A800-Y825 VanDerWaalsContact CB-O 3.3Å; A800-Y825 WeakPolarHBondContact CB-O 3.32Å; A800-L844 HydrophobicContact CB-CD1 3.78Å; A800-L844 HydrophobicContact CB-CD2 3.76Å; A800-L844 HydrophobicContact CB-CG 4.45Å; A800-F847 WeakPolarHBondContact O-CD2 3.35Å; A800-I848 PolarHBondContact O-N 2.93Å
801	T	95.1	Very high	87.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.			trans	-137.3	179.6	165.8	-167.8	0	0	0	0	110.8	A807 E808 M822 N826 V827 I848	T801-A807 WeakPolarHBondContact OG1-CB 3.49Å; T801-E808 HydrophobicContact CG2-CB 3.9Å; T801-M822 HydrophobicContact CG2-CE 3.41Å; T801-M822 VanDerWaalsContact CG2-CE 3.41Å; T801-M822 HydrophobicContact CG2-SD 3.79Å; T801-N826 PolarHBondContact N-OD1 3.45Å; T801-N826 VanDerWaalsContact O-CA 3.27Å; T801-N826 WeakPolarHBondContact O-CA 3.37Å; T801-N826 WeakPolarHBondContact O-CB 3.48Å; T801-N826 PolarHBondContact O-OD1 2.82Å; T801-V827 PolarHBondContact O-N 3.14Å; T801-I848 WeakPolarHBondContact CA-O 3.43Å; T801-I848 WeakPolarHBondContact CB-O 3.45Å; T801-I848 PolarHBondContact OG1-O 3.35Å
802	V	94.4	Very high	87.6	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-77.4	134.6	174.8	-177.6	0	0	0	0	110	S805 V827 P828 F847 M849	V802-S805 WeakPolarHBondContact O-CB 3.33Å; V802-S805 PolarHBondContact O-OG 3.19Å; V802-V827 WeakPolarHBondContact CA-O 3.07Å; V802-V827 HydrophobicContact CG2-CG2 4.4Å; V802-P828 WeakPolarHBondContact CG1-O 3.43Å; V802-F847 HydrophobicContact CG2-CE2 4.32Å; V802-F847 HydrophobicContact CG2-CZ 3.83Å; V802-M849 HydrophobicContact CB-CE 4.26Å; V802-M849 HydrophobicContact CB-SD 4.01Å; V802-M849 HydrophobicContact CG2-CE 3.97Å; V802-M849 HydrophobicContact CG2-CG 4.38Å; V802-M849 HydrophobicContact CG2-SD 3.65Å
803	R	91.9	Very high	87.9	Confident	127 Å²	127	44 Å²	44	48%	0.479	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	141.6	178	-65.8	170.9	-168.7	-165.3	2.1	111.2	S805 N826 V827	R803-S805 PolarHBondContact O-N 3.35Å; R803-N826 HydrophobicContact CG-CB 3.79Å; R803-N826 VanDerWaalsContact CZ-O 3.25Å; R803-N826 PolarHBondContact NE-O 2.87Å; R803-N826 PolarHBondContact NH2-O 3.36Å; R803-V827 WeakPolarHBondContact CG-O 3.4Å; R803-V827 PolarHBondContact N-O 3.14Å
804	E	90.1	Very high	89	Confident	21 Å²	21	45.3 Å²	45.3	10%	0.098	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	27.7	176.6	-67.2	161.8	-118.4	0	0	114	K609 K614 T619 E808	K609-E804 HydrophobicContact CD-CB 4.18Å; K609-E804 VanDerWaalsContact CD-CD 3.5Å; K609-E804 HydrophobicContact CD-CG 4.43Å; K609-E804 WeakPolarHBondContact CD-OE2 3.45Å; K609-E804 IonicContact NZ-OE1 2.73Å; K609-E804 PolarHBondContact NZ-OE1 2.66Å; K609-E804 IonicContact NZ-OE2 2.7Å; K609-E804 PolarHBondContact NZ-OE2 3.29Å; K614-E804 HydrophobicContact CD-CG 4.48Å; K614-E804 HydrophobicContact CG-CG 4.38Å; T619-E804 WeakPolarHBondContact CB-OE2 3.25Å; T619-E804 WeakPolarHBondContact CG2-OE2 3.5Å; T619-E804 PolarHBondContact OG1-OE2 2.78Å; E804-E808 PolarHBondContact N-OE2 2.98Å
805	S	91.8	Very high	90.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-94.8	167.4	175.8	66	0	0	0	0	113.3	V802 R803 A807 E808 D809	V802-S805 WeakPolarHBondContact O-CB 3.33Å; V802-S805 PolarHBondContact O-OG 3.19Å; R803-S805 PolarHBondContact O-N 3.35Å; S805-A807 VanDerWaalsContact C-N 3.29Å; S805-A807 PolarHBondContact O-N 3.28Å; S805-A807 PolarHBondContact OG-N 3.08Å; S805-E808 PolarHBondContact O-N 3.37Å; S805-E808 PolarHBondContact OG-N 3.39Å; S805-D809 PolarHBondContact O-N 3.41Å
806	S	90.8	Very high	91.6	Very high	1 Å²	1	40 Å²	40	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-47.9	-51.3	162.5	37.6	0	0	0	0	111.4	S638 E808 D809 Y810 D850 E876	S638-S806 PolarHBondContact OG-OG 3.38Å; S806-E808 PolarHBondContact O-N 3.11Å; S806-D809 PolarHBondContact O-N 3.08Å; S806-Y810 WeakPolarHBondContact O-CB 3.27Å; S806-Y810 PolarHBondContact O-N 3.43Å; S806-D850 PolarHBondContact OG-OD1 2.94Å; S806-D850 PolarHBondContact OG-OD2 2.88Å; S806-E876 WeakPolarHBondContact CB-OE2 3.43Å
807	A	92.3	Very high	92.1	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60	-42.5	-179.2	0	0	0	0	0	113.4	L658 T801 S805 V811 M849	L658-A807 HydrophobicContact CD1-CB 4.42Å; L658-A807 HydrophobicContact CD2-CB 3.64Å; T801-A807 WeakPolarHBondContact OG1-CB 3.49Å; S805-A807 VanDerWaalsContact C-N 3.29Å; S805-A807 PolarHBondContact O-N 3.28Å; S805-A807 PolarHBondContact OG-N 3.08Å; A807-V811 WeakPolarHBondContact O-CB 3.42Å; A807-V811 VanDerWaalsContact O-CG2 3.32Å; A807-V811 WeakPolarHBondContact O-CG2 3.21Å; A807-V811 PolarHBondContact O-N 2.81Å; A807-M849 HydrophobicContact CB-SD 4.32Å
808	E	92.7	Very high	92.2	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-47.2	176.3	-176.6	174	-128.9	0	0	111.5	K614 T801 E804 S805 S806 K812 H819 N826	K614-E808 IonicContact NZ-OE2 2.64Å; T801-E808 HydrophobicContact CG2-CB 3.9Å; E804-E808 PolarHBondContact N-OE2 2.98Å; S805-E808 PolarHBondContact O-N 3.37Å; S805-E808 PolarHBondContact OG-N 3.39Å; S806-E808 PolarHBondContact O-N 3.11Å; E808-K812 WeakPolarHBondContact O-CB 3.41Å; E808-K812 PolarHBondContact O-N 3.21Å; E808-H819 IonicContact OE1-CE1 3.7Å; E808-N826 PolarHBondContact OE1-ND2 3.09Å
809	D	90.5	Very high	92.3	Very high	33 Å²	33	40.7 Å²	40.7	18%	0.176	19%	0.193	C	C	.	.	H	α-helix	trans	-72	-34.3	-178.5	-91.2	-31.6	0	0	0	112.9	S805 S806 K812 K813	S805-D809 PolarHBondContact O-N 3.41Å; S806-D809 PolarHBondContact O-N 3.08Å; D809-K812 IonicContact OD1-NZ 2.87Å; D809-K812 PolarHBondContact OD1-NZ 2.8Å; D809-K813 WeakPolarHBondContact O-CB 3.37Å; D809-K813 PolarHBondContact O-N 3.28Å
810	Y	92.1	Very high	92.2	Very high	62 Å²	62	47.1 Å²	47.1	24%	0.243	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-51.8	171.9	177.2	-93.9	0	0	0	111.2	L658 S806 K812 K813 S814 F815 F873 A874	L658-Y810 HydrophobicContact CD1-CD1 3.45Å; L658-Y810 VanDerWaalsContact CD1-CD1 3.45Å; L658-Y810 HydrophobicContact CD1-CE1 4.24Å; L658-Y810 HydrophobicContact CD1-CG 3.72Å; S806-Y810 WeakPolarHBondContact O-CB 3.27Å; S806-Y810 PolarHBondContact O-N 3.43Å; Y810-K812 VanDerWaalsContact C-N 3.3Å; Y810-K812 PolarHBondContact O-N 3.38Å; Y810-K813 PolarHBondContact O-N 2.93Å; Y810-K813 VanDerWaalsContact O-N 3.12Å; Y810-S814 WeakPolarHBondContact CE2-OG 3.45Å; Y810-S814 WeakPolarHBondContact O-CB 3.25Å; Y810-S814 PolarHBondContact O-N 3.42Å; Y810-S814 PolarHBondContact O-OG 3.19Å; Y810-F815 HydrophobicContact CE1-CE2 4.17Å; Y810-F873 HydrophobicContact CD1-CD2 4.36Å; Y810-F873 HydrophobicContact CD1-CE2 4.16Å; Y810-F873 AromaticContact CE1-CD2 3.62Å; Y810-F873 HydrophobicContact CE1-CD2 3.62Å; Y810-F873 AromaticContact CE1-CE2 3.76Å; Y810-F873 HydrophobicContact CE1-CE2 3.76Å; Y810-A874 HydrophobicContact CD1-CB 4.18Å; Y810-A874 HydrophobicContact CD2-CB 3.64Å; Y810-A874 HydrophobicContact CE1-CB 4.09Å; Y810-A874 HydrophobicContact CE2-CB 3.55Å; Y810-A874 HydrophobicContact CG-CB 3.97Å
811	V	93	Very high	92.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-39.3	179.4	171.1	0	0	0	0	110.9	A807 K813 F815 M818 H819 M822	A807-V811 WeakPolarHBondContact O-CB 3.42Å; A807-V811 VanDerWaalsContact O-CG2 3.32Å; A807-V811 WeakPolarHBondContact O-CG2 3.21Å; A807-V811 PolarHBondContact O-N 2.81Å; V811-K813 VanDerWaalsContact C-N 3.35Å; V811-K813 PolarHBondContact O-N 3.09Å; V811-F815 CarbonylContact O-C 3.59Å; V811-F815 WeakPolarHBondContact O-CA 3.41Å; V811-F815 PolarHBondContact O-N 3.49Å; V811-F815 VanDerWaalsContact O-O 3.14Å; V811-M818 HydrophobicContact CB-CE 4.44Å; V811-M818 HydrophobicContact CG1-CB 4.47Å; V811-M818 HydrophobicContact CG1-CE 3.6Å; V811-M818 HydrophobicContact CG1-CG 4.4Å; V811-M818 HydrophobicContact CG2-CE 4.07Å; V811-H819 HydrophobicContact CG1-CB 4.07Å; V811-M822 HydrophobicContact CB-CE 3.91Å; V811-M822 HydrophobicContact CG1-CE 3.55Å; V811-M822 HydrophobicContact CG1-SD 4.27Å; V811-M822 HydrophobicContact CG2-CE 4.41Å
812	K	91.9	Very high	92	Very high	97 Å²	97	48.2 Å²	48.2	42%	0.422	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-37.3	173.7	177	178	143.7	-146.5	0	113.6	E808 D809 Y810 H819	E808-K812 WeakPolarHBondContact O-CB 3.41Å; E808-K812 PolarHBondContact O-N 3.21Å; D809-K812 IonicContact OD1-NZ 2.87Å; D809-K812 PolarHBondContact OD1-NZ 2.8Å; Y810-K812 VanDerWaalsContact C-N 3.3Å; Y810-K812 PolarHBondContact O-N 3.38Å; K812-H819 HydrophobicContact CB-CB 4.27Å
813	K	91	Very high	91.8	Very high	175 Å²	175	54.8 Å²	54.8	76%	0.761	25%	0.252	S	S	*	.	H	α-helix	trans	-80.9	-37.7	-179.8	-174.4	176.7	178.9	-179.5	0	112.8	D809 Y810 V811	D809-K813 WeakPolarHBondContact O-CB 3.37Å; D809-K813 PolarHBondContact O-N 3.28Å; Y810-K813 PolarHBondContact O-N 2.93Å; Y810-K813 VanDerWaalsContact O-N 3.12Å; V811-K813 VanDerWaalsContact C-N 3.35Å; V811-K813 PolarHBondContact O-N 3.09Å
814	S	92.5	Very high	91.8	Very high	51 Å²	51	57 Å²	57	36%	0.357	26%	0.26	S	S	.	.	H	α-helix	trans	-92.9	-31.5	-174.1	-64.1	0	0	0	0	114	Y810	Y810-S814 WeakPolarHBondContact CE2-OG 3.45Å; Y810-S814 WeakPolarHBondContact O-CB 3.25Å; Y810-S814 PolarHBondContact O-N 3.42Å; Y810-S814 PolarHBondContact O-OG 3.19Å
815	F	93.1	Very high	91.9	Very high	33 Å²	33	60 Å²	60	15%	0.145	27%	0.271	C	S	.	.			trans	-143.1	70.2	-170.1	-54.4	-65.7	0	0	0	111.1	I785 H786 H791 Y810 V811 E817 M818 H819	I785-F815 HydrophobicContact CG1-CE2 3.86Å; I785-F815 HydrophobicContact CG1-CZ 4.39Å; H786-F815 AromaticContact CE1-CZ 3.72Å; H791-F815 AromaticContact CE1-CD1 3.75Å; H791-F815 AromaticContact CE1-CE1 3.85Å; Y810-F815 HydrophobicContact CE1-CE2 4.17Å; V811-F815 CarbonylContact O-C 3.59Å; V811-F815 WeakPolarHBondContact O-CA 3.41Å; V811-F815 PolarHBondContact O-N 3.49Å; V811-F815 VanDerWaalsContact O-O 3.14Å; F815-E817 PolarHBondContact O-N 3.5Å; F815-M818 HydrophobicContact CB-CB 3.8Å; F815-M818 HydrophobicContact CB-CE 3.78Å; F815-M818 HydrophobicContact CD2-CE 3.55Å; F815-M818 HydrophobicContact CE2-CE 4.39Å; F815-M818 HydrophobicContact CG-CE 3.86Å; F815-M818 WeakPolarHBondContact O-CB 3.47Å; F815-M818 PolarHBondContact O-N 3.43Å; F815-M818 VanDerWaalsContact O-N 3.1Å; F815-H819 PolarHBondContact O-N 3.14Å
816	P	92.6	Very high	92	Very high	91 Å²	91	60.1 Å²	60.1	59%	0.591	27%	0.272	S	S	*	.	H	α-helix	trans	-60.8	-38	-169.5	22	-33.5	0	0	0	114.5	H819 E820	P816-H819 WeakPolarHBondContact O-CB 3.41Å; P816-H819 PolarHBondContact O-N 3.21Å; P816-E820 PolarHBondContact O-N 3.49Å
817	E	90.4	Very high	92.2	Very high	134 Å²	134	60.3 Å²	60.3	63%	0.626	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-43.4	174.8	-179.8	177.2	-167.4	0	0	111.9	F815 H819 E820 Y821	F815-E817 PolarHBondContact O-N 3.5Å; E817-H819 VanDerWaalsContact C-N 3.34Å; E817-H819 PolarHBondContact O-N 3.04Å; E817-E820 PolarHBondContact O-N 3.15Å; E817-Y821 PolarHBondContact O-N 3.47Å; E817-Y821 VanDerWaalsContact O-N 3.16Å
818	M	92	Very high	92.1	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-41.4	175.7	-169.3	169.5	75	0	0	110.8	I785 L790 F799 V811 F815 M822	I785-M818 HydrophobicContact CD1-CE 3.62Å; I785-M818 HydrophobicContact CD1-SD 4.37Å; I785-M818 HydrophobicContact CG1-CE 4.33Å; L790-M818 HydrophobicContact CB-SD 3.89Å; F799-M818 HydrophobicContact CE2-CG 3.41Å; F799-M818 VanDerWaalsContact CE2-CG 3.41Å; F799-M818 HydrophobicContact CE2-SD 4.28Å; F799-M818 HydrophobicContact CZ-CG 3.62Å; V811-M818 HydrophobicContact CB-CE 4.44Å; V811-M818 HydrophobicContact CG1-CB 4.47Å; V811-M818 HydrophobicContact CG1-CE 3.6Å; V811-M818 HydrophobicContact CG1-CG 4.4Å; V811-M818 HydrophobicContact CG2-CE 4.07Å; F815-M818 HydrophobicContact CB-CB 3.8Å; F815-M818 HydrophobicContact CB-CE 3.78Å; F815-M818 HydrophobicContact CD2-CE 3.55Å; F815-M818 HydrophobicContact CE2-CE 4.39Å; F815-M818 HydrophobicContact CG-CE 3.86Å; F815-M818 WeakPolarHBondContact O-CB 3.47Å; F815-M818 PolarHBondContact O-N 3.43Å; F815-M818 VanDerWaalsContact O-N 3.1Å; M818-M822 WeakPolarHBondContact O-CB 3.09Å; M818-M822 PolarHBondContact O-N 3.4Å
819	H	92.5	Very high	92	Very high	10 Å²	10	65 Å²	65	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-42.5	173.6	173.4	77.6	0	0	0	112.8	E808 V811 K812 F815 P816 E817 M822 R823	E808-H819 IonicContact OE1-CE1 3.7Å; V811-H819 HydrophobicContact CG1-CB 4.07Å; K812-H819 HydrophobicContact CB-CB 4.27Å; F815-H819 PolarHBondContact O-N 3.14Å; P816-H819 WeakPolarHBondContact O-CB 3.41Å; P816-H819 PolarHBondContact O-N 3.21Å; E817-H819 VanDerWaalsContact C-N 3.34Å; E817-H819 PolarHBondContact O-N 3.04Å; H819-M822 PolarHBondContact O-N 3.08Å; H819-R823 PolarHBondContact CD2-NH2 3.03Å; H819-R823 VanDerWaalsContact CD2-NH2 3.27Å; H819-R823 PolarHBondContact NE2-NE 3.46Å; H819-R823 PolarHBondContact NE2-NH2 2.98Å; H819-R823 WeakPolarHBondContact O-CB 3.48Å; H819-R823 PolarHBondContact O-N 3.44Å
820	E	92.1	Very high	92	Very high	135 Å²	135	63.6 Å²	63.6	63%	0.631	30%	0.299	S	S	*	.	H	α-helix	trans	-63	-42.7	180	-177.4	166.1	-164.2	0	0	112.2	P816 E817	P816-E820 PolarHBondContact O-N 3.49Å; E817-E820 PolarHBondContact O-N 3.15Å
821	Y	91.5	Very high	91.9	Very high	24 Å²	24	64 Å²	64	9%	0.094	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-51.3	171.7	178	-92	0	0	0	111.9	P793 F797 F799 E817 R823 R824 Y825	P793-Y821 HydrophobicContact CB-CD1 3.97Å; P793-Y821 HydrophobicContact CB-CD2 3.2Å; P793-Y821 HydrophobicContact CB-CE1 4.13Å; P793-Y821 HydrophobicContact CB-CE2 3.4Å; P793-Y821 HydrophobicContact CB-CG 3.52Å; P793-Y821 HydrophobicContact CG-CD2 3.72Å; P793-Y821 HydrophobicContact CG-CE2 4.38Å; P793-Y821 HydrophobicContact CG-CG 3.9Å; F797-Y821 PolarHBondContact O-OH 3.4Å; F799-Y821 HydrophobicContact CD1-CD1 4.19Å; F799-Y821 AromaticContact CD1-CE1 3.92Å; F799-Y821 HydrophobicContact CD1-CE1 3.92Å; F799-Y821 AromaticContact CE1-CD1 3.54Å; F799-Y821 HydrophobicContact CE1-CD1 3.54Å; F799-Y821 AromaticContact CE1-CE1 3.61Å; F799-Y821 HydrophobicContact CE1-CE1 3.61Å; F799-Y821 HydrophobicContact CE2-CD1 4.04Å; F799-Y821 AromaticContact CZ-CD1 3.45Å; F799-Y821 HydrophobicContact CZ-CD1 3.45Å; F799-Y821 VanDerWaalsContact CZ-CD1 3.45Å; F799-Y821 HydrophobicContact CZ-CE1 4.02Å; F799-Y821 HydrophobicContact CZ-CG 4.3Å; E817-Y821 PolarHBondContact O-N 3.47Å; E817-Y821 VanDerWaalsContact O-N 3.16Å; Y821-R823 VanDerWaalsContact C-N 3.33Å; Y821-R823 PolarHBondContact O-N 3.47Å; Y821-R824 PolarHBondContact O-N 3.17Å; Y821-Y825 AromaticContact CE1-CD2 4Å; Y821-Y825 HydrophobicContact CE1-CD2 4Å; Y821-Y825 AromaticContact CE1-CE2 3.8Å; Y821-Y825 HydrophobicContact CE1-CE2 3.8Å; Y821-Y825 HydrophobicContact CE2-CE2 4.24Å; Y821-Y825 AromaticContact CZ-CE2 3.62Å
822	M	92.4	Very high	91.9	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-34.1	-172.2	-167.9	-177.6	59.4	0	0	112.9	F799 T801 V811 M818 H819 R824 Y825 N826 I848	F799-M822 HydrophobicContact CD2-CB 4.1Å; F799-M822 HydrophobicContact CD2-CG 3.84Å; F799-M822 HydrophobicContact CD2-SD 4.12Å; F799-M822 HydrophobicContact CE2-CB 3.81Å; F799-M822 HydrophobicContact CE2-CG 4.06Å; F799-M822 HydrophobicContact CE2-SD 4.38Å; T801-M822 HydrophobicContact CG2-CE 3.41Å; T801-M822 VanDerWaalsContact CG2-CE 3.41Å; T801-M822 HydrophobicContact CG2-SD 3.79Å; V811-M822 HydrophobicContact CB-CE 3.91Å; V811-M822 HydrophobicContact CG1-CE 3.55Å; V811-M822 HydrophobicContact CG1-SD 4.27Å; V811-M822 HydrophobicContact CG2-CE 4.41Å; M818-M822 WeakPolarHBondContact O-CB 3.09Å; M818-M822 PolarHBondContact O-N 3.4Å; H819-M822 PolarHBondContact O-N 3.08Å; M822-R824 PolarHBondContact O-N 3.47Å; M822-Y825 PolarHBondContact O-N 3.43Å; M822-N826 WeakPolarHBondContact CG-OD1 3.39Å; M822-N826 PolarHBondContact O-N 2.98Å; M822-N826 VanDerWaalsContact O-N 3.13Å; M822-N826 PolarHBondContact O-OD1 3.01Å; M822-I848 HydrophobicContact SD-CD1 4.44Å
823	R	91.5	Very high	91.9	Very high	142 Å²	142	62.3 Å²	62.3	54%	0.536	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-30.4	179.3	-171.4	-174.5	-64.8	164.7	0.3	113.8	H819 Y821 Y825	H819-R823 PolarHBondContact CD2-NH2 3.03Å; H819-R823 VanDerWaalsContact CD2-NH2 3.27Å; H819-R823 PolarHBondContact NE2-NE 3.46Å; H819-R823 PolarHBondContact NE2-NH2 2.98Å; H819-R823 WeakPolarHBondContact O-CB 3.48Å; H819-R823 PolarHBondContact O-N 3.44Å; Y821-R823 VanDerWaalsContact C-N 3.33Å; Y821-R823 PolarHBondContact O-N 3.47Å; R823-Y825 VanDerWaalsContact C-N 3.32Å
824	R	91.1	Very high	92	Very high	172 Å²	172	54.7 Å²	54.7	65%	0.649	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.9	179.1	-62.3	-177.7	-65.2	-176.7	1.9	114	Y821 M822	Y821-R824 PolarHBondContact O-N 3.17Å; M822-R824 PolarHBondContact O-N 3.47Å
825	Y	92.8	Very high	91.9	Very high	85 Å²	85	57.8 Å²	57.8	33%	0.333	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-9.4	-177.1	-61.5	-74.2	0	0	0	113.5	R798 A800 Y821 M822 R823 V827 L844	R798-Y825 HydrophobicContact CG-CE1 4.41Å; A800-Y825 VanDerWaalsContact CB-O 3.3Å; A800-Y825 WeakPolarHBondContact CB-O 3.32Å; Y821-Y825 AromaticContact CE1-CD2 4Å; Y821-Y825 HydrophobicContact CE1-CD2 4Å; Y821-Y825 AromaticContact CE1-CE2 3.8Å; Y821-Y825 HydrophobicContact CE1-CE2 3.8Å; Y821-Y825 HydrophobicContact CE2-CE2 4.24Å; Y821-Y825 AromaticContact CZ-CE2 3.62Å; M822-Y825 PolarHBondContact O-N 3.43Å; R823-Y825 VanDerWaalsContact C-N 3.32Å; Y825-V827 PolarHBondContact O-N 2.67Å; Y825-L844 HydrophobicContact CG-CD2 4.48Å
826	N	94.1	Very high	92	Very high	3 Å²	3	58.6 Å²	58.6	2%	0.016	29%	0.285	C	S	.	.			trans	-54	133.1	-179.2	-78.6	-4	0	0	0	113.2	T801 R803 E808 M822	T801-N826 PolarHBondContact N-OD1 3.45Å; T801-N826 VanDerWaalsContact O-CA 3.27Å; T801-N826 WeakPolarHBondContact O-CA 3.37Å; T801-N826 WeakPolarHBondContact O-CB 3.48Å; T801-N826 PolarHBondContact O-OD1 2.82Å; R803-N826 HydrophobicContact CG-CB 3.79Å; R803-N826 VanDerWaalsContact CZ-O 3.25Å; R803-N826 PolarHBondContact NE-O 2.87Å; R803-N826 PolarHBondContact NH2-O 3.36Å; E808-N826 PolarHBondContact OE1-ND2 3.09Å; M822-N826 WeakPolarHBondContact CG-OD1 3.39Å; M822-N826 PolarHBondContact O-N 2.98Å; M822-N826 VanDerWaalsContact O-N 3.13Å; M822-N826 PolarHBondContact O-OD1 3.01Å
