A0A087YEG4_POEFO Loading...

Calmodulin binding transcription activator 2

AlphaFold DB , UniProt , Accession A0A087YEG4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,185 aa.

						>A0A087YEG4_POEFO|A0A087YEG4
SDPLPSVLSAENKGQRKVFVPNKLLDCLPRSACLPNERLRWNTNEEIASYLISFDRHDEWLCCSLKTRPKNGSIILYNRKKVKYRKDGYCWKKRKDGKTTREDHMKLKVQGMECLYGCYVHSSIVPTFHRRCYWLLQNPDIVLVHYLNVPSPEDSGRCSPLLCTVSERHDTLRWSRDDLLGQLKPMFHSIKCSMGSGDFSIEELVQHILDRQRTKPQPRTHACLCSTNQVSPGVNIPHRCNSTKHRIISPKLPPTSSGPAASPPSSEPGESGRGGGESKLSQLQPQSPASSPSPSSTRQKHCGNFSRSSEAFPAPPAALPGAGRAGGVRRGEGGVPTSHAPSSPSPRQHTDSGSAPLLLASQDRPGEPTQPTNQTPAPPEGQQPLVLPSSNQLPGPEAPPPAESSHQHLELLSSSAAVAMETASLATVQVKEERRRRYDSEDACMDSQEEAEPEELDISFDSQFPDLISDLITDEPGPTDAPPAPPSASGPAVFPTGVRYVVPPQPSPSSSFLPFPQPLPAAARLAAITDFSPEWSYPEGGVKVLITGPWSEPSGRYSCVFDQSAVPASLIQPGVLRCYCPAHEAGLVCLQVLESGGSVSSSVLFEYRARNASSLPSSQLDWLSLDDNQFRMSILERLEQMERRMAEMAARDGWSPGVKIAAVRRRGLGPGPKQLLLVLRGFPLKVLTQTGPGRLRHSAGHRGMTLLHLAAAQGYTHLIHTLIHWRAMSSDSLDLEQEVDPLNVDHFSCTPLMWACALGHQRAAELLYSWNGLALGIPDSLGRLPLAVARSRGHTRLAAALEELHTQRAQAATRDGPPPSPLSTSLDTGLSSSSSLPSPSDPSSPSPSSAYSSGPAPMDTSPSSPSSLSSSSLSISPSSPSFIQSTVPLASMWREEPNPTVGTGNPGNAASSPIPSQSSVTMTDLIWINLVQFGPVDMATLAEQIIEATPERIKQEDFPRGAESPLRERRDNPAIQDTWLATYLETVDSQSPPSALALQRLRPPSSAAWAEFLNASANGKMERDFALLTLTDGEQRELYEAARIIQNAFRRYKGRRLKEQQDMAAAVIQRCYRKYKQYALYKKMTQAAILIQSKFRSYYEQKRFQQSRRAAVLIQQYYRSYKEYERLKQAPRGGAALNPKSNRGSFLTKKQDQAARKIMRFLRRCRHRIKELKQSRELERRGLTT
					

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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	S	36.6	Very low	34.5	Very low	175 Å²	175	138.1 Å²	138.1	100%	1.224	84%	0.843	S	S	*	*				0	128.7	0	-42.9	0	0	0	0	108.3
2	D	38.5	Very low	34	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	84%	0.84	S	S	*	*			trans	-59.5	156.2	163.7	-84.3	-66	0	0	0	111
3	P	46.9	Very low	34	Very low	126 Å²	126	144.1 Å²	144.1	82%	0.818	84%	0.843	S	S	*	*			cis	-140.5	160	48.8	39.9	-21.1	0	0	0	120.5
4	L	29.4	Very low	34	Very low	145 Å²	145	137.6 Å²	137.6	76%	0.759	82%	0.822	S	S	*	*			trans	-57.1	176	158.9	-64.9	157.1	0	0	0	113.5
5	P	56.8	Low	34.3	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	81%	0.814	S	S	*	*			cis	-136.1	174.8	-47.2	38.7	-23.8	0	0	0	112.3
6	S	24.1	Very low	35.1	Very low	125 Å²	125	137.4 Å²	137.4	87%	0.874	79%	0.792	S	S	*	*			trans	-153.3	132.6	157.8	-74.2	0	0	0	0	112.6
7	V	28.8	Very low	35.7	Very low	133 Å²	133	138.6 Å²	138.6	81%	0.806	79%	0.786	S	S	*	*			trans	-66.1	136.2	-177.3	173.4	0	0	0	0	111.9	S9	V7-S9 PolarHBondContact O-N 3.48Å; V7-S9 VanDerWaalsContact O-N 3.1Å
8	L	34	Very low	36.6	Very low	175 Å²	175	132.2 Å²	132.2	92%	0.916	75%	0.75	S	S	*	*			trans	-63.5	107.4	166.6	-72	171	0	0	0	110.3
9	S	25.9	Very low	37.3	Very low	102 Å²	102	134.1 Å²	134.1	71%	0.713	75%	0.749	S	S	*	*			trans	-115.6	113	161.6	-72.7	0	0	0	0	108.6	V7 E11	V7-S9 PolarHBondContact O-N 3.48Å; V7-S9 VanDerWaalsContact O-N 3.1Å; S9-E11 PolarHBondContact O-N 3.35Å
10	A	31	Very low	38.4	Very low	98 Å²	98	127.8 Å²	127.8	81%	0.81	71%	0.714	S	S	*	*			trans	-69.9	99	176.2	0	0	0	0	0	109.3	N12	A10-N12 PolarHBondContact O-N 3.11Å
11	E	27.8	Very low	39.4	Very low	192 Å²	192	123.8 Å²	123.8	90%	0.897	69%	0.694	S	S	*	*			trans	-60.4	103.1	166.3	-82.7	-152.8	109.6	0	0	108.6	S9 K13	S9-E11 PolarHBondContact O-N 3.35Å; E11-K13 PolarHBondContact O-N 3.11Å; E11-K13 VanDerWaalsContact O-N 3.1Å
12	N	27.8	Very low	40.5	Very low	151 Å²	151	121 Å²	121	81%	0.807	67%	0.665	S	S	*	*			trans	-49.6	118.4	178.8	-124.5	-62.4	0	0	0	108.8	A10 G14	A10-N12 PolarHBondContact O-N 3.11Å; N12-G14 PolarHBondContact O-N 3.24Å
13	K	34.9	Very low	41.6	Very low	203 Å²	203	121.9 Å²	121.9	88%	0.883	66%	0.662	S	S	*	*			trans	-65.8	77.4	160.1	-82.2	-173.6	176.4	178.2	0	107.2	E11 Q15	E11-K13 PolarHBondContact O-N 3.11Å; E11-K13 VanDerWaalsContact O-N 3.1Å; K13-Q15 PolarHBondContact O-N 3.44Å
14	G	33.3	Very low	42.4	Very low	53 Å²	53	115.9 Å²	115.9	55%	0.546	62%	0.623	S	S	.	*			trans	-60.4	97.8	-170.6	0	0	0	0	0	109.4	N12 R16	N12-G14 PolarHBondContact O-N 3.24Å; G14-R16 PolarHBondContact O-N 3.19Å
15	Q	38.9	Very low	44.2	Very low	151 Å²	151	111.4 Å²	111.4	71%	0.706	60%	0.6	S	S	*	*			trans	-49	114.2	172.8	-71.5	179.3	-15.8	0	0	106.8	K13 K17	K13-Q15 PolarHBondContact O-N 3.44Å; Q15-K17 HydrophobicContact CB-CG 4.04Å; Q15-K17 PolarHBondContact O-N 2.96Å
16	R	47.3	Very low	44.7	Very low	121 Å²	121	112.1 Å²	112.1	46%	0.457	60%	0.598	S	S	.	*			trans	-72.2	72.3	172.9	-73.9	-179	173.9	155.5	3.3	107.8	G14 V18 D58	G14-R16 PolarHBondContact O-N 3.19Å; R16-V18 WeakPolarHBondContact O-CG2 3.22Å; R16-V18 PolarHBondContact O-N 3Å; R16-D58 IonicContact NH1-OD1 2.74Å
17	K	44.4	Very low	46.6	Very low	159 Å²	159	109.7 Å²	109.7	69%	0.691	58%	0.58	S	S	*	*			trans	-60.6	90.3	177.3	-70	-174.4	178.6	-179	0	107.7	Q15 F19	Q15-K17 HydrophobicContact CB-CG 4.04Å; Q15-K17 PolarHBondContact O-N 2.96Å; K17-F19 PolarHBondContact O-N 2.75Å
18	V	52.5	Low	48.8	Very low	23 Å²	23	104.1 Å²	104.1	14%	0.139	55%	0.545	C	S	.	.			trans	-62.5	110.5	173.9	-164.7	0	0	0	0	105	R16 V20 F54 D55 L135 N138	R16-V18 WeakPolarHBondContact O-CG2 3.22Å; R16-V18 PolarHBondContact O-N 3Å; V18-V20 HydrophobicContact CB-CG2 3.94Å; V18-V20 HydrophobicContact CG1-CG2 3.52Å; V18-V20 PolarHBondContact O-N 2.76Å; V18-F54 HydrophobicContact CG2-CE1 3.56Å; V18-F54 HydrophobicContact CG2-CZ 3.91Å; V18-D55 HydrophobicContact CG2-CB 4.43Å; V18-L135 HydrophobicContact CG1-CD1 3.78Å; V18-N138 HydrophobicContact CG1-CB 3.88Å
19	F	50.2	Low	50.7	Low	168 Å²	168	100.9 Å²	100.9	74%	0.737	54%	0.535	S	S	*	.			trans	-78.7	61.2	-173.1	-137.7	-83.7	0	0	0	110.4	K17 Q137	K17-F19 PolarHBondContact O-N 2.75Å; F19-Q137 VanDerWaalsContact O-CB 3.24Å; F19-Q137 WeakPolarHBondContact O-CB 3.42Å; F19-Q137 WeakPolarHBondContact O-CG 3.32Å
20	V	57.9	Low	53.1	Low	8 Å²	8	102 Å²	102	5%	0.048	52%	0.524	C	S	.	.			trans	-78.8	134.2	176.1	-170.8	0	0	0	0	107.6	V18 N22 L24 L25 I52 L135	V18-V20 HydrophobicContact CB-CG2 3.94Å; V18-V20 HydrophobicContact CG1-CG2 3.52Å; V18-V20 PolarHBondContact O-N 2.76Å; V20-N22 PolarHBondContact O-N 2.92Å; V20-L24 HydrophobicContact CG1-CB 4.11Å; V20-L24 HydrophobicContact CG1-CD2 3.73Å; V20-L25 HydrophobicContact CB-CD1 4.18Å; V20-L25 HydrophobicContact CB-CD2 3.82Å; V20-L25 HydrophobicContact CB-CG 3.83Å; V20-L25 HydrophobicContact CG1-CD2 3.9Å; V20-L25 HydrophobicContact CG1-CG 3.86Å; V20-L25 HydrophobicContact CG2-CD2 4.05Å; V20-I52 HydrophobicContact CG1-CD1 4.15Å; V20-I52 HydrophobicContact CG1-CG1 4.46Å; V20-I52 HydrophobicContact CG2-CG1 4.11Å; V20-L135 HydrophobicContact CG2-CD1 4.4Å
21	P	60	Low	55.5	Low	43 Å²	43	98.4 Å²	98.4	28%	0.279	49%	0.492	S	S	.	.			trans	-56.6	127.9	171.3	-24.1	34.2	0	0	0	110.6	K23 L24 L25 M112	P21-K23 PolarHBondContact O-N 3.48Å; P21-K23 VanDerWaalsContact O-N 3.09Å; P21-L24 WeakPolarHBondContact O-CA 3.35Å; P21-L24 WeakPolarHBondContact O-CB 3.42Å; P21-L24 PolarHBondContact O-N 3.15Å; P21-L25 PolarHBondContact O-N 3.27Å; P21-M112 HydrophobicContact CB-CE 3.71Å; P21-M112 HydrophobicContact CG-CE 3.97Å
22	N	60.5	Low	58.1	Low	117 Å²	117	93.3 Å²	93.3	63%	0.626	48%	0.483	S	S	*	.	H	α-helix	trans	-49	-44.1	-173.5	-63.3	-0.2	0	0	0	112.9	V20 L24 L25 D26	V20-N22 PolarHBondContact O-N 2.92Å; N22-L24 PolarHBondContact O-N 2.94Å; N22-L25 WeakPolarHBondContact O-CA 3.18Å; N22-L25 WeakPolarHBondContact O-CB 3.44Å; N22-L25 PolarHBondContact O-N 2.73Å; N22-D26 VanDerWaalsContact C-OD2 3.23Å; N22-D26 PolarHBondContact O-N 3.25Å
23	K	60.3	Low	60.8	Low	156 Å²	156	90.3 Å²	90.3	68%	0.678	47%	0.473	S	S	*	.	H	α-helix	trans	-47.5	-27.5	174.8	-61.3	-176	177.9	-177.2	0	114.7	P21 C27 M112	P21-K23 PolarHBondContact O-N 3.48Å; P21-K23 VanDerWaalsContact O-N 3.09Å; K23-C27 VanDerWaalsContact O-CB 3.32Å; K23-C27 WeakPolarHBondContact O-CB 3.48Å; K23-C27 PolarHBondContact O-SG 2.98Å; K23-M112 HydrophobicContact CB-SD 4.3Å
24	L	64.6	Low	63.3	Low	1 Å²	1	81.7 Å²	81.7	1%	0.005	44%	0.436	C	S	.	.	H	α-helix	trans	-98.5	-16.4	-178.2	-160.4	139.4	0	0	0	112.9	V20 P21 N22 L28 I52 V109 M112 C114	V20-L24 HydrophobicContact CG1-CB 4.11Å; V20-L24 HydrophobicContact CG1-CD2 3.73Å; P21-L24 WeakPolarHBondContact O-CA 3.35Å; P21-L24 WeakPolarHBondContact O-CB 3.42Å; P21-L24 PolarHBondContact O-N 3.15Å; N22-L24 PolarHBondContact O-N 2.94Å; L24-L28 HydrophobicContact CD2-CD1 3.58Å; L24-L28 HydrophobicContact CG-CD1 3.94Å; L24-L28 WeakPolarHBondContact O-CG 3.32Å; L24-I52 HydrophobicContact CD2-CD1 3.53Å; L24-V109 HydrophobicContact CD1-CB 4.33Å; L24-M112 HydrophobicContact CB-SD 4.5Å; L24-M112 HydrophobicContact CD1-CB 4.11Å; L24-M112 HydrophobicContact CD1-SD 4.23Å; L24-C114 HydrophobicContact CD1-CB 3.94Å
25	L	67.3	Low	65.9	Low	50 Å²	50	80.5 Å²	80.5	26%	0.262	42%	0.419	S	S	.	.	H	α-helix	trans	-78.9	-38	164.1	-65.1	172.8	0	0	0	111.4	V20 P21 N22 I52	V20-L25 HydrophobicContact CB-CD1 4.18Å; V20-L25 HydrophobicContact CB-CD2 3.82Å; V20-L25 HydrophobicContact CB-CG 3.83Å; V20-L25 HydrophobicContact CG1-CD2 3.9Å; V20-L25 HydrophobicContact CG1-CG 3.86Å; V20-L25 HydrophobicContact CG2-CD2 4.05Å; P21-L25 PolarHBondContact O-N 3.27Å; N22-L25 WeakPolarHBondContact O-CA 3.18Å; N22-L25 WeakPolarHBondContact O-CB 3.44Å; N22-L25 PolarHBondContact O-N 2.73Å; L25-I52 HydrophobicContact CD2-CG2 3.57Å
26	D	66.7	Low	67.9	Low	125 Å²	125	79.8 Å²	79.8	67%	0.668	42%	0.42	S	S	*	.	H	α-helix	trans	-73.6	-29.6	-177.5	-54.8	-34.8	0	0	0	112.2	N22	N22-D26 VanDerWaalsContact C-OD2 3.23Å; N22-D26 PolarHBondContact O-N 3.25Å