827	V	94.3	Very high	91.9	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.03	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-98.2	158	-178	-70.2	0	0	0	0	111.4	T801 V802 R803 Y825 A829 D832 F847	T801-V827 PolarHBondContact O-N 3.14Å; V802-V827 WeakPolarHBondContact CA-O 3.07Å; V802-V827 HydrophobicContact CG2-CG2 4.4Å; R803-V827 WeakPolarHBondContact CG-O 3.4Å; R803-V827 PolarHBondContact N-O 3.14Å; Y825-V827 PolarHBondContact O-N 2.67Å; V827-A829 WeakPolarHBondContact CG2-O 3.05Å; V827-D832 HydrophobicContact CB-CB 3.91Å; V827-D832 HydrophobicContact CG1-CB 4.04Å; V827-F847 HydrophobicContact CG2-CE2 3.75Å; V827-F847 HydrophobicContact CG2-CZ 4.34Å
828	P	90.1	Very high	91.9	Very high	73 Å²	73	50.1 Å²	50.1	47%	0.474	24%	0.237	S	C	.	.	S	Bend	trans	-77.6	-31.6	-179.9	31.2	-33	0	0	0	113.2	V802 D832	V802-P828 WeakPolarHBondContact CG1-O 3.43Å; P828-D832 WeakPolarHBondContact CD-OD2 3.29Å; P828-D832 VanDerWaalsContact CG-OD2 3.26Å; P828-D832 WeakPolarHBondContact CG-OD2 3.2Å
829	A	90.1	Very high	91.8	Very high	35 Å²	35	50.9 Å²	50.9	29%	0.289	24%	0.244	S	C	.	.	S	Bend	trans	-136.2	164.2	-179.6	0	0	0	0	0	112.6	V827 D832	V827-A829 WeakPolarHBondContact CG2-O 3.05Å; A829-D832 PolarHBondContact O-N 2.98Å
830	T	91.3	Very high	91.3	Very high	3 Å²	3	58 Å²	58	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-44.5	-178.6	-52.9	0	0	0	0	113.8	E527 D832 G833 I834 F847 M849 L853	E527-T830 VanDerWaalsContact CD-OG1 3.3Å; E527-T830 VanDerWaalsContact OE1-CB 3.22Å; E527-T830 WeakPolarHBondContact OE1-CB 3.03Å; E527-T830 PolarHBondContact OE1-OG1 2.71Å; E527-T830 WeakPolarHBondContact OE2-CB 3.41Å; E527-T830 PolarHBondContact OE2-OG1 2.93Å; T830-D832 VanDerWaalsContact C-N 3.3Å; T830-D832 PolarHBondContact O-N 3.06Å; T830-G833 PolarHBondContact O-N 3.46Å; T830-I834 HydrophobicContact CG2-CD1 3.97Å; T830-I834 PolarHBondContact O-N 3.2Å; T830-F847 HydrophobicContact CG2-CE1 4.02Å; T830-F847 HydrophobicContact CG2-CZ 4.33Å; T830-M849 HydrophobicContact CG2-CG 4.2Å; T830-L853 HydrophobicContact CG2-CD2 4.22Å
831	P	90.8	Very high	91	Very high	70 Å²	70	56.9 Å²	56.9	46%	0.455	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-32.6	-179.8	-26.1	36.9	0	0	0	114.4	G833 I834 H835	P831-G833 PolarHBondContact O-N 3.35Å; P831-I834 PolarHBondContact O-N 3.02Å; P831-H835 WeakPolarHBondContact O-CB 3.41Å; P831-H835 PolarHBondContact O-N 2.91Å
832	D	92.3	Very high	90.6	Very high	63 Å²	63	57.7 Å²	57.7	34%	0.337	29%	0.292	S	S	.	.	H	α-helix	trans	-65.1	-38.8	177.8	-70.4	-40.1	0	0	0	112.3	V827 P828 A829 T830 H835 H836	V827-D832 HydrophobicContact CB-CB 3.91Å; V827-D832 HydrophobicContact CG1-CB 4.04Å; P828-D832 WeakPolarHBondContact CD-OD2 3.29Å; P828-D832 VanDerWaalsContact CG-OD2 3.26Å; P828-D832 WeakPolarHBondContact CG-OD2 3.2Å; A829-D832 PolarHBondContact O-N 2.98Å; T830-D832 VanDerWaalsContact C-N 3.3Å; T830-D832 PolarHBondContact O-N 3.06Å; D832-H835 PolarHBondContact O-N 2.88Å; D832-H836 WeakPolarHBondContact O-CB 3.34Å; D832-H836 VanDerWaalsContact O-CG 3.28Å; D832-H836 PolarHBondContact O-N 3.18Å
833	G	92.3	Very high	90.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-42.9	177.5	0	0	0	0	0	111.6	T830 P831 H836 L837	T830-G833 PolarHBondContact O-N 3.46Å; P831-G833 PolarHBondContact O-N 3.35Å; G833-H836 PolarHBondContact O-N 3.48Å; G833-L837 PolarHBondContact O-N 3.11Å; G833-L837 VanDerWaalsContact O-N 3.08Å
834	I	91.8	Very high	90.5	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-48.6	174.4	-64.9	159.7	0	0	0	110.5	L661 T830 P831 H836 L837 K838 F847 E857	L661-I834 HydrophobicContact CD2-CG1 4.18Å; T830-I834 HydrophobicContact CG2-CD1 3.97Å; T830-I834 PolarHBondContact O-N 3.2Å; P831-I834 PolarHBondContact O-N 3.02Å; I834-H836 VanDerWaalsContact C-N 3.33Å; I834-H836 PolarHBondContact O-N 3.26Å; I834-L837 WeakPolarHBondContact O-CB 3.21Å; I834-L837 PolarHBondContact O-N 2.87Å; I834-L837 VanDerWaalsContact O-N 3.1Å; I834-K838 HydrophobicContact CG2-CD 4.03Å; I834-K838 HydrophobicContact CG2-CG 4.48Å; I834-K838 PolarHBondContact O-N 3.5Å; I834-F847 HydrophobicContact CG1-CE1 4.41Å; I834-E857 HydrophobicContact CB-CG 4.48Å; I834-E857 HydrophobicContact CD1-CB 4.03Å; I834-E857 HydrophobicContact CD1-CG 3.64Å; I834-E857 HydrophobicContact CG1-CG 3.97Å; I834-E857 HydrophobicContact CG2-CG 3.68Å; I834-E857 WeakPolarHBondContact CG2-OE1 3.36Å
835	H	91.8	Very high	90.5	Very high	117 Å²	117	48.7 Å²	48.7	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-41.9	177	175.4	-131.8	0	0	0	111.8	P831 D832 L837 K838 A839	P831-H835 WeakPolarHBondContact O-CB 3.41Å; P831-H835 PolarHBondContact O-N 2.91Å; D832-H835 PolarHBondContact O-N 2.88Å; H835-L837 VanDerWaalsContact C-N 3.28Å; H835-L837 PolarHBondContact O-N 3.4Å; H835-K838 PolarHBondContact O-N 2.87Å; H835-A839 VanDerWaalsContact O-CB 3.3Å; H835-A839 WeakPolarHBondContact O-CB 3.33Å; H835-A839 PolarHBondContact O-N 3.1Å
836	H	93.5	Very high	90.5	Very high	49 Å²	49	44.6 Å²	44.6	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-21.9	175.9	-75.6	175.9	0	0	0	114.8	D832 G833 I834 K843 L844	D832-H836 WeakPolarHBondContact O-CB 3.34Å; D832-H836 VanDerWaalsContact O-CG 3.28Å; D832-H836 PolarHBondContact O-N 3.18Å; G833-H836 PolarHBondContact O-N 3.48Å; I834-H836 VanDerWaalsContact C-N 3.33Å; I834-H836 PolarHBondContact O-N 3.26Å; H836-K843 HydrophobicContact CB-CB 4.13Å; H836-K843 VanDerWaalsContact CD2-CD 3.45Å; H836-K843 WeakPolarHBondContact CD2-CD 3.5Å; H836-K843 PolarHBondContact NE2-NZ 3.06Å; H836-K843 PolarHBondContact O-N 3.4Å; H836-K843 VanDerWaalsContact O-N 3.13Å; H836-L844 HydrophobicContact CB-CD1 3.77Å; H836-L844 HydrophobicContact CB-CG 3.94Å; H836-L844 PolarHBondContact O-N 2.98Å; H836-L844 VanDerWaalsContact O-N 3.08Å
837	L	91.6	Very high	90.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-84.8	-33.6	172.8	-173.3	70.5	0	0	0	112.7	L661 R663 G833 I834 H835 L844 T866	L661-L837 HydrophobicContact CB-CD2 4.13Å; L661-L837 HydrophobicContact CD2-CD2 3.62Å; L661-L837 HydrophobicContact CG-CD2 3.67Å; R663-L837 HydrophobicContact CB-CG 4.29Å; G833-L837 PolarHBondContact O-N 3.11Å; G833-L837 VanDerWaalsContact O-N 3.08Å; I834-L837 WeakPolarHBondContact O-CB 3.21Å; I834-L837 PolarHBondContact O-N 2.87Å; I834-L837 VanDerWaalsContact O-N 3.1Å; H835-L837 VanDerWaalsContact C-N 3.28Å; H835-L837 PolarHBondContact O-N 3.4Å; L837-L844 HydrophobicContact CD1-CB 4.47Å; L837-T866 HydrophobicContact CD2-CG2 4.21Å
838	K	89.8	Confident	90.5	Very high	47 Å²	47	44.2 Å²	44.2	20%	0.204	24%	0.244	C	C	.	.	H	α-helix	trans	-85.8	-21.8	179.6	-68.1	-174	-179.5	-173.5	0	113.9	I834 H835 E857 D861 T866	I834-K838 HydrophobicContact CG2-CD 4.03Å; I834-K838 HydrophobicContact CG2-CG 4.48Å; I834-K838 PolarHBondContact O-N 3.5Å; H835-K838 PolarHBondContact O-N 2.87Å; K838-E857 WeakPolarHBondContact CE-OE1 3.32Å; K838-E857 IonicContact NZ-OE1 3.58Å; K838-E857 PolarHBondContact NZ-OE1 3.47Å; K838-D861 WeakPolarHBondContact CE-OD1 3.18Å; K838-D861 VanDerWaalsContact NZ-CG 3.32Å; K838-D861 IonicContact NZ-OD1 2.86Å; K838-D861 PolarHBondContact NZ-OD1 2.94Å; K838-T866 HydrophobicContact CD-CG2 4.41Å; K838-T866 VanDerWaalsContact CE-CG2 3.48Å; K838-T866 WeakPolarHBondContact CE-OG1 2.76Å; K838-T866 HydrophobicContact CG-CG2 4.06Å
839	A	89.3	Confident	90.7	Very high	21 Å²	21	40.8 Å²	40.8	17%	0.174	22%	0.221	C	C	.	.	S	Bend	trans	-58.1	153.4	178.7	0	0	0	0	0	114.2	H835 P841 Q842	H835-A839 VanDerWaalsContact O-CB 3.3Å; H835-A839 WeakPolarHBondContact O-CB 3.33Å; H835-A839 PolarHBondContact O-N 3.1Å; A839-P841 CarbonylContact O-C 3.47Å; A839-Q842 WeakPolarHBondContact O-CA 3.37Å; A839-Q842 VanDerWaalsContact O-CG 3.24Å; A839-Q842 WeakPolarHBondContact O-CG 3.45Å; A839-Q842 PolarHBondContact O-N 2.96Å
840	D	83.6	Confident	90.9	Very high	160 Å²	160	39.1 Å²	39.1	86%	0.856	21%	0.207	S	C	*	.	S	Bend	trans	-126.8	118.4	173.9	-166.7	16.1	0	0	0	109.8
841	P	84.3	Confident	90.9	Very high	111 Å²	111	41.3 Å²	41.3	72%	0.721	22%	0.217	S	C	*	.	S	Bend	cis	-67.4	143.7	-3.4	29.9	-35.8	0	0	0	112.9	A839 K843	A839-P841 CarbonylContact O-C 3.47Å; P841-K843 PolarHBondContact O-N 3.28Å
842	Q	84.3	Confident	90.9	Very high	41 Å²	41	38.3 Å²	38.3	19%	0.192	20%	0.198	C	C	.	.			trans	-59.4	126.2	-177.9	-67.1	178.3	-55.2	0	0	111.6	R798 A839	R798-Q842 VanDerWaalsContact CZ-O 3.27Å; R798-Q842 PolarHBondContact NH1-O 3.09Å; R798-Q842 PolarHBondContact NH2-O 2.93Å; A839-Q842 WeakPolarHBondContact O-CA 3.37Å; A839-Q842 VanDerWaalsContact O-CG 3.24Å; A839-Q842 WeakPolarHBondContact O-CG 3.45Å; A839-Q842 PolarHBondContact O-N 2.96Å
843	K	89.9	Confident	90.9	Very high	108 Å²	108	35.5 Å²	35.5	47%	0.47	18%	0.183	S	C	.	.	S	Bend	trans	-88.1	-32.8	178	-66.8	179	-175.8	177.5	0	112.4	R798 H836 P841	R798-K843 PolarHBondContact NH1-O 3.24Å; R798-K843 VanDerWaalsContact NH1-O 3.13Å; H836-K843 HydrophobicContact CB-CB 4.13Å; H836-K843 VanDerWaalsContact CD2-CD 3.45Å; H836-K843 WeakPolarHBondContact CD2-CD 3.5Å; H836-K843 PolarHBondContact NE2-NZ 3.06Å; H836-K843 PolarHBondContact O-N 3.4Å; H836-K843 VanDerWaalsContact O-N 3.13Å; P841-K843 PolarHBondContact O-N 3.28Å
844	L	91.7	Very high	90.9	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.183	C	C	.	.			trans	-118	152.2	171.6	-63.2	174.9	0	0	0	110.1	A800 Y825 H836 L837	A800-L844 HydrophobicContact CB-CD1 3.78Å; A800-L844 HydrophobicContact CB-CD2 3.76Å; A800-L844 HydrophobicContact CB-CG 4.45Å; Y825-L844 HydrophobicContact CG-CD2 4.48Å; H836-L844 HydrophobicContact CB-CD1 3.77Å; H836-L844 HydrophobicContact CB-CG 3.94Å; H836-L844 PolarHBondContact O-N 2.98Å; H836-L844 VanDerWaalsContact O-N 3.08Å; L837-L844 HydrophobicContact CD1-CB 4.47Å
845	D	90.6	Very high	90.8	Very high	13 Å²	13	37.6 Å²	37.6	7%	0.07	19%	0.194	C	C	.	.	S	Bend	trans	-105	-24.5	172.7	-61.9	-82.9	0	0	0	111.8	R665 F797 R798	R665-D845 IonicContact CZ-OD1 3.08Å; R665-D845 IonicContact NH1-OD1 2.74Å; R665-D845 IonicContact NH2-OD1 3.36Å; R665-D845 PolarHBondContact NH2-OD1 2.8Å; F797-D845 HydrophobicContact CD2-CB 3.85Å; F797-D845 HydrophobicContact CE1-CB 4.39Å; F797-D845 HydrophobicContact CE2-CB 3.48Å; F797-D845 VanDerWaalsContact CE2-CB 3.48Å; F797-D845 HydrophobicContact CG-CB 4.45Å; F797-D845 HydrophobicContact CZ-CB 3.76Å; R798-D845 IonicContact CZ-OD2 3.16Å; R798-D845 VanDerWaalsContact CZ-OD2 3.24Å; R798-D845 PolarHBondContact N-OD2 2.82Å; R798-D845 IonicContact NE-OD2 2.71Å; R798-D845 PolarHBondContact NE-OD2 3.03Å; R798-D845 IonicContact NH2-OD1 3.15Å; R798-D845 PolarHBondContact NH2-OD1 3.17Å; R798-D845 IonicContact NH2-OD2 2.69Å; R798-D845 PolarHBondContact NH2-OD2 2.88Å; R798-D845 PolarHBondContact O-N 3.31Å
846	A	92.3	Very high	90.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.9	168.5	0	0	0	0	0	112.4	I660 L661 V662 L782 F797 R798 F799	I660-A846 HydrophobicContact CG2-CB 3.93Å; L661-A846 CarbonylContact O-C 3.55Å; L661-A846 WeakPolarHBondContact O-CA 3.38Å; V662-A846 HydrophobicContact CG1-CB 3.95Å; L782-A846 HydrophobicContact CD1-CB 3.73Å; F797-A846 HydrophobicContact CE1-CB 3.76Å; F797-A846 HydrophobicContact CZ-CB 3.81Å; R798-A846 PolarHBondContact O-N 2.05Å; F799-A846 VanDerWaalsContact CA-O 3.3Å; F799-A846 WeakPolarHBondContact CA-O 3.38Å; F799-A846 HydrophobicContact CB-CB 4.25Å
847	F	94.6	Very high	90.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.7	176.4	177.2	-117.4	0	0	0	110.3	I660 L661 A800 V802 V827 T830 I834 M849 L854	I660-F847 CarbonylContact C-O 3.56Å; I660-F847 WeakPolarHBondContact CA-O 3.33Å; L661-F847 HydrophobicContact CB-CB 4.45Å; L661-F847 PolarHBondContact N-O 2.95Å; L661-F847 PolarHBondContact O-N 2.81Å; A800-F847 WeakPolarHBondContact O-CD2 3.35Å; V802-F847 HydrophobicContact CG2-CE2 4.32Å; V802-F847 HydrophobicContact CG2-CZ 3.83Å; V827-F847 HydrophobicContact CG2-CE2 3.75Å; V827-F847 HydrophobicContact CG2-CZ 4.34Å; T830-F847 HydrophobicContact CG2-CE1 4.02Å; T830-F847 HydrophobicContact CG2-CZ 4.33Å; I834-F847 HydrophobicContact CG1-CE1 4.41Å; F847-M849 HydrophobicContact CD1-CB 4.46Å; F847-M849 HydrophobicContact CE1-CB 3.84Å; F847-M849 HydrophobicContact CE1-CG 4.41Å; F847-M849 HydrophobicContact CZ-CB 4.13Å; F847-M849 HydrophobicContact CZ-CG 4.47Å; F847-L854 HydrophobicContact CD1-CD2 3.97Å; F847-L854 HydrophobicContact CE1-CD2 4.09Å
848	I	95.1	Very high	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122	-174.5	-49.6	-177.9	0	0	0	109	I660 I785 F799 A800 T801 M822 F873	I660-I848 HydrophobicContact CG1-CG1 4.33Å; I785-I848 HydrophobicContact CD1-CD1 4.22Å; F799-I848 HydrophobicContact CD2-CD1 4.37Å; A800-I848 PolarHBondContact O-N 2.93Å; T801-I848 WeakPolarHBondContact CA-O 3.43Å; T801-I848 WeakPolarHBondContact CB-O 3.45Å; T801-I848 PolarHBondContact OG1-O 3.35Å; M822-I848 HydrophobicContact SD-CD1 4.44Å; I848-F873 HydrophobicContact CG2-CZ 4.16Å
849	M	94.1	Very high	90	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	171.4	179.5	-164.8	51.8	-174.8	0	0	110.7	Y610 G659 V802 A807 T830 F847 K851 L853 L854	Y610-M849 HydrophobicContact CE2-CE 3.79Å; G659-M849 PolarHBondContact N-O 3.08Å; G659-M849 PolarHBondContact O-N 3.06Å; V802-M849 HydrophobicContact CB-CE 4.26Å; V802-M849 HydrophobicContact CB-SD 4.01Å; V802-M849 HydrophobicContact CG2-CE 3.97Å; V802-M849 HydrophobicContact CG2-CG 4.38Å; V802-M849 HydrophobicContact CG2-SD 3.65Å; A807-M849 HydrophobicContact CB-SD 4.32Å; T830-M849 HydrophobicContact CG2-CG 4.2Å; F847-M849 HydrophobicContact CD1-CB 4.46Å; F847-M849 HydrophobicContact CE1-CB 3.84Å; F847-M849 HydrophobicContact CE1-CG 4.41Å; F847-M849 HydrophobicContact CZ-CB 4.13Å; F847-M849 HydrophobicContact CZ-CG 4.47Å; M849-K851 PolarHBondContact O-N 3.45Å; M849-L853 HydrophobicContact CE-CD2 4.31Å; M849-L854 HydrophobicContact CB-CD1 4.28Å; M849-L854 HydrophobicContact CB-CD2 3.99Å; M849-L854 HydrophobicContact CB-CG 4.19Å; M849-L854 WeakPolarHBondContact O-CD1 3.34Å
850	D	93.6	Very high	89.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	120	175.4	-63.9	24.7	0	0	0	110.9	S638 S657 L658 S806 A852 L853 L854 Y878	S638-D850 PolarHBondContact OG-OD2 3.15Å; S657-D850 CarbonylContact O-C 3.6Å; L658-D850 VanDerWaalsContact CD2-OD1 3.24Å; L658-D850 WeakPolarHBondContact CD2-OD1 3.45Å; S806-D850 PolarHBondContact OG-OD1 2.94Å; S806-D850 PolarHBondContact OG-OD2 2.88Å; D850-A852 PolarHBondContact O-N 3.15Å; D850-A852 VanDerWaalsContact O-N 3.11Å; D850-L853 HydrophobicContact CB-CD1 4.37Å; D850-L853 PolarHBondContact O-N 2.98Å; D850-L854 PolarHBondContact O-N 3.5Å; D850-Y878 WeakPolarHBondContact CB-OH 3.26Å; D850-Y878 WeakPolarHBondContact OD2-CE1 3.35Å
851	K	91.9	Very high	89.8	Confident	50 Å²	50	27.6 Å²	27.6	22%	0.217	15%	0.146	C	C	.	.	H	α-helix	trans	-55.5	-32.7	-170	-168.5	-167.7	-174.3	-55.2	0	113	S657 M849 L853 L854 D855 P872	S657-K851 WeakPolarHBondContact O-CB 3.32Å; S657-K851 PolarHBondContact O-N 2.96Å; M849-K851 PolarHBondContact O-N 3.45Å; K851-L853 VanDerWaalsContact C-N 3.28Å; K851-L853 PolarHBondContact O-N 2.91Å; K851-L854 PolarHBondContact O-N 2.94Å; K851-L854 VanDerWaalsContact O-N 3.16Å; K851-D855 IonicContact NZ-OD1 3.93Å; K851-D855 PolarHBondContact NZ-OD1 3.42Å; K851-D855 IonicContact NZ-OD2 3.24Å; K851-D855 PolarHBondContact NZ-OD2 2.86Å; K851-D855 WeakPolarHBondContact O-CB 3.26Å; K851-D855 VanDerWaalsContact O-CG 3.23Å; K851-D855 PolarHBondContact O-N 3.39Å; K851-P872 HydrophobicContact CD-CB 4.47Å
852	A	91.4	Very high	89.6	Confident	6 Å²	6	26 Å²	26	5%	0.05	14%	0.142	C	C	.	.	H	α-helix	trans	-57.3	-39.2	176.9	0	0	0	0	0	113	F530 F654 D850 Y856 Y878 Y913	F530-A852 HydrophobicContact CE2-CB 4.31Å; F530-A852 HydrophobicContact CZ-CB 4.42Å; F654-A852 HydrophobicContact CD1-CB 4.37Å; F654-A852 HydrophobicContact CE1-CB 3.63Å; F654-A852 HydrophobicContact CZ-CB 4.32Å; D850-A852 PolarHBondContact O-N 3.15Å; D850-A852 VanDerWaalsContact O-N 3.11Å; A852-Y856 PolarHBondContact O-N 3.24Å; A852-Y878 HydrophobicContact CB-CE2 4.21Å; A852-Y913 WeakPolarHBondContact O-CE1 3.45Å; A852-Y913 PolarHBondContact O-OH 3.5Å
853	L	91.9	Very high	89.2	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-75	-39.3	177.3	-74.1	63.7	0	0	0	110.2	E527 F530 T830 M849 D850 K851 Y856 E857 Y878	E527-L853 HydrophobicContact CB-CD2 4.33Å; E527-L853 HydrophobicContact CG-CD2 4.34Å; F530-L853 HydrophobicContact CD2-CD1 4.25Å; F530-L853 HydrophobicContact CE2-CD1 3.99Å; T830-L853 HydrophobicContact CG2-CD2 4.22Å; M849-L853 HydrophobicContact CE-CD2 4.31Å; D850-L853 HydrophobicContact CB-CD1 4.37Å; D850-L853 PolarHBondContact O-N 2.98Å; K851-L853 VanDerWaalsContact C-N 3.28Å; K851-L853 PolarHBondContact O-N 2.91Å; L853-Y856 PolarHBondContact O-N 3.29Å; L853-E857 PolarHBondContact O-N 3.45Å; L853-Y878 WeakPolarHBondContact CD1-OH 3.49Å
854	L	91.6	Very high	88.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.5	-38.8	179	-58.4	-177.1	0	0	0	112.7	L661 F847 M849 D850 K851 Y856 E857 V858 T868	L661-L854 HydrophobicContact CB-CD1 4.14Å; L661-L854 HydrophobicContact CB-CD2 3.96Å; L661-L854 HydrophobicContact CB-CG 4.5Å; L661-L854 HydrophobicContact CD1-CB 4.42Å; L661-L854 HydrophobicContact CD2-CD2 4.23Å; F847-L854 HydrophobicContact CD1-CD2 3.97Å; F847-L854 HydrophobicContact CE1-CD2 4.09Å; M849-L854 HydrophobicContact CB-CD1 4.28Å; M849-L854 HydrophobicContact CB-CD2 3.99Å; M849-L854 HydrophobicContact CB-CG 4.19Å; M849-L854 WeakPolarHBondContact O-CD1 3.34Å; D850-L854 PolarHBondContact O-N 3.5Å; K851-L854 PolarHBondContact O-N 2.94Å; K851-L854 VanDerWaalsContact O-N 3.16Å; L854-Y856 VanDerWaalsContact C-N 3.31Å; L854-Y856 PolarHBondContact O-N 3.41Å; L854-E857 PolarHBondContact O-N 3.38Å; L854-V858 WeakPolarHBondContact O-CB 3.4Å; L854-V858 VanDerWaalsContact O-CG2 3.26Å; L854-V858 WeakPolarHBondContact O-CG2 3.4Å; L854-V858 PolarHBondContact O-N 3.14Å; L854-T868 HydrophobicContact CB-CG2 3.82Å
855	D	89.2	Confident	88.3	Confident	57 Å²	57	28.4 Å²	28.4	31%	0.305	16%	0.162	S	C	.	.	H	α-helix	trans	-63.9	-37.5	175.7	-74.6	-11.6	0	0	0	111.3	K851 S859	K851-D855 IonicContact NZ-OD1 3.93Å; K851-D855 PolarHBondContact NZ-OD1 3.42Å; K851-D855 IonicContact NZ-OD2 3.24Å; K851-D855 PolarHBondContact NZ-OD2 2.86Å; K851-D855 WeakPolarHBondContact O-CB 3.26Å; K851-D855 VanDerWaalsContact O-CG 3.23Å; K851-D855 PolarHBondContact O-N 3.39Å; D855-S859 WeakPolarHBondContact O-CB 3.23Å; D855-S859 PolarHBondContact O-N 3.07Å
856	Y	89.6	Confident	88.1	Confident	23 Å²	23	28 Å²	28	9%	0.09	16%	0.16	C	C	.	.	H	α-helix	trans	-67.1	-47.8	173.5	179.2	-103.1	0	0	0	111.7	H528 P529 A852 L853 L854 V858 S859 I860 V915	H528-Y856 HydrophobicContact CB-CD1 4.12Å; H528-Y856 HydrophobicContact CB-CE1 3.71Å; P529-Y856 HydrophobicContact CB-CD1 4.19Å; P529-Y856 HydrophobicContact CB-CD2 3.72Å; P529-Y856 HydrophobicContact CB-CE1 4.15Å; P529-Y856 HydrophobicContact CB-CE2 3.68Å; P529-Y856 HydrophobicContact CB-CG 3.99Å; P529-Y856 HydrophobicContact CG-CD1 4.32Å; P529-Y856 HydrophobicContact CG-CD2 3.73Å; P529-Y856 HydrophobicContact CG-CE2 4.23Å; P529-Y856 HydrophobicContact CG-CG 3.79Å; A852-Y856 PolarHBondContact O-N 3.24Å; L853-Y856 PolarHBondContact O-N 3.29Å; L854-Y856 VanDerWaalsContact C-N 3.31Å; L854-Y856 PolarHBondContact O-N 3.41Å; Y856-V858 VanDerWaalsContact C-N 3.28Å; Y856-V858 PolarHBondContact O-N 2.87Å; Y856-S859 PolarHBondContact O-N 3.25Å; Y856-S859 PolarHBondContact O-OG 2.95Å; Y856-I860 HydrophobicContact CD1-CD1 4.35Å; Y856-I860 HydrophobicContact CD2-CG2 4.37Å; Y856-I860 HydrophobicContact CE1-CD1 3.79Å; Y856-I860 HydrophobicContact CE1-CG2 4.29Å; Y856-I860 HydrophobicContact CE2-CG2 3.86Å; Y856-I860 WeakPolarHBondContact O-CG1 3.36Å; Y856-I860 PolarHBondContact O-N 3.39Å; Y856-V915 HydrophobicContact CE2-CG2 4.38Å
857	E	88.8	Confident	87.9	Confident	37 Å²	37	30.5 Å²	30.5	17%	0.173	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-37.5	176.7	-178.4	60.8	-153.5	0	0	112.5	I834 K838 L853 L854 D861	I834-E857 HydrophobicContact CB-CG 4.48Å; I834-E857 HydrophobicContact CD1-CB 4.03Å; I834-E857 HydrophobicContact CD1-CG 3.64Å; I834-E857 HydrophobicContact CG1-CG 3.97Å; I834-E857 HydrophobicContact CG2-CG 3.68Å; I834-E857 WeakPolarHBondContact CG2-OE1 3.36Å; K838-E857 WeakPolarHBondContact CE-OE1 3.32Å; K838-E857 IonicContact NZ-OE1 3.58Å; K838-E857 PolarHBondContact NZ-OE1 3.47Å; L853-E857 PolarHBondContact O-N 3.45Å; L854-E857 PolarHBondContact O-N 3.38Å; E857-D861 PolarHBondContact O-N 3.18Å
858	V	87.8	Confident	87.6	Confident	32 Å²	32	32.4 Å²	32.4	19%	0.194	19%	0.185	C	C	.	.	H	α-helix	trans	-67.8	-37.4	173.6	168.8	0	0	0	0	111.6	L661 L854 Y856 I860 T868	L661-V858 HydrophobicContact CD1-CG2 3.33Å; L854-V858 WeakPolarHBondContact O-CB 3.4Å; L854-V858 VanDerWaalsContact O-CG2 3.26Å; L854-V858 WeakPolarHBondContact O-CG2 3.4Å; L854-V858 PolarHBondContact O-N 3.14Å; Y856-V858 VanDerWaalsContact C-N 3.28Å; Y856-V858 PolarHBondContact O-N 2.87Å; V858-I860 VanDerWaalsContact C-N 3.34Å; V858-T868 HydrophobicContact CG2-CG2 4.26Å
859	S	84.6	Confident	87.2	Confident	28 Å²	28	32.8 Å²	32.8	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-67.4	-36.5	179.7	85.4	0	0	0	0	111.8	D855 Y856 P917	D855-S859 WeakPolarHBondContact O-CB 3.23Å; D855-S859 PolarHBondContact O-N 3.07Å; Y856-S859 PolarHBondContact O-N 3.25Å; Y856-S859 PolarHBondContact O-OG 2.95Å; S859-P917 WeakPolarHBondContact O-CD 3.5Å; S859-P917 WeakPolarHBondContact O-CG 3.43Å
860	I	86.1	Confident	86.6	Confident	54 Å²	54	34.4 Å²	34.4	28%	0.277	20%	0.204	S	C	.	.	H	α-helix	trans	-88.2	-9.1	-178.2	70.9	171.8	0	0	0	115.5	Y856 V858 A862 V915 P917	Y856-I860 HydrophobicContact CD1-CD1 4.35Å; Y856-I860 HydrophobicContact CD2-CG2 4.37Å; Y856-I860 HydrophobicContact CE1-CD1 3.79Å; Y856-I860 HydrophobicContact CE1-CG2 4.29Å; Y856-I860 HydrophobicContact CE2-CG2 3.86Å; Y856-I860 WeakPolarHBondContact O-CG1 3.36Å; Y856-I860 PolarHBondContact O-N 3.39Å; V858-I860 VanDerWaalsContact C-N 3.34Å; I860-A862 PolarHBondContact O-N 2.87Å; I860-A862 VanDerWaalsContact O-N 3.12Å; I860-V915 HydrophobicContact CG2-CB 4.22Å; I860-V915 HydrophobicContact CG2-CG1 4.05Å; I860-P917 VanDerWaalsContact CA-CG 3.49Å; I860-P917 WeakPolarHBondContact O-CG 3.34Å
861	D	83.7	Confident	86.2	Confident	11 Å²	11	43.1 Å²	43.1	6%	0.059	24%	0.242	C	C	.	.			trans	-61.3	112.6	-175.4	-173.6	41.9	0	0	0	112.7	K838 E857 D863 C864 K865 T866 C918	K838-D861 WeakPolarHBondContact CE-OD1 3.18Å; K838-D861 VanDerWaalsContact NZ-CG 3.32Å; K838-D861 IonicContact NZ-OD1 2.86Å; K838-D861 PolarHBondContact NZ-OD1 2.94Å; E857-D861 PolarHBondContact O-N 3.18Å; D861-D863 PolarHBondContact O-N 3.02Å; D861-C864 PolarHBondContact O-N 3.04Å; D861-C864 WeakPolarHBondContact OD2-CA 3.27Å; D861-C864 PolarHBondContact OD2-N 2.98Å; D861-K865 PolarHBondContact OD2-N 3.25Å; D861-T866 PolarHBondContact OD2-N 2.97Å; D861-T866 VanDerWaalsContact OD2-N 3.09Å; D861-T866 PolarHBondContact OD2-OG1 3Å; D861-C918 PolarHBondContact O-SG 2.73Å
862	A	79.8	Confident	85.7	Confident	78 Å²	78	44.3 Å²	44.3	65%	0.645	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.2	-176.6	0	0	0	0	0	113.7	I860	I860-A862 PolarHBondContact O-N 2.87Å; I860-A862 VanDerWaalsContact O-N 3.12Å
863	D	75.8	Confident	85.5	Confident	90 Å²	90	45.2 Å²	45.2	48%	0.481	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-25.7	175.4	-96.3	3.2	0	0	0	112.9	R663 D861 K865	R663-D863 IonicContact CZ-OD2 3.29Å; R663-D863 IonicContact NH1-OD2 2.67Å; R663-D863 PolarHBondContact NH1-OD2 3.22Å; R663-D863 IonicContact NH2-OD2 3.49Å; R663-D863 PolarHBondContact NH2-OD2 3.04Å; D861-D863 PolarHBondContact O-N 3.02Å; D863-K865 HydrophobicContact CB-CB 3.98Å; D863-K865 HydrophobicContact CB-CD 4.35Å; D863-K865 HydrophobicContact CB-CG 4Å; D863-K865 PolarHBondContact O-N 3.44Å
864	C	80.5	Confident	85.3	Confident	53 Å²	53	46 Å²	46	36%	0.358	26%	0.264	S	S	.	.			trans	48.1	37.1	-161.2	-55.2	0	0	0	0	114	D861 C918	D861-C864 PolarHBondContact O-N 3.04Å; D861-C864 WeakPolarHBondContact OD2-CA 3.27Å; D861-C864 PolarHBondContact OD2-N 2.98Å; C864-C918 WeakPolarHBondContact CA-SG 3.45Å; C864-C918 HydrophobicContact CB-CB 4.09Å; C864-C918 WeakPolarHBondContact CB-SG 3.29Å; C864-C918 WeakPolarHBondContact SG-CA 3.46Å; C864-C918 WeakPolarHBondContact SG-CB 3.32Å; C864-C918 CovalentContact SG-SG 2.05Å; C864-C918 PolarHBondContact SG-SG 3.36Å
865	K	82.3	Confident	85.2	Confident	60 Å²	60	52.6 Å²	52.6	26%	0.261	30%	0.298	S	S	.	.			trans	-107.6	-5.9	-179.6	-70.3	-173.9	-174.2	-159.3	0	114	R663 T664 D666 D861 D863	R663-K865 CarbonylContact C-O 3.54Å; R663-K865 VanDerWaalsContact CA-O 3.28Å; R663-K865 WeakPolarHBondContact CA-O 3.38Å; R663-K865 HydrophobicContact CG-CB 4.39Å; T664-K865 PolarHBondContact N-O 3.39Å; T664-K865 PolarHBondContact OG1-O 2.96Å; D666-K865 IonicContact OD1-NZ 3.9Å; D666-K865 IonicContact OD2-NZ 3.61Å; D666-K865 PolarHBondContact OD2-NZ 3.42Å; D861-K865 PolarHBondContact OD2-N 3.25Å; D863-K865 HydrophobicContact CB-CB 3.98Å; D863-K865 HydrophobicContact CB-CD 4.35Å; D863-K865 HydrophobicContact CB-CG 4Å; D863-K865 PolarHBondContact O-N 3.44Å
866	T	86.5	Confident	85.2	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	140.8	164.1	43.4	0	0	0	0	111.8	L661 V662 R663 L837 K838 D861	L661-T866 HydrophobicContact CD2-CG2 4.45Å; V662-T866 WeakPolarHBondContact O-CA 3.31Å; R663-T866 HydrophobicContact CB-CG2 4.35Å; L837-T866 HydrophobicContact CD2-CG2 4.21Å; K838-T866 HydrophobicContact CD-CG2 4.41Å; K838-T866 VanDerWaalsContact CE-CG2 3.48Å; K838-T866 WeakPolarHBondContact CE-OG1 2.76Å; K838-T866 HydrophobicContact CG-CG2 4.06Å; D861-T866 PolarHBondContact OD2-N 2.97Å; D861-T866 VanDerWaalsContact OD2-N 3.09Å; D861-T866 PolarHBondContact OD2-OG1 3Å
867	L	86.5	Confident	85.4	Confident	51 Å²	51	50.8 Å²	50.8	27%	0.267	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.3	171.5	62.2	77	0	0	0	111.8	V662 T664 V869	V662-L867 HydrophobicContact CG2-CD1 3.75Å; V662-L867 HydrophobicContact CG2-CG 4.41Å; V662-L867 PolarHBondContact N-O 3.09Å; V662-L867 PolarHBondContact O-N 2.82Å; T664-L867 HydrophobicContact CG2-CD2 3.46Å; T664-L867 VanDerWaalsContact CG2-CD2 3.46Å; T664-L867 HydrophobicContact CG2-CG 3.89Å; L867-V869 HydrophobicContact CD1-CG1 3.46Å; L867-V869 VanDerWaalsContact CD1-CG1 3.46Å
868	T	88.9	Confident	85.8	Confident	41 Å²	41	49 Å²	49	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.9	172.7	56.6	0	0	0	0	110.9	I660 L661 L854 V858	I660-T868 CarbonylContact O-C 3.51Å; I660-T868 VanDerWaalsContact O-CA 3.29Å; I660-T868 WeakPolarHBondContact O-CA 3.5Å; L661-T868 HydrophobicContact CD1-CG2 4.3Å; L854-T868 HydrophobicContact CB-CG2 3.82Å; V858-T868 HydrophobicContact CG2-CG2 4.26Å
869	V	87	Confident	86.1	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.6	178.9	-75.8	0	0	0	0	113.7	I660 V662 E780 L782 L867	I660-V869 HydrophobicContact CB-CG2 3.97Å; I660-V869 HydrophobicContact CG2-CG2 4Å; I660-V869 WeakPolarHBondContact O-CG2 3.49Å; I660-V869 PolarHBondContact O-N 2.9Å; V662-V869 HydrophobicContact CG1-CG2 3.79Å; V662-V869 HydrophobicContact CG2-CB 4.46Å; V662-V869 HydrophobicContact CG2-CG1 3.62Å; V662-V869 HydrophobicContact CG2-CG2 4.02Å; E780-V869 HydrophobicContact CB-CG1 3.99Å; E780-V869 HydrophobicContact CG-CG1 3.93Å; L782-V869 HydrophobicContact CB-CG2 4.04Å; L867-V869 HydrophobicContact CD1-CG1 3.46Å; L867-V869 VanDerWaalsContact CD1-CG1 3.46Å
870	G	82.1	Confident	86.7	Confident	34 Å²	34	46.2 Å²	46.2	35%	0.351	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80.9	175.5	173.6	0	0	0	0	0	114.5	S783	S783-G870 WeakPolarHBondContact O-CA 3.48Å
871	K	84.3	Confident	87.2	Confident	184 Å²	184	43.6 Å²	43.6	80%	0.8	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	142.3	173.5	-65.5	-177.1	179.4	-178.4	0	110.1	F873	K871-F873 PolarHBondContact O-N 2.92Å
872	P	81.7	Confident	87.8	Confident	74 Å²	74	43.1 Å²	43.1	48%	0.481	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	137.7	171.6	24.9	-33.7	0	0	0	110.7	S657 K851	S657-P872 WeakPolarHBondContact OG-CB 3.29Å; K851-P872 HydrophobicContact CD-CB 4.47Å
873	F	87.4	Confident	88.5	Confident	25 Å²	25	41.4 Å²	41.4	11%	0.11	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	162.5	177.2	62.1	-82.5	0	0	0	109.1	L658 I660 I785 Y810 I848 K871	L658-F873 HydrophobicContact CB-CD2 3.93Å; L658-F873 HydrophobicContact CB-CE1 4.15Å; L658-F873 HydrophobicContact CB-CE2 3.5Å; L658-F873 HydrophobicContact CB-CG 4.43Å; L658-F873 HydrophobicContact CB-CZ 3.62Å; L658-F873 WeakPolarHBondContact CB-O 3.5Å; L658-F873 HydrophobicContact CD1-CD2 4.34Å; L658-F873 HydrophobicContact CD1-CE2 3.78Å; L658-F873 HydrophobicContact CG-CE2 4.29Å; L658-F873 PolarHBondContact N-O 3.48Å; L658-F873 WeakPolarHBondContact O-CD1 3.24Å; L658-F873 PolarHBondContact O-N 2.84Å; I660-F873 HydrophobicContact CD1-CE1 4.3Å; I660-F873 HydrophobicContact CG1-CE1 4.09Å; I660-F873 HydrophobicContact CG1-CZ 4.45Å; I785-F873 HydrophobicContact CB-CD1 3.93Å; I785-F873 HydrophobicContact CB-CD2 4.45Å; I785-F873 HydrophobicContact CB-CE1 3.77Å; I785-F873 HydrophobicContact CB-CE2 4.3Å; I785-F873 HydrophobicContact CB-CG 4.28Å; I785-F873 HydrophobicContact CB-CZ 3.97Å; I785-F873 HydrophobicContact CD1-CE1 4.16Å; I785-F873 HydrophobicContact CD1-CE2 3.93Å; I785-F873 HydrophobicContact CD1-CZ 3.56Å; I785-F873 HydrophobicContact CG1-CD1 4.49Å; I785-F873 HydrophobicContact CG1-CD2 4.23Å; I785-F873 HydrophobicContact CG1-CE1 4.12Å; I785-F873 HydrophobicContact CG1-CE2 3.82Å; I785-F873 HydrophobicContact CG1-CZ 3.77Å; I785-F873 HydrophobicContact CG2-CD1 4.04Å; I785-F873 HydrophobicContact CG2-CD2 4.44Å; I785-F873 HydrophobicContact CG2-CE1 4.4Å; I785-F873 HydrophobicContact CG2-CG 4.08Å; Y810-F873 HydrophobicContact CD1-CD2 4.36Å; Y810-F873 HydrophobicContact CD1-CE2 4.16Å; Y810-F873 AromaticContact CE1-CD2 3.62Å; Y810-F873 HydrophobicContact CE1-CD2 3.62Å; Y810-F873 AromaticContact CE1-CE2 3.76Å; Y810-F873 HydrophobicContact CE1-CE2 3.76Å; I848-F873 HydrophobicContact CG2-CZ 4.16Å; K871-F873 PolarHBondContact O-N 2.92Å
874	A	87.9	Confident	89.2	Confident	22 Å²	22	42 Å²	42	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.9	71.6	-172.8	0	0	0	0	0	112.3	S657 L658 Y810 E876	S657-A874 VanDerWaalsContact CA-O 3.3Å; S657-A874 WeakPolarHBondContact CA-O 3.28Å; L658-A874 HydrophobicContact CB-CB 4.34Å; L658-A874 HydrophobicContact CD1-CB 3.77Å; L658-A874 HydrophobicContact CG-CB 3.91Å; L658-A874 PolarHBondContact N-O 3.46Å; Y810-A874 HydrophobicContact CD1-CB 4.18Å; Y810-A874 HydrophobicContact CD2-CB 3.64Å; Y810-A874 HydrophobicContact CE1-CB 4.09Å; Y810-A874 HydrophobicContact CE2-CB 3.55Å; Y810-A874 HydrophobicContact CG-CB 3.97Å; A874-E876 PolarHBondContact O-N 2.87Å
875	I	88.9	Confident	89.6	Confident	138 Å²	138	46 Å²	46	71%	0.708	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.8	176	-58.3	173	0	0	0	108
876	E	90.1	Very high	89.9	Confident	30 Å²	30	44.3 Å²	44.3	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	157.7	-178.5	-68.8	-170.8	-177	0	0	109.7	S638 T656 S806 A874	S638-E876 WeakPolarHBondContact CB-OE2 3.4Å; T656-E876 CarbonylContact C-O 3.48Å; T656-E876 HydrophobicContact CG2-CB 4.11Å; T656-E876 WeakPolarHBondContact CG2-O 3.43Å; T656-E876 PolarHBondContact N-O 2.96Å; T656-E876 PolarHBondContact O-N 3.45Å; T656-E876 VanDerWaalsContact O-N 3.09Å; S806-E876 WeakPolarHBondContact CB-OE2 3.43Å; A874-E876 PolarHBondContact O-N 2.87Å
877	G	93.6	Very high	89.9	Confident	13 Å²	13	49.3 Å²	49.3	13%	0.134	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	147.6	171.9	0	0	0	0	0	110.9	I639 F654	I639-G877 VanDerWaalsContact CG1-O 3.31Å; I639-G877 WeakPolarHBondContact CG1-O 3.37Å; I639-G877 PolarHBondContact N-O 2.92Å; F654-G877 WeakPolarHBondContact O-CA 3.33Å
878	Y	95.7	Very high	90	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.2	161.3	-57.8	-32	0	0	0	109.1	F530 F637 P652 F653 F654 T656 D850 A852 L853	F530-Y878 HydrophobicContact CD2-CE2 4.45Å; F530-Y878 AromaticContact CE1-CD2 3.98Å; F530-Y878 HydrophobicContact CE1-CD2 3.98Å; F530-Y878 HydrophobicContact CE1-CE2 4.09Å; F530-Y878 HydrophobicContact CE2-CD2 4.37Å; F530-Y878 AromaticContact CE2-CE2 3.67Å; F530-Y878 HydrophobicContact CE2-CE2 3.67Å; F530-Y878 AromaticContact CZ-CD2 3.82Å; F530-Y878 HydrophobicContact CZ-CD2 3.82Å; F530-Y878 AromaticContact CZ-CE2 3.46Å; F530-Y878 HydrophobicContact CZ-CE2 3.46Å; F530-Y878 VanDerWaalsContact CZ-CE2 3.46Å; F637-Y878 WeakPolarHBondContact O-CA 3.38Å; P652-Y878 CarbonylContact C-O 3.53Å; P652-Y878 VanDerWaalsContact CA-O 3.24Å; P652-Y878 WeakPolarHBondContact CA-O 3.32Å; F653-Y878 WeakPolarHBondContact CD1-O 3.43Å; F653-Y878 HydrophobicContact CZ-CG 4.48Å; F653-Y878 PolarHBondContact N-O 2.97Å; F654-Y878 HydrophobicContact CB-CD2 3.72Å; F654-Y878 HydrophobicContact CB-CG 4.28Å; F654-Y878 AromaticContact CD1-CD2 3.91Å; F654-Y878 HydrophobicContact CD1-CD2 3.91Å; F654-Y878 AromaticContact CD1-CE2 3.97Å; F654-Y878 HydrophobicContact CD1-CE2 3.97Å; F654-Y878 HydrophobicContact CG-CD2 4.04Å; F654-Y878 HydrophobicContact CG-CE2 4.48Å; F654-Y878 PolarHBondContact O-N 3.38Å; T656-Y878 HydrophobicContact CG2-CD1 4.04Å; T656-Y878 HydrophobicContact CG2-CE1 3.5Å; T656-Y878 VanDerWaalsContact CG2-CE1 3.5Å; T656-Y878 PolarHBondContact OG1-OH 2.92Å; D850-Y878 WeakPolarHBondContact CB-OH 3.26Å; D850-Y878 WeakPolarHBondContact OD2-CE1 3.35Å; A852-Y878 HydrophobicContact CB-CE2 4.21Å; L853-Y878 WeakPolarHBondContact CD1-OH 3.49Å
879	G	95.5	Very high	90.2	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.27	C	S	.	.			trans	-126.6	156.6	176.2	0	0	0	0	0	110.6	F637	F637-G879 PolarHBondContact O-N 2.92Å; F637-G879 VanDerWaalsContact O-N 3.16Å
880	I	97.1	Very high	90.4	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.292	C	S	.	.			trans	-77.7	131	171	-67.8	166.1	0	0	0	107.6	L592 L632 V634 F649 T650 F653 L882 V896	L592-I880 HydrophobicContact CD1-CD1 3.41Å; L592-I880 VanDerWaalsContact CD1-CD1 3.41Å; L632-I880 HydrophobicContact CD1-CG2 3.38Å; L632-I880 HydrophobicContact CG-CG2 3.9Å; V634-I880 HydrophobicContact CG1-CG1 4.31Å; V634-I880 HydrophobicContact CG2-CG1 4.28Å; V634-I880 HydrophobicContact CG2-CG2 4.01Å; F649-I880 WeakPolarHBondContact CA-O 3.39Å; T650-I880 HydrophobicContact CG2-CB 3.73Å; T650-I880 HydrophobicContact CG2-CG2 4.25Å; T650-I880 PolarHBondContact N-O 2.69Å; T650-I880 PolarHBondContact OG1-N 3.17Å; F653-I880 HydrophobicContact CD1-CG1 4.28Å; F653-I880 HydrophobicContact CE1-CG1 4.31Å; I880-L882 HydrophobicContact CG2-CD1 4.22Å; I880-V896 HydrophobicContact CD1-CG2 4.26Å
881	G	96.2	Very high	90.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.5	-178.4	0	0	0	0	0	112.3	L632 A633	L632-G881 CarbonylContact C-O 3.55Å; A633-G881 PolarHBondContact N-O 3.27Å; A633-G881 PolarHBondContact O-N 3Å
882	L	95.9	Very high	91.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	155.9	175.8	-66.7	97.9	0	0	0	111.1	L632 I647 D648 T650 I880 S886 L888 T889 F892	L632-L882 HydrophobicContact CD1-CD1 4.25Å; L632-L882 HydrophobicContact CD1-CD2 4.06Å; L632-L882 HydrophobicContact CD1-CG 3.79Å; I647-L882 WeakPolarHBondContact CB-O 3.32Å; D648-L882 HydrophobicContact CB-CB 4.2Å; D648-L882 PolarHBondContact N-O 2.94Å; D648-L882 PolarHBondContact O-N 3.36Å; T650-L882 HydrophobicContact CG2-CD1 3.86Å; I880-L882 HydrophobicContact CG2-CD1 4.22Å; L882-S886 WeakPolarHBondContact CD2-OG 3.46Å; L882-L888 HydrophobicContact CD2-CB 4.07Å; L882-T889 HydrophobicContact CD1-CG2 4.49Å; L882-F892 HydrophobicContact CD2-CD2 3.94Å; L882-F892 HydrophobicContact CD2-CE2 4.15Å
883	P	94.1	Very high	91.9	Very high	42 Å²	42	42 Å²	42	27%	0.273	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	147.7	166.3	-22.6	34.7	0	0	0	111.3	L625 H631 S886	L625-P883 HydrophobicContact CD2-CG 4.33Å; H631-P883 VanDerWaalsContact O-CD 3.24Å; H631-P883 WeakPolarHBondContact O-CD 3.36Å; P883-S886 VanDerWaalsContact O-CB 3.25Å; P883-S886 WeakPolarHBondContact O-CB 3.5Å; P883-S886 PolarHBondContact O-N 3.08Å
884	Q	91	Very high	92.3	Very high	101 Å²	101	47.5 Å²	47.5	47%	0.472	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	136.5	-172.7	-164.8	173.1	45.3	0	0	113.1	Q645 D648	Q645-Q884 PolarHBondContact O-NE2 3.01Å; D648-Q884 WeakPolarHBondContact OD1-CA 3.46Å
885	N	88.3	Confident	92.6	Very high	139 Å²	139	48 Å²	48	74%	0.743	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	35.5	-172.1	-47.3	-78.3	0	0	0	114	D648	D648-N885 VanDerWaalsContact CG-N 3.33Å; D648-N885 PolarHBondContact OD1-N 2.7Å; D648-N885 WeakPolarHBondContact OD2-CA 3.27Å; D648-N885 PolarHBondContact OD2-N 2.94Å