27	C	64.3	Low	70	Confident	74 Å²	74	76.9 Å²	76.9	50%	0.5	41%	0.412	S	S	.	.	S	Bend	trans	-108	6.5	-172	-59.8	0	0	0	0	114.8	K23 Q110	K23-C27 VanDerWaalsContact O-CB 3.32Å; K23-C27 WeakPolarHBondContact O-CB 3.48Å; K23-C27 PolarHBondContact O-SG 2.98Å; C27-Q110 PolarHBondContact O-NE2 3.42Å
28	L	74.2	Confident	72.2	Confident	16 Å²	16	72.3 Å²	72.3	8%	0.084	39%	0.39	C	S	.	.	S	Bend	trans	-124.8	131.2	174.4	-67.6	177.8	0	0	0	111.4	L24 R30 E45 A48 I52 V109	L24-L28 HydrophobicContact CD2-CD1 3.58Å; L24-L28 HydrophobicContact CG-CD1 3.94Å; L24-L28 WeakPolarHBondContact O-CG 3.32Å; L28-R30 PolarHBondContact O-N 2.8Å; L28-E45 HydrophobicContact CD2-CB 4.36Å; L28-E45 HydrophobicContact CD2-CG 4.45Å; L28-A48 HydrophobicContact CD1-CB 3.82Å; L28-I52 HydrophobicContact CD1-CD1 4.02Å; L28-V109 HydrophobicContact CD1-CG1 3.95Å; L28-V109 HydrophobicContact CD2-CG1 3.96Å; L28-V109 HydrophobicContact CG-CG1 4.45Å
29	P	73.9	Confident	74	Confident	107 Å²	107	75.8 Å²	75.8	70%	0.695	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-66.1	134.1	171.7	28.2	-33.1	0	0	0	110.2	S49	P29-S49 WeakPolarHBondContact O-CB 3.19Å; P29-S49 PolarHBondContact O-OG 2.87Å
30	R	76.3	Confident	76	Confident	126 Å²	126	73.3 Å²	73.3	48%	0.475	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-72.4	127.4	171.9	-60.7	-173.1	-168.8	-163.7	6.4	109	L28 S53	L28-R30 PolarHBondContact O-N 2.8Å; R30-S53 WeakPolarHBondContact CA-OG 3.08Å
31	S	82.9	Confident	77.7	Confident	22 Å²	22	75.2 Å²	75.2	15%	0.154	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-66.4	137.5	176.3	-78.8	0	0	0	0	110.6	S49 Y50 S53	S31-S49 WeakPolarHBondContact CB-OG 3.47Å; S31-S49 PolarHBondContact N-OG 2.82Å; S31-S49 PolarHBondContact OG-OG 3.34Å; S31-Y50 WeakPolarHBondContact OG-CD1 3.46Å; S31-Y50 WeakPolarHBondContact OG-CE1 3.27Å; S31-S53 PolarHBondContact N-OG 3.09Å
32	A	80.9	Confident	79.2	Confident	85 Å²	85	73.6 Å²	73.6	70%	0.702	39%	0.389	S	S	*	.	S	Bend	trans	-96.2	-8.8	174.3	0	0	0	0	0	113.6
33	C	84.6	Confident	80.7	Confident	89 Å²	89	70.9 Å²	70.9	60%	0.601	38%	0.377	S	S	*	.			trans	-151.8	148.4	176.4	62.7	0	0	0	0	111.5	Y50 W60	C33-Y50 WeakPolarHBondContact O-CE1 3.25Å; C33-W60 VanDerWaalsContact C-CZ2 3.47Å; C33-W60 VanDerWaalsContact CA-CZ2 3.47Å
34	L	87.4	Confident	82.3	Confident	21 Å²	21	65.7 Å²	65.7	11%	0.11	36%	0.356	C	S	.	.			trans	-99.3	120.8	168.1	-174.5	71.7	0	0	0	109.7	N36 Y50 W60 I74 L76 L143	L34-N36 PolarHBondContact O-N 3.5Å; L34-Y50 HydrophobicContact CD1-CD1 3.69Å; L34-Y50 HydrophobicContact CD1-CD2 4.06Å; L34-Y50 HydrophobicContact CD1-CE1 4.19Å; L34-Y50 HydrophobicContact CD1-CG 3.65Å; L34-W60 HydrophobicContact CB-CD2 3.56Å; L34-W60 HydrophobicContact CB-CE3 3.83Å; L34-W60 HydrophobicContact CB-CG 3.87Å; L34-W60 HydrophobicContact CB-CZ2 4.41Å; L34-W60 HydrophobicContact CB-CZ3 4.36Å; L34-W60 HydrophobicContact CD2-CB 4.06Å; L34-W60 HydrophobicContact CD2-CD2 4.47Å; L34-W60 HydrophobicContact CD2-CG 4.26Å; L34-I74 HydrophobicContact CD1-CG2 4.02Å; L34-I74 HydrophobicContact CG-CG2 4.39Å; L34-L76 HydrophobicContact CD2-CB 4.05Å; L34-L143 HydrophobicContact CD1-CD1 3.94Å
35	P	87.9	Confident	83.6	Confident	29 Å²	29	69.3 Å²	69.3	19%	0.188	37%	0.373	C	S	.	.			trans	-73.2	120.6	178.6	27.9	-33	0	0	0	111.1	E37 Y50 I74	P35-E37 PolarHBondContact O-N 3.11Å; P35-Y50 WeakPolarHBondContact CD-OH 3.32Å; P35-Y50 WeakPolarHBondContact CG-OH 3.04Å; P35-I74 HydrophobicContact CG-CD1 4.07Å; P35-I74 WeakPolarHBondContact O-CB 3.4Å
36	N	82.6	Confident	84.8	Confident	135 Å²	135	68.6 Å²	68.6	72%	0.722	37%	0.369	S	S	*	.	S	Bend	trans	-62.8	-26	179.9	-71.2	-47	0	0	0	114	L34 S73 I74	L34-N36 PolarHBondContact O-N 3.5Å; N36-S73 WeakPolarHBondContact O-CA 3.47Å; N36-I74 PolarHBondContact O-N 2.85Å
37	E	90	Very high	86.1	Confident	61 Å²	61	62.7 Å²	62.7	29%	0.285	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-141.1	137.7	178.7	-172.3	173.3	165.8	0	0	110.7	P35 K70 G72 S189	P35-E37 PolarHBondContact O-N 3.11Å; E37-K70 WeakPolarHBondContact OE2-CE 3.4Å; E37-K70 IonicContact OE2-NZ 2.76Å; E37-K70 PolarHBondContact OE2-NZ 2.85Å; E37-G72 CarbonylContact C-O 3.52Å; E37-G72 WeakPolarHBondContact CA-O 3.46Å; E37-S189 WeakPolarHBondContact OE1-CB 3.36Å; E37-S189 PolarHBondContact OE1-OG 3.41Å
38	R	90.9	Very high	87.3	Confident	62 Å²	62	59.1 Å²	59.1	23%	0.234	31%	0.313	C	S	.	.			trans	-150.9	113.2	175.4	-161.1	178.9	-158.6	72.4	-14.5	110.2	R40 N42 E46 G72 I74 H145	R38-R40 HydrophobicContact CG-CG 4.21Å; R38-R40 PolarHBondContact O-N 2.91Å; R38-N42 WeakPolarHBondContact CD-OD1 3.27Å; R38-N42 PolarHBondContact NE-OD1 2.79Å; R38-N42 VanDerWaalsContact NE-OD1 3.07Å; R38-E46 IonicContact CZ-OE1 3.24Å; R38-E46 IonicContact NE-OE1 3.31Å; R38-E46 IonicContact NH2-OE1 3.43Å; R38-E46 PolarHBondContact NH2-OE1 3.1Å; R38-G72 PolarHBondContact N-O 2.82Å; R38-G72 WeakPolarHBondContact O-CA 3.38Å; R38-I74 HydrophobicContact CB-CD1 3.52Å; R38-I74 HydrophobicContact CB-CG1 4.46Å; R38-I74 HydrophobicContact CG-CD1 4.42Å; R38-H145 PolarHBondContact O-NE2 2.79Å; R38-H145 VanDerWaalsContact O-NE2 3.09Å
39	L	90	Very high	88.1	Confident	97 Å²	97	58.8 Å²	58.8	51%	0.508	31%	0.312	S	S	.	.	S	Bend	trans	-80.4	14	-178.2	-58.2	177.1	0	0	0	114.2	L147	L39-L147 HydrophobicContact CD2-CD1 4.47Å
40	R	91.9	Very high	88.9	Confident	115 Å²	115	54.5 Å²	54.5	43%	0.434	28%	0.282	S	S	.	.	S	Bend	trans	-130.6	153.8	165.7	68.9	159.3	178.3	80.9	-8.4	110.1	R38 E46 H145	R38-R40 HydrophobicContact CG-CG 4.21Å; R38-R40 PolarHBondContact O-N 2.91Å; R40-E46 IonicContact CZ-OE1 3.25Å; R40-E46 IonicContact CZ-OE2 2.86Å; R40-E46 IonicContact NH1-OE1 3.14Å; R40-E46 PolarHBondContact NH1-OE1 2.86Å; R40-E46 IonicContact NH1-OE2 2.72Å; R40-E46 PolarHBondContact NH1-OE2 2.84Å; R40-E46 IonicContact NH2-OE1 3.65Å; R40-E46 PolarHBondContact NH2-OE1 2.95Å; R40-E46 IonicContact NH2-OE2 3.77Å; R40-H145 PolarHBondContact O-CE1 2.98Å
41	W	93.8	Very high	89.6	Confident	48 Å²	48	48.6 Å²	48.6	18%	0.182	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-59.6	145.9	168.6	-65.2	115.3	0	0	0	111.2	H129 R131 H145 L147 V149	W41-H129 HydrophobicContact CH2-CB 3.84Å; W41-H129 HydrophobicContact CZ2-CB 3.8Å; W41-R131 VanDerWaalsContact CE2-CZ 3.44Å; W41-R131 HydrophobicContact CE3-CB 4.49Å; W41-R131 HydrophobicContact CE3-CG 4.28Å; W41-R131 HydrophobicContact CH2-CB 4.27Å; W41-R131 HydrophobicContact CH2-CG 3.72Å; W41-R131 HydrophobicContact CZ2-CG 4.35Å; W41-R131 HydrophobicContact CZ3-CB 3.83Å; W41-R131 HydrophobicContact CZ3-CG 3.68Å; W41-H145 HydrophobicContact CE3-CB 4.49Å; W41-H145 AromaticContact CE3-CG 3.98Å; W41-H145 AromaticContact CE3-ND1 3.6Å; W41-H145 HydrophobicContact CZ3-CB 4.08Å; W41-H145 AromaticContact CZ3-CG 3.86Å; W41-H145 AromaticContact CZ3-ND1 3.99Å; W41-L147 HydrophobicContact CD2-CD2 3.79Å; W41-L147 HydrophobicContact CE3-CB 4.37Å; W41-L147 HydrophobicContact CE3-CD2 4.18Å; W41-L147 HydrophobicContact CG-CD2 4.05Å; W41-L147 HydrophobicContact CH2-CB 3.7Å; W41-L147 HydrophobicContact CZ2-CB 3.91Å; W41-L147 HydrophobicContact CZ2-CD2 4.28Å; W41-L147 HydrophobicContact CZ3-CB 3.95Å; W41-V149 HydrophobicContact CZ2-CG2 4.5Å
42	N	91.9	Very high	89.8	Confident	10 Å²	10	48 Å²	48	5%	0.053	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-74.4	151.2	170.5	-67.9	-69.7	0	0	0	111.3	R38 E46 I47 I74 H145	R38-N42 WeakPolarHBondContact CD-OD1 3.27Å; R38-N42 PolarHBondContact NE-OD1 2.79Å; R38-N42 VanDerWaalsContact NE-OD1 3.07Å; N42-E46 WeakPolarHBondContact CA-OE2 3.34Å; N42-E46 HydrophobicContact CB-CB 4.08Å; N42-I47 HydrophobicContact CB-CD1 4.07Å; N42-I47 HydrophobicContact CB-CG1 3.65Å; N42-I74 VanDerWaalsContact ND2-CD1 3.32Å; N42-I74 WeakPolarHBondContact ND2-CD1 3.45Å; N42-H145 PolarHBondContact ND2-CE1 3.1Å; N42-H145 VanDerWaalsContact ND2-CE1 3.35Å; N42-H145 PolarHBondContact ND2-ND1 2.91Å; N42-H145 VanDerWaalsContact ND2-ND1 3.12Å
43	T	92.9	Very high	90.1	Very high	60 Å²	60	43.9 Å²	43.9	37%	0.368	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-76.4	167.2	167.8	77.3	0	0	0	0	110.9	E45 E46 I47	T43-E45 WeakPolarHBondContact CB-OE2 3.45Å; T43-E45 PolarHBondContact O-N 3.48Å; T43-E45 PolarHBondContact OG1-N 2.85Å; T43-E45 PolarHBondContact OG1-OE2 2.95Å; T43-E45 VanDerWaalsContact OG1-OE2 3.06Å; T43-E46 PolarHBondContact N-OE2 2.93Å; T43-E46 PolarHBondContact O-N 3.15Å; T43-E46 PolarHBondContact OG1-N 2.82Å; T43-I47 WeakPolarHBondContact O-CB 3.09Å; T43-I47 VanDerWaalsContact O-CD1 3.28Å; T43-I47 WeakPolarHBondContact O-CD1 3.13Å; T43-I47 WeakPolarHBondContact O-CG1 3.38Å; T43-I47 PolarHBondContact O-N 3.34Å
44	N	93.8	Very high	90	Very high	46 Å²	46	39.7 Å²	39.7	25%	0.246	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-33.7	179.5	-59.4	-9.1	0	0	0	111	I47 A48 K108 V109 L115	N44-I47 PolarHBondContact O-N 3.46Å; N44-A48 WeakPolarHBondContact O-CB 3.23Å; N44-A48 PolarHBondContact O-N 2.89Å; N44-K108 PolarHBondContact ND2-O 2.89Å; N44-V109 HydrophobicContact CB-CG2 3.72Å; N44-V109 WeakPolarHBondContact O-CG2 3.2Å; N44-L115 HydrophobicContact CB-CD1 4.35Å; N44-L115 WeakPolarHBondContact O-CD1 3.38Å
45	E	91.1	Very high	89.6	Confident	77 Å²	77	42.1 Å²	42.1	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-67.2	-45.8	177.6	-60.7	62.6	-140.2	0	0	111.2	L28 T43 A48 S49 V109	L28-E45 HydrophobicContact CD2-CB 4.36Å; L28-E45 HydrophobicContact CD2-CG 4.45Å; T43-E45 WeakPolarHBondContact CB-OE2 3.45Å; T43-E45 PolarHBondContact O-N 3.48Å; T43-E45 PolarHBondContact OG1-N 2.85Å; T43-E45 PolarHBondContact OG1-OE2 2.95Å; T43-E45 VanDerWaalsContact OG1-OE2 3.06Å; E45-A48 PolarHBondContact O-N 2.78Å; E45-S49 WeakPolarHBondContact O-CB 3.31Å; E45-S49 PolarHBondContact O-N 2.84Å; E45-V109 HydrophobicContact CG-CG1 4.13Å