886	S	88.9	Confident	93	Very high	23 Å²	23	41.5 Å²	41.5	16%	0.161	23%	0.234	C	C	.	.			trans	-71.5	127.7	177.4	173.6	0	0	0	0	111.1	D648 L882 P883 L888 T889	D648-S886 PolarHBondContact OD2-N 3.48Å; L882-S886 WeakPolarHBondContact CD2-OG 3.46Å; P883-S886 VanDerWaalsContact O-CB 3.25Å; P883-S886 WeakPolarHBondContact O-CB 3.5Å; P883-S886 PolarHBondContact O-N 3.08Å; S886-L888 PolarHBondContact O-N 2.71Å; S886-L888 PolarHBondContact OG-N 3.13Å; S886-T889 WeakPolarHBondContact CB-OG1 3.48Å; S886-T889 PolarHBondContact O-N 3.2Å; S886-T889 PolarHBondContact O-OG1 3.07Å
887	P	87.5	Confident	93.2	Very high	111 Å²	111	43.1 Å²	43.1	72%	0.721	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-3.8	179.5	31.1	-36.9	0	0	0	113.4
888	L	88.9	Confident	93.2	Very high	43 Å²	43	47 Å²	47	23%	0.225	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-17.5	178.4	-58.3	168.9	0	0	0	112.4	L518 M520 L882 S886 S890 N891 F892	L518-L888 HydrophobicContact CD2-CD1 4.08Å; L518-L888 HydrophobicContact CD2-CD2 4.13Å; M520-L888 HydrophobicContact CE-CD1 3.69Å; L882-L888 HydrophobicContact CD2-CB 4.07Å; S886-L888 PolarHBondContact O-N 2.71Å; S886-L888 PolarHBondContact OG-N 3.13Å; L888-S890 VanDerWaalsContact C-N 3.27Å; L888-S890 PolarHBondContact O-N 3.3Å; L888-N891 PolarHBondContact O-N 3.16Å; L888-F892 HydrophobicContact CB-CD2 3.76Å; L888-F892 HydrophobicContact CB-CE2 3.77Å; L888-F892 HydrophobicContact CD1-CE2 4.28Å; L888-F892 WeakPolarHBondContact O-CD2 3.48Å; L888-F892 PolarHBondContact O-N 2.87Å
889	T	92.4	Very high	93.3	Very high	20 Å²	20	47.3 Å²	47.3	12%	0.123	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-38.2	-173.9	-56.6	0	0	0	0	112.3	D648 L882 S886 S893	D648-T889 HydrophobicContact CB-CG2 4.03Å; D648-T889 PolarHBondContact OD2-OG1 3.42Å; L882-T889 HydrophobicContact CD1-CG2 4.49Å; S886-T889 WeakPolarHBondContact CB-OG1 3.48Å; S886-T889 PolarHBondContact O-N 3.2Å; S886-T889 PolarHBondContact O-OG1 3.07Å; T889-S893 VanDerWaalsContact O-CB 3.29Å; T889-S893 WeakPolarHBondContact O-CB 3.24Å; T889-S893 PolarHBondContact O-N 2.81Å; T889-S893 VanDerWaalsContact O-N 3.08Å; T889-S893 PolarHBondContact O-OG 2.89Å
890	S	90.8	Very high	93.1	Very high	72 Å²	72	53 Å²	53	50%	0.503	29%	0.29	S	S	.	.	H	α-helix	trans	-60.8	-51.4	173.5	44.6	0	0	0	0	112	L888 S893 E894	L888-S890 VanDerWaalsContact C-N 3.27Å; L888-S890 PolarHBondContact O-N 3.3Å; S890-S893 WeakPolarHBondContact O-CB 3.44Å; S890-S893 PolarHBondContact O-N 3.13Å; S890-S893 VanDerWaalsContact O-N 3.09Å; S890-E894 PolarHBondContact O-N 3.4Å
891	N	91.5	Very high	92.9	Very high	80 Å²	80	57.3 Å²	57.3	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-69.8	-41	-171.1	-55.4	18.7	0	0	0	110.8	L888 S893 E894 L895	L888-N891 PolarHBondContact O-N 3.16Å; N891-S893 VanDerWaalsContact C-N 3.33Å; N891-E894 PolarHBondContact O-N 2.93Å; N891-L895 PolarHBondContact O-N 3.27Å; N891-L895 VanDerWaalsContact O-N 3.12Å
892	F	94.3	Very high	92.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.1	-39.2	170.4	-80.1	-70.5	0	0	0	111.8	M520 L592 I596 F598 L632 T650 L882 L888 V896	M520-F892 HydrophobicContact CE-CE2 4.28Å; M520-F892 HydrophobicContact CE-CZ 4.07Å; M520-F892 HydrophobicContact SD-CZ 4.33Å; L592-F892 HydrophobicContact CB-CE1 4.17Å; L592-F892 HydrophobicContact CD1-CD1 4.01Å; L592-F892 HydrophobicContact CD1-CE1 4.21Å; L592-F892 HydrophobicContact CD2-CD1 4.04Å; L592-F892 HydrophobicContact CG-CD1 4.42Å; I596-F892 HydrophobicContact CD1-CD1 3.62Å; I596-F892 HydrophobicContact CD1-CE1 3.47Å; I596-F892 VanDerWaalsContact CD1-CE1 3.47Å; I596-F892 HydrophobicContact CD1-CE2 4.44Å; I596-F892 HydrophobicContact CD1-CG 4.18Å; I596-F892 HydrophobicContact CD1-CZ 3.91Å; F598-F892 HydrophobicContact CD1-CZ 4.45Å; F598-F892 AromaticContact CE1-CE1 3.77Å; F598-F892 HydrophobicContact CE1-CE1 3.77Å; F598-F892 AromaticContact CE1-CZ 3.73Å; F598-F892 HydrophobicContact CE1-CZ 3.73Å; F598-F892 HydrophobicContact CZ-CE1 4.15Å; F598-F892 HydrophobicContact CZ-CZ 4.1Å; L632-F892 HydrophobicContact CD1-CE2 4.12Å; L632-F892 HydrophobicContact CD1-CZ 4.17Å; L632-F892 HydrophobicContact CD2-CE1 4.43Å; L632-F892 HydrophobicContact CD2-CZ 4.11Å; T650-F892 HydrophobicContact CG2-CB 3.63Å; L882-F892 HydrophobicContact CD2-CD2 3.94Å; L882-F892 HydrophobicContact CD2-CE2 4.15Å; L888-F892 HydrophobicContact CB-CD2 3.76Å; L888-F892 HydrophobicContact CB-CE2 3.77Å; L888-F892 HydrophobicContact CD1-CE2 4.28Å; L888-F892 WeakPolarHBondContact O-CD2 3.48Å; L888-F892 PolarHBondContact O-N 2.87Å; F892-V896 WeakPolarHBondContact O-CB 3.28Å; F892-V896 VanDerWaalsContact O-CG2 3.25Å; F892-V896 WeakPolarHBondContact O-CG2 3.34Å; F892-V896 PolarHBondContact O-N 3.32Å
893	S	95	Very high	92.6	Very high	23 Å²	23	63.4 Å²	63.4	16%	0.161	36%	0.359	C	S	.	.	H	α-helix	trans	-69.5	-34.6	179	-60.8	0	0	0	0	113.3	T650 S651 T889 S890 N891 S897	T650-S893 VanDerWaalsContact CA-OG 3.25Å; T650-S893 WeakPolarHBondContact CA-OG 3.44Å; S651-S893 PolarHBondContact N-OG 3.41Å; S651-S893 VanDerWaalsContact N-OG 3.13Å; S651-S893 WeakPolarHBondContact OG-CA 3.27Å; S651-S893 PolarHBondContact OG-O 3.13Å; T889-S893 VanDerWaalsContact O-CB 3.29Å; T889-S893 WeakPolarHBondContact O-CB 3.24Å; T889-S893 PolarHBondContact O-N 2.81Å; T889-S893 VanDerWaalsContact O-N 3.08Å; T889-S893 PolarHBondContact O-OG 2.89Å; S890-S893 WeakPolarHBondContact O-CB 3.44Å; S890-S893 PolarHBondContact O-N 3.13Å; S890-S893 VanDerWaalsContact O-N 3.09Å; N891-S893 VanDerWaalsContact C-N 3.33Å; S893-S897 WeakPolarHBondContact O-CB 3.31Å; S893-S897 PolarHBondContact O-N 2.76Å; S893-S897 VanDerWaalsContact O-N 3.09Å; S893-S897 PolarHBondContact O-OG 3.24Å
894	E	94.9	Very high	92.6	Very high	140 Å²	140	63.4 Å²	63.4	65%	0.654	36%	0.355	S	S	*	.	H	α-helix	trans	-65.2	-51.3	174.6	-172.7	168.5	-163.8	0	0	110.4	S890 N891 V896 S897 Q898	S890-E894 PolarHBondContact O-N 3.4Å; N891-E894 PolarHBondContact O-N 2.93Å; E894-V896 PolarHBondContact O-N 2.94Å; E894-S897 WeakPolarHBondContact O-CA 3.43Å; E894-S897 WeakPolarHBondContact O-CB 3.5Å; E894-S897 PolarHBondContact O-N 3.05Å; E894-S897 VanDerWaalsContact O-N 3.1Å; E894-Q898 PolarHBondContact O-N 2.89Å
895	L	95.1	Very high	92.7	Very high	31 Å²	31	59 Å²	59	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-63.7	-41.9	177.8	-72.6	168.5	0	0	0	113.2	L592 D595 I596 N891 S897 Q898 Y899	L592-L895 HydrophobicContact CD2-CB 4Å; L592-L895 HydrophobicContact CD2-CD1 4.46Å; D595-L895 HydrophobicContact CB-CD1 4.49Å; D595-L895 HydrophobicContact CB-CD2 4.46Å; I596-L895 HydrophobicContact CD1-CD1 3.72Å; I596-L895 HydrophobicContact CG1-CD1 3.35Å; N891-L895 PolarHBondContact O-N 3.27Å; N891-L895 VanDerWaalsContact O-N 3.12Å; L895-S897 PolarHBondContact O-N 3.24Å; L895-Q898 PolarHBondContact O-N 2.93Å; L895-Q898 VanDerWaalsContact O-N 3.15Å; L895-Y899 HydrophobicContact CD2-CE1 4.43Å; L895-Y899 WeakPolarHBondContact O-CD1 3.41Å; L895-Y899 PolarHBondContact O-N 3.48Å
896	V	96	Very high	92.9	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.012	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-33.4	173.7	165.8	0	0	0	0	111.7	L592 S651 F653 I880 F892 E894 K900 M905	L592-V896 HydrophobicContact CD2-CG2 4.47Å; S651-V896 WeakPolarHBondContact OG-CG1 3.48Å; F653-V896 HydrophobicContact CB-CG1 3.7Å; I880-V896 HydrophobicContact CD1-CG2 4.26Å; F892-V896 WeakPolarHBondContact O-CB 3.28Å; F892-V896 VanDerWaalsContact O-CG2 3.25Å; F892-V896 WeakPolarHBondContact O-CG2 3.34Å; F892-V896 PolarHBondContact O-N 3.32Å; E894-V896 PolarHBondContact O-N 2.94Å; V896-K900 PolarHBondContact O-N 3.11Å; V896-M905 HydrophobicContact CG1-CE 4.1Å
897	S	94.3	Very high	93.2	Very high	65 Å²	65	62.1 Å²	62.1	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-71.9	-39.9	174.3	-54.3	0	0	0	0	111.6	S651 S893 E894 L895 K900 S901	S651-S897 PolarHBondContact OG-OG 2.58Å; S893-S897 WeakPolarHBondContact O-CB 3.31Å; S893-S897 PolarHBondContact O-N 2.76Å; S893-S897 VanDerWaalsContact O-N 3.09Å; S893-S897 PolarHBondContact O-OG 3.24Å; E894-S897 WeakPolarHBondContact O-CA 3.43Å; E894-S897 WeakPolarHBondContact O-CB 3.5Å; E894-S897 PolarHBondContact O-N 3.05Å; E894-S897 VanDerWaalsContact O-N 3.1Å; L895-S897 PolarHBondContact O-N 3.24Å; S897-K900 WeakPolarHBondContact O-CB 3.49Å; S897-K900 PolarHBondContact O-N 3Å; S897-S901 PolarHBondContact O-N 3.46Å; S897-S901 VanDerWaalsContact O-N 3.08Å
898	Q	95	Very high	93.4	Very high	93 Å²	93	57 Å²	57	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.1	-174.3	-174.7	-19.7	0	0	111.8	E894 L895 K900 S901 D902	E894-Q898 PolarHBondContact O-N 2.89Å; L895-Q898 PolarHBondContact O-N 2.93Å; L895-Q898 VanDerWaalsContact O-N 3.15Å; Q898-K900 PolarHBondContact O-N 3.39Å; Q898-S901 WeakPolarHBondContact CA-OG 3.48Å; Q898-S901 PolarHBondContact O-N 3.03Å; Q898-S901 PolarHBondContact O-OG 3.4Å; Q898-D902 VanDerWaalsContact CG-OD2 3.32Å; Q898-D902 WeakPolarHBondContact CG-OD2 3.48Å; Q898-D902 PolarHBondContact NE2-OD2 3.44Å; Q898-D902 WeakPolarHBondContact O-CB 3.42Å; Q898-D902 PolarHBondContact O-N 2.99Å; Q898-D902 VanDerWaalsContact O-OD1 3.12Å
899	Y	95.9	Very high	93.5	Very high	8 Å²	8	58.7 Å²	58.7	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-59.7	-20	176.3	-63.7	-10.5	0	0	0	113.4	L588 K591 L592 D595 L895 F904 M905	L588-Y899 HydrophobicContact CD1-CD2 3.76Å; L588-Y899 HydrophobicContact CD1-CE2 4.05Å; K591-Y899 HydrophobicContact CG-CE1 4.3Å; K591-Y899 HydrophobicContact CG-CE2 3.99Å; K591-Y899 PolarHBondContact O-OH 3.01Å; L592-Y899 HydrophobicContact CD2-CD2 4.42Å; L592-Y899 HydrophobicContact CD2-CE2 3.48Å; L592-Y899 VanDerWaalsContact CD2-CE2 3.48Å; L592-Y899 HydrophobicContact CG-CE2 3.87Å; D595-Y899 VanDerWaalsContact OD2-CE1 3.28Å; D595-Y899 WeakPolarHBondContact OD2-CE1 3.45Å; D595-Y899 PolarHBondContact OD2-OH 2.8Å; L895-Y899 HydrophobicContact CD2-CE1 4.43Å; L895-Y899 WeakPolarHBondContact O-CD1 3.41Å; L895-Y899 PolarHBondContact O-N 3.48Å; Y899-F904 HydrophobicContact CD2-CD1 4.18Å; Y899-F904 HydrophobicContact CD2-CE1 4.47Å; Y899-F904 HydrophobicContact CG-CD1 4.12Å; Y899-F904 WeakPolarHBondContact O-CB 3.39Å; Y899-F904 PolarHBondContact O-N 2.95Å; Y899-M905 HydrophobicContact CD2-CE 4.09Å; Y899-M905 HydrophobicContact CG-CE 4.49Å; Y899-M905 PolarHBondContact O-N 2.91Å; Y899-M905 VanDerWaalsContact O-N 3.13Å
900	K	92.8	Very high	93.4	Very high	119 Å²	119	61.9 Å²	61.9	52%	0.517	34%	0.336	S	S	.	.	H	α-helix	trans	-87.4	-31.4	173.6	-167.9	174	-175.9	170.6	0	113.2	V896 S897 Q898 M905	V896-K900 PolarHBondContact O-N 3.11Å; S897-K900 WeakPolarHBondContact O-CB 3.49Å; S897-K900 PolarHBondContact O-N 3Å; Q898-K900 PolarHBondContact O-N 3.39Å; K900-M905 HydrophobicContact CB-CG 4.26Å
901	S	92.8	Very high	93.4	Very high	91 Å²	91	64.1 Å²	64.1	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-72.3	-34.2	168.8	55.2	0	0	0	0	112.5	S897 Q898 G903	S897-S901 PolarHBondContact O-N 3.46Å; S897-S901 VanDerWaalsContact O-N 3.08Å; Q898-S901 WeakPolarHBondContact CA-OG 3.48Å; Q898-S901 PolarHBondContact O-N 3.03Å; Q898-S901 PolarHBondContact O-OG 3.4Å; S901-G903 VanDerWaalsContact C-N 3.28Å; S901-G903 PolarHBondContact O-N 2.92Å
902	D	93.3	Very high	93.3	Very high	102 Å²	102	62.1 Å²	62.1	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.5	-171.9	-61.2	10.9	0	0	0	112.2	Q898 F904	Q898-D902 VanDerWaalsContact CG-OD2 3.32Å; Q898-D902 WeakPolarHBondContact CG-OD2 3.48Å; Q898-D902 PolarHBondContact NE2-OD2 3.44Å; Q898-D902 WeakPolarHBondContact O-CB 3.42Å; Q898-D902 PolarHBondContact O-N 2.99Å; Q898-D902 VanDerWaalsContact O-OD1 3.12Å; D902-F904 VanDerWaalsContact C-N 3.27Å; D902-F904 PolarHBondContact O-N 2.93Å
903	G	92.6	Very high	92.9	Very high	27 Å²	27	63.7 Å²	63.7	28%	0.278	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	4	178.2	0	0	0	0	0	115.5	S901 M905 D906 M907	S901-G903 VanDerWaalsContact C-N 3.28Å; S901-G903 PolarHBondContact O-N 2.92Å; G903-M905 VanDerWaalsContact C-N 3.34Å; G903-M905 PolarHBondContact O-N 3.45Å; G903-D906 PolarHBondContact O-N 3.29Å; G903-M907 PolarHBondContact O-N 3.21Å
904	F	94.3	Very high	91.8	Very high	42 Å²	42	68.8 Å²	68.8	18%	0.184	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-40.1	179.3	179	-99.8	0	0	0	112.1	L588 K591 Y899 D902 D906 M907 L908	L588-F904 HydrophobicContact CD1-CE1 4.4Å; K591-F904 HydrophobicContact CB-CE1 4.05Å; K591-F904 HydrophobicContact CB-CZ 3.75Å; K591-F904 HydrophobicContact CG-CE1 3.95Å; K591-F904 HydrophobicContact CG-CE2 4.21Å; K591-F904 HydrophobicContact CG-CZ 3.72Å; Y899-F904 HydrophobicContact CD2-CD1 4.18Å; Y899-F904 HydrophobicContact CD2-CE1 4.47Å; Y899-F904 HydrophobicContact CG-CD1 4.12Å; Y899-F904 WeakPolarHBondContact O-CB 3.39Å; Y899-F904 PolarHBondContact O-N 2.95Å; D902-F904 VanDerWaalsContact C-N 3.27Å; D902-F904 PolarHBondContact O-N 2.93Å; F904-D906 VanDerWaalsContact C-N 3.3Å; F904-D906 PolarHBondContact O-N 3.49Å; F904-M907 HydrophobicContact CD2-CE 3.54Å; F904-M907 HydrophobicContact CE2-CE 3.7Å; F904-M907 WeakPolarHBondContact O-CB 3.35Å; F904-M907 PolarHBondContact O-N 2.9Å; F904-L908 HydrophobicContact CD1-CD1 4.09Å; F904-L908 HydrophobicContact CD1-CG 4.27Å; F904-L908 HydrophobicContact CE1-CD1 3.51Å; F904-L908 HydrophobicContact CE1-CD2 4.34Å; F904-L908 HydrophobicContact CE1-CG 3.88Å; F904-L908 HydrophobicContact CZ-CD1 4.02Å; F904-L908 HydrophobicContact CZ-CD2 4.03Å; F904-L908 HydrophobicContact CZ-CG 4.06Å; F904-L908 PolarHBondContact O-N 3.26Å
905	M	93.1	Very high	90.2	Very high	7 Å²	7	65.3 Å²	65.3	3%	0.034	34%	0.337	C	S	.	.	H	α-helix	trans	-62.1	-35.4	176.4	-67.2	-66.4	178.9	0	0	113	Y584 L588 F653 V896 Y899 K900 G903 H909	Y584-M905 PolarHBondContact OH-O 3.06Å; L588-M905 HydrophobicContact CD1-CE 3.57Å; L588-M905 HydrophobicContact CD1-SD 4.35Å; L588-M905 HydrophobicContact CD2-CE 4.12Å; F653-M905 HydrophobicContact CB-CE 3.73Å; F653-M905 HydrophobicContact CB-SD 4.14Å; V896-M905 HydrophobicContact CG1-CE 4.1Å; Y899-M905 HydrophobicContact CD2-CE 4.09Å; Y899-M905 HydrophobicContact CG-CE 4.49Å; Y899-M905 PolarHBondContact O-N 2.91Å; Y899-M905 VanDerWaalsContact O-N 3.13Å; K900-M905 HydrophobicContact CB-CG 4.26Å; G903-M905 VanDerWaalsContact C-N 3.34Å; G903-M905 PolarHBondContact O-N 3.45Å; M905-H909 PolarHBondContact O-N 2.91Å
906	D	92.1	Very high	88.4	Confident	114 Å²	114	67.5 Å²	67.5	61%	0.61	35%	0.351	S	S	*	.	H	α-helix	trans	-72.4	-40.2	176.2	-63.7	-35.5	0	0	0	110.7	G903 F904 L908 H909 D910	G903-D906 PolarHBondContact O-N 3.29Å; F904-D906 VanDerWaalsContact C-N 3.3Å; F904-D906 PolarHBondContact O-N 3.49Å; D906-L908 VanDerWaalsContact C-N 3.34Å; D906-L908 PolarHBondContact O-N 2.75Å; D906-H909 WeakPolarHBondContact O-CB 3.45Å; D906-H909 PolarHBondContact O-N 3Å; D906-H909 VanDerWaalsContact O-N 3.14Å; D906-D910 WeakPolarHBondContact O-CB 3.43Å; D906-D910 PolarHBondContact O-N 2.89Å
907	M	94	Very high	86.6	Confident	115 Å²	115	68.8 Å²	68.8	57%	0.567	36%	0.36	S	S	*	.	H	α-helix	trans	-60.6	-40.9	173	-175.2	-177.6	68.4	0	0	112	G903 F904 D910 K911	G903-M907 PolarHBondContact O-N 3.21Å; F904-M907 HydrophobicContact CD2-CE 3.54Å; F904-M907 HydrophobicContact CE2-CE 3.7Å; F904-M907 WeakPolarHBondContact O-CB 3.35Å; F904-M907 PolarHBondContact O-N 2.9Å; M907-D910 PolarHBondContact O-N 3.16Å; M907-K911 WeakPolarHBondContact O-CB 3.38Å; M907-K911 PolarHBondContact O-N 2.93Å
908	L	93.1	Very high	85	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-40.1	172.6	-69.3	-172.3	0	0	0	111.9	Y584 D587 L588 F904 D906 K911 W912	Y584-L908 HydrophobicContact CD1-CD1 4.48Å; Y584-L908 HydrophobicContact CD2-CB 3.75Å; Y584-L908 HydrophobicContact CE1-CD1 4.23Å; Y584-L908 HydrophobicContact CE2-CB 3.43Å; Y584-L908 VanDerWaalsContact CE2-CB 3.43Å; Y584-L908 HydrophobicContact CG-CB 4.42Å; D587-L908 HydrophobicContact CB-CD1 4.37Å; D587-L908 HydrophobicContact CB-CD2 3.6Å; D587-L908 VanDerWaalsContact OD2-CD2 3.32Å; D587-L908 WeakPolarHBondContact OD2-CD2 3.16Å; L588-L908 HydrophobicContact CB-CD1 4.12Å; F904-L908 HydrophobicContact CD1-CD1 4.09Å; F904-L908 HydrophobicContact CD1-CG 4.27Å; F904-L908 HydrophobicContact CE1-CD1 3.51Å; F904-L908 HydrophobicContact CE1-CD2 4.34Å; F904-L908 HydrophobicContact CE1-CG 3.88Å; F904-L908 HydrophobicContact CZ-CD1 4.02Å; F904-L908 HydrophobicContact CZ-CD2 4.03Å; F904-L908 HydrophobicContact CZ-CG 4.06Å; F904-L908 PolarHBondContact O-N 3.26Å; D906-L908 VanDerWaalsContact C-N 3.34Å; D906-L908 PolarHBondContact O-N 2.75Å; L908-K911 PolarHBondContact O-N 3.48Å; L908-W912 PolarHBondContact O-N 3.5Å; L908-W912 VanDerWaalsContact O-N 3.08Å
909	H	90.9	Very high	82.8	Confident	78 Å²	78	64.8 Å²	64.8	36%	0.361	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-45.8	177.4	-175.1	65.1	0	0	0	110.6	Y584 F654 M905 D906 K911 W912 Y913	Y584-H909 HydrophobicContact CE2-CB 4.22Å; F654-H909 AromaticContact CE2-ND1 3.73Å; F654-H909 AromaticContact CZ-ND1 3.99Å; M905-H909 PolarHBondContact O-N 2.91Å; D906-H909 WeakPolarHBondContact O-CB 3.45Å; D906-H909 PolarHBondContact O-N 3Å; D906-H909 VanDerWaalsContact O-N 3.14Å; H909-K911 VanDerWaalsContact C-N 3.29Å; H909-K911 PolarHBondContact O-N 3.19Å; H909-W912 PolarHBondContact O-N 2.89Å; H909-Y913 AromaticContact CE1-CD1 3.66Å; H909-Y913 AromaticContact CE1-CD2 3.53Å; H909-Y913 AromaticContact CE1-CG 3.33Å; H909-Y913 AromaticContact ND1-CD2 3.16Å; H909-Y913 WeakPolarHBondContact ND1-CD2 3.4Å; H909-Y913 AromaticContact ND1-CE2 3.6Å; H909-Y913 AromaticContact ND1-CG 3.49Å; H909-Y913 WeakPolarHBondContact O-CB 3.36Å; H909-Y913 PolarHBondContact O-N 3.42Å
910	D	89.9	Confident	80.3	Confident	87 Å²	87	72.4 Å²	72.4	47%	0.465	38%	0.384	S	S	.	.	H	α-helix	trans	-68.1	-24.6	178.5	-147.4	52.2	0	0	0	112.9	D906 M907 K914	D906-D910 WeakPolarHBondContact O-CB 3.43Å; D906-D910 PolarHBondContact O-N 2.89Å; M907-D910 PolarHBondContact O-N 3.16Å; D910-K914 WeakPolarHBondContact O-CB 3.37Å; D910-K914 WeakPolarHBondContact OD1-CD 3.34Å; D910-K914 IonicContact OD1-NZ 3.33Å; D910-K914 PolarHBondContact OD1-NZ 2.93Å; D910-K914 IonicContact OD2-NZ 2.82Å; D910-K914 PolarHBondContact OD2-NZ 3.46Å
911	K	90.5	Very high	78	Confident	119 Å²	119	73.5 Å²	73.5	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-71.9	-45.9	170.2	179.7	-178.5	172.7	-170.9	0	112.4	D587 M907 L908 H909	D587-K911 IonicContact OD1-NZ 2.96Å; D587-K911 PolarHBondContact OD1-NZ 3Å; D587-K911 WeakPolarHBondContact OD2-CD 3.45Å; D587-K911 WeakPolarHBondContact OD2-CE 3.35Å; D587-K911 IonicContact OD2-NZ 2.96Å; D587-K911 PolarHBondContact OD2-NZ 3.46Å; M907-K911 WeakPolarHBondContact O-CB 3.38Å; M907-K911 PolarHBondContact O-N 2.93Å; L908-K911 PolarHBondContact O-N 3.48Å; H909-K911 VanDerWaalsContact C-N 3.29Å; H909-K911 PolarHBondContact O-N 3.19Å
912	W	89.8	Confident	75.6	Confident	38 Å²	38	72 Å²	72	14%	0.144	37%	0.374	C	S	.	.	H	α-helix	trans	-98.8	-27.9	-167.9	-67.1	108.1	0	0	0	115.4	P529 F532 Y582 G583 Y584 D587 L908 H909	P529-W912 HydrophobicContact CB-CB 4.47Å; F532-W912 HydrophobicContact CD2-CE3 4.46Å; F532-W912 HydrophobicContact CD2-CZ3 4.17Å; F532-W912 AromaticContact CE2-CE3 3.77Å; F532-W912 HydrophobicContact CE2-CE3 3.77Å; F532-W912 AromaticContact CE2-CZ3 3.87Å; F532-W912 HydrophobicContact CE2-CZ3 3.87Å; Y582-W912 AromaticContact CD2-CH2 3.77Å; Y582-W912 HydrophobicContact CD2-CH2 3.77Å; Y582-W912 AromaticContact CD2-CZ3 3.99Å; Y582-W912 HydrophobicContact CD2-CZ3 3.99Å; Y582-W912 HydrophobicContact CE2-CZ3 4.38Å; G583-W912 VanDerWaalsContact C-CE2 3.47Å; G583-W912 VanDerWaalsContact CA-CZ2 3.45Å; Y584-W912 VanDerWaalsContact CA-CD1 3.49Å; Y584-W912 AromaticContact CD2-CD1 3.99Å; D587-W912 PolarHBondContact OD2-NE1 3.24Å; L908-W912 PolarHBondContact O-N 3.5Å; L908-W912 VanDerWaalsContact O-N 3.08Å; H909-W912 PolarHBondContact O-N 2.89Å
913	Y	84.8	Confident	73.2	Confident	32 Å²	32	75.4 Å²	75.4	13%	0.125	39%	0.385	C	S	.	.	S	Bend	trans	-94.9	-15	-178.2	-78.7	-104.9	0	0	0	114.1	P529 F530 F654 A852 H909 V915	P529-Y913 HydrophobicContact CG-CD2 4.07Å; P529-Y913 HydrophobicContact CG-CE1 4.08Å; P529-Y913 HydrophobicContact CG-CE2 3.5Å; P529-Y913 VanDerWaalsContact CG-CE2 3.5Å; P529-Y913 VanDerWaalsContact CG-CZ 3.5Å; F530-Y913 WeakPolarHBondContact CE2-OH 3.45Å; F530-Y913 HydrophobicContact CZ-CE2 4.4Å; F530-Y913 WeakPolarHBondContact CZ-OH 3.27Å; F654-Y913 HydrophobicContact CE2-CE2 4.15Å; F654-Y913 HydrophobicContact CZ-CE2 4.2Å; F654-Y913 AromaticContact CZ-CZ 3.96Å; A852-Y913 WeakPolarHBondContact O-CE1 3.45Å; A852-Y913 PolarHBondContact O-OH 3.5Å; H909-Y913 AromaticContact CE1-CD1 3.66Å; H909-Y913 AromaticContact CE1-CD2 3.53Å; H909-Y913 AromaticContact CE1-CG 3.33Å; H909-Y913 AromaticContact ND1-CD2 3.16Å; H909-Y913 WeakPolarHBondContact ND1-CD2 3.4Å; H909-Y913 AromaticContact ND1-CE2 3.6Å; H909-Y913 AromaticContact ND1-CG 3.49Å; H909-Y913 WeakPolarHBondContact O-CB 3.36Å; H909-Y913 PolarHBondContact O-N 3.42Å; Y913-V915 PolarHBondContact O-N 3.26Å
914	K	72.6	Confident	70.5	Confident	130 Å²	130	76.8 Å²	76.8	57%	0.565	39%	0.394	S	S	*	.			trans	-80.2	33.7	-171.3	-156.1	174.6	-162.6	135.7	0	114.3	D910 V916	D910-K914 WeakPolarHBondContact O-CB 3.37Å; D910-K914 WeakPolarHBondContact OD1-CD 3.34Å; D910-K914 IonicContact OD1-NZ 3.33Å; D910-K914 PolarHBondContact OD1-NZ 2.93Å; D910-K914 IonicContact OD2-NZ 2.82Å; D910-K914 PolarHBondContact OD2-NZ 3.46Å; K914-V916 WeakPolarHBondContact O-CG2 3.35Å
915	V	61.3	Low	68.1	Low	67 Å²	67	78.9 Å²	78.9	41%	0.406	41%	0.41	S	S	.	.			trans	-85.3	132.9	176.4	-170.5	0	0	0	0	108.9	Y856 I860 Y913	Y856-V915 HydrophobicContact CE2-CG2 4.38Å; I860-V915 HydrophobicContact CG2-CB 4.22Å; I860-V915 HydrophobicContact CG2-CG1 4.05Å; Y913-V915 PolarHBondContact O-N 3.26Å
916	V	57.9	Low	65.8	Low	77 Å²	77	81.8 Å²	81.8	47%	0.467	43%	0.428	S	S	.	.			trans	-130	81.2	-166.3	-161.7	0	0	0	0	114.7	K914 K920	K914-V916 WeakPolarHBondContact O-CG2 3.35Å; V916-K920 HydrophobicContact CG1-CB 3.98Å; V916-K920 HydrophobicContact CG1-CD 4.17Å; V916-K920 HydrophobicContact CG1-CG 3.9Å
917	P	57.9	Low	63.4	Low	29 Å²	29	84.3 Å²	84.3	19%	0.188	44%	0.436	C	S	.	.	S	Bend	trans	-95.3	-28.3	156	27.5	-29.7	0	0	0	115	S859 I860 R921	S859-P917 WeakPolarHBondContact O-CD 3.5Å; S859-P917 WeakPolarHBondContact O-CG 3.43Å; I860-P917 VanDerWaalsContact CA-CG 3.49Å; I860-P917 WeakPolarHBondContact O-CG 3.34Å; P917-R921 WeakPolarHBondContact O-CD 3.39Å; P917-R921 VanDerWaalsContact O-CG 3.29Å; P917-R921 WeakPolarHBondContact O-CG 3.25Å
918	C	60.8	Low	61.1	Low	19 Å²	19	83.5 Å²	83.5	13%	0.128	44%	0.438	C	S	.	.	S	Bend	trans	-102.4	-44.9	179.5	-63.9	0	0	0	0	116.1	D861 C864 K920 R921 S922	D861-C918 PolarHBondContact O-SG 2.73Å; C864-C918 WeakPolarHBondContact CA-SG 3.45Å; C864-C918 HydrophobicContact CB-CB 4.09Å; C864-C918 WeakPolarHBondContact CB-SG 3.29Å; C864-C918 WeakPolarHBondContact SG-CA 3.46Å; C864-C918 WeakPolarHBondContact SG-CB 3.32Å; C864-C918 CovalentContact SG-SG 2.05Å; C864-C918 PolarHBondContact SG-SG 3.36Å; C918-K920 PolarHBondContact O-N 2.92Å; C918-R921 PolarHBondContact O-N 3.46Å; C918-S922 PolarHBondContact O-N 2.99Å
919	G	48	Very low	59	Low	56 Å²	56	89 Å²	89	58%	0.577	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.8	-169	0	0	0	0	0	117.4
920	K	43.2	Very low	57.1	Low	168 Å²	168	93.4 Å²	93.4	73%	0.73	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	-6.4	169.7	-73	-178.5	-179.2	177.6	0	113.9	V916 C918	V916-K920 HydrophobicContact CG1-CB 3.98Å; V916-K920 HydrophobicContact CG1-CD 4.17Å; V916-K920 HydrophobicContact CG1-CG 3.9Å; C918-K920 PolarHBondContact O-N 2.92Å
921	R	44.7	Very low	55.8	Low	141 Å²	141	92.6 Å²	92.6	53%	0.532	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-36.7	175.9	-76.5	-167.9	-179.3	158	-2.8	112.1	P917 C918 F923 A924 V925	P917-R921 WeakPolarHBondContact O-CD 3.39Å; P917-R921 VanDerWaalsContact O-CG 3.29Å; P917-R921 WeakPolarHBondContact O-CG 3.25Å; C918-R921 PolarHBondContact O-N 3.46Å; R921-F923 PolarHBondContact O-N 3.22Å; R921-A924 PolarHBondContact O-N 3.11Å; R921-A924 VanDerWaalsContact O-N 3.09Å; R921-V925 HydrophobicContact CB-CG2 4.49Å; R921-V925 WeakPolarHBondContact O-CB 3.46Å; R921-V925 VanDerWaalsContact O-CG2 3.26Å; R921-V925 WeakPolarHBondContact O-CG2 3.46Å; R921-V925 PolarHBondContact O-N 2.8Å
922	S	43	Very low	54.5	Low	59 Å²	59	88.6 Å²	88.6	41%	0.413	47%	0.474	S	S	.	.	H	α-helix	trans	-49.6	-61.4	177.3	50.7	0	0	0	0	111.6	C918 A924 V925 T926	C918-S922 PolarHBondContact O-N 2.99Å; S922-A924 PolarHBondContact O-N 3.36Å; S922-V925 PolarHBondContact O-N 3.25Å; S922-V925 VanDerWaalsContact O-N 3.15Å; S922-T926 VanDerWaalsContact O-CG2 3.26Å; S922-T926 WeakPolarHBondContact O-CG2 3.35Å; S922-T926 PolarHBondContact O-N 3.45Å; S922-T926 PolarHBondContact O-OG1 3.21Å
923	F	41.9	Very low	53.6	Low	174 Å²	174	93.2 Å²	93.2	76%	0.763	50%	0.5	S	S	*	.	H	α-helix	trans	-62.8	-12.2	179.7	-69	-75.8	0	0	0	116	R921 T926	R921-F923 PolarHBondContact O-N 3.22Å; F923-T926 VanDerWaalsContact C-OG1 3.3Å; F923-T926 WeakPolarHBondContact CA-OG1 3.43Å; F923-T926 PolarHBondContact O-OG1 3.44Å
924	A	37.6	Very low	52.8	Low	57 Å²	57	99.6 Å²	99.6	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-104.1	-23.7	176.7	0	0	0	0	0	112.8	R921 S922	R921-A924 PolarHBondContact O-N 3.11Å; R921-A924 VanDerWaalsContact O-N 3.09Å; S922-A924 PolarHBondContact O-N 3.36Å
925	V	42.4	Very low	52.7	Low	85 Å²	85	96.7 Å²	96.7	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-86.9	-30.4	176.9	172.5	0	0	0	0	111	R921 S922 E927 T928	R921-V925 HydrophobicContact CB-CG2 4.49Å; R921-V925 WeakPolarHBondContact O-CB 3.46Å; R921-V925 VanDerWaalsContact O-CG2 3.26Å; R921-V925 WeakPolarHBondContact O-CG2 3.46Å; R921-V925 PolarHBondContact O-N 2.8Å; S922-V925 PolarHBondContact O-N 3.25Å; S922-V925 VanDerWaalsContact O-N 3.15Å; V925-E927 PolarHBondContact O-N 3.04Å; V925-E927 VanDerWaalsContact O-N 3.08Å; V925-T928 PolarHBondContact O-N 3.4Å
926	T	45	Very low	53.4	Low	68 Å²	68	97.5 Å²	97.5	42%	0.417	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-24.5	169.3	47.4	0	0	0	0	113.1	S922 F923 T928	S922-T926 VanDerWaalsContact O-CG2 3.26Å; S922-T926 WeakPolarHBondContact O-CG2 3.35Å; S922-T926 PolarHBondContact O-N 3.45Å; S922-T926 PolarHBondContact O-OG1 3.21Å; F923-T926 VanDerWaalsContact C-OG1 3.3Å; F923-T926 WeakPolarHBondContact CA-OG1 3.43Å; F923-T926 PolarHBondContact O-OG1 3.44Å; T926-T928 VanDerWaalsContact C-N 3.35Å
927	E	43.1	Very low	54.5	Low	168 Å²	168	95.8 Å²	95.8	79%	0.785	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-16.2	-179.4	-149.4	174	-149.6	0	0	113.4	V925	V925-E927 PolarHBondContact O-N 3.04Å; V925-E927 VanDerWaalsContact O-N 3.08Å
928	T	43.7	Very low	55.8	Low	98 Å²	98	94.5 Å²	94.5	60%	0.601	50%	0.498	S	S	*	.			trans	-140	39.4	-175.4	54.7	0	0	0	0	115.2	V925 T926 Q930	V925-T928 PolarHBondContact O-N 3.4Å; T926-T928 VanDerWaalsContact C-N 3.35Å; T928-Q930 PolarHBondContact O-N 3.49Å
929	L	48.9	Very low	57	Low	119 Å²	119	97.3 Å²	97.3	62%	0.623	51%	0.512	S	S	*	.			trans	-67.5	75.6	163.6	-111.1	174.3	0	0	0	110.8	M931	L929-M931 PolarHBondContact O-N 2.85Å; L929-M931 VanDerWaalsContact O-N 3.13Å
930	Q	52.7	Low	58.8	Low	170 Å²	170	100.2 Å²	100.2	79%	0.794	51%	0.508	S	S	*	.			trans	-61.3	115.3	178.4	-67.8	-173	-1.7	0	0	109.7	T928 G932	T928-Q930 PolarHBondContact O-N 3.49Å; Q930-G932 PolarHBondContact O-N 2.9Å
931	M	61.6	Low	61	Low	71 Å²	71	96 Å²	96	35%	0.35	50%	0.497	S	S	.	.			trans	-66.7	92.2	-172.6	-146.7	80.7	168.2	0	0	111.3	M773 L929 H935 F936	M773-M931 HydrophobicContact CB-CE 4.27Å; M773-M931 HydrophobicContact CE-CB 4.13Å; M773-M931 HydrophobicContact CE-CE 4.12Å; M773-M931 HydrophobicContact CE-CG 3.77Å; M773-M931 HydrophobicContact CE-SD 3.91Å; M773-M931 HydrophobicContact CG-CE 3.94Å; L929-M931 PolarHBondContact O-N 2.85Å; L929-M931 VanDerWaalsContact O-N 3.13Å; M931-H935 HydrophobicContact CE-CB 4.32Å; M931-H935 HydrophobicContact CG-CB 3.88Å; M931-F936 HydrophobicContact CB-CE2 3.98Å; M931-F936 HydrophobicContact CB-CZ 4.26Å; M931-F936 HydrophobicContact CG-CE2 4.14Å; M931-F936 HydrophobicContact CG-CZ 4.2Å; M931-F936 WeakPolarHBondContact O-CE2 3.49Å
932	G	63.8	Low	63	Low	34 Å²	34	94.7 Å²	94.7	35%	0.351	50%	0.498	S	S	.	.			trans	-63.2	158.2	-171.4	0	0	0	0	0	113.8	Q930 K934 H935	Q930-G932 PolarHBondContact O-N 2.9Å; G932-K934 PolarHBondContact O-N 3.38Å; G932-H935 WeakPolarHBondContact O-CB 3.39Å; G932-H935 PolarHBondContact O-CD2 2.99Å; G932-H935 PolarHBondContact O-N 3.48Å
933	I	71.6	Confident	65.3	Low	136 Å²	136	97.3 Å²	97.3	70%	0.697	51%	0.507	S	S	*	.	H	α-helix	trans	-48.7	-33.1	-175.8	-60	171	0	0	0	112.9	H935 F936 S937 F940	I933-H935 VanDerWaalsContact C-N 3.27Å; I933-H935 PolarHBondContact O-N 3.37Å; I933-F936 PolarHBondContact O-N 2.86Å; I933-F936 VanDerWaalsContact O-N 3.07Å; I933-S937 PolarHBondContact O-N 3.33Å; I933-S937 VanDerWaalsContact O-N 3.16Å; I933-F940 HydrophobicContact CG2-CE2 4.22Å
934	K	67.7	Low	67.7	Low	165 Å²	165	93.2 Å²	93.2	72%	0.717	50%	0.499	S	S	*	.	H	α-helix	trans	-54	-38.2	175.7	-66.7	-177.1	179.6	177.9	0	113.3	G932 F936 S937	G932-K934 PolarHBondContact O-N 3.38Å; K934-F936 VanDerWaalsContact C-N 3.29Å; K934-F936 PolarHBondContact O-N 3.5Å; K934-S937 VanDerWaalsContact O-CB 3.24Å; K934-S937 WeakPolarHBondContact O-CB 3.3Å; K934-S937 PolarHBondContact O-N 2.86Å; K934-S937 PolarHBondContact O-OG 3.28Å
935	H	70.4	Confident	70.3	Confident	70 Å²	70	93.9 Å²	93.9	32%	0.324	50%	0.497	S	S	.	.	H	α-helix	trans	-70.3	-24.9	180	-62.4	-96.2	0	0	0	112.9	M931 G932 I933	M931-H935 HydrophobicContact CE-CB 4.32Å; M931-H935 HydrophobicContact CG-CB 3.88Å; G932-H935 WeakPolarHBondContact O-CB 3.39Å; G932-H935 PolarHBondContact O-CD2 2.99Å; G932-H935 PolarHBondContact O-N 3.48Å; I933-H935 VanDerWaalsContact C-N 3.27Å; I933-H935 PolarHBondContact O-N 3.37Å
936	F	75.9	Confident	72.7	Confident	83 Å²	83	91.6 Å²	91.6	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-98.2	1.9	176.8	-60.8	-67.4	0	0	0	113.5	M773 M931 I933 K934 G938 L939 F940	M773-F936 HydrophobicContact CE-CZ 4.46Å; M931-F936 HydrophobicContact CB-CE2 3.98Å; M931-F936 HydrophobicContact CB-CZ 4.26Å; M931-F936 HydrophobicContact CG-CE2 4.14Å; M931-F936 HydrophobicContact CG-CZ 4.2Å; M931-F936 WeakPolarHBondContact O-CE2 3.49Å; I933-F936 PolarHBondContact O-N 2.86Å; I933-F936 VanDerWaalsContact O-N 3.07Å; K934-F936 VanDerWaalsContact C-N 3.29Å; K934-F936 PolarHBondContact O-N 3.5Å; F936-G938 VanDerWaalsContact C-N 3.25Å; F936-G938 PolarHBondContact O-N 3.35Å; F936-G938 VanDerWaalsContact O-N 3.13Å; F936-L939 HydrophobicContact CD1-CD1 4.01Å; F936-L939 WeakPolarHBondContact O-CB 3.38Å; F936-L939 PolarHBondContact O-N 2.97Å; F936-F940 HydrophobicContact CB-CE2 4.07Å; F936-F940 WeakPolarHBondContact O-CD2 3.4Å
937	S	81.6	Confident	75.1	Confident	41 Å²	41	92.7 Å²	92.7	29%	0.287	50%	0.497	S	S	.	.	H	α-helix	trans	-48.5	-41.9	-177.4	56.3	0	0	0	0	113.9	I933 K934 L939 F940 V941	I933-S937 PolarHBondContact O-N 3.33Å; I933-S937 VanDerWaalsContact O-N 3.16Å; K934-S937 VanDerWaalsContact O-CB 3.24Å; K934-S937 WeakPolarHBondContact O-CB 3.3Å; K934-S937 PolarHBondContact O-N 2.86Å; K934-S937 PolarHBondContact O-OG 3.28Å; S937-L939 VanDerWaalsContact C-N 3.32Å; S937-L939 PolarHBondContact O-N 3.39Å; S937-F940 PolarHBondContact O-N 3.29Å; S937-V941 PolarHBondContact O-N 2.92Å; S937-V941 VanDerWaalsContact O-N 3.08Å
938	G	84.1	Confident	77.5	Confident	2 Å²	2	87.1 Å²	87.1	2%	0.021	48%	0.48	C	S	.	.	H	α-helix	trans	-63.3	-30.3	177.9	0	0	0	0	0	115.1	I671 F936 V941 M942	I671-G938 VanDerWaalsContact CG2-CA 3.43Å; I671-G938 WeakPolarHBondContact O-CA 3.45Å; F936-G938 VanDerWaalsContact C-N 3.25Å; F936-G938 PolarHBondContact O-N 3.35Å; F936-G938 VanDerWaalsContact O-N 3.13Å; G938-V941 PolarHBondContact O-N 2.99Å; G938-M942 WeakPolarHBondContact O-CB 3.27Å; G938-M942 VanDerWaalsContact O-CG 3.28Å; G938-M942 WeakPolarHBondContact O-CG 3.22Å; G938-M942 PolarHBondContact O-N 3.5Å
939	L	85.3	Confident	79.9	Confident	78 Å²	78	87.2 Å²	87.2	41%	0.408	48%	0.476	S	S	.	.	H	α-helix	trans	-69.7	-38.4	175.3	-62.8	178.2	0	0	0	111.2	F674 F936 S937 M942 L943	F674-L939 HydrophobicContact CB-CD2 4.07Å; F674-L939 HydrophobicContact CB-CG 4.47Å; F674-L939 HydrophobicContact CD1-CD2 3.97Å; F674-L939 HydrophobicContact CD1-CG 4.42Å; F674-L939 HydrophobicContact CD2-CD2 3.59Å; F674-L939 HydrophobicContact CE1-CD2 4.33Å; F674-L939 HydrophobicContact CE2-CD2 3.98Å; F674-L939 HydrophobicContact CG-CD2 3.6Å; F674-L939 HydrophobicContact CG-CG 4.3Å; F674-L939 HydrophobicContact CZ-CD2 4.34Å; F936-L939 HydrophobicContact CD1-CD1 4.01Å; F936-L939 WeakPolarHBondContact O-CB 3.38Å; F936-L939 PolarHBondContact O-N 2.97Å; S937-L939 VanDerWaalsContact C-N 3.32Å; S937-L939 PolarHBondContact O-N 3.39Å; L939-M942 PolarHBondContact O-N 3.19Å; L939-L943 WeakPolarHBondContact O-CB 3.32Å; L939-L943 PolarHBondContact O-N 3.28Å
940	F	87.1	Confident	81.9	Confident	117 Å²	117	84.7 Å²	84.7	51%	0.513	47%	0.468	S	S	.	.	H	α-helix	trans	-66.4	-42.4	174.5	-63.3	-73.8	0	0	0	111.6	I933 F936 S937 L943 C944	I933-F940 HydrophobicContact CG2-CE2 4.22Å; F936-F940 HydrophobicContact CB-CE2 4.07Å; F936-F940 WeakPolarHBondContact O-CD2 3.4Å; S937-F940 PolarHBondContact O-N 3.29Å; F940-L943 WeakPolarHBondContact O-CB 3.42Å; F940-L943 PolarHBondContact O-N 2.89Å; F940-C944 PolarHBondContact O-N 3.37Å; F940-C944 PolarHBondContact O-SG 3.35Å; F940-C944 VanDerWaalsContact O-SG 3.37Å
941	V	88.3	Confident	83.9	Confident	81 Å²	81	81.5 Å²	81.5	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-46.5	174.4	174.4	0	0	0	0	111.1	S937 G938 L943 C944 V945	S937-V941 PolarHBondContact O-N 2.92Å; S937-V941 VanDerWaalsContact O-N 3.08Å; G938-V941 PolarHBondContact O-N 2.99Å; V941-L943 VanDerWaalsContact C-N 3.32Å; V941-L943 PolarHBondContact O-N 2.85Å; V941-C944 PolarHBondContact O-N 3.29Å; V941-V945 WeakPolarHBondContact O-CG2 3.43Å; V941-V945 PolarHBondContact O-N 2.92Å
942	M	87.9	Confident	85.4	Confident	113 Å²	113	83.5 Å²	83.5	56%	0.557	47%	0.468	S	S	*	.	H	α-helix	trans	-63.7	-35.1	176.8	-73.9	-64	-68.1	0	0	112.8	F674 G938 L939 V945 G946	F674-M942 HydrophobicContact CZ-CG 4.01Å; G938-M942 WeakPolarHBondContact O-CB 3.27Å; G938-M942 VanDerWaalsContact O-CG 3.28Å; G938-M942 WeakPolarHBondContact O-CG 3.22Å; G938-M942 PolarHBondContact O-N 3.5Å; L939-M942 PolarHBondContact O-N 3.19Å; M942-V945 PolarHBondContact O-N 3.37Å; M942-G946 PolarHBondContact O-N 2.94Å
943	L	90.2	Very high	86.7	Confident	113 Å²	113	86 Å²	86	59%	0.592	48%	0.476	S	S	*	.	H	α-helix	trans	-64.1	-45.5	173.2	179.7	62.5	0	0	0	111.4	L939 F940 V941 V945 G946 V947	L939-L943 WeakPolarHBondContact O-CB 3.32Å; L939-L943 PolarHBondContact O-N 3.28Å; F940-L943 WeakPolarHBondContact O-CB 3.42Å; F940-L943 PolarHBondContact O-N 2.89Å; V941-L943 VanDerWaalsContact C-N 3.32Å; V941-L943 PolarHBondContact O-N 2.85Å; L943-V945 VanDerWaalsContact C-N 3.35Å; L943-V945 PolarHBondContact O-N 2.94Å; L943-G946 PolarHBondContact O-N 3.37Å; L943-V947 HydrophobicContact CD1-CG2 4.42Å; L943-V947 WeakPolarHBondContact O-CG2 3.47Å; L943-V947 PolarHBondContact O-N 2.88Å
944	C	91.9	Very high	87.6	Confident	89 Å²	89	82.7 Å²	82.7	60%	0.601	46%	0.463	S	S	*	.	H	α-helix	trans	-60.1	-43	175.5	-68.5	0	0	0	0	112.1	F940 V941 V947 A948	F940-C944 PolarHBondContact O-N 3.37Å; F940-C944 PolarHBondContact O-SG 3.35Å; F940-C944 VanDerWaalsContact O-SG 3.37Å; V941-C944 PolarHBondContact O-N 3.29Å; C944-V947 PolarHBondContact O-N 3.19Å; C944-A948 WeakPolarHBondContact O-CB 3.42Å; C944-A948 PolarHBondContact O-N 3.41Å
945	V	92.8	Very high	88.7	Confident	70 Å²	70	78.7 Å²	78.7	42%	0.424	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-42.2	174	172.7	0	0	0	0	111.3	V941 M942 L943 A948 L949	V941-V945 WeakPolarHBondContact O-CG2 3.43Å; V941-V945 PolarHBondContact O-N 2.92Å; M942-V945 PolarHBondContact O-N 3.37Å; L943-V945 VanDerWaalsContact C-N 3.35Å; L943-V945 PolarHBondContact O-N 2.94Å; V945-A948 PolarHBondContact O-N 3.41Å; V945-L949 HydrophobicContact CG1-CD1 3.94Å; V945-L949 HydrophobicContact CG1-CG 4.47Å; V945-L949 WeakPolarHBondContact O-CB 3.42Å; V945-L949 WeakPolarHBondContact O-CG 3.4Å; V945-L949 PolarHBondContact O-N 3.45Å
946	G	92.4	Very high	89.6	Confident	37 Å²	37	77.7 Å²	77.7	38%	0.381	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-39.8	176	0	0	0	0	0	113.7	M942 L943 S950	M942-G946 PolarHBondContact O-N 2.94Å; L943-G946 PolarHBondContact O-N 3.37Å; G946-S950 WeakPolarHBondContact O-CB 3.3Å; G946-S950 PolarHBondContact O-N 3.03Å