46	E	92.1	Very high	89.2	Confident	36 Å²	36	48 Å²	48	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-47.4	173.2	-69.8	174	138.4	0	0	110.7	R38 R40 N42 T43 A48 S49 Y50	R38-E46 IonicContact CZ-OE1 3.24Å; R38-E46 IonicContact NE-OE1 3.31Å; R38-E46 IonicContact NH2-OE1 3.43Å; R38-E46 PolarHBondContact NH2-OE1 3.1Å; R40-E46 IonicContact CZ-OE1 3.25Å; R40-E46 IonicContact CZ-OE2 2.86Å; R40-E46 IonicContact NH1-OE1 3.14Å; R40-E46 PolarHBondContact NH1-OE1 2.86Å; R40-E46 IonicContact NH1-OE2 2.72Å; R40-E46 PolarHBondContact NH1-OE2 2.84Å; R40-E46 IonicContact NH2-OE1 3.65Å; R40-E46 PolarHBondContact NH2-OE1 2.95Å; R40-E46 IonicContact NH2-OE2 3.77Å; N42-E46 WeakPolarHBondContact CA-OE2 3.34Å; N42-E46 HydrophobicContact CB-CB 4.08Å; T43-E46 PolarHBondContact N-OE2 2.93Å; T43-E46 PolarHBondContact O-N 3.15Å; T43-E46 PolarHBondContact OG1-N 2.82Å; E46-A48 PolarHBondContact O-N 2.9Å; E46-S49 PolarHBondContact O-N 2.84Å; E46-Y50 HydrophobicContact CB-CE2 4.15Å; E46-Y50 WeakPolarHBondContact O-CD2 3.42Å; E46-Y50 PolarHBondContact O-N 2.88Å
47	I	93.6	Very high	89.2	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-45.5	179	-69.3	160.4	0	0	0	111.4	N42 T43 N44 L51 L115 Y133 L143	N42-I47 HydrophobicContact CB-CD1 4.07Å; N42-I47 HydrophobicContact CB-CG1 3.65Å; T43-I47 WeakPolarHBondContact O-CB 3.09Å; T43-I47 VanDerWaalsContact O-CD1 3.28Å; T43-I47 WeakPolarHBondContact O-CD1 3.13Å; T43-I47 WeakPolarHBondContact O-CG1 3.38Å; T43-I47 PolarHBondContact O-N 3.34Å; N44-I47 PolarHBondContact O-N 3.46Å; I47-L51 HydrophobicContact CG2-CD1 3.73Å; I47-L51 WeakPolarHBondContact O-CB 3.31Å; I47-L51 WeakPolarHBondContact O-CG 3.41Å; I47-L51 PolarHBondContact O-N 3.01Å; I47-L115 HydrophobicContact CB-CD1 4.1Å; I47-L115 HydrophobicContact CG2-CD1 3.68Å; I47-L115 HydrophobicContact CG2-CD2 3.94Å; I47-L115 HydrophobicContact CG2-CG 4.48Å; I47-Y133 HydrophobicContact CD1-CD1 3.96Å; I47-Y133 HydrophobicContact CD1-CD2 3.88Å; I47-Y133 HydrophobicContact CD1-CE1 3.68Å; I47-Y133 HydrophobicContact CD1-CE2 3.57Å; I47-Y133 HydrophobicContact CD1-CG 4.04Å; I47-Y133 VanDerWaalsContact CD1-CZ 3.43Å; I47-Y133 HydrophobicContact CG1-CD2 4.09Å; I47-Y133 HydrophobicContact CG1-CE2 4.11Å; I47-Y133 HydrophobicContact CG1-CG 4.41Å; I47-Y133 HydrophobicContact CG2-CD1 4.29Å; I47-Y133 HydrophobicContact CG2-CD2 4.11Å; I47-Y133 HydrophobicContact CG2-CG 3.76Å; I47-L143 HydrophobicContact CB-CD2 4.39Å; I47-L143 HydrophobicContact CG1-CD2 4.18Å; I47-L143 HydrophobicContact CG2-CD2 4.19Å
48	A	91.1	Very high	88.6	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.4	-44.8	176.6	0	0	0	0	0	111.6	L28 N44 E45 E46 Y50 L51 I52 V109 L115	L28-A48 HydrophobicContact CD1-CB 3.82Å; N44-A48 WeakPolarHBondContact O-CB 3.23Å; N44-A48 PolarHBondContact O-N 2.89Å; E45-A48 PolarHBondContact O-N 2.78Å; E46-A48 PolarHBondContact O-N 2.9Å; A48-Y50 VanDerWaalsContact C-N 3.32Å; A48-Y50 PolarHBondContact O-N 3.01Å; A48-L51 CarbonylContact O-C 3.44Å; A48-L51 PolarHBondContact O-N 2.8Å; A48-L51 VanDerWaalsContact O-N 3.14Å; A48-I52 HydrophobicContact CB-CD1 4.26Å; A48-I52 VanDerWaalsContact O-CB 3.31Å; A48-I52 WeakPolarHBondContact O-CB 3.41Å; A48-I52 WeakPolarHBondContact O-CD1 3.38Å; A48-I52 WeakPolarHBondContact O-CG1 3.42Å; A48-I52 PolarHBondContact O-N 2.8Å; A48-V109 HydrophobicContact CB-CG2 4Å; A48-L115 HydrophobicContact CB-CD1 4.17Å
49	S	90.1	Very high	88.3	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.063	23%	0.227	C	C	.	.	H	α-helix	trans	-56.3	-44	177.5	-178.3	0	0	0	0	112	P29 S31 E45 E46 S53	P29-S49 WeakPolarHBondContact O-CB 3.19Å; P29-S49 PolarHBondContact O-OG 2.87Å; S31-S49 WeakPolarHBondContact CB-OG 3.47Å; S31-S49 PolarHBondContact N-OG 2.82Å; S31-S49 PolarHBondContact OG-OG 3.34Å; E45-S49 WeakPolarHBondContact O-CB 3.31Å; E45-S49 PolarHBondContact O-N 2.84Å; E46-S49 PolarHBondContact O-N 2.84Å; S49-S53 VanDerWaalsContact O-CB 3.31Å; S49-S53 WeakPolarHBondContact O-CB 3.39Å; S49-S53 PolarHBondContact O-N 3.27Å; S49-S53 PolarHBondContact O-OG 3.24Å
50	Y	91.4	Very high	88.2	Confident	17 Å²	17	45.1 Å²	45.1	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-43.9	174.5	-59.4	-44.5	0	0	0	113	S31 C33 L34 P35 E46 A48 I52 S53 W60 L143	S31-Y50 WeakPolarHBondContact OG-CD1 3.46Å; S31-Y50 WeakPolarHBondContact OG-CE1 3.27Å; C33-Y50 WeakPolarHBondContact O-CE1 3.25Å; L34-Y50 HydrophobicContact CD1-CD1 3.69Å; L34-Y50 HydrophobicContact CD1-CD2 4.06Å; L34-Y50 HydrophobicContact CD1-CE1 4.19Å; L34-Y50 HydrophobicContact CD1-CG 3.65Å; P35-Y50 WeakPolarHBondContact CD-OH 3.32Å; P35-Y50 WeakPolarHBondContact CG-OH 3.04Å; E46-Y50 HydrophobicContact CB-CE2 4.15Å; E46-Y50 WeakPolarHBondContact O-CD2 3.42Å; E46-Y50 PolarHBondContact O-N 2.88Å; A48-Y50 VanDerWaalsContact C-N 3.32Å; A48-Y50 PolarHBondContact O-N 3.01Å; Y50-I52 VanDerWaalsContact C-N 3.29Å; Y50-I52 PolarHBondContact O-N 2.91Å; Y50-S53 PolarHBondContact O-N 3.44Å; Y50-W60 HydrophobicContact CD1-CZ3 4.44Å; Y50-L143 HydrophobicContact CD2-CD2 4.03Å
51	L	90.4	Very high	88.1	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-74.2	-15.3	-179	-76	167.5	0	0	0	114.4	I47 A48 F54 L76 L115 L135 I141 L143	I47-L51 HydrophobicContact CG2-CD1 3.73Å; I47-L51 WeakPolarHBondContact O-CB 3.31Å; I47-L51 WeakPolarHBondContact O-CG 3.41Å; I47-L51 PolarHBondContact O-N 3.01Å; A48-L51 CarbonylContact O-C 3.44Å; A48-L51 PolarHBondContact O-N 2.8Å; A48-L51 VanDerWaalsContact O-N 3.14Å; L51-F54 WeakPolarHBondContact O-CD1 3.46Å; L51-L76 HydrophobicContact CD2-CD1 4Å; L51-L115 HydrophobicContact CD1-CD2 3.52Å; L51-L135 HydrophobicContact CB-CD1 4.16Å; L51-L135 HydrophobicContact CB-CG 4.04Å; L51-L135 WeakPolarHBondContact O-CD1 3.44Å; L51-I141 HydrophobicContact CD2-CG2 4.13Å; L51-L143 HydrophobicContact CD1-CB 4.4Å; L51-L143 HydrophobicContact CD2-CB 3.97Å; L51-L143 HydrophobicContact CG-CB 4.12Å
52	I	87.9	Confident	87.9	Confident	9 Å²	9	39.5 Å²	39.5	5%	0.046	19%	0.192	C	C	.	.	H	α-helix	trans	-90.3	-39.6	173.7	-69	166.2	0	0	0	110.5	V20 L24 L25 L28 A48 Y50 F54 L135	V20-I52 HydrophobicContact CG1-CD1 4.15Å; V20-I52 HydrophobicContact CG1-CG1 4.46Å; V20-I52 HydrophobicContact CG2-CG1 4.11Å; L24-I52 HydrophobicContact CD2-CD1 3.53Å; L25-I52 HydrophobicContact CD2-CG2 3.57Å; L28-I52 HydrophobicContact CD1-CD1 4.02Å; A48-I52 HydrophobicContact CB-CD1 4.26Å; A48-I52 VanDerWaalsContact O-CB 3.31Å; A48-I52 WeakPolarHBondContact O-CB 3.41Å; A48-I52 WeakPolarHBondContact O-CD1 3.38Å; A48-I52 WeakPolarHBondContact O-CG1 3.42Å; A48-I52 PolarHBondContact O-N 2.8Å; Y50-I52 VanDerWaalsContact C-N 3.29Å; Y50-I52 PolarHBondContact O-N 2.91Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 3.18Å; I52-L135 HydrophobicContact CG1-CD1 4.13Å
53	S	86.9	Confident	87.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-83.2	-2.6	-170.2	-47	0	0	0	0	114.9	R30 S31 S49 Y50 D55 R56 H57	R30-S53 WeakPolarHBondContact CA-OG 3.08Å; S31-S53 PolarHBondContact N-OG 3.09Å; S49-S53 VanDerWaalsContact O-CB 3.31Å; S49-S53 WeakPolarHBondContact O-CB 3.39Å; S49-S53 PolarHBondContact O-N 3.27Å; S49-S53 PolarHBondContact O-OG 3.24Å; Y50-S53 PolarHBondContact O-N 3.44Å; S53-D55 PolarHBondContact O-N 2.68Å; S53-R56 PolarHBondContact O-N 2.7Å; S53-H57 PolarHBondContact O-CD2 3.27Å
54	F	82	Confident	87.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-63.5	-24.2	-176.3	86.3	-86.6	0	0	0	113.6	V18 L51 I52 R56 H57 D58 L61 L76 N138 I141	V18-F54 HydrophobicContact CG2-CE1 3.56Å; V18-F54 HydrophobicContact CG2-CZ 3.91Å; L51-F54 WeakPolarHBondContact O-CD1 3.46Å; I52-F54 VanDerWaalsContact C-N 3.34Å; I52-F54 PolarHBondContact O-N 3.18Å; F54-R56 PolarHBondContact O-N 3.08Å; F54-H57 CarbonylContact O-C 3.19Å; F54-H57 PolarHBondContact O-N 3.45Å; F54-D58 PolarHBondContact O-N 3.06Å; F54-L61 HydrophobicContact CD2-CD1 4.23Å; F54-L76 HydrophobicContact CB-CD2 3.63Å; F54-N138 WeakPolarHBondContact CE1-ND2 3.39Å; F54-I141 HydrophobicContact CD1-CG1 4.21Å; F54-I141 HydrophobicContact CD1-CG2 4.3Å; F54-I141 HydrophobicContact CD2-CD1 4.32Å; F54-I141 HydrophobicContact CD2-CG1 4.05Å; F54-I141 HydrophobicContact CE1-CG1 3.88Å; F54-I141 HydrophobicContact CE2-CD1 4.03Å; F54-I141 HydrophobicContact CE2-CG1 3.73Å; F54-I141 HydrophobicContact CG-CG1 4.3Å; F54-I141 HydrophobicContact CG-CG2 4.2Å; F54-I141 HydrophobicContact CZ-CD1 4.4Å; F54-I141 HydrophobicContact CZ-CG1 3.65Å
55	D	79.5	Confident	87	Confident	73 Å²	73	44.8 Å²	44.8	39%	0.39	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-68.8	-19.9	179.6	69.1	-33.7	0	0	0	112.8	V18 S53	V18-D55 HydrophobicContact CG2-CB 4.43Å; S53-D55 PolarHBondContact O-N 2.68Å
56	R	78.9	Confident	87	Confident	153 Å²	153	46.1 Å²	46.1	58%	0.577	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-94.8	-5.3	171.9	-57.1	176.5	74	-148	5.1	113	S53 F54	S53-R56 PolarHBondContact O-N 2.7Å; F54-R56 PolarHBondContact O-N 3.08Å