947	V	94.9	Very high	90.2	Very high	92 Å²	92	80.4 Å²	80.4	56%	0.558	47%	0.466	S	S	*	.	H	α-helix	trans	-67.2	-43.2	174.5	171.8	0	0	0	0	111	L943 C944 S950 L951	L943-V947 HydrophobicContact CD1-CG2 4.42Å; L943-V947 WeakPolarHBondContact O-CG2 3.47Å; L943-V947 PolarHBondContact O-N 2.88Å; C944-V947 PolarHBondContact O-N 3.19Å; V947-S950 WeakPolarHBondContact O-CB 3.46Å; V947-S950 PolarHBondContact O-N 3.16Å; V947-L951 PolarHBondContact O-N 3.25Å
948	A	93.5	Very high	90.5	Very high	51 Å²	51	83.5 Å²	83.5	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-43.9	175.8	0	0	0	0	0	112	C944 V945 L951 L952	C944-A948 WeakPolarHBondContact O-CB 3.42Å; C944-A948 PolarHBondContact O-N 3.41Å; V945-A948 PolarHBondContact O-N 3.41Å; A948-L951 PolarHBondContact O-N 2.99Å; A948-L952 WeakPolarHBondContact O-CB 3.42Å; A948-L952 VanDerWaalsContact O-CG 3.3Å; A948-L952 WeakPolarHBondContact O-CG 3.41Å; A948-L952 PolarHBondContact O-N 3.39Å
949	L	94.1	Very high	90.6	Very high	100 Å²	100	87.5 Å²	87.5	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-62.5	-41.7	174	-75.6	168.6	0	0	0	112.1	V945 L952 T953	V945-L949 HydrophobicContact CG1-CD1 3.94Å; V945-L949 HydrophobicContact CG1-CG 4.47Å; V945-L949 WeakPolarHBondContact O-CB 3.42Å; V945-L949 WeakPolarHBondContact O-CG 3.4Å; V945-L949 PolarHBondContact O-N 3.45Å; L949-L952 PolarHBondContact O-N 3.33Å; L949-T953 WeakPolarHBondContact O-CG2 3.35Å; L949-T953 PolarHBondContact O-N 3.14Å; L949-T953 PolarHBondContact O-OG1 3.17Å
950	S	92.8	Very high	90.5	Very high	66 Å²	66	87.2 Å²	87.2	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-42	175.4	-172.8	0	0	0	0	112.4	G946 V947 T953 T954	G946-S950 WeakPolarHBondContact O-CB 3.3Å; G946-S950 PolarHBondContact O-N 3.03Å; V947-S950 WeakPolarHBondContact O-CB 3.46Å; V947-S950 PolarHBondContact O-N 3.16Å; S950-T953 WeakPolarHBondContact CA-OG1 3.31Å; S950-T953 PolarHBondContact O-N 3.47Å; S950-T953 PolarHBondContact O-OG1 3.36Å; S950-T953 VanDerWaalsContact O-OG1 3.05Å; S950-T954 WeakPolarHBondContact O-CB 3.33Å; S950-T954 WeakPolarHBondContact O-CG2 3.46Å; S950-T954 PolarHBondContact O-N 3.3Å; S950-T954 PolarHBondContact O-OG1 3.5Å
951	L	94	Very high	90.3	Very high	103 Å²	103	89.7 Å²	89.7	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-64.7	-42.5	174.7	-176.6	61	0	0	0	111.2	V947 A948 T954 I955	V947-L951 PolarHBondContact O-N 3.25Å; A948-L951 PolarHBondContact O-N 2.99Å; L951-T954 WeakPolarHBondContact CA-OG1 3.46Å; L951-T954 PolarHBondContact O-OG1 2.96Å; L951-T954 VanDerWaalsContact O-OG1 3.1Å; L951-I955 HydrophobicContact CD1-CD1 4.01Å; L951-I955 HydrophobicContact CD1-CG1 4.38Å; L951-I955 HydrophobicContact CG-CD1 3.88Å; L951-I955 WeakPolarHBondContact O-CB 3.46Å; L951-I955 WeakPolarHBondContact O-CD1 3.31Å; L951-I955 WeakPolarHBondContact O-CG1 3.29Å; L951-I955 PolarHBondContact O-N 2.88Å
952	L	92.1	Very high	89.9	Confident	112 Å²	112	92.4 Å²	92.4	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-40.5	175.9	-72.3	168.8	0	0	0	112.5	A948 L949 A956	A948-L952 WeakPolarHBondContact O-CB 3.42Å; A948-L952 VanDerWaalsContact O-CG 3.3Å; A948-L952 WeakPolarHBondContact O-CG 3.41Å; A948-L952 PolarHBondContact O-N 3.39Å; L949-L952 PolarHBondContact O-N 3.33Å; L952-A956 VanDerWaalsContact O-CB 3.25Å; L952-A956 WeakPolarHBondContact O-CB 3.31Å; L952-A956 PolarHBondContact O-N 3.36Å
953	T	91.6	Very high	89.2	Confident	86 Å²	86	91.1 Å²	91.1	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-71.1	-36.7	177.9	54.4	0	0	0	0	112.6	L949 S950 A956 E957	L949-T953 WeakPolarHBondContact O-CG2 3.35Å; L949-T953 PolarHBondContact O-N 3.14Å; L949-T953 PolarHBondContact O-OG1 3.17Å; S950-T953 WeakPolarHBondContact CA-OG1 3.31Å; S950-T953 PolarHBondContact O-N 3.47Å; S950-T953 PolarHBondContact O-OG1 3.36Å; S950-T953 VanDerWaalsContact O-OG1 3.05Å; T953-A956 PolarHBondContact O-N 2.95Å; T953-E957 WeakPolarHBondContact O-CB 3.35Å; T953-E957 PolarHBondContact O-N 2.9Å
954	T	91.7	Very high	88.1	Confident	68 Å²	68	89 Å²	89	42%	0.417	50%	0.496	S	S	.	.	H	α-helix	trans	-71.8	-35.8	175.2	49.5	0	0	0	0	112.4	S950 L951 E957 H958	S950-T954 WeakPolarHBondContact O-CB 3.33Å; S950-T954 WeakPolarHBondContact O-CG2 3.46Å; S950-T954 PolarHBondContact O-N 3.3Å; S950-T954 PolarHBondContact O-OG1 3.5Å; L951-T954 WeakPolarHBondContact CA-OG1 3.46Å; L951-T954 PolarHBondContact O-OG1 2.96Å; L951-T954 VanDerWaalsContact O-OG1 3.1Å; T954-E957 PolarHBondContact O-N 2.97Å; T954-H958 WeakPolarHBondContact O-CB 3.19Å; T954-H958 PolarHBondContact O-N 3.37Å
955	I	90.5	Very high	87	Confident	81 Å²	81	88.8 Å²	88.8	42%	0.415	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-44.8	167.9	-71.4	168	0	0	0	110.5	L951 H958 I959	L951-I955 HydrophobicContact CD1-CD1 4.01Å; L951-I955 HydrophobicContact CD1-CG1 4.38Å; L951-I955 HydrophobicContact CG-CD1 3.88Å; L951-I955 WeakPolarHBondContact O-CB 3.46Å; L951-I955 WeakPolarHBondContact O-CD1 3.31Å; L951-I955 WeakPolarHBondContact O-CG1 3.29Å; L951-I955 PolarHBondContact O-N 2.88Å; I955-H958 PolarHBondContact O-N 3Å; I955-I959 HydrophobicContact CG2-CD1 3.72Å; I955-I959 HydrophobicContact CG2-CG1 4.43Å; I955-I959 WeakPolarHBondContact O-CB 3.28Å; I955-I959 VanDerWaalsContact O-CG1 3.28Å; I955-I959 WeakPolarHBondContact O-CG1 3.45Å; I955-I959 PolarHBondContact O-N 2.93Å
956	A	87.7	Confident	85.7	Confident	48 Å²	48	88.3 Å²	88.3	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-41.1	177.4	0	0	0	0	0	112.4	L952 T953 I959 V960	L952-A956 VanDerWaalsContact O-CB 3.25Å; L952-A956 WeakPolarHBondContact O-CB 3.31Å; L952-A956 PolarHBondContact O-N 3.36Å; T953-A956 PolarHBondContact O-N 2.95Å; A956-I959 PolarHBondContact O-N 2.91Å; A956-V960 WeakPolarHBondContact O-CB 3.48Å; A956-V960 VanDerWaalsContact O-CG2 3.31Å; A956-V960 WeakPolarHBondContact O-CG2 3.39Å; A956-V960 PolarHBondContact O-N 3.25Å
957	E	90.6	Very high	84.1	Confident	140 Å²	140	94.5 Å²	94.5	65%	0.654	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-44.8	173.3	-176.7	175.8	-162.5	0	0	111.1	T953 T954 I959 V960 Y961	T953-E957 WeakPolarHBondContact O-CB 3.35Å; T953-E957 PolarHBondContact O-N 2.9Å; T954-E957 PolarHBondContact O-N 2.97Å; E957-I959 VanDerWaalsContact C-N 3.33Å; E957-I959 PolarHBondContact O-N 3.33Å; E957-V960 PolarHBondContact O-N 3.34Å; E957-Y961 VanDerWaalsContact O-CB 3.27Å; E957-Y961 WeakPolarHBondContact O-CB 3.46Å; E957-Y961 PolarHBondContact O-N 2.86Å
958	H	87.5	Confident	82.5	Confident	107 Å²	107	94.1 Å²	94.1	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-39.5	175.9	-168.1	86.6	0	0	0	112.1	T954 I955 Y961 K962	T954-H958 WeakPolarHBondContact O-CB 3.19Å; T954-H958 PolarHBondContact O-N 3.37Å; I955-H958 PolarHBondContact O-N 3Å; H958-Y961 PolarHBondContact O-N 2.86Å; H958-K962 WeakPolarHBondContact NE2-CD 3.31Å; H958-K962 WeakPolarHBondContact O-CB 3.41Å; H958-K962 PolarHBondContact O-N 3.44Å
959	I	85.1	Confident	80.6	Confident	85 Å²	85	100 Å²	100	44%	0.436	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-44.9	174.1	-74.7	169.3	0	0	0	111.1	I955 A956 E957 K962 L963	I955-I959 HydrophobicContact CG2-CD1 3.72Å; I955-I959 HydrophobicContact CG2-CG1 4.43Å; I955-I959 WeakPolarHBondContact O-CB 3.28Å; I955-I959 VanDerWaalsContact O-CG1 3.28Å; I955-I959 WeakPolarHBondContact O-CG1 3.45Å; I955-I959 PolarHBondContact O-N 2.93Å; A956-I959 PolarHBondContact O-N 2.91Å; E957-I959 VanDerWaalsContact C-N 3.33Å; E957-I959 PolarHBondContact O-N 3.33Å; I959-K962 PolarHBondContact O-N 2.83Å; I959-L963 HydrophobicContact CG2-CD1 4.37Å; I959-L963 WeakPolarHBondContact O-CA 3.25Å; I959-L963 WeakPolarHBondContact O-CB 3.33Å; I959-L963 PolarHBondContact O-N 2.97Å
960	V	83.7	Confident	78.8	Confident	73 Å²	73	101.4 Å²	101.4	44%	0.442	52%	0.515	S	S	.	.	I	π-helix	trans	-62.7	-46.5	176.1	167.4	0	0	0	0	110.4	A956 E957 K962 V964 I965	A956-V960 WeakPolarHBondContact O-CB 3.48Å; A956-V960 VanDerWaalsContact O-CG2 3.31Å; A956-V960 WeakPolarHBondContact O-CG2 3.39Å; A956-V960 PolarHBondContact O-N 3.25Å; E957-V960 PolarHBondContact O-N 3.34Å; V960-K962 PolarHBondContact O-N 2.93Å; V960-V964 HydrophobicContact CG1-CB 4.26Å; V960-V964 HydrophobicContact CG2-CG2 4.31Å; V960-V964 CarbonylContact O-C 3.58Å; V960-V964 WeakPolarHBondContact O-CA 3.48Å; V960-V964 WeakPolarHBondContact O-CB 3.49Å; V960-V964 PolarHBondContact O-N 3.1Å; V960-I965 PolarHBondContact O-N 2.8Å
961	Y	82.6	Confident	76.9	Confident	169 Å²	169	104.6 Å²	104.6	66%	0.663	54%	0.535	S	S	*	.	I	π-helix	trans	-63	-42.1	178.7	-173.3	-90.8	0	0	0	112.8	E957 H958 I965 P966	E957-Y961 VanDerWaalsContact O-CB 3.27Å; E957-Y961 WeakPolarHBondContact O-CB 3.46Å; E957-Y961 PolarHBondContact O-N 2.86Å; H958-Y961 PolarHBondContact O-N 2.86Å; Y961-I965 HydrophobicContact CD2-CD1 4Å; Y961-P966 WeakPolarHBondContact O-CD 3.49Å
962	K	79.4	Confident	74.9	Confident	137 Å²	137	111.5 Å²	111.5	60%	0.596	55%	0.553	S	S	*	*	I	π-helix	trans	-93.5	-21.8	-172.2	-164.1	176.2	179.7	-176.5	0	114.8	H958 I959 V960 P966	H958-K962 WeakPolarHBondContact NE2-CD 3.31Å; H958-K962 WeakPolarHBondContact O-CB 3.41Å; H958-K962 PolarHBondContact O-N 3.44Å; I959-K962 PolarHBondContact O-N 2.83Å; V960-K962 PolarHBondContact O-N 2.93Å; K962-P966 WeakPolarHBondContact O-CG 3.43Å
963	L	74.6	Confident	72.8	Confident	86 Å²	86	109.4 Å²	109.4	45%	0.45	55%	0.549	S	S	.	.	I	π-helix	trans	-118.1	-37.3	178.8	-61.7	-177.8	0	0	0	114	I959 R967	I959-L963 HydrophobicContact CG2-CD1 4.37Å; I959-L963 WeakPolarHBondContact O-CA 3.25Å; I959-L963 WeakPolarHBondContact O-CB 3.33Å; I959-L963 PolarHBondContact O-N 2.97Å; L963-R967 VanDerWaalsContact O-CB 3.32Å; L963-R967 WeakPolarHBondContact O-CB 3.49Å; L963-R967 WeakPolarHBondContact O-CD 3.39Å; L963-R967 VanDerWaalsContact O-CG 3.3Å; L963-R967 WeakPolarHBondContact O-CG 3.41Å; L963-R967 PolarHBondContact O-N 3.44Å
964	V	67.2	Low	71	Confident	70 Å²	70	114.6 Å²	114.6	42%	0.424	56%	0.564	S	S	.	*	I	π-helix	trans	-85.8	-50.3	-175.1	-177.4	0	0	0	0	111.4	V960 R967 V968	V960-V964 HydrophobicContact CG1-CB 4.26Å; V960-V964 HydrophobicContact CG2-CG2 4.31Å; V960-V964 CarbonylContact O-C 3.58Å; V960-V964 WeakPolarHBondContact O-CA 3.48Å; V960-V964 WeakPolarHBondContact O-CB 3.49Å; V960-V964 PolarHBondContact O-N 3.1Å; V964-R967 PolarHBondContact O-N 2.91Å; V964-V968 HydrophobicContact CG1-CG2 4.03Å; V964-V968 WeakPolarHBondContact O-CB 3.49Å; V964-V968 VanDerWaalsContact O-CG2 3.3Å; V964-V968 WeakPolarHBondContact O-CG2 3.18Å; V964-V968 PolarHBondContact O-N 3.42Å
965	I	68.2	Low	69.1	Low	84 Å²	84	121.9 Å²	121.9	43%	0.431	59%	0.585	S	S	.	*	H	α-helix	trans	-56	-45.8	177.8	-62.9	-176.1	0	0	0	112.8	V960 Y961 K969	V960-I965 PolarHBondContact O-N 2.8Å; Y961-I965 HydrophobicContact CD2-CD1 4Å; I965-K969 PolarHBondContact O-N 3.31Å
966	P	65.1	Low	67.1	Low	60 Å²	60	127.1 Å²	127.1	39%	0.39	60%	0.6	S	S	.	*	H	α-helix	trans	-68.3	-40.3	175.3	21.7	-30	0	0	0	113.4	Y961 K962 V968 K969 E970	Y961-P966 WeakPolarHBondContact O-CD 3.49Å; K962-P966 WeakPolarHBondContact O-CG 3.43Å; P966-V968 VanDerWaalsContact C-N 3.32Å; P966-V968 PolarHBondContact O-N 3.01Å; P966-K969 WeakPolarHBondContact O-CA 3.48Å; P966-K969 WeakPolarHBondContact O-CB 3.48Å; P966-K969 PolarHBondContact O-N 3.41Å; P966-E970 PolarHBondContact O-N 3.49Å
967	R	59.8	Low	65.4	Low	167 Å²	167	127.7 Å²	127.7	63%	0.63	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-29.5	177.4	-76.9	179.5	166.5	144.8	-2.7	113.5	L963 V964 K969 E970	L963-R967 VanDerWaalsContact O-CB 3.32Å; L963-R967 WeakPolarHBondContact O-CB 3.49Å; L963-R967 WeakPolarHBondContact O-CD 3.39Å; L963-R967 VanDerWaalsContact O-CG 3.3Å; L963-R967 WeakPolarHBondContact O-CG 3.41Å; L963-R967 PolarHBondContact O-N 3.44Å; V964-R967 PolarHBondContact O-N 2.91Å; R967-K969 PolarHBondContact O-N 3.05Å; R967-E970 PolarHBondContact O-N 2.8Å
968	V	59.9	Low	63.4	Low	83 Å²	83	126.6 Å²	126.6	50%	0.503	59%	0.59	S	S	.	*	H	α-helix	trans	-74.7	-15.3	171.9	173	0	0	0	0	112	V964 P966	V964-V968 HydrophobicContact CG1-CG2 4.03Å; V964-V968 WeakPolarHBondContact O-CB 3.49Å; V964-V968 VanDerWaalsContact O-CG2 3.3Å; V964-V968 WeakPolarHBondContact O-CG2 3.18Å; V964-V968 PolarHBondContact O-N 3.42Å; P966-V968 VanDerWaalsContact C-N 3.32Å; P966-V968 PolarHBondContact O-N 3.01Å
969	K	54.8	Low	61.5	Low	176 Å²	176	126 Å²	126	77%	0.765	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-12.2	166.8	-82.4	-176.9	170.6	-176.8	0	113.9	I965 P966 R967	I965-K969 PolarHBondContact O-N 3.31Å; P966-K969 WeakPolarHBondContact O-CA 3.48Å; P966-K969 WeakPolarHBondContact O-CB 3.48Å; P966-K969 PolarHBondContact O-N 3.41Å; R967-K969 PolarHBondContact O-N 3.05Å
970	E	55.7	Low	59.9	Low	128 Å²	128	123.7 Å²	123.7	60%	0.598	59%	0.586	S	S	*	*	S	Bend	trans	-86.1	132.2	175.8	-67.6	-174.9	124.1	0	0	111.5	P966 R967 R972	P966-E970 PolarHBondContact O-N 3.49Å; R967-E970 PolarHBondContact O-N 2.8Å; E970-R972 PolarHBondContact O-N 2.9Å
971	P	52.2	Low	58.3	Low	134 Å²	134	123.6 Å²	123.6	87%	0.87	58%	0.581	S	S	*	*	S	Bend	trans	-87.3	69.9	-161.1	34.8	-38.5	0	0	0	114
972	R	52.3	Low	56.5	Low	247 Å²	247	124.4 Å²	124.4	93%	0.932	58%	0.582	S	S	*	*			trans	-140.1	12.6	179.2	-123.2	170.2	-175.5	161.8	1.4	120	E970	E970-R972 PolarHBondContact O-N 2.9Å
973	S	49.7	Very low	55.1	Low	69 Å²	69	123.7 Å²	123.7	48%	0.483	59%	0.585	S	S	.	*			trans	-131.7	59.1	178.4	54.6	0	0	0	0	114.6	Y975 W976	S973-Y975 PolarHBondContact O-N 3.43Å; S973-W976 PolarHBondContact O-N 3.24Å
974	K	52.2	Low	53.7	Low	195 Å²	195	125.7 Å²	125.7	85%	0.848	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-22.4	-171.7	-82.3	-175.2	173.9	179.2	0	116.8
975	Y	52.5	Low	52.6	Low	221 Å²	221	129.3 Å²	129.3	87%	0.867	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-39.8	-176.6	-120.1	-98.2	0	0	0	114.1	S973 L977 H978	S973-Y975 PolarHBondContact O-N 3.43Å; Y975-L977 VanDerWaalsContact C-N 3.34Å; Y975-L977 PolarHBondContact O-N 2.75Å; Y975-H978 PolarHBondContact O-N 2.93Å
976	W	49.3	Very low	51.6	Low	190 Å²	190	129.4 Å²	129.4	72%	0.72	61%	0.611	S	S	*	*	H	α-helix	trans	-78.3	-20	-176.7	-153.7	84.3	0	0	0	113	S973 H978 T979 S980	S973-W976 PolarHBondContact O-N 3.24Å; W976-H978 VanDerWaalsContact C-N 3.26Å; W976-H978 PolarHBondContact O-N 3.4Å; W976-T979 PolarHBondContact O-OG1 3.3Å; W976-S980 PolarHBondContact O-OG 3.23Å
977	L	50.9	Low	50.6	Low	60 Å²	60	132.3 Å²	132.3	31%	0.314	62%	0.622	S	S	.	*	H	α-helix	trans	-63.6	-29.3	169.8	-108.6	69.9	0	0	0	112.6	Y975 S980 Q981	Y975-L977 VanDerWaalsContact C-N 3.34Å; Y975-L977 PolarHBondContact O-N 2.75Å; L977-S980 WeakPolarHBondContact CA-OG 3.47Å; L977-S980 PolarHBondContact O-OG 3.04Å; L977-Q981 WeakPolarHBondContact O-CB 3.33Å; L977-Q981 WeakPolarHBondContact O-CG 3.43Å; L977-Q981 PolarHBondContact O-N 3.34Å
978	H	47.8	Very low	49.8	Very low	117 Å²	117	130.3 Å²	130.3	54%	0.542	62%	0.624	S	S	.	*	H	α-helix	trans	-77.7	-32.1	-168.7	-150.1	-102.8	0	0	0	113.7	Y975 W976 R982	Y975-H978 PolarHBondContact O-N 2.93Å; W976-H978 VanDerWaalsContact C-N 3.26Å; W976-H978 PolarHBondContact O-N 3.4Å; H978-R982 PolarHBondContact O-N 3.29Å
979	T	49.2	Very low	48.7	Very low	96 Å²	96	131.1 Å²	131.1	59%	0.589	63%	0.634	S	S	*	*	H	α-helix	trans	-78.2	-48.7	173.3	47.6	0	0	0	0	111.4	W976 Q981 R982 L983	W976-T979 PolarHBondContact O-OG1 3.3Å; T979-Q981 PolarHBondContact O-N 3.12Å; T979-R982 WeakPolarHBondContact O-CB 3.39Å; T979-R982 PolarHBondContact O-N 3.39Å; T979-L983 PolarHBondContact O-N 3.48Å; T979-L983 VanDerWaalsContact O-N 3.12Å
980	S	50.7	Low	47.8	Very low	36 Å²	36	128.4 Å²	128.4	25%	0.252	63%	0.631	S	S	.	*	H	α-helix	trans	-60.3	-41.5	177.6	54.6	0	0	0	0	112.4	W976 L977 R982 L983 H984	W976-S980 PolarHBondContact O-OG 3.23Å; L977-S980 WeakPolarHBondContact CA-OG 3.47Å; L977-S980 PolarHBondContact O-OG 3.04Å; S980-R982 PolarHBondContact O-N 2.99Å; S980-L983 PolarHBondContact O-N 2.94Å; S980-H984 WeakPolarHBondContact O-CB 3.48Å; S980-H984 PolarHBondContact O-N 3.09Å
981	Q	49.5	Very low	46.7	Very low	70 Å²	70	128.1 Å²	128.1	33%	0.327	63%	0.628	S	S	.	*	H	α-helix	trans	-70.8	-24.2	173.1	-69.6	-179.2	-5.7	0	0	113.7	L977 T979 R985	L977-Q981 WeakPolarHBondContact O-CB 3.33Å; L977-Q981 WeakPolarHBondContact O-CG 3.43Å; L977-Q981 PolarHBondContact O-N 3.34Å; T979-Q981 PolarHBondContact O-N 3.12Å; Q981-R985 VanDerWaalsContact CB-NH1 3.33Å; Q981-R985 VanDerWaalsContact O-CB 3.24Å; Q981-R985 WeakPolarHBondContact O-CB 3.44Å; Q981-R985 WeakPolarHBondContact O-CG 3.28Å; Q981-R985 PolarHBondContact O-N 3.34Å
982	R	45.8	Very low	45.8	Very low	186 Å²	186	129.6 Å²	129.6	70%	0.702	63%	0.627	S	S	*	*	H	α-helix	trans	-68.9	-43	172.4	-116.7	179.7	176.8	168.6	-0.3	110.8	H978 T979 S980 R985 A986	H978-R982 PolarHBondContact O-N 3.29Å; T979-R982 WeakPolarHBondContact O-CB 3.39Å; T979-R982 PolarHBondContact O-N 3.39Å; S980-R982 PolarHBondContact O-N 2.99Å; R982-R985 PolarHBondContact O-N 3.09Å; R982-A986 PolarHBondContact O-N 3.24Å; R982-A986 VanDerWaalsContact O-N 3.11Å
983	L	48.8	Very low	45.1	Very low	123 Å²	123	123.6 Å²	123.6	64%	0.644	61%	0.614	S	S	*	*	H	α-helix	trans	-65.3	-43.3	174.4	-163.5	69.3	0	0	0	111.6	T979 S980 A986 L987	T979-L983 PolarHBondContact O-N 3.48Å; T979-L983 VanDerWaalsContact O-N 3.12Å; S980-L983 PolarHBondContact O-N 2.94Å; L983-A986 PolarHBondContact O-N 3.25Å; L983-L987 HydrophobicContact CG-CD1 4.49Å; L983-L987 PolarHBondContact O-N 3.47Å
984	H	46.5	Very low	44.1	Very low	128 Å²	128	126.2 Å²	126.2	59%	0.593	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-37.3	175.7	-101.8	-73.6	0	0	0	113.8	S980 A986 L987 N988	S980-H984 WeakPolarHBondContact O-CB 3.48Å; S980-H984 PolarHBondContact O-N 3.09Å; H984-A986 VanDerWaalsContact C-N 3.33Å; H984-L987 PolarHBondContact O-N 2.89Å; H984-N988 PolarHBondContact O-N 3.42Å
985	R	43.7	Very low	43	Very low	146 Å²	146	125.4 Å²	125.4	55%	0.551	62%	0.619	S	S	*	*	H	α-helix	trans	-71.1	-26.7	176.1	-75.1	173.7	-173.3	117.3	7.3	113.1	Q981 R982 L987	Q981-R985 VanDerWaalsContact CB-NH1 3.33Å; Q981-R985 VanDerWaalsContact O-CB 3.24Å; Q981-R985 WeakPolarHBondContact O-CB 3.44Å; Q981-R985 WeakPolarHBondContact O-CG 3.28Å; Q981-R985 PolarHBondContact O-N 3.34Å; R982-R985 PolarHBondContact O-N 3.09Å; R985-L987 VanDerWaalsContact C-N 3.3Å