57	H	82.2	Confident	87	Confident	30 Å²	30	49.3 Å²	49.3	14%	0.139	26%	0.256	C	S	.	.			trans	-144.2	58.5	-165	-72.5	-72.5	0	0	0	111.5	S53 F54 E59 W60	S53-H57 PolarHBondContact O-CD2 3.27Å; F54-H57 CarbonylContact O-C 3.19Å; F54-H57 PolarHBondContact O-N 3.45Å; H57-E59 WeakPolarHBondContact CA-OE2 3.47Å; H57-E59 IonicContact CE1-OE1 3.79Å; H57-E59 IonicContact CG-OE1 3.32Å; H57-E59 IonicContact ND1-OE1 3.99Å; H57-E59 PolarHBondContact ND1-OE1 2.84Å; H57-E59 IonicContact ND1-OE2 2.77Å; H57-E59 PolarHBondContact O-N 3.24Å; H57-E59 VanDerWaalsContact O-N 3.14Å; H57-W60 HydrophobicContact CB-CD2 3.51Å; H57-W60 HydrophobicContact CB-CE3 3.97Å; H57-W60 HydrophobicContact CB-CG 3.84Å; H57-W60 HydrophobicContact CB-CH2 4.19Å; H57-W60 HydrophobicContact CB-CZ2 3.74Å; H57-W60 HydrophobicContact CB-CZ3 4.3Å; H57-W60 AromaticContact CD2-CE2 3.93Å; H57-W60 AromaticContact CD2-CH2 3.54Å; H57-W60 AromaticContact CD2-CZ2 3.31Å; H57-W60 WeakPolarHBondContact CD2-CZ2 3.44Å; H57-W60 AromaticContact CE1-CZ2 3.82Å; H57-W60 AromaticContact CG-CE2 3.4Å; H57-W60 VanDerWaalsContact CG-CE2 3.4Å; H57-W60 AromaticContact CG-CH2 3.88Å; H57-W60 AromaticContact CG-CZ2 3.29Å; H57-W60 AromaticContact CG-NE1 3.67Å; H57-W60 AromaticContact ND1-CE2 3.68Å; H57-W60 AromaticContact ND1-CZ2 3.61Å; H57-W60 AromaticContact ND1-NE1 3.55Å; H57-W60 AromaticContact NE2-CZ2 3.67Å; H57-W60 WeakPolarHBondContact O-CB 3.48Å; H57-W60 PolarHBondContact O-N 3.08Å
58	D	78.8	Confident	87	Confident	101 Å²	101	52.4 Å²	52.4	54%	0.54	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-58.4	-23.7	177.4	-96.4	-43.1	0	0	0	111.9	R16 F54 W60 L61	R16-D58 IonicContact NH1-OD1 2.74Å; F54-D58 PolarHBondContact O-N 3.06Å; D58-W60 PolarHBondContact O-N 3.31Å; D58-L61 WeakPolarHBondContact O-CB 3.32Å; D58-L61 PolarHBondContact O-N 2.83Å; D58-L61 VanDerWaalsContact O-N 3.12Å; D58-L61 WeakPolarHBondContact OD1-CD1 3.45Å
59	E	84.2	Confident	87.2	Confident	132 Å²	132	52.9 Å²	52.9	62%	0.617	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.4	-18.4	175.9	79.6	-69	169.3	0	0	113.9	H57 L61	H57-E59 WeakPolarHBondContact CA-OE2 3.47Å; H57-E59 IonicContact CE1-OE1 3.79Å; H57-E59 IonicContact CG-OE1 3.32Å; H57-E59 IonicContact ND1-OE1 3.99Å; H57-E59 PolarHBondContact ND1-OE1 2.84Å; H57-E59 IonicContact ND1-OE2 2.77Å; H57-E59 PolarHBondContact O-N 3.24Å; H57-E59 VanDerWaalsContact O-N 3.14Å; E59-L61 VanDerWaalsContact C-N 3.29Å
60	W	88.7	Confident	87.4	Confident	30 Å²	30	56 Å²	56	11%	0.114	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-74.5	-20.2	173.4	-61.3	1.5	0	0	0	112.4	C33 L34 Y50 H57 D58 C62 L76	C33-W60 VanDerWaalsContact C-CZ2 3.47Å; C33-W60 VanDerWaalsContact CA-CZ2 3.47Å; L34-W60 HydrophobicContact CB-CD2 3.56Å; L34-W60 HydrophobicContact CB-CE3 3.83Å; L34-W60 HydrophobicContact CB-CG 3.87Å; L34-W60 HydrophobicContact CB-CZ2 4.41Å; L34-W60 HydrophobicContact CB-CZ3 4.36Å; L34-W60 HydrophobicContact CD2-CB 4.06Å; L34-W60 HydrophobicContact CD2-CD2 4.47Å; L34-W60 HydrophobicContact CD2-CG 4.26Å; Y50-W60 HydrophobicContact CD1-CZ3 4.44Å; H57-W60 HydrophobicContact CB-CD2 3.51Å; H57-W60 HydrophobicContact CB-CE3 3.97Å; H57-W60 HydrophobicContact CB-CG 3.84Å; H57-W60 HydrophobicContact CB-CH2 4.19Å; H57-W60 HydrophobicContact CB-CZ2 3.74Å; H57-W60 HydrophobicContact CB-CZ3 4.3Å; H57-W60 AromaticContact CD2-CE2 3.93Å; H57-W60 AromaticContact CD2-CH2 3.54Å; H57-W60 AromaticContact CD2-CZ2 3.31Å; H57-W60 WeakPolarHBondContact CD2-CZ2 3.44Å; H57-W60 AromaticContact CE1-CZ2 3.82Å; H57-W60 AromaticContact CG-CE2 3.4Å; H57-W60 VanDerWaalsContact CG-CE2 3.4Å; H57-W60 AromaticContact CG-CH2 3.88Å; H57-W60 AromaticContact CG-CZ2 3.29Å; H57-W60 AromaticContact CG-NE1 3.67Å; H57-W60 AromaticContact ND1-CE2 3.68Å; H57-W60 AromaticContact ND1-CZ2 3.61Å; H57-W60 AromaticContact ND1-NE1 3.55Å; H57-W60 AromaticContact NE2-CZ2 3.67Å; H57-W60 WeakPolarHBondContact O-CB 3.48Å; H57-W60 PolarHBondContact O-N 3.08Å; D58-W60 PolarHBondContact O-N 3.31Å; W60-C62 PolarHBondContact O-N 2.94Å; W60-C62 VanDerWaalsContact O-N 3.17Å; W60-L76 HydrophobicContact CB-CD2 4.09Å; W60-L76 WeakPolarHBondContact O-CB 3.32Å
61	L	89.3	Confident	87.5	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.115	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-76.9	103.4	-176.6	-67.5	176.2	0	0	0	111.3	F54 D58 E59 C63 L76 I141	F54-L61 HydrophobicContact CD2-CD1 4.23Å; D58-L61 WeakPolarHBondContact O-CB 3.32Å; D58-L61 PolarHBondContact O-N 2.83Å; D58-L61 VanDerWaalsContact O-N 3.12Å; D58-L61 WeakPolarHBondContact OD1-CD1 3.45Å; E59-L61 VanDerWaalsContact C-N 3.29Å; L61-C63 PolarHBondContact O-N 2.89Å; L61-L76 HydrophobicContact CD2-CB 4.5Å; L61-L76 HydrophobicContact CD2-CD2 3.68Å; L61-L76 HydrophobicContact CD2-CG 3.84Å; L61-L76 HydrophobicContact CG-CD2 4.44Å; L61-I141 HydrophobicContact CD2-CD1 4.02Å; L61-I141 HydrophobicContact CD2-CG2 4.08Å
62	C	88.4	Confident	87.7	Confident	23 Å²	23	55.2 Å²	55.2	16%	0.155	28%	0.28	C	S	.	.			trans	-70.2	99.6	179.7	-168.4	0	0	0	0	110.9	W60 S64 K66 I75 L76 Y77	W60-C62 PolarHBondContact O-N 2.94Å; W60-C62 VanDerWaalsContact O-N 3.17Å; C62-S64 PolarHBondContact O-N 2.97Å; C62-S64 PolarHBondContact SG-O 2.97Å; C62-K66 VanDerWaalsContact SG-CE 3.56Å; C62-I75 HydrophobicContact CB-CG2 3.44Å; C62-I75 VanDerWaalsContact CB-CG2 3.44Å; C62-L76 WeakPolarHBondContact CB-O 3.34Å; C62-L76 PolarHBondContact N-O 3Å; C62-Y77 HydrophobicContact CB-CD1 4.07Å; C62-Y77 HydrophobicContact CB-CE1 3.66Å; C62-Y77 WeakPolarHBondContact O-CD1 3.26Å; C62-Y77 VanDerWaalsContact O-CE1 3.29Å; C62-Y77 WeakPolarHBondContact O-CE1 3.36Å
63	C	84.4	Confident	88	Confident	95 Å²	95	55.5 Å²	55.5	64%	0.642	28%	0.283	S	S	*	.			trans	-69.3	-11.6	179.8	-73.7	0	0	0	0	114.7	L61 V82	L61-C63 PolarHBondContact O-N 2.89Å; C63-V82 WeakPolarHBondContact O-CG2 3.25Å
64	S	86.8	Confident	88.5	Confident	68 Å²	68	55.7 Å²	55.7	48%	0.476	28%	0.284	S	S	.	.	S	Bend	trans	-117.1	142.3	178.3	56.2	0	0	0	0	112.7	C62 K66 Y77	C62-S64 PolarHBondContact O-N 2.97Å; C62-S64 PolarHBondContact SG-O 2.97Å; S64-K66 PolarHBondContact O-N 2.88Å; S64-Y77 WeakPolarHBondContact O-CE1 3.46Å; S64-Y77 PolarHBondContact O-OH 3.03Å
65	L	90.3	Very high	89.1	Confident	65 Å²	65	56.6 Å²	56.6	34%	0.34	29%	0.288	S	S	.	.			trans	-67.5	119	175.6	178.6	63.7	0	0	0	109.6	V82 K86	L65-V82 HydrophobicContact CB-CG1 4.03Å; L65-V82 HydrophobicContact CD1-CG1 4.28Å; L65-K86 HydrophobicContact CD2-CB 3.79Å
66	K	90.9	Very high	89.8	Confident	104 Å²	104	53.1 Å²	53.1	45%	0.452	27%	0.27	S	S	.	.			trans	-86.1	114.5	175.2	-63.1	-67.6	-176.7	174.7	0	108.8	C62 S64 P69 I75 Y77	C62-K66 VanDerWaalsContact SG-CE 3.56Å; S64-K66 PolarHBondContact O-N 2.88Å; K66-P69 HydrophobicContact CB-CG 3.92Å; K66-P69 WeakPolarHBondContact O-CD 3.36Å; K66-P69 WeakPolarHBondContact O-CG 3.26Å; K66-I75 HydrophobicContact CB-CD1 3.94Å; K66-I75 HydrophobicContact CG-CD1 3.96Å; K66-Y77 WeakPolarHBondContact CB-OH 3.45Å; K66-Y77 WeakPolarHBondContact CG-OH 3.17Å; K66-Y77 PolarHBondContact N-OH 2.92Å
67	T	92.4	Very high	90.5	Very high	104 Å²	104	45.9 Å²	45.9	64%	0.638	24%	0.242	S	C	*	.	S	Bend	trans	-76.7	130.4	176	-57.2	0	0	0	0	110.2
68	R	93.1	Very high	91	Very high	65 Å²	65	45.3 Å²	45.3	25%	0.245	24%	0.24	C	C	.	.	S	Bend	trans	41.8	62.9	-177.8	-59.2	-179.2	-169.9	160	0.6	113.7	K70 D87 G88 Y89 G181 Q182 P185	R68-K70 PolarHBondContact O-N 2.86Å; R68-D87 WeakPolarHBondContact CA-O 3.32Å; R68-D87 PolarHBondContact N-O 3.07Å; R68-G88 PolarHBondContact NE-O 3.28Å; R68-Y89 HydrophobicContact CB-CD1 4.22Å; R68-Y89 HydrophobicContact CB-CE1 3.84Å; R68-Y89 HydrophobicContact CB-CE2 4.3Å; R68-Y89 HydrophobicContact CG-CD1 4Å; R68-Y89 HydrophobicContact CG-CE1 4.11Å; R68-Y89 HydrophobicContact CG-CG 4.37Å; R68-G181 WeakPolarHBondContact CD-O 3.47Å; R68-G181 PolarHBondContact NH1-O 3.31Å; R68-Q182 VanDerWaalsContact NE-NE2 3.19Å; R68-P185 HydrophobicContact CB-CB 4.49Å; R68-P185 HydrophobicContact CB-CG 4.24Å; R68-P185 WeakPolarHBondContact O-CB 3.42Å
69	P	94.9	Very high	91.5	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.058	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-56.8	134.2	-178.5	-26.6	38.3	0	0	0	112.3	K66 I75 Y89 Y146	K66-P69 HydrophobicContact CB-CG 3.92Å; K66-P69 WeakPolarHBondContact O-CD 3.36Å; K66-P69 WeakPolarHBondContact O-CG 3.26Å; P69-I75 HydrophobicContact CB-CD1 3.9Å; P69-I75 HydrophobicContact CG-CD1 3.88Å; P69-Y89 VanDerWaalsContact O-CE2 3.28Å; P69-Y89 WeakPolarHBondContact O-CE2 3.43Å; P69-Y89 PolarHBondContact O-OH 3.01Å; P69-Y146 HydrophobicContact CB-CD2 3.65Å; P69-Y146 HydrophobicContact CB-CE2 3.71Å; P69-Y146 HydrophobicContact CB-CG 4.09Å; P69-Y146 HydrophobicContact CG-CD2 4.07Å; P69-Y146 HydrophobicContact CG-CE1 4.29Å; P69-Y146 HydrophobicContact CG-CE2 3.59Å
70	K	94.2	Very high	91.7	Very high	74 Å²	74	46.9 Å²	46.9	32%	0.322	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-61.6	160.5	-173.6	65.3	179.5	-151.4	156.4	0	112.7	E37 R68 G72 S73 H188	E37-K70 WeakPolarHBondContact OE2-CE 3.4Å; E37-K70 IonicContact OE2-NZ 2.76Å; E37-K70 PolarHBondContact OE2-NZ 2.85Å; R68-K70 PolarHBondContact O-N 2.86Å; K70-G72 PolarHBondContact O-N 3.01Å; K70-S73 VanDerWaalsContact CG-OG 3.25Å; K70-S73 WeakPolarHBondContact CG-OG 3.34Å; K70-S73 WeakPolarHBondContact O-CB 3.23Å; K70-S73 PolarHBondContact O-N 2.81Å; K70-S73 PolarHBondContact O-OG 2.89Å; K70-H188 HydrophobicContact CB-CB 4.01Å; K70-H188 PolarHBondContact NZ-CD2 3.14Å; K70-H188 PolarHBondContact NZ-NE2 3.11Å
71	N	94.2	Very high	91.6	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.016	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	139.4	172.5	-176.6	34.4	0	0	0	111.6	S73 N148 P185 H188 I190	N71-S73 PolarHBondContact O-N 3.18Å; N71-N148 WeakPolarHBondContact OD1-CB 3.49Å; N71-N148 PolarHBondContact OD1-N 2.79Å; N71-P185 PolarHBondContact N-O 2.75Å; N71-H188 HydrophobicContact CB-CB 4.12Å; N71-H188 VanDerWaalsContact CB-O 3.29Å; N71-H188 WeakPolarHBondContact CB-O 3.43Å; N71-H188 PolarHBondContact ND2-O 2.81Å; N71-I190 WeakPolarHBondContact ND2-CG1 3.17Å
72	G	93.1	Very high	91.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-12.4	-176.4	0	0	0	0	0	115.4	E37 R38 K70 I74 Y146	E37-G72 CarbonylContact C-O 3.52Å; E37-G72 WeakPolarHBondContact CA-O 3.46Å; R38-G72 PolarHBondContact N-O 2.82Å; R38-G72 WeakPolarHBondContact O-CA 3.38Å; K70-G72 PolarHBondContact O-N 3.01Å; G72-I74 PolarHBondContact O-N 3.32Å; G72-Y146 CarbonylContact C-O 3.54Å; G72-Y146 VanDerWaalsContact CA-O 3.23Å; G72-Y146 WeakPolarHBondContact CA-O 3.42Å; G72-Y146 PolarHBondContact N-O 3.32Å
73	S	95.8	Very high	91.9	Very high	14 Å²	14	58.8 Å²	58.8	10%	0.098	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-58.6	130	-175.4	-79.6	0	0	0	0	113.4	N36 K70 N71 H145 Y146	N36-S73 WeakPolarHBondContact O-CA 3.47Å; K70-S73 VanDerWaalsContact CG-OG 3.25Å; K70-S73 WeakPolarHBondContact CG-OG 3.34Å; K70-S73 WeakPolarHBondContact O-CB 3.23Å; K70-S73 PolarHBondContact O-N 2.81Å; K70-S73 PolarHBondContact O-OG 2.89Å; N71-S73 PolarHBondContact O-N 3.18Å; S73-H145 WeakPolarHBondContact O-CA 3.35Å; S73-Y146 PolarHBondContact N-O 3.32Å; S73-Y146 PolarHBondContact O-N 3.31Å
74	I	95.6	Very high	92.2	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.2	167.8	-63.9	164.6	0	0	0	107.6	L34 P35 N36 R38 N42 G72 L143 V144 H145	L34-I74 HydrophobicContact CD1-CG2 4.02Å; L34-I74 HydrophobicContact CG-CG2 4.39Å; P35-I74 HydrophobicContact CG-CD1 4.07Å; P35-I74 WeakPolarHBondContact O-CB 3.4Å; N36-I74 PolarHBondContact O-N 2.85Å; R38-I74 HydrophobicContact CB-CD1 3.52Å; R38-I74 HydrophobicContact CB-CG1 4.46Å; R38-I74 HydrophobicContact CG-CD1 4.42Å; N42-I74 VanDerWaalsContact ND2-CD1 3.32Å; N42-I74 WeakPolarHBondContact ND2-CD1 3.45Å; G72-I74 PolarHBondContact O-N 3.32Å; I74-L143 HydrophobicContact CG2-CD1 3.55Å; I74-L143 HydrophobicContact CG2-CG 4.28Å; I74-V144 CarbonylContact C-O 3.59Å; I74-V144 WeakPolarHBondContact CA-O 3.33Å; I74-H145 HydrophobicContact CG1-CB 4.3Å
75	I	94.9	Very high	92.5	Very high	19 Å²	19	57.3 Å²	57.3	10%	0.097	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	130.8	-178.1	-48.5	169.7	0	0	0	109.2	C62 K66 P69 Y77 V144 Y146	C62-I75 HydrophobicContact CB-CG2 3.44Å; C62-I75 VanDerWaalsContact CB-CG2 3.44Å; K66-I75 HydrophobicContact CB-CD1 3.94Å; K66-I75 HydrophobicContact CG-CD1 3.96Å; P69-I75 HydrophobicContact CB-CD1 3.9Å; P69-I75 HydrophobicContact CG-CD1 3.88Å; I75-Y77 HydrophobicContact CB-CD2 4.35Å; I75-Y77 HydrophobicContact CB-CE2 3.85Å; I75-Y77 HydrophobicContact CD1-CE2 4.33Å; I75-Y77 HydrophobicContact CG2-CD2 4Å; I75-Y77 HydrophobicContact CG2-CE1 4.14Å; I75-Y77 HydrophobicContact CG2-CE2 3.48Å; I75-Y77 VanDerWaalsContact CG2-CE2 3.48Å; I75-V144 PolarHBondContact N-O 3.03Å; I75-V144 PolarHBondContact O-N 2.98Å; I75-Y146 HydrophobicContact CD1-CE2 4.29Å
76	L	94.9	Very high	92.6	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.9	173.6	-161.7	70.4	0	0	0	110.1	L34 L51 F54 W60 L61 C62 I141 L143	L34-L76 HydrophobicContact CD2-CB 4.05Å; L51-L76 HydrophobicContact CD2-CD1 4Å; F54-L76 HydrophobicContact CB-CD2 3.63Å; W60-L76 HydrophobicContact CB-CD2 4.09Å; W60-L76 WeakPolarHBondContact O-CB 3.32Å; L61-L76 HydrophobicContact CD2-CB 4.5Å; L61-L76 HydrophobicContact CD2-CD2 3.68Å; L61-L76 HydrophobicContact CD2-CG 3.84Å; L61-L76 HydrophobicContact CG-CD2 4.44Å; C62-L76 WeakPolarHBondContact CB-O 3.34Å; C62-L76 PolarHBondContact N-O 3Å; L76-I141 HydrophobicContact CD1-CG2 3.69Å; L76-I141 HydrophobicContact CD2-CG2 3.99Å; L76-I141 HydrophobicContact CG-CG2 3.77Å; L76-L143 HydrophobicContact CD1-CB 3.91Å; L76-L143 HydrophobicContact CD1-CD1 3.84Å
77	Y	94.4	Very high	92.6	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.4	-176.8	-80	-63	0	0	0	112.2	C62 S64 K66 I75 V82 Y84 V142 V144	C62-Y77 HydrophobicContact CB-CD1 4.07Å; C62-Y77 HydrophobicContact CB-CE1 3.66Å; C62-Y77 WeakPolarHBondContact O-CD1 3.26Å; C62-Y77 VanDerWaalsContact O-CE1 3.29Å; C62-Y77 WeakPolarHBondContact O-CE1 3.36Å; S64-Y77 WeakPolarHBondContact O-CE1 3.46Å; S64-Y77 PolarHBondContact O-OH 3.03Å; K66-Y77 WeakPolarHBondContact CB-OH 3.45Å; K66-Y77 WeakPolarHBondContact CG-OH 3.17Å; K66-Y77 PolarHBondContact N-OH 2.92Å; I75-Y77 HydrophobicContact CB-CD2 4.35Å; I75-Y77 HydrophobicContact CB-CE2 3.85Å; I75-Y77 HydrophobicContact CD1-CE2 4.33Å; I75-Y77 HydrophobicContact CG2-CD2 4Å; I75-Y77 HydrophobicContact CG2-CE1 4.14Å; I75-Y77 HydrophobicContact CG2-CE2 3.48Å; I75-Y77 VanDerWaalsContact CG2-CE2 3.48Å; Y77-V82 HydrophobicContact CD1-CB 3.82Å; Y77-V82 HydrophobicContact CD1-CG1 3.73Å; Y77-V82 HydrophobicContact CD1-CG2 4.17Å; Y77-V82 HydrophobicContact CE1-CB 4.27Å; Y77-V82 HydrophobicContact CE1-CG1 3.72Å; Y77-Y84 HydrophobicContact CD2-CG 4.44Å; Y77-V142 PolarHBondContact N-O 3.29Å; Y77-V142 PolarHBondContact O-N 2.91Å; Y77-V144 HydrophobicContact CD2-CB 4.42Å; Y77-V144 HydrophobicContact CD2-CG2 3.92Å
78	N	91.6	Very high	92.6	Very high	18 Å²	18	53.3 Å²	53.3	10%	0.096	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	115	161.5	-178	-65.7	0	0	0	109.2	K80 K81 V82 I141	N78-K80 VanDerWaalsContact C-N 3.28Å; N78-K80 PolarHBondContact O-N 3.49Å; N78-K80 WeakPolarHBondContact OD1-CB 3.17Å; N78-K80 PolarHBondContact OD1-N 2.86Å; N78-K81 HydrophobicContact CB-CB 4.4Å; N78-K81 PolarHBondContact O-N 3.03Å; N78-K81 PolarHBondContact OD1-N 3.44Å; N78-K81 VanDerWaalsContact OD1-N 3.15Å; N78-V82 PolarHBondContact O-N 3.08Å; N78-I141 HydrophobicContact CB-CD1 4.08Å
79	R	89.4	Confident	92.6	Very high	109 Å²	109	50.9 Å²	50.9	41%	0.411	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-26.1	-173.5	78.2	-177	173.3	176.1	-1.4	114.1	Y84 P139 D140 V142	R79-Y84 HydrophobicContact CB-CE1 4.34Å; R79-P139 WeakPolarHBondContact CD-O 3.28Å; R79-P139 PolarHBondContact NE-O 2.94Å; R79-P139 VanDerWaalsContact NE-O 3.08Å; R79-P139 PolarHBondContact NH1-O 3.03Å; R79-P139 VanDerWaalsContact NH1-O 3.17Å; R79-D140 IonicContact CZ-OD1 2.69Å; R79-D140 PolarHBondContact N-O 3.32Å; R79-D140 IonicContact NE-OD1 2.74Å; R79-D140 PolarHBondContact NE-OD1 2.83Å; R79-D140 IonicContact NH2-OD1 3.65Å; R79-D140 PolarHBondContact NH2-OD1 3.3Å; R79-V142 HydrophobicContact CB-CG2 4.21Å
80	K	87.6	Confident	92.4	Very high	158 Å²	158	52.2 Å²	52.2	69%	0.687	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-33.4	177.9	-71.3	175.7	168.6	163.1	0	110.7	N78 D140	N78-K80 VanDerWaalsContact C-N 3.28Å; N78-K80 PolarHBondContact O-N 3.49Å; N78-K80 WeakPolarHBondContact OD1-CB 3.17Å; N78-K80 PolarHBondContact OD1-N 2.86Å; K80-D140 WeakPolarHBondContact CD-OD2 3.39Å; K80-D140 VanDerWaalsContact CE-OD1 3.23Å; K80-D140 WeakPolarHBondContact CE-OD1 3.26Å; K80-D140 WeakPolarHBondContact CE-OD2 3.41Å; K80-D140 IonicContact NZ-OD1 2.7Å; K80-D140 IonicContact NZ-OD2 2.68Å; K80-D140 PolarHBondContact NZ-OD2 3.41Å
81	K	88.4	Confident	92.3	Very high	148 Å²	148	49.6 Å²	49.6	64%	0.643	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-43.6	175.3	-64.7	-169.3	175.9	-170.4	0	113.6	N78	N78-K81 HydrophobicContact CB-CB 4.4Å; N78-K81 PolarHBondContact O-N 3.03Å; N78-K81 PolarHBondContact OD1-N 3.44Å; N78-K81 VanDerWaalsContact OD1-N 3.15Å
82	V	91.2	Very high	92.1	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.055	24%	0.244	C	C	.	.			trans	-122.8	122.4	-169.5	-173.3	0	0	0	0	112.6	C63 L65 Y77 N78 Y84	C63-V82 WeakPolarHBondContact O-CG2 3.25Å; L65-V82 HydrophobicContact CB-CG1 4.03Å; L65-V82 HydrophobicContact CD1-CG1 4.28Å; Y77-V82 HydrophobicContact CD1-CB 3.82Å; Y77-V82 HydrophobicContact CD1-CG1 3.73Å; Y77-V82 HydrophobicContact CD1-CG2 4.17Å; Y77-V82 HydrophobicContact CE1-CB 4.27Å; Y77-V82 HydrophobicContact CE1-CG1 3.72Å; N78-V82 PolarHBondContact O-N 3.08Å; V82-Y84 PolarHBondContact O-N 3.39Å
83	K	91.3	Very high	91.8	Very high	167 Å²	167	58.2 Å²	58.2	73%	0.726	26%	0.264	S	S	*	.			trans	-77.7	62.1	175	-65.1	-175.4	179.5	178.3	0	111.4	R85 K86	K83-R85 PolarHBondContact O-N 3.12Å; K83-K86 WeakPolarHBondContact O-CB 3.43Å; K83-K86 PolarHBondContact O-N 2.84Å
84	Y	92.3	Very high	91.2	Very high	14 Å²	14	63.9 Å²	63.9	6%	0.055	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-50.4	-29	-171.9	71	-95.3	0	0	0	115.1	Y77 R79 V82 K86 D87 C132 V142 V144	Y77-Y84 HydrophobicContact CD2-CG 4.44Å; R79-Y84 HydrophobicContact CB-CE1 4.34Å; V82-Y84 PolarHBondContact O-N 3.39Å; Y84-K86 PolarHBondContact O-N 2.66Å; Y84-K86 VanDerWaalsContact O-N 3.08Å; Y84-D87 PolarHBondContact O-N 2.95Å; Y84-C132 HydrophobicContact CE2-CB 4.26Å; Y84-V142 HydrophobicContact CE1-CB 4.2Å; Y84-V142 HydrophobicContact CE1-CG1 4.07Å; Y84-V142 HydrophobicContact CE1-CG2 4.02Å; Y84-V142 HydrophobicContact CE2-CG1 4.38Å; Y84-V144 HydrophobicContact CD2-CG2 3.84Å; Y84-V144 HydrophobicContact CE2-CG2 4.25Å; Y84-V144 HydrophobicContact CG-CG2 4.27Å
85	R	91.8	Very high	90.3	Very high	118 Å²	118	74.3 Å²	74.3	45%	0.445	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-61.6	-12.8	175.1	-75.1	-167.4	171.1	103	-8.6	114.2	K83 D87 E102	K83-R85 PolarHBondContact O-N 3.12Å; R85-D87 PolarHBondContact O-N 3.3Å; R85-E102 IonicContact CZ-OE1 3.94Å; R85-E102 IonicContact CZ-OE2 3.97Å; R85-E102 VanDerWaalsContact CZ-OE2 3.25Å; R85-E102 IonicContact NE-OE1 3.34Å; R85-E102 PolarHBondContact NE-OE1 2.78Å; R85-E102 IonicContact NE-OE2 3.63Å; R85-E102 PolarHBondContact NE-OE2 2.99Å; R85-E102 IonicContact NH2-OE2 3.56Å; R85-E102 PolarHBondContact NH2-OE2 3.49Å