986	A	46.6	Very low	41.9	Very low	85 Å²	85	122.6 Å²	122.6	70%	0.702	62%	0.618	S	S	*	*	H	α-helix	trans	-72.2	-24	171.2	0	0	0	0	0	112.8	R982 L983 H984	R982-A986 PolarHBondContact O-N 3.24Å; R982-A986 VanDerWaalsContact O-N 3.11Å; L983-A986 PolarHBondContact O-N 3.25Å; H984-A986 VanDerWaalsContact C-N 3.33Å
987	L	45.5	Very low	41.6	Very low	121 Å²	121	118.3 Å²	118.3	63%	0.634	62%	0.615	S	S	*	*	H	α-helix	trans	-104.3	-19.4	-177.1	-70.1	170.3	0	0	0	114.7	L983 H984 R985	L983-L987 HydrophobicContact CG-CD1 4.49Å; L983-L987 PolarHBondContact O-N 3.47Å; H984-L987 PolarHBondContact O-N 2.89Å; R985-L987 VanDerWaalsContact C-N 3.3Å
988	N	43	Very low	40.5	Very low	125 Å²	125	120.3 Å²	120.3	67%	0.668	63%	0.634	S	S	*	*			trans	-139.7	99.1	174.3	-88.8	-37.5	0	0	0	109.9	H984	H984-N988 PolarHBondContact O-N 3.42Å
989	S	36	Very low	39.5	Very low	101 Å²	101	120.7 Å²	120.7	71%	0.706	64%	0.644	S	S	*	*			trans	-94.2	156.1	166.4	61.1	0	0	0	0	111
990	V	35.3	Very low	38.5	Very low	118 Å²	118	122 Å²	122	72%	0.715	65%	0.652	S	S	*	*			trans	63.4	90	172.5	-165.2	0	0	0	0	116.4
991	F	33.3	Very low	37.3	Very low	122 Å²	122	129 Å²	129	54%	0.535	68%	0.678	S	S	.	*				-161.8	128.1	118.9	-127.3	-121	0	0	0	113.8	R715 D993	R715-F991 VanDerWaalsContact NH1-CE2 3.28Å; R715-F991 VanDerWaalsContact NH2-CE1 3.25Å; R715-F991 VanDerWaalsContact NH2-CE2 3.27Å; R715-F991 VanDerWaalsContact NH2-CZ 3.29Å; F991-D993 VanDerWaalsContact CE1-OD1 3.29Å; F991-D993 WeakPolarHBondContact CE1-OD1 3.44Å
992	I	32.6	Very low	37.1	Very low	165 Å²	165	130.6 Å²	130.6	85%	0.846	69%	0.694	S	S	*	*			trans	-138.8	135.3	148.4	-70.8	-173.2	0	0	0	104.8
993	D	38.1	Very low	36.3	Very low	122 Å²	122	127.7 Å²	127.7	65%	0.652	69%	0.689	S	S	*	*			trans	-82.6	160.3	177.4	-66.6	-82.8	0	0	0	112	F991	F991-D993 VanDerWaalsContact CE1-OD1 3.29Å; F991-D993 WeakPolarHBondContact CE1-OD1 3.44Å
994	D	28.1	Very low	35.4	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	69%	0.694	S	S	*	*				-157.7	149.7	125.1	-141.2	-8.4	0	0	0	114.9
995	K	28.8	Very low	34.4	Very low	178 Å²	178	134.3 Å²	134.3	77%	0.774	71%	0.705	S	S	*	*			trans	63.4	132.1	157.1	-78	145.4	-168.5	152.4	0	125
996	L	31.1	Very low	33.6	Very low	161 Å²	161	132 Å²	132	84%	0.843	71%	0.71	S	S	*	*			trans	-72.4	-176.8	160.3	-117.5	69.9	0	0	0	111.3
997	P	42.9	Very low	32.9	Very low	101 Å²	101	133.3 Å²	133.3	66%	0.656	71%	0.705	S	S	*	*			cis	-143.6	170.7	9	38.5	-17.4	0	0	0	119.9
998	S	26.5	Very low	32.2	Very low	102 Å²	102	136 Å²	136	71%	0.713	71%	0.714	S	S	*	*			trans	79	162.3	135.4	65.8	0	0	0	0	124.9
999	V	28.3	Very low	31.5	Very low	125 Å²	125	133 Å²	133	76%	0.758	71%	0.713	S	S	*	*			trans	106.1	109	156.6	-174.7	0	0	0	0	120
1000	T	27.5	Very low	31.4	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	72%	0.719	S	S	*	*			trans	28.7	130.8	153.8	60.8	0	0	0	0	126.1
1001	K	26.4	Very low	31.3	Very low	182 Å²	182	135.9 Å²	135.9	79%	0.791	72%	0.716	S	S	*	*				21.9	161.7	108.6	-88.6	-168.7	178.3	-172	0	120.3
1002	P	44.8	Very low	31.4	Very low	105 Å²	105	137.4 Å²	137.4	68%	0.682	73%	0.725	S	S	*	*			cis	-139.5	-142.6	-18	36.5	-10.9	0	0	0	111.4
1003	E	27.7	Very low	31.5	Very low	125 Å²	125	134.3 Å²	134.3	58%	0.584	72%	0.718	S	S	*	*			cis	-164	144.5	-10.3	-152.3	138.2	110.5	0	0	114.6
1004	K	31.1	Very low	31.2	Very low	174 Å²	174	132.9 Å²	132.9	76%	0.757	72%	0.723	S	S	*	*			trans	59.5	176.1	156.5	-70.5	164.9	-165.9	150.6	0	117.8
1005	R	25	Very low	31.2	Very low	216 Å²	216	131.6 Å²	131.6	82%	0.815	72%	0.724	S	S	*	*			cis	-159.9	138	15.7	-159.6	165.6	-179.2	176.3	1	114.8
1006	C	27.1	Very low	31.1	Very low	98 Å²	98	134 Å²	134	66%	0.662	73%	0.729	S	S	*	*			trans	52.5	161.5	145.7	-65.3	0	0	0	0	121.9
1007	N	31.7	Very low	31.1	Very low	111 Å²	111	133.2 Å²	133.2	59%	0.594	73%	0.725	S	S	*	*			cis	-159.2	168.3	-10	-115.8	18.6	0	0	0	111.5
1008	E	30.2	Very low	31.5	Very low	177 Å²	177	133.8 Å²	133.8	83%	0.827	73%	0.728	S	S	*	*			trans	43.1	150.1	145	-66.6	152.6	154.7	0	0	122.3
1009	G	29.2	Very low	31.7	Very low	62 Å²	62	133.1 Å²	133.1	64%	0.639	73%	0.729	S	S	*	*			cis	163	142.1	-5.3	0	0	0	0	0	113.4
1010	N	32.7	Very low	31.6	Very low	157 Å²	157	135.6 Å²	135.6	84%	0.84	73%	0.732	S	S	*	*			trans	64.4	166.2	179	-60	-14.5	0	0	0	114.2
1011	N	33.6	Very low	31.6	Very low	123 Å²	123	135 Å²	135	66%	0.658	73%	0.734	S	S	*	*			cis	-150.6	169.9	-2.3	-131.2	3.1	0	0	0	108.4
1012	Q	36.7	Very low	31.6	Very low	155 Å²	155	131 Å²	131	72%	0.724	73%	0.728	S	S	*	*			cis	-154	-176.9	2.2	-154.3	162.6	-22	0	0	110.8
1013	S	34.6	Very low	30.8	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	73%	0.734	S	S	*	*			trans	-21.5	153.1	163.3	61	0	0	0	0	120.4
1014	A	31	Very low	30.7	Very low	92 Å²	92	133.1 Å²	133.1	76%	0.76	74%	0.739	S	S	*	*			cis	-161.1	-178.3	12.4	0	0	0	0	0	108.6
1015	S	29.2	Very low	30.6	Very low	96 Å²	96	132.3 Å²	132.3	67%	0.671	74%	0.743	S	S	*	*			cis	-168.9	-174.7	-23.9	54.4	0	0	0	0	105.5
1016	W	26.5	Very low	30.6	Very low	230 Å²	230	132.9 Å²	132.9	87%	0.871	75%	0.745	S	S	*	*			cis	-148.5	-168.1	5.3	-118.9	136	0	0	0	108.6
1017	N	31.3	Very low	30.6	Very low	144 Å²	144	138.1 Å²	138.1	77%	0.77	75%	0.751	S	S	*	*			trans	-165.6	-172.6	176.3	-115.9	-30.2	0	0	0	107.9
1018	P	50.1	Low	30.2	Very low	112 Å²	112	142.9 Å²	142.9	73%	0.727	76%	0.76	S	S	*	*			cis	-153.8	172.3	27.4	46.9	-26.1	0	0	0	120.6
1019	A	30.2	Very low	30	Very low	88 Å²	88	143.4 Å²	143.4	73%	0.727	76%	0.76	S	S	*	*			trans	60.3	168.4	134.5	0	0	0	0	0	121.7
1020	E	27.4	Very low	29.8	Very low	177 Å²	177	147.6 Å²	147.6	83%	0.827	77%	0.767	S	S	*	*			cis	-140.9	151	17.8	-71.8	-170.4	127.4	0	0	116.7
1021	S	26.8	Very low	30.2	Very low	112 Å²	112	144.9 Å²	144.9	78%	0.783	76%	0.758	S	S	*	*			trans	45.4	159	134.9	99.9	0	0	0	0	123.1
1022	S	27.5	Very low	29.9	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	76%	0.761	S	S	*	*			cis	-157.4	166.6	5.7	69.8	0	0	0	0	115.2
1023	H	28	Very low	29.3	Very low	172 Å²	172	144.6 Å²	144.6	80%	0.796	76%	0.757	S	S	*	*			trans	66.3	125.7	149.8	-86	-70.7	0	0	0	127.3
1024	C	25.2	Very low	28.9	Very low	102 Å²	102	146.9 Å²	146.9	69%	0.689	76%	0.76	S	S	*	*			trans	69.9	99.2	135.2	-78.1	0	0	0	0	125.8
1025	N	27.6	Very low	28.7	Very low	157 Å²	157	149.7 Å²	149.7	84%	0.84	76%	0.757	S	S	*	*				35.2	118.6	116.5	-81.4	-38.5	0	0	0	122.2
1026	R	27	Very low	28.4	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	76%	0.755	S	S	*	*				150.1	114.6	101.6	-179	178.8	-100.1	-152.4	0.1	116.6
1027	R	25.5	Very low	28.3	Very low	208 Å²	208	145.5 Å²	145.5	79%	0.785	74%	0.744	S	S	*	*			trans	30.5	124.8	146.1	-63.6	-178.4	176.2	179.6	-0.6	123.2
1028	R	24.8	Very low	28.2	Very low	210 Å²	210	144.7 Å²	144.7	79%	0.792	74%	0.739	S	S	*	*			trans	65.4	150.8	144.3	-58.7	177.3	179.5	175.1	-3.4	116.3
1029	F	25.8	Very low	27	Very low	188 Å²	188	147.3 Å²	147.3	83%	0.825	74%	0.742	S	S	*	*			cis	-147.9	-179.8	30.3	-127.8	-85.1	0	0	0	112.5
1030	L	24.8	Very low	26.8	Very low	150 Å²	150	151.7 Å²	151.7	79%	0.785	75%	0.747	S	S	*	*			trans	-74	176.7	163.5	-106	94.4	0	0	0	111.7
1031	P	41.7	Very low	27.5	Very low	100 Å²	100	148.6 Å²	148.6	65%	0.649	74%	0.742	S	S	*	*			cis	-141.4	177.1	14.3	44	-25.6	0	0	0	118.4
1032	Q	25.5	Very low	27.4	Very low	154 Å²	154	147.7 Å²	147.7	72%	0.72	74%	0.736	S	S	*	*			trans	51.8	124.8	137.8	-75.1	-179.7	-95	0	0	125.5
1033	D	25.2	Very low	27.6	Very low	119 Å²	119	148.1 Å²	148.1	64%	0.636	74%	0.739	S	S	*	*				80.2	136.5	118.9	-60.1	-6.8	0	0	0	125.8
1034	I	26.6	Very low	27.6	Very low	148 Å²	148	147.8 Å²	147.8	76%	0.759	74%	0.738	S	S	*	*			trans	82.9	100.9	140.3	-74.3	165.3	0	0	0	120.5
1035	Q	25.2	Very low	27.9	Very low	150 Å²	150	149.1 Å²	149.1	70%	0.701	74%	0.738	S	S	*	*				73.3	118.5	117.3	-150.4	77.4	44.2	0	0	121.9
1036	N	24.3	Very low	28.2	Very low	116 Å²	116	148.9 Å²	148.9	62%	0.62	74%	0.736	S	S	*	*			trans	66.6	161.2	148.1	-75.3	36.6	0	0	0	118.8
1037	D	24.4	Very low	28.8	Very low	122 Å²	122	143 Å²	143	65%	0.652	73%	0.727	S	S	*	*			cis	-156.7	171.6	1	-125.8	-29.4	0	0	0	114.1
1038	L	28.1	Very low	29.4	Very low	127 Å²	127	138.5 Å²	138.5	67%	0.665	73%	0.725	S	S	*	*			trans	68.5	135.4	154.1	-95.3	70.1	0	0	0	124.7
1039	E	25.1	Very low	30.1	Very low	168 Å²	168	134.4 Å²	134.4	79%	0.785	73%	0.726	S	S	*	*			trans	55	124.3	146.1	-64.6	171.9	165.7	0	0	122.2
1040	H	25.5	Very low	30.8	Very low	180 Å²	180	131.2 Å²	131.2	83%	0.833	72%	0.724	S	S	*	*				86.5	151.3	51.9	-101.3	37.9	0	0	0	115.8
1041	P	42.5	Very low	31.5	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	72%	0.724	S	S	*	*			cis	-110.2	-145.3	-0.6	44.2	-33.1	0	0	0	111.4
1042	S	25.7	Very low	31.4	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	73%	0.732	S	S	*	*			cis	-164	151.5	-1.2	44.4	0	0	0	0	111.8
1043	S	30.5	Very low	31.9	Very low	106 Å²	106	129.5 Å²	129.5	74%	0.741	74%	0.738	S	S	*	*			trans	48.9	131.6	148.7	67	0	0	0	0	121
1044	Q	29.8	Very low	32.7	Very low	166 Å²	166	129.7 Å²	129.7	78%	0.776	75%	0.746	S	S	*	*			cis	-147.9	153	31.3	-69.6	-179.9	-69.3	0	0	114
1045	D	30.4	Very low	32.8	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	75%	0.753	S	S	*	*			trans	37.8	139.5	140	-46.9	-28.8	0	0	0	123.1
1046	L	34.1	Very low	33.5	Very low	151 Å²	151	133.1 Å²	133.1	79%	0.791	76%	0.759	S	S	*	*			cis	-166.6	176	-20.6	-111.3	166.9	0	0	0	107
1047	P	38.9	Very low	33.8	Very low	105 Å²	105	136.3 Å²	136.3	68%	0.682	77%	0.77	S	S	*	*				-121.7	167.8	-121.7	41.9	-27.5	0	0	0	118.5
1048	P	38.6	Very low	34.7	Very low	114 Å²	114	135.9 Å²	135.9	74%	0.74	77%	0.773	S	S	*	*			trans	-97	169.4	172.7	39	-35.8	0	0	0	114.7
1049	P	39.4	Very low	34.8	Very low	125 Å²	125	138 Å²	138	81%	0.812	78%	0.78	S	S	*	*			trans	-85.8	146.4	-178.6	33.1	-35.7	0	0	0	115.6
1050	P	40.9	Very low	34.8	Very low	121 Å²	121	136.6 Å²	136.6	79%	0.786	78%	0.783	S	S	*	*			trans	-104.2	171.5	-177.3	39.6	-36.3	0	0	0	116.4
1051	P	40.2	Very low	34.8	Very low	122 Å²	122	135.5 Å²	135.5	79%	0.792	78%	0.782	S	S	*	*			trans	-102.8	174.7	-171.3	40.6	-36.8	0	0	0	116.1
1052	P	39.3	Very low	34.6	Very low	125 Å²	125	135.1 Å²	135.1	81%	0.812	78%	0.78	S	S	*	*			trans	-109.4	137.1	-169.5	38.3	-31.8	0	0	0	117.6
1053	S	35.8	Very low	34.7	Very low	120 Å²	120	137.7 Å²	137.7	84%	0.839	79%	0.785	S	S	*	*			trans	173.1	170.8	151.6	54.4	0	0	0	0	109.1
1054	P	40.6	Very low	34.5	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	79%	0.785	S	S	*	*			cis	-123.4	-155.1	-4	42.1	-25.5	0	0	0	113.2
1055	R	29.7	Very low	34.2	Very low	244 Å²	244	138.7 Å²	138.7	92%	0.921	78%	0.782	S	S	*	*			trans	-137.6	149.1	175.6	-78.6	-173.2	175.9	-174.9	-1	113.4
1056	P	39	Very low	34	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	78%	0.782	S	S	*	*			trans	-133.7	-179.9	145.1	31.9	-13.9	0	0	0	114.7
1057	H	30.7	Very low	33.6	Very low	183 Å²	183	140.5 Å²	140.5	85%	0.847	78%	0.779	S	S	*	*			trans	-83.9	179.3	178.6	-69.6	-72.4	0	0	0	112.4
1058	P	43.5	Very low	33.3	Very low	112 Å²	112	143.5 Å²	143.5	73%	0.727	79%	0.786	S	S	*	*			cis	-148.8	-157.3	26.5	45	-21	0	0	0	118.9
1059	H	29.9	Very low	33	Very low	173 Å²	173	143.8 Å²	143.8	80%	0.801	79%	0.788	S	S	*	*			trans	-30.4	154.3	-178.3	-48.3	-76.3	0	0	0	119.4
1060	T	25.6	Very low	32.4	Very low	138 Å²	138	144.8 Å²	144.8	85%	0.847	79%	0.785	S	S	*	*				-173.9	171	70.7	-53.5	0	0	0	0	112.9
1061	L	27	Very low	31.9	Very low	157 Å²	157	145 Å²	145	82%	0.822	78%	0.784	S	S	*	*			trans	-70	175.6	170.6	-80.5	166.9	0	0	0	113.5
1062	P	38.1	Very low	31.2	Very low	103 Å²	103	145.1 Å²	145.1	67%	0.669	78%	0.782	S	S	*	*			cis	-150.9	-177.2	26.9	46.1	-25	0	0	0	120.6
1063	L	26	Very low	30.7	Very low	146 Å²	146	145.3 Å²	145.3	76%	0.764	78%	0.782	S	S	*	*			trans	53.8	132	141.5	-80.4	164.7	0	0	0	125.2
1064	L	26.6	Very low	30.4	Very low	141 Å²	141	144.4 Å²	144.4	74%	0.738	78%	0.775	S	S	*	*			trans	57.4	164.2	143.5	-111.1	63.6	0	0	0	118.9
1065	E	23.7	Very low	29.9	Very low	152 Å²	152	146.2 Å²	146.2	71%	0.71	78%	0.778	S	S	*	*			cis	-148.6	142.7	-5.3	-169.4	158.8	-170.8	0	0	112.6
1066	K	27.5	Very low	29.9	Very low	161 Å²	161	138.5 Å²	138.5	70%	0.7	78%	0.775	S	S	*	*			trans	11	154.4	144.7	-136.9	177.1	175.5	-168.5	0	123.3
1067	H	24.4	Very low	29.3	Very low	159 Å²	159	144.2 Å²	144.2	74%	0.736	78%	0.78	S	S	*	*			trans	94.3	156.4	157.4	-76.5	-70.3	0	0	0	121.9
1068	M	33.4	Very low	29.3	Very low	167 Å²	167	139.6 Å²	139.6	82%	0.823	77%	0.768	S	S	*	*			trans	-97.8	163.6	-170.8	-59.6	168.4	166.7	0	0	112.8
1069	P	32.2	Very low	28.6	Very low	120 Å²	120	140.7 Å²	140.7	78%	0.779	77%	0.768	S	S	*	*				-127.4	156	120.7	36.8	-29.6	0	0	0	110.9
1070	I	26.2	Very low	28.6	Very low	147 Å²	147	139.9 Å²	139.9	75%	0.754	77%	0.769	S	S	*	*			cis	73.2	82.9	35.8	-52.7	-175.7	0	0	0	114.3
1071	V	31.2	Very low	28.8	Very low	126 Å²	126	140 Å²	140	76%	0.764	77%	0.769	S	S	*	*			trans	26.1	118.5	137.8	-171.6	0	0	0	0	119
1072	T	26.1	Very low	28.8	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	77%	0.773	S	S	*	*				-171.6	142	119.5	16.9	0	0	0	0	114
1073	T	28.1	Very low	28.5	Very low	130 Å²	130	139.6 Å²	139.6	80%	0.798	78%	0.78	S	S	*	*			trans	16.8	146.6	145.8	64.8	0	0	0	0	121.2
1074	S	29	Very low	28.7	Very low	100 Å²	100	142.1 Å²	142.1	70%	0.699	79%	0.788	S	S	*	*			cis	-167.2	150.2	35	55.1	0	0	0	0	116.6
1075	N	29.9	Very low	29.1	Very low	163 Å²	163	142 Å²	142	87%	0.872	79%	0.793	S	S	*	*			trans	42.9	127.8	138.1	-58.2	-7.9	0	0	0	125.1
1076	G	30	Very low	29.5	Very low	82 Å²	82	138.2 Å²	138.2	85%	0.845	80%	0.795	S	S	*	*			trans	116.6	138	145.9	0	0	0	0	0	115.7
1077	R	27.1	Very low	30	Very low	245 Å²	245	138.4 Å²	138.4	93%	0.925	80%	0.798	S	S	*	*			cis	-151.9	171.1	-5.8	-171.6	168.7	176.5	163.7	-0.4	109.6
1078	S	30	Very low	31.1	Very low	86 Å²	86	136.5 Å²	136.5	60%	0.601	79%	0.794	S	S	*	*			trans	-60.7	162.5	-175.5	59.2	0	0	0	0	114.9
1079	D	28.5	Very low	31.9	Very low	136 Å²	136	133 Å²	133	73%	0.727	78%	0.783	S	S	*	*				-153.9	146.9	64.6	-76.2	-28.9	0	0	0	117.6
1080	L	30.7	Very low	32.9	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	78%	0.775	S	S	*	*			trans	31.4	117.5	145.2	-62.4	165.2	0	0	0	121.6
1081	T	28.5	Very low	34.6	Very low	140 Å²	140	130.1 Å²	130.1	86%	0.859	77%	0.765	S	S	*	*				-174.4	149.4	100.3	22.9	0	0	0	0	115.3
1082	L	28.7	Very low	35.9	Very low	174 Å²	174	129.9 Å²	129.9	91%	0.911	76%	0.756	S	S	*	*			trans	49	70.6	151.6	-133.3	73.9	0	0	0	122.1
1083	G	29.9	Very low	37.9	Very low	79 Å²	79	130 Å²	130	81%	0.814	75%	0.748	S	S	*	*			trans	33.1	118.4	134.3	0	0	0	0	0	123.3
1084	Q	30.2	Very low	39.6	Very low	198 Å²	198	128.5 Å²	128.5	93%	0.925	74%	0.735	S	S	*	*			trans	-141.7	156.1	143.7	-136.7	171.8	5	0	0	110.8
1085	V	35.1	Very low	41.4	Very low	139 Å²	139	126.9 Å²	126.9	84%	0.842	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-76.9	130.2	-173.8	178.1	0	0	0	0	110.7
1086	G	32.9	Very low	43.7	Very low	73 Å²	73	125 Å²	125	75%	0.753	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-65.9	140	-174.1	0	0	0	0	0	114.4
1087	Q	38.7	Very low	45.6	Very low	164 Å²	164	125.4 Å²	125.4	77%	0.766	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-102.1	149.4	164.4	-63.7	-173.9	0.3	0	0	109.5
1088	N	47.6	Very low	48.1	Very low	120 Å²	120	120.3 Å²	120.3	64%	0.642	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-71.4	124.6	179	-72.5	-23.1	0	0	0	110.2	L1090 V1091	N1088-L1090 PolarHBondContact O-N 3.36Å; N1088-V1091 HydrophobicContact CB-CG2 4.07Å; N1088-V1091 WeakPolarHBondContact O-CB 3.42Å; N1088-V1091 PolarHBondContact O-N 3.18Å
1089	P	49.3	Very low	50.3	Low	94 Å²	94	118 Å²	118	61%	0.61	67%	0.668	S	S	*	*	H	α-helix	trans	-60	-34.4	-175.4	22.4	-33.2	0	0	0	112.9	V1091 Q1092 E1093	P1089-V1091 PolarHBondContact O-N 3.43Å; P1089-Q1092 WeakPolarHBondContact O-CA 3.35Å; P1089-Q1092 WeakPolarHBondContact O-CB 3.32Å; P1089-Q1092 PolarHBondContact O-N 3.42Å; P1089-E1093 PolarHBondContact O-N 2.88Å
1090	L	53	Low	52.5	Low	115 Å²	115	116.8 Å²	116.8	60%	0.602	66%	0.657	S	S	*	*	H	α-helix	trans	-62.3	-22.6	177.8	-168.4	142.2	0	0	0	113.7	N1088 L1094	N1088-L1090 PolarHBondContact O-N 3.36Å; L1090-L1094 HydrophobicContact CD2-CD1 3.9Å; L1090-L1094 WeakPolarHBondContact O-CB 3.38Å; L1090-L1094 WeakPolarHBondContact O-CD1 3.3Å; L1090-L1094 VanDerWaalsContact O-CG 3.31Å; L1090-L1094 WeakPolarHBondContact O-CG 3.49Å; L1090-L1094 PolarHBondContact O-N 2.94Å
1091	V	62.2	Low	54.9	Low	90 Å²	90	114.4 Å²	114.4	55%	0.545	65%	0.645	S	S	.	*	H	α-helix	trans	-77.4	-34.1	172.3	179.3	0	0	0	0	110.9	N1088 P1089 S1095	N1088-V1091 HydrophobicContact CB-CG2 4.07Å; N1088-V1091 WeakPolarHBondContact O-CB 3.42Å; N1088-V1091 PolarHBondContact O-N 3.18Å; P1089-V1091 PolarHBondContact O-N 3.43Å; V1091-S1095 PolarHBondContact O-N 3.04Å
1092	Q	57.6	Low	57.2	Low	122 Å²	122	111.7 Å²	111.7	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-71.9	-45.4	178.2	-167.7	165.1	-15.6	0	0	110.8	P1089 L1094 S1095 E1096	P1089-Q1092 WeakPolarHBondContact O-CA 3.35Å; P1089-Q1092 WeakPolarHBondContact O-CB 3.32Å; P1089-Q1092 PolarHBondContact O-N 3.42Å; Q1092-L1094 VanDerWaalsContact C-N 3.33Å; Q1092-L1094 PolarHBondContact O-N 3.21Å; Q1092-S1095 PolarHBondContact O-N 3.35Å; Q1092-S1095 VanDerWaalsContact O-N 3.11Å; Q1092-S1095 PolarHBondContact O-OG 3.03Å; Q1092-E1096 PolarHBondContact O-N 3.11Å
1093	E	69.1	Low	59.6	Low	124 Å²	124	105.8 Å²	105.8	58%	0.579	60%	0.604	S	S	*	*	H	α-helix	trans	-57.1	-43	172.3	-68.2	179.4	150.5	0	0	112.2	P1089 E1096 L1097	P1089-E1093 PolarHBondContact O-N 2.88Å; E1093-E1096 PolarHBondContact O-N 2.7Å; E1093-L1097 WeakPolarHBondContact O-CB 3.47Å; E1093-L1097 PolarHBondContact O-N 3.43Å
1094	L	63.5	Low	62	Low	100 Å²	100	107.1 Å²	107.1	52%	0.524	59%	0.592	S	S	.	*	H	α-helix	trans	-62.3	-41.6	174.5	-81.7	169.8	0	0	0	112.4	L1090 Q1092 E1096 L1097 E1098	L1090-L1094 HydrophobicContact CD2-CD1 3.9Å; L1090-L1094 WeakPolarHBondContact O-CB 3.38Å; L1090-L1094 WeakPolarHBondContact O-CD1 3.3Å; L1090-L1094 VanDerWaalsContact O-CG 3.31Å; L1090-L1094 WeakPolarHBondContact O-CG 3.49Å; L1090-L1094 PolarHBondContact O-N 2.94Å; Q1092-L1094 VanDerWaalsContact C-N 3.33Å; Q1092-L1094 PolarHBondContact O-N 3.21Å; L1094-E1096 VanDerWaalsContact C-N 3.32Å; L1094-E1096 PolarHBondContact O-N 3.34Å; L1094-L1097 PolarHBondContact O-N 3.5Å; L1094-E1098 PolarHBondContact O-N 2.87Å