86	K	91.8	Very high	89.4	Confident	153 Å²	153	77.5 Å²	77.5	67%	0.665	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-86.3	27.9	174.2	-72.1	-165.6	170.6	-166.4	0	113.6	L65 K83 Y84 G88	L65-K86 HydrophobicContact CD2-CB 3.79Å; K83-K86 WeakPolarHBondContact O-CB 3.43Å; K83-K86 PolarHBondContact O-N 2.84Å; Y84-K86 PolarHBondContact O-N 2.66Å; Y84-K86 VanDerWaalsContact O-N 3.08Å; K86-G88 PolarHBondContact O-N 3.23Å
87	D	92.8	Very high	88.4	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.011	36%	0.363	C	S	.	.	S	Bend	trans	-55.4	-3.6	-179.9	60.4	23.7	0	0	0	116.7	R68 Y84 R85 Y89 W91 R130 Y146	R68-D87 WeakPolarHBondContact CA-O 3.32Å; R68-D87 PolarHBondContact N-O 3.07Å; Y84-D87 PolarHBondContact O-N 2.95Å; R85-D87 PolarHBondContact O-N 3.3Å; D87-Y89 PolarHBondContact O-N 3.44Å; D87-Y89 PolarHBondContact OD1-N 3.16Å; D87-W91 VanDerWaalsContact CG-NE1 3.32Å; D87-W91 PolarHBondContact OD1-NE1 3.45Å; D87-W91 WeakPolarHBondContact OD2-CZ2 3.49Å; D87-W91 PolarHBondContact OD2-NE1 3.08Å; D87-R130 WeakPolarHBondContact OD2-CD 3.1Å; D87-R130 IonicContact OD2-CZ 3.34Å; D87-R130 IonicContact OD2-NE 2.66Å; D87-R130 IonicContact OD2-NH1 2.81Å; D87-R130 PolarHBondContact OD2-NH1 3.24Å; D87-Y146 HydrophobicContact CB-CE1 4.25Å; D87-Y146 WeakPolarHBondContact CB-OH 3.39Å; D87-Y146 PolarHBondContact OD2-OH 3.42Å
88	G	90.9	Very high	87.5	Confident	35 Å²	35	87.7 Å²	87.7	36%	0.361	40%	0.4	S	S	.	.	S	Bend	trans	74.9	7.1	176.4	0	0	0	0	0	114.6	R68 K86 Q182	R68-G88 PolarHBondContact NE-O 3.28Å; K86-G88 PolarHBondContact O-N 3.23Å; G88-Q182 PolarHBondContact O-NE2 3.43Å
89	Y	93.4	Very high	87	Confident	13 Å²	13	89.8 Å²	89.8	5%	0.051	41%	0.414	C	S	.	.			trans	-88.4	148.3	172	-79.8	-55.1	0	0	0	112.2	R68 P69 D87 W91 F128 Y146 P185 M186	R68-Y89 HydrophobicContact CB-CD1 4.22Å; R68-Y89 HydrophobicContact CB-CE1 3.84Å; R68-Y89 HydrophobicContact CB-CE2 4.3Å; R68-Y89 HydrophobicContact CG-CD1 4Å; R68-Y89 HydrophobicContact CG-CE1 4.11Å; R68-Y89 HydrophobicContact CG-CG 4.37Å; P69-Y89 VanDerWaalsContact O-CE2 3.28Å; P69-Y89 WeakPolarHBondContact O-CE2 3.43Å; P69-Y89 PolarHBondContact O-OH 3.01Å; D87-Y89 PolarHBondContact O-N 3.44Å; D87-Y89 PolarHBondContact OD1-N 3.16Å; Y89-W91 HydrophobicContact CD2-CH2 4.37Å; Y89-W91 AromaticContact CD2-CZ2 3.77Å; Y89-W91 HydrophobicContact CD2-CZ2 3.77Å; Y89-W91 HydrophobicContact CG-CZ2 4.01Å; Y89-W91 VanDerWaalsContact O-CD1 3.26Å; Y89-W91 PolarHBondContact O-N 3.44Å; Y89-F128 HydrophobicContact CD1-CE1 4.31Å; Y89-F128 AromaticContact CD2-CE1 3.96Å; Y89-F128 HydrophobicContact CD2-CE1 3.96Å; Y89-F128 HydrophobicContact CD2-CZ 4.39Å; Y89-F128 HydrophobicContact CE1-CE1 4.02Å; Y89-F128 HydrophobicContact CE1-CZ 4.28Å; Y89-F128 AromaticContact CE2-CE1 3.63Å; Y89-F128 HydrophobicContact CE2-CE1 3.63Å; Y89-F128 AromaticContact CE2-CZ 3.62Å; Y89-F128 HydrophobicContact CE2-CZ 3.62Å; Y89-F128 HydrophobicContact CG-CE1 4.25Å; Y89-F128 AromaticContact CZ-CE1 3.64Å; Y89-F128 AromaticContact CZ-CZ 3.53Å; Y89-F128 WeakPolarHBondContact OH-CZ 3.28Å; Y89-Y146 HydrophobicContact CD2-CD1 4.13Å; Y89-Y146 HydrophobicContact CD2-CE1 4.04Å; Y89-Y146 AromaticContact CE2-CD1 3.9Å; Y89-Y146 HydrophobicContact CE2-CD1 3.9Å; Y89-Y146 HydrophobicContact CE2-CE1 4.17Å; Y89-P185 HydrophobicContact CE1-CB 4.49Å; Y89-P185 VanDerWaalsContact OH-CB 3.27Å; Y89-P185 WeakPolarHBondContact OH-CB 3.42Å; Y89-M186 HydrophobicContact CD1-CE 3.32Å; Y89-M186 HydrophobicContact CE1-CE 3.49Å; Y89-M186 VanDerWaalsContact CE1-CE 3.49Å; Y89-M186 HydrophobicContact CE1-CG 3.79Å; Y89-M186 HydrophobicContact CG-CE 4.29Å
90	C	90.6	Very high	86.9	Confident	37 Å²	37	87.1 Å²	87.1	25%	0.25	41%	0.409	C	S	.	.			trans	-88	93.4	-179.9	-67.2	0	0	0	0	111.4	S123 I124 W174 Q182	C90-S123 WeakPolarHBondContact CB-OG 3.37Å; C90-S123 WeakPolarHBondContact O-CB 3.25Å; C90-S123 PolarHBondContact O-N 2.82Å; C90-S123 PolarHBondContact O-OG 3.37Å; C90-I124 HydrophobicContact CB-CD1 4.14Å; C90-I124 HydrophobicContact CB-CG1 4.44Å; C90-W174 HydrophobicContact CB-CH2 3.94Å; C90-W174 VanDerWaalsContact SG-CH2 3.6Å; C90-Q182 PolarHBondContact SG-NE2 3.44Å; C90-Q182 VanDerWaalsContact SG-NE2 3.42Å
91	W	92.7	Very high	86.9	Confident	20 Å²	20	85.1 Å²	85.1	8%	0.076	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-84.1	147.7	-178.2	-60.1	109.6	0	0	0	114.2	D87 Y89 K93 T100 V120 F128 R130 Y146	D87-W91 VanDerWaalsContact CG-NE1 3.32Å; D87-W91 PolarHBondContact OD1-NE1 3.45Å; D87-W91 WeakPolarHBondContact OD2-CZ2 3.49Å; D87-W91 PolarHBondContact OD2-NE1 3.08Å; Y89-W91 HydrophobicContact CD2-CH2 4.37Å; Y89-W91 AromaticContact CD2-CZ2 3.77Å; Y89-W91 HydrophobicContact CD2-CZ2 3.77Å; Y89-W91 HydrophobicContact CG-CZ2 4.01Å; Y89-W91 VanDerWaalsContact O-CD1 3.26Å; Y89-W91 PolarHBondContact O-N 3.44Å; W91-K93 PolarHBondContact O-N 3.3Å; W91-T100 HydrophobicContact CB-CG2 3.74Å; W91-V120 HydrophobicContact CB-CG2 3.88Å; W91-V120 HydrophobicContact CD2-CG1 3.91Å; W91-V120 HydrophobicContact CD2-CG2 4.14Å; W91-V120 HydrophobicContact CE3-CB 4.33Å; W91-V120 HydrophobicContact CE3-CG1 3.7Å; W91-V120 HydrophobicContact CE3-CG2 3.87Å; W91-V120 HydrophobicContact CG-CG1 4.48Å; W91-V120 HydrophobicContact CG-CG2 4.17Å; W91-V120 HydrophobicContact CZ3-CG1 4.07Å; W91-F128 AromaticContact CH2-CD1 3.99Å; W91-F128 HydrophobicContact CH2-CD1 3.99Å; W91-F128 AromaticContact CH2-CE1 3.7Å; W91-F128 HydrophobicContact CH2-CE1 3.7Å; W91-F128 HydrophobicContact CZ2-CE1 4.46Å; W91-F128 HydrophobicContact CZ3-CD1 4.27Å; W91-F128 HydrophobicContact CZ3-CE1 4.42Å; W91-R130 HydrophobicContact CH2-CB 3.44Å; W91-R130 VanDerWaalsContact CH2-CB 3.44Å; W91-R130 HydrophobicContact CZ2-CB 3.65Å; W91-R130 HydrophobicContact CZ2-CG 4.48Å; W91-R130 HydrophobicContact CZ3-CB 4.07Å; W91-Y146 HydrophobicContact CH2-CD1 4.44Å; W91-Y146 HydrophobicContact CZ2-CD1 4.32Å; W91-Y146 HydrophobicContact CZ2-CE1 4.09Å
92	K	90.1	Very high	87.1	Confident	87 Å²	87	78.8 Å²	78.8	38%	0.378	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-64.2	127.8	179	-165.6	168.6	-165.8	161.6	0	111.1	R101 H121	K92-R101 WeakPolarHBondContact O-CB 3.5Å; K92-R101 PolarHBondContact O-N 3.33Å; K92-H121 VanDerWaalsContact CB-O 3.27Å; K92-H121 WeakPolarHBondContact CB-O 3.09Å; K92-H121 HydrophobicContact CD-CB 4.47Å; K92-H121 PolarHBondContact N-O 2.86Å
93	K	86.8	Confident	87	Confident	96 Å²	96	81 Å²	81	42%	0.417	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-94.8	164.9	-177.3	-60.3	-164.4	-174.8	-177.1	0	113.5	W91 G97 T99	W91-K93 PolarHBondContact O-N 3.3Å; K93-G97 WeakPolarHBondContact CD-O 3.48Å; K93-G97 PolarHBondContact NZ-O 2.68Å; K93-G97 VanDerWaalsContact NZ-O 3.1Å; K93-T99 CarbonylContact C-O 3.58Å; K93-T99 VanDerWaalsContact CA-O 3.29Å; K93-T99 WeakPolarHBondContact CA-O 3.45Å; K93-T99 WeakPolarHBondContact CB-O 3.34Å
94	R	83.3	Confident	87	Confident	133 Å²	133	77.2 Å²	77.2	50%	0.502	37%	0.367	S	S	.	.			trans	-77.5	178.2	171.1	-61.2	-173	178.7	-167.8	-5.7	110.3	D96 G97 T99 R101 E102	R94-D96 VanDerWaalsContact C-OD1 3.31Å; R94-D96 WeakPolarHBondContact CB-OD1 3.21Å; R94-D96 PolarHBondContact O-N 2.89Å; R94-D96 VanDerWaalsContact O-N 3.14Å; R94-G97 PolarHBondContact O-N 2.93Å; R94-G97 VanDerWaalsContact O-N 3.14Å; R94-T99 WeakPolarHBondContact CD-OG1 3.38Å; R94-T99 PolarHBondContact N-O 2.83Å; R94-R101 HydrophobicContact CG-CB 3.87Å; R94-R101 HydrophobicContact CG-CG 4.23Å; R94-E102 PolarHBondContact NH2-O 3.38Å
95	K	77.3	Confident	87	Confident	223 Å²	223	80.6 Å²	80.6	97%	0.97	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.9	-176.2	-68.7	-178	-179.1	175.5	0	114.3
96	D	75.1	Confident	87.1	Confident	86 Å²	86	81.2 Å²	81.2	46%	0.46	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.6	177.1	65.2	-19	0	0	0	113.5	R94 K98 T99	R94-D96 VanDerWaalsContact C-OD1 3.31Å; R94-D96 WeakPolarHBondContact CB-OD1 3.21Å; R94-D96 PolarHBondContact O-N 2.89Å; R94-D96 VanDerWaalsContact O-N 3.14Å; D96-K98 PolarHBondContact O-N 3.42Å; D96-K98 PolarHBondContact OD1-N 3.38Å; D96-T99 VanDerWaalsContact CG-OG1 3.29Å; D96-T99 PolarHBondContact OD1-N 2.96Å; D96-T99 PolarHBondContact OD1-OG1 2.83Å; D96-T99 WeakPolarHBondContact OD2-CB 3.44Å; D96-T99 WeakPolarHBondContact OD2-CG2 3.45Å; D96-T99 PolarHBondContact OD2-N 3.14Å; D96-T99 PolarHBondContact OD2-OG1 2.85Å
97	G	73.6	Confident	87.1	Confident	34 Å²	34	75.2 Å²	75.2	35%	0.351	37%	0.365	S	S	.	.	S	Bend	trans	66.8	-2.4	-173.6	0	0	0	0	0	115.2	K93 R94	K93-G97 WeakPolarHBondContact CD-O 3.48Å; K93-G97 PolarHBondContact NZ-O 2.68Å; K93-G97 VanDerWaalsContact NZ-O 3.1Å; R94-G97 PolarHBondContact O-N 2.93Å; R94-G97 VanDerWaalsContact O-N 3.14Å
98	K	75.1	Confident	87	Confident	181 Å²	181	80.2 Å²	80.2	79%	0.787	39%	0.386	S	S	*	.	S	Bend	trans	-104.1	-46.7	-173.5	-168.6	173.9	-177.3	179.2	0	111.8	D96	D96-K98 PolarHBondContact O-N 3.42Å; D96-K98 PolarHBondContact OD1-N 3.38Å
99	T	81.8	Confident	86.9	Confident	63 Å²	63	78.6 Å²	78.6	39%	0.387	37%	0.369	S	S	.	.	S	Bend	trans	-94.5	144.2	-178	55.5	0	0	0	0	113.1	K93 R94 D96	K93-T99 CarbonylContact C-O 3.58Å; K93-T99 VanDerWaalsContact CA-O 3.29Å; K93-T99 WeakPolarHBondContact CA-O 3.45Å; K93-T99 WeakPolarHBondContact CB-O 3.34Å; R94-T99 WeakPolarHBondContact CD-OG1 3.38Å; R94-T99 PolarHBondContact N-O 2.83Å; D96-T99 VanDerWaalsContact CG-OG1 3.29Å; D96-T99 PolarHBondContact OD1-N 2.96Å; D96-T99 PolarHBondContact OD1-OG1 2.83Å; D96-T99 WeakPolarHBondContact OD2-CB 3.44Å; D96-T99 WeakPolarHBondContact OD2-CG2 3.45Å; D96-T99 PolarHBondContact OD2-N 3.14Å; D96-T99 PolarHBondContact OD2-OG1 2.85Å
100	T	87.3	Confident	86.5	Confident	52 Å²	52	83.1 Å²	83.1	32%	0.319	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-68.7	139.7	171.9	-56.1	0	0	0	0	110.2	W91 E102 V120	W91-T100 HydrophobicContact CB-CG2 3.74Å; T100-E102 VanDerWaalsContact C-N 3.28Å; T100-E102 HydrophobicContact CG2-CG 3.83Å; T100-E102 PolarHBondContact O-N 2.82Å; T100-V120 HydrophobicContact CG2-CG2 3.61Å
101	R	88.6	Confident	86	Confident	117 Å²	117	83.8 Å²	83.8	44%	0.442	41%	0.405	S	S	.	.			trans	-83	77.9	172.1	-170.9	-173.3	161.9	174.1	-9.2	109.8	K92 R94 D103	K92-R101 WeakPolarHBondContact O-CB 3.5Å; K92-R101 PolarHBondContact O-N 3.33Å; R94-R101 HydrophobicContact CG-CB 3.87Å; R94-R101 HydrophobicContact CG-CG 4.23Å; R101-D103 IonicContact NE-OD1 3.7Å; R101-D103 PolarHBondContact NE-OD1 2.95Å; R101-D103 IonicContact NE-OD2 2.69Å; R101-D103 IonicContact NH2-OD1 3.61Å; R101-D103 IonicContact NH2-OD2 3.82Å; R101-D103 PolarHBondContact NH2-OD2 3.04Å
102	E	91.1	Very high	85.6	Confident	15 Å²	15	86.1 Å²	86.1	7%	0.07	42%	0.417	C	S	.	.			trans	-84.2	130	163.7	-53.6	-171.2	167.8	0	0	108.8	R85 R94 T100 H104 Y119 V120 R130	R85-E102 IonicContact CZ-OE1 3.94Å; R85-E102 IonicContact CZ-OE2 3.97Å; R85-E102 VanDerWaalsContact CZ-OE2 3.25Å; R85-E102 IonicContact NE-OE1 3.34Å; R85-E102 PolarHBondContact NE-OE1 2.78Å; R85-E102 IonicContact NE-OE2 3.63Å; R85-E102 PolarHBondContact NE-OE2 2.99Å; R85-E102 IonicContact NH2-OE2 3.56Å; R85-E102 PolarHBondContact NH2-OE2 3.49Å; R94-E102 PolarHBondContact NH2-O 3.38Å; T100-E102 VanDerWaalsContact C-N 3.28Å; T100-E102 HydrophobicContact CG2-CG 3.83Å; T100-E102 PolarHBondContact O-N 2.82Å; E102-H104 IonicContact OE2-NE2 2.99Å; E102-Y119 WeakPolarHBondContact CA-O 3.24Å; E102-V120 HydrophobicContact CG-CB 4.27Å; E102-R130 IonicContact OE1-NH2 3.04Å; E102-R130 PolarHBondContact OE1-NH2 3.25Å
103	D	89.6	Confident	85.6	Confident	55 Å²	55	86.1 Å²	86.1	29%	0.294	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	136.1	170.9	-63.4	-37.3	0	0	0	107.8	R101 C118 Y119	R101-D103 IonicContact NE-OD1 3.7Å; R101-D103 PolarHBondContact NE-OD1 2.95Å; R101-D103 IonicContact NE-OD2 2.69Å; R101-D103 IonicContact NH2-OD1 3.61Å; R101-D103 IonicContact NH2-OD2 3.82Å; R101-D103 PolarHBondContact NH2-OD2 3.04Å; D103-C118 WeakPolarHBondContact O-CA 3.43Å; D103-Y119 PolarHBondContact N-O 3.4Å; D103-Y119 PolarHBondContact O-N 3.45Å
104	H	91.6	Very high	85.7	Confident	88 Å²	88	81.6 Å²	81.6	41%	0.407	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.3	-166.5	-73.2	-147	0	0	0	112.5	E102 Y116 G117	E102-H104 IonicContact OE2-NE2 2.99Å; H104-Y116 HydrophobicContact CB-CE1 4.05Å; H104-Y116 AromaticContact CG-CE1 3.98Å; H104-Y116 AromaticContact ND1-CE1 3.47Å; H104-Y116 WeakPolarHBondContact ND1-CE1 3.15Å; H104-Y116 AromaticContact ND1-CZ 3.61Å; H104-Y116 PolarHBondContact ND1-OH 3.05Å; H104-G117 WeakPolarHBondContact CA-O 3.39Å
105	M	92.4	Very high	86.1	Confident	85 Å²	85	75.3 Å²	75.3	42%	0.419	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	146.9	178.7	60.9	-165.6	77	0	0	113.2	L107 G117	M105-L107 HydrophobicContact CG-CD2 4.08Å; M105-L107 HydrophobicContact CG-CG 4.14Å; M105-L107 HydrophobicContact SD-CD2 3.9Å; M105-L107 HydrophobicContact SD-CG 4.48Å; M105-G117 PolarHBondContact N-O 3.2Å; M105-G117 PolarHBondContact O-N 3.2Å
106	K	92.9	Very high	87	Confident	130 Å²	130	67.6 Å²	67.6	57%	0.565	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	146	158.4	-67.1	-174.3	-179.8	-178	0	109.1	E113 L115 Y116	K106-E113 WeakPolarHBondContact CD-OE2 3.15Å; K106-L115 CarbonylContact C-O 3.55Å; K106-L115 WeakPolarHBondContact CA-O 3.36Å; K106-Y116 HydrophobicContact CG-CD2 4.43Å
107	L	92.5	Very high	88	Confident	27 Å²	27	63.6 Å²	63.6	14%	0.141	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.3	-177.5	-67.5	173.7	0	0	0	110.7	M105 L115 Y133	M105-L107 HydrophobicContact CG-CD2 4.08Å; M105-L107 HydrophobicContact CG-CG 4.14Å; M105-L107 HydrophobicContact SD-CD2 3.9Å; M105-L107 HydrophobicContact SD-CG 4.48Å; L107-L115 HydrophobicContact CB-CB 3.87Å; L107-L115 PolarHBondContact N-O 3.41Å; L107-L115 PolarHBondContact O-N 2.95Å; L107-Y133 HydrophobicContact CD1-CD1 3.97Å; L107-Y133 HydrophobicContact CD1-CE1 3.9Å
108	K	90.7	Very high	89	Confident	108 Å²	108	62.1 Å²	62.1	47%	0.47	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.8	178.7	-70.2	174.5	-172.6	-73.8	0	111.1	N44 G111 M112 E113	N44-K108 PolarHBondContact ND2-O 2.89Å; K108-G111 WeakPolarHBondContact CD-O 3.44Å; K108-G111 WeakPolarHBondContact CG-O 3.35Å; K108-G111 PolarHBondContact NZ-O 3.47Å; K108-M112 CarbonylContact C-O 3.56Å; K108-M112 WeakPolarHBondContact CA-O 3.3Å; K108-E113 HydrophobicContact CD-CG 4.29Å; K108-E113 WeakPolarHBondContact CE-OE1 3.47Å; K108-E113 HydrophobicContact CG-CG 3.48Å; K108-E113 VanDerWaalsContact CG-CG 3.48Å; K108-E113 IonicContact NZ-OE1 2.68Å; K108-E113 PolarHBondContact NZ-OE1 3.1Å
109	V	88.9	Confident	89.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126	166.3	-179	0	0	0	0	106.8	L24 L28 N44 E45 A48 G111 M112 L115	L24-V109 HydrophobicContact CD1-CB 4.33Å; L28-V109 HydrophobicContact CD1-CG1 3.95Å; L28-V109 HydrophobicContact CD2-CG1 3.96Å; L28-V109 HydrophobicContact CG-CG1 4.45Å; N44-V109 HydrophobicContact CB-CG2 3.72Å; N44-V109 WeakPolarHBondContact O-CG2 3.2Å; E45-V109 HydrophobicContact CG-CG1 4.13Å; A48-V109 HydrophobicContact CB-CG2 4Å; V109-G111 PolarHBondContact O-N 2.86Å; V109-M112 PolarHBondContact N-O 3.33Å; V109-M112 PolarHBondContact O-N 3.15Å; V109-L115 HydrophobicContact CG2-CD1 3.81Å; V109-L115 HydrophobicContact CG2-CG 4.43Å
110	Q	83.8	Confident	90.5	Very high	108 Å²	108	52.8 Å²	52.8	51%	0.505	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	33.6	-174.7	-62.3	173.8	-4.4	0	0	113.4	C27 M112	C27-Q110 PolarHBondContact O-NE2 3.42Å; Q110-M112 VanDerWaalsContact C-N 3.35Å; Q110-M112 PolarHBondContact O-N 2.96Å
111	G	81.4	Confident	90.8	Very high	52 Å²	52	52.5 Å²	52.5	54%	0.536	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-23.2	-177.5	0	0	0	0	0	115.9	K108 V109	K108-G111 WeakPolarHBondContact CD-O 3.44Å; K108-G111 WeakPolarHBondContact CG-O 3.35Å; K108-G111 PolarHBondContact NZ-O 3.47Å; V109-G111 PolarHBondContact O-N 2.86Å
112	M	84.3	Confident	90.9	Very high	68 Å²	68	47.1 Å²	47.1	34%	0.335	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	132.2	-178.2	-60.8	-177.1	66.6	0	0	111.8	P21 K23 L24 K108 V109 Q110 C114	P21-M112 HydrophobicContact CB-CE 3.71Å; P21-M112 HydrophobicContact CG-CE 3.97Å; K23-M112 HydrophobicContact CB-SD 4.3Å; L24-M112 HydrophobicContact CB-SD 4.5Å; L24-M112 HydrophobicContact CD1-CB 4.11Å; L24-M112 HydrophobicContact CD1-SD 4.23Å; K108-M112 CarbonylContact C-O 3.56Å; K108-M112 WeakPolarHBondContact CA-O 3.3Å; V109-M112 PolarHBondContact N-O 3.33Å; V109-M112 PolarHBondContact O-N 3.15Å; Q110-M112 VanDerWaalsContact C-N 3.35Å; Q110-M112 PolarHBondContact O-N 2.96Å; M112-C114 PolarHBondContact O-N 2.04Å
113	E	89.4	Confident	90.7	Very high	87 Å²	87	47.6 Å²	47.6	41%	0.407	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	101.3	171.3	-73.5	-179.6	-145.9	0	0	110.2	K106 K108 L136	K106-E113 WeakPolarHBondContact CD-OE2 3.15Å; K108-E113 HydrophobicContact CD-CG 4.29Å; K108-E113 WeakPolarHBondContact CE-OE1 3.47Å; K108-E113 HydrophobicContact CG-CG 3.48Å; K108-E113 VanDerWaalsContact CG-CG 3.48Å; K108-E113 IonicContact NZ-OE1 2.68Å; K108-E113 PolarHBondContact NZ-OE1 3.1Å; E113-L136 HydrophobicContact CB-CD1 4.46Å; E113-L136 WeakPolarHBondContact O-CD1 3.48Å
114	C	88.3	Confident	90.5	Very high	2 Å²	2	45 Å²	45	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	-16.5	-180	61.2	0	0	0	0	113.4	L24 M112 L135 L136	L24-C114 HydrophobicContact CD1-CB 3.94Å; M112-C114 PolarHBondContact O-N 2.04Å; C114-L135 CarbonylContact O-C 3.58Å; C114-L135 WeakPolarHBondContact O-CA 3.39Å; C114-L136 PolarHBondContact O-N 2.74Å
115	L	93.1	Very high	90.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.3	-175.5	-75.8	175.5	0	0	0	111.9	N44 I47 A48 L51 K106 L107 V109 L135	N44-L115 HydrophobicContact CB-CD1 4.35Å; N44-L115 WeakPolarHBondContact O-CD1 3.38Å; I47-L115 HydrophobicContact CB-CD1 4.1Å; I47-L115 HydrophobicContact CG2-CD1 3.68Å; I47-L115 HydrophobicContact CG2-CD2 3.94Å; I47-L115 HydrophobicContact CG2-CG 4.48Å; A48-L115 HydrophobicContact CB-CD1 4.17Å; L51-L115 HydrophobicContact CD1-CD2 3.52Å; K106-L115 CarbonylContact C-O 3.55Å; K106-L115 WeakPolarHBondContact CA-O 3.36Å; L107-L115 HydrophobicContact CB-CB 3.87Å; L107-L115 PolarHBondContact N-O 3.41Å; L107-L115 PolarHBondContact O-N 2.95Å; V109-L115 HydrophobicContact CG2-CD1 3.81Å; V109-L115 HydrophobicContact CG2-CG 4.43Å; L115-L135 HydrophobicContact CD2-CD2 3.95Å; L115-L135 HydrophobicContact CD2-CG 4.44Å
116	Y	95.6	Very high	89.9	Confident	62 Å²	62	39.1 Å²	39.1	24%	0.243	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.4	164.8	-159.3	-74.6	0	0	0	108.9	H104 K106 Y133 W134 L136	H104-Y116 HydrophobicContact CB-CE1 4.05Å; H104-Y116 AromaticContact CG-CE1 3.98Å; H104-Y116 AromaticContact ND1-CE1 3.47Å; H104-Y116 WeakPolarHBondContact ND1-CE1 3.15Å; H104-Y116 AromaticContact ND1-CZ 3.61Å; H104-Y116 PolarHBondContact ND1-OH 3.05Å; K106-Y116 HydrophobicContact CG-CD2 4.43Å; Y116-Y133 VanDerWaalsContact O-CA 3.26Å; Y116-Y133 WeakPolarHBondContact O-CA 3.37Å; Y116-W134 HydrophobicContact CD1-CD2 4.48Å; Y116-W134 AromaticContact CD1-CE2 3.65Å; Y116-W134 AromaticContact CD1-CH2 3.62Å; Y116-W134 HydrophobicContact CD1-CH2 3.62Å; Y116-W134 AromaticContact CD1-CZ2 3.17Å; Y116-W134 HydrophobicContact CD1-CZ2 3.17Å; Y116-W134 HydrophobicContact CD1-CZ3 4.42Å; Y116-W134 AromaticContact CE1-CH2 3.91Å; Y116-W134 HydrophobicContact CE1-CH2 3.91Å; Y116-W134 AromaticContact CE1-CZ2 3.59Å; Y116-W134 HydrophobicContact CE1-CZ2 3.59Å; Y116-W134 AromaticContact CG-CE2 3.81Å; Y116-W134 AromaticContact CG-CZ2 3.77Å; Y116-W134 HydrophobicContact CG-CZ2 3.77Å; Y116-W134 AromaticContact CG-NE1 3.8Å; Y116-W134 PolarHBondContact N-O 2.69Å; Y116-W134 PolarHBondContact O-N 3.33Å; Y116-L136 HydrophobicContact CD2-CD2 3.85Å; Y116-L136 HydrophobicContact CG-CD2 4.43Å