1095	S	68.1	Low	64.2	Low	66 Å²	66	104.2 Å²	104.2	46%	0.462	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-32.4	177.5	73.3	0	0	0	0	113	V1091 Q1092 G1099	V1091-S1095 PolarHBondContact O-N 3.04Å; Q1092-S1095 PolarHBondContact O-N 3.35Å; Q1092-S1095 VanDerWaalsContact O-N 3.11Å; Q1092-S1095 PolarHBondContact O-OG 3.03Å; S1095-G1099 PolarHBondContact O-N 3.3Å
1096	E	76.3	Confident	66.5	Low	124 Å²	124	103.1 Å²	103.1	58%	0.579	57%	0.565	S	S	*	*	H	α-helix	trans	-74.1	-37.2	176.5	-167.8	160.5	-153.2	0	0	111.2	Q1092 E1093 L1094 G1099 Q1100	Q1092-E1096 PolarHBondContact O-N 3.11Å; E1093-E1096 PolarHBondContact O-N 2.7Å; L1094-E1096 VanDerWaalsContact C-N 3.32Å; L1094-E1096 PolarHBondContact O-N 3.34Å; E1096-G1099 WeakPolarHBondContact O-CA 3.33Å; E1096-G1099 PolarHBondContact O-N 3.1Å; E1096-Q1100 WeakPolarHBondContact O-CG 3.3Å; E1096-Q1100 PolarHBondContact O-N 3.11Å
1097	L	70.9	Confident	68.7	Low	89 Å²	89	106.1 Å²	106.1	47%	0.466	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-43.3	169.1	-87.4	161.3	0	0	0	112.7	E1093 L1094 G1099 Q1100 I1101	E1093-L1097 WeakPolarHBondContact O-CB 3.47Å; E1093-L1097 PolarHBondContact O-N 3.43Å; L1094-L1097 PolarHBondContact O-N 3.5Å; L1097-G1099 VanDerWaalsContact C-N 3.27Å; L1097-G1099 PolarHBondContact O-N 2.87Å; L1097-Q1100 PolarHBondContact O-N 2.92Å; L1097-I1101 WeakPolarHBondContact O-CB 3.13Å; L1097-I1101 VanDerWaalsContact O-CG1 3.27Å; L1097-I1101 WeakPolarHBondContact O-CG1 3.39Å; L1097-I1101 PolarHBondContact O-N 3.33Å
1098	E	79.1	Confident	70.5	Confident	139 Å²	139	103.7 Å²	103.7	65%	0.65	55%	0.551	S	S	*	*	H	α-helix	trans	-61.2	-37.1	171.9	-74.5	-167.1	137.1	0	0	111.6	L1094 T1102	L1094-E1098 PolarHBondContact O-N 2.87Å; E1098-T1102 WeakPolarHBondContact O-CB 3.39Å; E1098-T1102 WeakPolarHBondContact O-CG2 3.39Å; E1098-T1102 PolarHBondContact O-N 2.89Å; E1098-T1102 PolarHBondContact O-OG1 3.36Å
1099	G	77.1	Confident	72	Confident	37 Å²	37	103.3 Å²	103.3	38%	0.381	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-46.4	171.6	0	0	0	0	0	113.2	S1095 E1096 L1097 T1102 A1103	S1095-G1099 PolarHBondContact O-N 3.3Å; E1096-G1099 WeakPolarHBondContact O-CA 3.33Å; E1096-G1099 PolarHBondContact O-N 3.1Å; L1097-G1099 VanDerWaalsContact C-N 3.27Å; L1097-G1099 PolarHBondContact O-N 2.87Å; G1099-T1102 PolarHBondContact O-N 3.43Å; G1099-T1102 PolarHBondContact O-OG1 3.49Å; G1099-A1103 WeakPolarHBondContact O-CB 3.27Å; G1099-A1103 PolarHBondContact O-N 2.92Å
1100	Q	73.3	Confident	73.5	Confident	110 Å²	110	102.2 Å²	102.2	51%	0.514	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-43.6	177	-69.2	179.1	24.7	0	0	112	E1096 L1097 T1102 A1103 I1104	E1096-Q1100 WeakPolarHBondContact O-CG 3.3Å; E1096-Q1100 PolarHBondContact O-N 3.11Å; L1097-Q1100 PolarHBondContact O-N 2.92Å; Q1100-T1102 PolarHBondContact O-N 3.37Å; Q1100-A1103 PolarHBondContact O-N 3.04Å; Q1100-I1104 VanDerWaalsContact O-CG1 3.29Å; Q1100-I1104 WeakPolarHBondContact O-CG1 3.11Å; Q1100-I1104 PolarHBondContact O-N 3.4Å
1101	I	81.2	Confident	74.6	Confident	106 Å²	106	99.5 Å²	99.5	54%	0.544	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-41.6	177.5	-69.2	165	0	0	0	111.1	L1097 I1104 K1105	L1097-I1101 WeakPolarHBondContact O-CB 3.13Å; L1097-I1101 VanDerWaalsContact O-CG1 3.27Å; L1097-I1101 WeakPolarHBondContact O-CG1 3.39Å; L1097-I1101 PolarHBondContact O-N 3.33Å; I1101-I1104 PolarHBondContact O-N 3.23Å; I1101-K1105 WeakPolarHBondContact O-CB 3.33Å; I1101-K1105 PolarHBondContact O-N 3.2Å
1102	T	76.8	Confident	75.4	Confident	82 Å²	82	99.7 Å²	99.7	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-69.4	-36.6	176.8	50.1	0	0	0	0	112.6	E1098 G1099 Q1100 K1105 L1106	E1098-T1102 WeakPolarHBondContact O-CB 3.39Å; E1098-T1102 WeakPolarHBondContact O-CG2 3.39Å; E1098-T1102 PolarHBondContact O-N 2.89Å; E1098-T1102 PolarHBondContact O-OG1 3.36Å; G1099-T1102 PolarHBondContact O-N 3.43Å; G1099-T1102 PolarHBondContact O-OG1 3.49Å; Q1100-T1102 PolarHBondContact O-N 3.37Å; T1102-K1105 PolarHBondContact O-N 3.42Å; T1102-L1106 PolarHBondContact O-N 2.93Å
1103	A	79.5	Confident	76.5	Confident	51 Å²	51	101.7 Å²	101.7	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-45.5	172.3	0	0	0	0	0	112.6	G1099 Q1100 K1105 L1106 Q1107	G1099-A1103 WeakPolarHBondContact O-CB 3.27Å; G1099-A1103 PolarHBondContact O-N 2.92Å; Q1100-A1103 PolarHBondContact O-N 3.04Å; A1103-K1105 VanDerWaalsContact C-N 3.33Å; A1103-K1105 PolarHBondContact O-N 3.38Å; A1103-L1106 WeakPolarHBondContact O-CB 3.16Å; A1103-L1106 PolarHBondContact O-N 2.98Å; A1103-Q1107 PolarHBondContact O-N 2.82Å
1104	I	80.6	Confident	76.9	Confident	107 Å²	107	104.4 Å²	104.4	55%	0.549	54%	0.537	S	S	.	.	H	α-helix	trans	-61.6	-41.6	175.5	-68.9	164.8	0	0	0	110.5	Q1100 I1101 L1106 Q1107 L1108	Q1100-I1104 VanDerWaalsContact O-CG1 3.29Å; Q1100-I1104 WeakPolarHBondContact O-CG1 3.11Å; Q1100-I1104 PolarHBondContact O-N 3.4Å; I1101-I1104 PolarHBondContact O-N 3.23Å; I1104-L1106 VanDerWaalsContact C-N 3.32Å; I1104-L1106 PolarHBondContact O-N 2.96Å; I1104-Q1107 PolarHBondContact O-N 3.26Å; I1104-L1108 WeakPolarHBondContact O-CB 3.13Å; I1104-L1108 PolarHBondContact O-N 2.87Å
1105	K	75.6	Confident	77.9	Confident	136 Å²	136	105.2 Å²	105.2	59%	0.591	54%	0.537	S	S	*	.	H	α-helix	trans	-62.6	-37.1	176.5	-167	172.3	-174.6	174.5	0	112.3	I1101 T1102 A1103 Q1109	I1101-K1105 WeakPolarHBondContact O-CB 3.33Å; I1101-K1105 PolarHBondContact O-N 3.2Å; T1102-K1105 PolarHBondContact O-N 3.42Å; A1103-K1105 VanDerWaalsContact C-N 3.33Å; A1103-K1105 PolarHBondContact O-N 3.38Å; K1105-Q1109 WeakPolarHBondContact O-CG 3.4Å; K1105-Q1109 PolarHBondContact O-N 3.44Å
1106	L	83.9	Confident	78.3	Confident	117 Å²	117	109.4 Å²	109.4	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-67.3	-42.4	172.9	-94.7	160.7	0	0	0	112.6	T1102 A1103 I1104 Q1109 S1110	T1102-L1106 PolarHBondContact O-N 2.93Å; A1103-L1106 WeakPolarHBondContact O-CB 3.16Å; A1103-L1106 PolarHBondContact O-N 2.98Å; I1104-L1106 VanDerWaalsContact C-N 3.32Å; I1104-L1106 PolarHBondContact O-N 2.96Å; L1106-Q1109 PolarHBondContact O-N 2.87Å; L1106-S1110 PolarHBondContact O-N 3.45Å
1107	Q	79.4	Confident	78.6	Confident	135 Å²	135	108.3 Å²	108.3	63%	0.631	54%	0.537	S	S	*	.	H	α-helix	trans	-63.7	-41.5	173.9	-71.8	-175	-9.1	0	0	112	A1103 I1104 Q1109 S1110 A1111	A1103-Q1107 PolarHBondContact O-N 2.82Å; I1104-Q1107 PolarHBondContact O-N 3.26Å; Q1107-Q1109 VanDerWaalsContact C-N 3.33Å; Q1107-Q1109 PolarHBondContact O-N 3.5Å; Q1107-S1110 PolarHBondContact O-N 3.27Å; Q1107-S1110 PolarHBondContact O-OG 3.3Å; Q1107-A1111 WeakPolarHBondContact O-CB 3.32Å; Q1107-A1111 PolarHBondContact O-N 2.94Å
1108	L	77.1	Confident	78.8	Confident	114 Å²	114	109.5 Å²	109.5	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-63.6	-39.7	176	-170.5	67.1	0	0	0	111.5	I1104 A1111 M1112	I1104-L1108 WeakPolarHBondContact O-CB 3.13Å; I1104-L1108 PolarHBondContact O-N 2.87Å; L1108-A1111 PolarHBondContact O-N 3.47Å; L1108-M1112 WeakPolarHBondContact O-CB 3.24Å; L1108-M1112 VanDerWaalsContact O-CG 3.23Å; L1108-M1112 WeakPolarHBondContact O-CG 3.48Å; L1108-M1112 PolarHBondContact O-N 2.86Å
1109	Q	78.4	Confident	78.5	Confident	111 Å²	111	106.8 Å²	106.8	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-35.4	174.4	-78.1	-175.2	-9.7	0	0	113.3	K1105 L1106 Q1107 R1113	K1105-Q1109 WeakPolarHBondContact O-CG 3.4Å; K1105-Q1109 PolarHBondContact O-N 3.44Å; L1106-Q1109 PolarHBondContact O-N 2.87Å; Q1107-Q1109 VanDerWaalsContact C-N 3.33Å; Q1107-Q1109 PolarHBondContact O-N 3.5Å; Q1109-R1113 WeakPolarHBondContact O-CB 3.48Å; Q1109-R1113 PolarHBondContact O-N 3.5Å
1110	S	81.5	Confident	78.1	Confident	72 Å²	72	112.4 Å²	112.4	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-72.2	-40.4	175.7	75.4	0	0	0	0	111.7	L1106 Q1107 R1113 R1114	L1106-S1110 PolarHBondContact O-N 3.45Å; Q1107-S1110 PolarHBondContact O-N 3.27Å; Q1107-S1110 PolarHBondContact O-OG 3.3Å; S1110-R1113 PolarHBondContact O-N 2.98Å; S1110-R1114 WeakPolarHBondContact O-CB 3.37Å; S1110-R1114 PolarHBondContact O-N 2.86Å
1111	A	75.3	Confident	78	Confident	57 Å²	57	114.6 Å²	114.6	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-61.2	-45	172.8	0	0	0	0	0	112.1	Q1107 L1108 R1113 R1114 K1115	Q1107-A1111 WeakPolarHBondContact O-CB 3.32Å; Q1107-A1111 PolarHBondContact O-N 2.94Å; L1108-A1111 PolarHBondContact O-N 3.47Å; A1111-R1113 VanDerWaalsContact C-N 3.3Å; A1111-R1113 PolarHBondContact O-N 3.41Å; A1111-R1114 PolarHBondContact O-N 3.2Å; A1111-K1115 PolarHBondContact O-N 3.24Å
1112	M	79.6	Confident	77.1	Confident	95 Å²	95	116 Å²	116	47%	0.468	55%	0.549	S	S	.	.	H	α-helix	trans	-62.4	-34.5	174.9	-77.2	-75	-80	0	0	112.9	L1108 R1116	L1108-M1112 WeakPolarHBondContact O-CB 3.24Å; L1108-M1112 VanDerWaalsContact O-CG 3.23Å; L1108-M1112 WeakPolarHBondContact O-CG 3.48Å; L1108-M1112 PolarHBondContact O-N 2.86Å; M1112-R1116 WeakPolarHBondContact O-CG 3.42Å; M1112-R1116 PolarHBondContact O-N 3.46Å
1113	R	79.8	Confident	76.4	Confident	163 Å²	163	115.5 Å²	115.5	62%	0.615	55%	0.546	S	S	*	.	H	α-helix	trans	-68.2	-47.1	174.4	-162.8	-177	-59.5	-170.5	1.2	111	Q1109 S1110 A1111 K1115 R1116 E1117	Q1109-R1113 WeakPolarHBondContact O-CB 3.48Å; Q1109-R1113 PolarHBondContact O-N 3.5Å; S1110-R1113 PolarHBondContact O-N 2.98Å; A1111-R1113 VanDerWaalsContact C-N 3.3Å; A1111-R1113 PolarHBondContact O-N 3.41Å; R1113-K1115 VanDerWaalsContact C-N 3.32Å; R1113-K1115 PolarHBondContact O-N 2.8Å; R1113-R1116 PolarHBondContact O-N 2.86Å; R1113-R1116 VanDerWaalsContact O-N 3.11Å; R1113-E1117 WeakPolarHBondContact CG-OE1 3.23Å; R1113-E1117 WeakPolarHBondContact O-CG 3.35Å; R1113-E1117 PolarHBondContact O-N 3.23Å
1114	R	78.9	Confident	75.8	Confident	182 Å²	182	117.7 Å²	117.7	69%	0.687	55%	0.548	S	S	*	.	H	α-helix	trans	-64.4	-33.4	178.8	-153.1	173	-166.8	164.3	3.2	112.9	S1110 A1111 E1117 L1118	S1110-R1114 WeakPolarHBondContact O-CB 3.37Å; S1110-R1114 PolarHBondContact O-N 2.86Å; A1111-R1114 PolarHBondContact O-N 3.2Å; R1114-E1117 PolarHBondContact O-N 3.48Å; R1114-L1118 WeakPolarHBondContact O-CG 3.39Å; R1114-L1118 PolarHBondContact O-N 2.9Å; R1114-L1118 VanDerWaalsContact O-N 3.1Å
1115	K	83.5	Confident	74.6	Confident	117 Å²	117	116.2 Å²	116.2	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-50.1	169.4	174.9	172.2	167.9	173.5	0	111.2	A1111 R1113 E1117 L1118 E1119	A1111-K1115 PolarHBondContact O-N 3.24Å; R1113-K1115 VanDerWaalsContact C-N 3.32Å; R1113-K1115 PolarHBondContact O-N 2.8Å; K1115-E1117 VanDerWaalsContact C-N 3.28Å; K1115-E1117 PolarHBondContact O-N 2.76Å; K1115-L1118 PolarHBondContact O-N 2.85Å; K1115-L1118 VanDerWaalsContact O-N 3.14Å; K1115-E1119 VanDerWaalsContact CE-CD 3.49Å; K1115-E1119 WeakPolarHBondContact CE-OE1 3.42Å; K1115-E1119 HydrophobicContact CG-CG 4.3Å; K1115-E1119 IonicContact NZ-OE1 2.75Å; K1115-E1119 WeakPolarHBondContact O-CG 3.48Å; K1115-E1119 PolarHBondContact O-N 2.9Å
1116	R	77.1	Confident	73.5	Confident	153 Å²	153	116.3 Å²	116.3	58%	0.577	54%	0.544	S	S	*	.	H	α-helix	trans	-63.8	-31.5	178.4	-68.7	172.4	-175.9	176.1	0.9	113.4	M1112 R1113 E1119 R1120	M1112-R1116 WeakPolarHBondContact O-CG 3.42Å; M1112-R1116 PolarHBondContact O-N 3.46Å; R1113-R1116 PolarHBondContact O-N 2.86Å; R1113-R1116 VanDerWaalsContact O-N 3.11Å; R1116-E1119 WeakPolarHBondContact CA-OE2 3.18Å; R1116-R1120 WeakPolarHBondContact O-CB 3.5Å; R1116-R1120 PolarHBondContact O-N 2.94Å; R1116-R1120 VanDerWaalsContact O-N 3.08Å
1117	E	82.3	Confident	71.9	Confident	102 Å²	102	118 Å²	118	48%	0.477	55%	0.548	S	S	.	.	H	α-helix	trans	-66.1	-44.2	172.9	-72.1	158.8	-172.5	0	0	110.9	R1113 R1114 K1115 R1120 Y1121	R1113-E1117 WeakPolarHBondContact CG-OE1 3.23Å; R1113-E1117 WeakPolarHBondContact O-CG 3.35Å; R1113-E1117 PolarHBondContact O-N 3.23Å; R1114-E1117 PolarHBondContact O-N 3.48Å; K1115-E1117 VanDerWaalsContact C-N 3.28Å; K1115-E1117 PolarHBondContact O-N 2.76Å; E1117-R1120 PolarHBondContact O-N 2.91Å; E1117-Y1121 PolarHBondContact O-N 3.48Å
1118	L	74.5	Confident	70.6	Confident	113 Å²	113	116.4 Å²	116.4	59%	0.592	55%	0.548	S	S	*	.	H	α-helix	trans	-66.8	-42	174.8	-71.2	166.3	0	0	0	113	R1114 K1115 R1120 Y1121 Q1122	R1114-L1118 WeakPolarHBondContact O-CG 3.39Å; R1114-L1118 PolarHBondContact O-N 2.9Å; R1114-L1118 VanDerWaalsContact O-N 3.1Å; K1115-L1118 PolarHBondContact O-N 2.85Å; K1115-L1118 VanDerWaalsContact O-N 3.14Å; L1118-R1120 VanDerWaalsContact C-N 3.28Å; L1118-R1120 PolarHBondContact O-N 2.91Å; L1118-Y1121 PolarHBondContact O-N 3.34Å; L1118-Q1122 WeakPolarHBondContact O-CG 3.34Å; L1118-Q1122 PolarHBondContact O-N 3.33Å
1119	E	73.1	Confident	68.7	Low	83 Å²	83	117.5 Å²	117.5	39%	0.388	55%	0.554	S	S	.	*	H	α-helix	trans	-60.1	-39.5	175.6	-72.2	169.2	146.7	0	0	111.3	K1115 R1116 Q1122 T1123	K1115-E1119 VanDerWaalsContact CE-CD 3.49Å; K1115-E1119 WeakPolarHBondContact CE-OE1 3.42Å; K1115-E1119 HydrophobicContact CG-CG 4.3Å; K1115-E1119 IonicContact NZ-OE1 2.75Å; K1115-E1119 WeakPolarHBondContact O-CG 3.48Å; K1115-E1119 PolarHBondContact O-N 2.9Å; R1116-E1119 WeakPolarHBondContact CA-OE2 3.18Å; E1119-Q1122 PolarHBondContact O-N 2.99Å; E1119-T1123 PolarHBondContact O-N 3.38Å; E1119-T1123 VanDerWaalsContact O-N 3.08Å; E1119-T1123 PolarHBondContact O-OG1 2.75Å
1120	R	69	Low	66.7	Low	155 Å²	155	123.3 Å²	123.3	59%	0.585	58%	0.582	S	S	*	*	H	α-helix	trans	-68.8	-41	174.8	-161.5	-177.2	-60.2	159.4	2.2	112.2	R1116 E1117 L1118 Q1122 T1123 E1124	R1116-R1120 WeakPolarHBondContact O-CB 3.5Å; R1116-R1120 PolarHBondContact O-N 2.94Å; R1116-R1120 VanDerWaalsContact O-N 3.08Å; E1117-R1120 PolarHBondContact O-N 2.91Å; L1118-R1120 VanDerWaalsContact C-N 3.28Å; L1118-R1120 PolarHBondContact O-N 2.91Å; R1120-Q1122 VanDerWaalsContact C-N 3.26Å; R1120-Q1122 PolarHBondContact O-N 3.48Å; R1120-T1123 WeakPolarHBondContact CA-OG1 3.5Å; R1120-T1123 PolarHBondContact O-N 3.49Å; R1120-T1123 PolarHBondContact O-OG1 3.42Å; R1120-T1123 VanDerWaalsContact O-OG1 3.09Å; R1120-E1124 WeakPolarHBondContact CG-OE1 3.18Å; R1120-E1124 WeakPolarHBondContact O-CB 3.45Å; R1120-E1124 WeakPolarHBondContact O-CG 3.32Å; R1120-E1124 PolarHBondContact O-N 3.01Å
1121	Y	71.4	Confident	66	Low	156 Å²	156	125.9 Å²	125.9	61%	0.612	59%	0.586	S	S	*	*	H	α-helix	trans	-63.8	-32.1	174.8	-143.4	-101.7	0	0	0	112.1	E1117 L1118 N1125	E1117-Y1121 PolarHBondContact O-N 3.48Å; L1118-Y1121 PolarHBondContact O-N 3.34Å; Y1121-N1125 VanDerWaalsContact CD1-ND2 3.33Å; Y1121-N1125 WeakPolarHBondContact CD1-ND2 3.16Å; Y1121-N1125 WeakPolarHBondContact O-CB 3.37Å; Y1121-N1125 PolarHBondContact O-N 3.44Å; Y1121-N1125 VanDerWaalsContact O-N 3.11Å; Y1121-N1125 PolarHBondContact O-ND2 2.89Å
1122	Q	61.1	Low	65.5	Low	134 Å²	134	129.5 Å²	129.5	63%	0.626	59%	0.592	S	S	*	*	H	α-helix	trans	-71.8	-41.3	173.9	-76	-176.6	-43.5	0	0	112.5	L1118 E1119 R1120 N1125 Q1126	L1118-Q1122 WeakPolarHBondContact O-CG 3.34Å; L1118-Q1122 PolarHBondContact O-N 3.33Å; E1119-Q1122 PolarHBondContact O-N 2.99Å; R1120-Q1122 VanDerWaalsContact C-N 3.26Å; R1120-Q1122 PolarHBondContact O-N 3.48Å; Q1122-N1125 PolarHBondContact O-N 3.38Å; Q1122-Q1126 WeakPolarHBondContact O-CG 3.2Å; Q1122-Q1126 PolarHBondContact O-N 3.43Å
1123	T	62.7	Low	64.7	Low	72 Å²	72	131.4 Å²	131.4	44%	0.442	60%	0.599	S	S	.	*	H	α-helix	trans	-70.3	-37.4	176.5	44.2	0	0	0	0	112.7	E1119 R1120 N1125 Q1126 Q1127	E1119-T1123 PolarHBondContact O-N 3.38Å; E1119-T1123 VanDerWaalsContact O-N 3.08Å; E1119-T1123 PolarHBondContact O-OG1 2.75Å; R1120-T1123 WeakPolarHBondContact CA-OG1 3.5Å; R1120-T1123 PolarHBondContact O-N 3.49Å; R1120-T1123 PolarHBondContact O-OG1 3.42Å; R1120-T1123 VanDerWaalsContact O-OG1 3.09Å; T1123-N1125 VanDerWaalsContact C-N 3.34Å; T1123-N1125 PolarHBondContact O-N 3.35Å; T1123-Q1126 PolarHBondContact O-N 3.41Å; T1123-Q1127 PolarHBondContact O-N 3.1Å
1124	E	66.9	Low	63.9	Low	98 Å²	98	129.6 Å²	129.6	46%	0.458	60%	0.598	S	S	.	*	H	α-helix	trans	-61.7	-39.5	171.6	-72.6	168	-170.7	0	0	111.7	R1120 T1128	R1120-E1124 WeakPolarHBondContact CG-OE1 3.18Å; R1120-E1124 WeakPolarHBondContact O-CB 3.45Å; R1120-E1124 WeakPolarHBondContact O-CG 3.32Å; R1120-E1124 PolarHBondContact O-N 3.01Å; E1124-T1128 PolarHBondContact O-N 3.26Å; E1124-T1128 PolarHBondContact O-OG1 3.38Å
1125	N	55.5	Low	62.9	Low	76 Å²	76	126.3 Å²	126.3	41%	0.406	59%	0.592	S	S	.	*	H	α-helix	trans	-72.9	-24.9	173.8	-80.8	-62.1	0	0	0	114	Y1121 Q1122 T1123 T1128 N1129	Y1121-N1125 VanDerWaalsContact CD1-ND2 3.33Å; Y1121-N1125 WeakPolarHBondContact CD1-ND2 3.16Å; Y1121-N1125 WeakPolarHBondContact O-CB 3.37Å; Y1121-N1125 PolarHBondContact O-N 3.44Å; Y1121-N1125 VanDerWaalsContact O-N 3.11Å; Y1121-N1125 PolarHBondContact O-ND2 2.89Å; Q1122-N1125 PolarHBondContact O-N 3.38Å; T1123-N1125 VanDerWaalsContact C-N 3.34Å; T1123-N1125 PolarHBondContact O-N 3.35Å; N1125-T1128 WeakPolarHBondContact CA-OG1 3.29Å; N1125-T1128 PolarHBondContact O-OG1 3.22Å; N1125-N1129 PolarHBondContact O-ND2 2.96Å
1126	Q	52	Low	61.5	Low	138 Å²	138	126.9 Å²	126.9	65%	0.645	60%	0.598	S	S	*	*	H	α-helix	trans	-75.6	-39.6	171.7	-78.9	-176.7	-39.9	0	0	111.9	Q1122 T1123 T1128 N1129	Q1122-Q1126 WeakPolarHBondContact O-CG 3.2Å; Q1122-Q1126 PolarHBondContact O-N 3.43Å; T1123-Q1126 PolarHBondContact O-N 3.41Å; Q1126-T1128 PolarHBondContact O-N 2.9Å; Q1126-N1129 PolarHBondContact O-N 3.14Å
1127	Q	51.6	Low	60.4	Low	152 Å²	152	125.1 Å²	125.1	71%	0.71	60%	0.599	S	S	*	*	H	α-helix	trans	-71.8	-10.9	176.8	-72.1	-173.3	-33	0	0	114.3	T1123	T1123-Q1127 PolarHBondContact O-N 3.1Å
1128	T	50.6	Low	58.7	Low	101 Å²	101	126.8 Å²	126.8	62%	0.62	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	3.5	174.3	45.1	0	0	0	0	113.5	E1124 N1125 Q1126	E1124-T1128 PolarHBondContact O-N 3.26Å; E1124-T1128 PolarHBondContact O-OG1 3.38Å; N1125-T1128 WeakPolarHBondContact CA-OG1 3.29Å; N1125-T1128 PolarHBondContact O-OG1 3.22Å; Q1126-T1128 PolarHBondContact O-N 2.9Å
1129	N	38.4	Very low	57.4	Low	137 Å²	137	128 Å²	128	73%	0.733	61%	0.61	S	S	*	*			trans	-119.2	22	172.1	-74.7	-81.5	0	0	0	112.3	N1125 Q1126	N1125-N1129 PolarHBondContact O-ND2 2.96Å; Q1126-N1129 PolarHBondContact O-N 3.14Å
1130	Q	37	Very low	56	Low	234 Å²	234	132.1 Å²	132.1	100%	1.093	63%	0.63	S	S	*	*			trans	-119.2	0	165	-71.3	-170.7	-19.6	0	0	109.4

Retrieved 1,130 of 1,130 residues in 344 ms (Link to these results)

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