117	G	95.9	Very high	89.7	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.4	174.9	0	0	0	0	0	112.1	H104 M105 C132	H104-G117 WeakPolarHBondContact CA-O 3.39Å; M105-G117 PolarHBondContact N-O 3.2Å; M105-G117 PolarHBondContact O-N 3.2Å; G117-C132 CarbonylContact C-O 3.57Å; G117-C132 WeakPolarHBondContact CA-O 3.36Å
118	C	95	Very high	89.7	Confident	4 Å²	4	32.5 Å²	32.5	3%	0.027	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.3	162.8	75.6	0	0	0	0	111.1	D103 R131 C132 W134	D103-C118 WeakPolarHBondContact O-CA 3.43Å; C118-R131 WeakPolarHBondContact O-CA 3.08Å; C118-C132 PolarHBondContact N-O 3.03Å; C118-C132 PolarHBondContact O-N 3.44Å; C118-W134 HydrophobicContact CB-CH2 4.36Å
119	Y	93.8	Very high	89.9	Confident	46 Å²	46	28.1 Å²	28.1	18%	0.18	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136	-168.6	169.4	-126.4	0	0	0	110.6	E102 D103 H121 H129 R131	E102-Y119 WeakPolarHBondContact CA-O 3.24Å; D103-Y119 PolarHBondContact N-O 3.4Å; D103-Y119 PolarHBondContact O-N 3.45Å; Y119-H121 AromaticContact CE1-CE1 3.33Å; Y119-H121 WeakPolarHBondContact CE1-CE1 3.47Å; Y119-H121 AromaticContact CE1-NE2 3.74Å; Y119-H121 AromaticContact CZ-CE1 3.69Å; Y119-H121 AromaticContact CZ-NE2 3.77Å; Y119-H121 PolarHBondContact OH-NE2 3.39Å; Y119-H129 HydrophobicContact CE2-CB 3.88Å; Y119-H129 AromaticContact CE2-CD2 3.21Å; Y119-H129 WeakPolarHBondContact CE2-CD2 3.28Å; Y119-H129 AromaticContact CE2-CG 3.67Å; Y119-H129 AromaticContact CE2-NE2 3.96Å; Y119-H129 AromaticContact CZ-CD2 3.44Å; Y119-H129 VanDerWaalsContact CZ-CD2 3.44Å; Y119-H129 AromaticContact CZ-NE2 3.73Å; Y119-H129 PolarHBondContact OH-CD2 3.22Å; Y119-H129 PolarHBondContact OH-NE2 3.41Å; Y119-R131 HydrophobicContact CD2-CG 3.59Å; Y119-R131 HydrophobicContact CE2-CG 4.4Å; Y119-R131 HydrophobicContact CG-CG 4.34Å
120	V	94.5	Very high	90.2	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.6	-180	63.3	0	0	0	0	111.5	W91 T100 E102 H129 R130	W91-V120 HydrophobicContact CB-CG2 3.88Å; W91-V120 HydrophobicContact CD2-CG1 3.91Å; W91-V120 HydrophobicContact CD2-CG2 4.14Å; W91-V120 HydrophobicContact CE3-CB 4.33Å; W91-V120 HydrophobicContact CE3-CG1 3.7Å; W91-V120 HydrophobicContact CE3-CG2 3.87Å; W91-V120 HydrophobicContact CG-CG1 4.48Å; W91-V120 HydrophobicContact CG-CG2 4.17Å; W91-V120 HydrophobicContact CZ3-CG1 4.07Å; T100-V120 HydrophobicContact CG2-CG2 3.61Å; E102-V120 HydrophobicContact CG-CB 4.27Å; V120-H129 WeakPolarHBondContact O-CA 3.18Å; V120-R130 HydrophobicContact CG1-CB 3.79Å; V120-R130 PolarHBondContact N-O 3.28Å; V120-R130 PolarHBondContact O-N 3.32Å; V120-R130 VanDerWaalsContact O-N 3.08Å
121	H	92.4	Very high	90.8	Very high	47 Å²	47	26.2 Å²	26.2	22%	0.218	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144.1	178.9	-49.1	64.3	0	0	0	109.8	K92 Y119 H129	K92-H121 VanDerWaalsContact CB-O 3.27Å; K92-H121 WeakPolarHBondContact CB-O 3.09Å; K92-H121 HydrophobicContact CD-CB 4.47Å; K92-H121 PolarHBondContact N-O 2.86Å; Y119-H121 AromaticContact CE1-CE1 3.33Å; Y119-H121 WeakPolarHBondContact CE1-CE1 3.47Å; Y119-H121 AromaticContact CE1-NE2 3.74Å; Y119-H121 AromaticContact CZ-CE1 3.69Å; Y119-H121 AromaticContact CZ-NE2 3.77Å; Y119-H121 PolarHBondContact OH-NE2 3.39Å; H121-H129 AromaticContact CD2-CD2 3.59Å; H121-H129 AromaticContact CD2-NE2 3.12Å; H121-H129 PolarHBondContact CD2-NE2 3.17Å; H121-H129 AromaticContact CG-CD2 3.67Å; H121-H129 AromaticContact CG-NE2 3.7Å; H121-H129 AromaticContact NE2-NE2 3.82Å
122	S	91.5	Very high	91.6	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.021	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-64.2	154.1	170.9	167.3	0	0	0	0	111.6	I124 V125 F128	S122-I124 PolarHBondContact OG-N 2.81Å; S122-V125 WeakPolarHBondContact CB-O 3.44Å; S122-V125 PolarHBondContact OG-N 3.46Å; S122-F128 WeakPolarHBondContact CB-O 3.42Å; S122-F128 PolarHBondContact N-O 3.12Å
123	S	86.6	Confident	92.1	Very high	25 Å²	25	21 Å²	21	18%	0.175	10%	0.1	C	C	.	.	S	Bend	trans	-87.2	-12.6	175.9	61.8	0	0	0	0	113.8	C90	C90-S123 WeakPolarHBondContact CB-OG 3.37Å; C90-S123 WeakPolarHBondContact O-CB 3.25Å; C90-S123 PolarHBondContact O-N 2.82Å; C90-S123 PolarHBondContact O-OG 3.37Å
124	I	86.1	Confident	92.4	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.087	C	C	.	.	S	Bend	trans	-107.8	-49.3	-179.8	-47.7	170.5	0	0	0	109.4	C90 S122 P126 V165 W174 L179 Q182 L183	C90-I124 HydrophobicContact CB-CD1 4.14Å; C90-I124 HydrophobicContact CB-CG1 4.44Å; S122-I124 PolarHBondContact OG-N 2.81Å; I124-P126 WeakPolarHBondContact O-CD 3.46Å; I124-V165 HydrophobicContact CG2-CG2 4.49Å; I124-W174 HydrophobicContact CD1-CH2 3.74Å; I124-W174 HydrophobicContact CD1-CZ2 4.46Å; I124-W174 HydrophobicContact CD1-CZ3 3.83Å; I124-W174 HydrophobicContact CG1-CH2 4.16Å; I124-W174 HydrophobicContact CG1-CZ2 4.48Å; I124-L179 HydrophobicContact CG2-CD2 4.26Å; I124-Q182 HydrophobicContact CD1-CB 3.77Å; I124-Q182 HydrophobicContact CD1-CG 3.72Å; I124-L183 HydrophobicContact CG2-CD1 3.95Å
125	V	86.9	Confident	92.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.087	C	C	.	.			trans	-88.8	75.1	-179.8	-148.9	0	0	0	0	119.6	S122 T127 F128 L183 M186 F187	S122-V125 WeakPolarHBondContact CB-O 3.44Å; S122-V125 PolarHBondContact OG-N 3.46Å; V125-T127 WeakPolarHBondContact CG1-OG1 3.48Å; V125-T127 PolarHBondContact O-N 2.76Å; V125-F128 HydrophobicContact CB-CB 4.13Å; V125-F128 HydrophobicContact CG1-CB 4.27Å; V125-F128 PolarHBondContact O-N 3.13Å; V125-L183 HydrophobicContact CG2-CD1 4.26Å; V125-M186 HydrophobicContact CB-SD 4.01Å; V125-M186 HydrophobicContact CG2-SD 4.19Å; V125-F187 HydrophobicContact CG1-CE2 4.48Å; V125-F187 HydrophobicContact CG1-CZ 4.25Å; V125-F187 HydrophobicContact CG2-CE2 4.1Å
126	P	85.3	Confident	92.3	Very high	49 Å²	49	21 Å²	21	32%	0.318	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.4	-171.6	-22.6	34.6	0	0	0	114.2	I124 H129 L162 T164	I124-P126 WeakPolarHBondContact O-CD 3.46Å; P126-H129 PolarHBondContact O-CE1 2.79Å; P126-H129 VanDerWaalsContact O-CE1 3.28Å; P126-H129 PolarHBondContact O-NE2 3.02Å; P126-L162 WeakPolarHBondContact CD-O 3.47Å; P126-L162 VanDerWaalsContact CG-O 3.3Å; P126-L162 WeakPolarHBondContact CG-O 3.18Å; P126-T164 WeakPolarHBondContact CG-OG1 3.41Å
127	T	87.3	Confident	91.7	Very high	19 Å²	19	22.2 Å²	22.2	12%	0.117	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.7	175	53.5	0	0	0	0	113.5	V125 H129 N148 V149 L162	V125-T127 WeakPolarHBondContact CG1-OG1 3.48Å; V125-T127 PolarHBondContact O-N 2.76Å; T127-H129 VanDerWaalsContact C-CE1 3.49Å; T127-H129 PolarHBondContact O-CE1 3.04Å; T127-H129 VanDerWaalsContact O-CE1 3.28Å; T127-H129 PolarHBondContact O-ND1 2.7Å; T127-N148 WeakPolarHBondContact CB-OD1 3.49Å; T127-N148 CarbonylContact O-C 3.48Å; T127-N148 WeakPolarHBondContact O-CA 3.3Å; T127-N148 PolarHBondContact O-OD1 3.24Å; T127-N148 PolarHBondContact OG1-OD1 3.33Å; T127-V149 VanDerWaalsContact CB-O 3.28Å; T127-V149 WeakPolarHBondContact CB-O 3.38Å; T127-V149 WeakPolarHBondContact CG2-O 3.46Å; T127-V149 PolarHBondContact O-N 2.87Å; T127-L162 HydrophobicContact CG2-CD2 4.47Å
128	F	92.9	Very high	91.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129	179	-172.7	-98.9	0	0	0	112.5	Y89 W91 S122 V125 Y146 N148 M186	Y89-F128 HydrophobicContact CD1-CE1 4.31Å; Y89-F128 AromaticContact CD2-CE1 3.96Å; Y89-F128 HydrophobicContact CD2-CE1 3.96Å; Y89-F128 HydrophobicContact CD2-CZ 4.39Å; Y89-F128 HydrophobicContact CE1-CE1 4.02Å; Y89-F128 HydrophobicContact CE1-CZ 4.28Å; Y89-F128 AromaticContact CE2-CE1 3.63Å; Y89-F128 HydrophobicContact CE2-CE1 3.63Å; Y89-F128 AromaticContact CE2-CZ 3.62Å; Y89-F128 HydrophobicContact CE2-CZ 3.62Å; Y89-F128 HydrophobicContact CG-CE1 4.25Å; Y89-F128 AromaticContact CZ-CE1 3.64Å; Y89-F128 AromaticContact CZ-CZ 3.53Å; Y89-F128 WeakPolarHBondContact OH-CZ 3.28Å; W91-F128 AromaticContact CH2-CD1 3.99Å; W91-F128 HydrophobicContact CH2-CD1 3.99Å; W91-F128 AromaticContact CH2-CE1 3.7Å; W91-F128 HydrophobicContact CH2-CE1 3.7Å; W91-F128 HydrophobicContact CZ2-CE1 4.46Å; W91-F128 HydrophobicContact CZ3-CD1 4.27Å; W91-F128 HydrophobicContact CZ3-CE1 4.42Å; S122-F128 WeakPolarHBondContact CB-O 3.42Å; S122-F128 PolarHBondContact N-O 3.12Å; V125-F128 HydrophobicContact CB-CB 4.13Å; V125-F128 HydrophobicContact CG1-CB 4.27Å; V125-F128 PolarHBondContact O-N 3.13Å; F128-Y146 HydrophobicContact CZ-CD1 4.27Å; F128-N148 HydrophobicContact CD2-CB 3.94Å; F128-M186 HydrophobicContact CB-CB 4.47Å; F128-M186 HydrophobicContact CB-CG 4.29Å; F128-M186 HydrophobicContact CB-SD 4.03Å; F128-M186 HydrophobicContact CD1-CE 3.96Å; F128-M186 HydrophobicContact CD1-CG 3.67Å; F128-M186 HydrophobicContact CD1-SD 3.77Å; F128-M186 HydrophobicContact CD2-CB 3.82Å; F128-M186 HydrophobicContact CD2-CG 3.79Å; F128-M186 HydrophobicContact CE1-CE 4.24Å; F128-M186 HydrophobicContact CE1-CG 3.84Å; F128-M186 HydrophobicContact CE1-SD 4.39Å; F128-M186 HydrophobicContact CE2-CB 4.15Å; F128-M186 HydrophobicContact CE2-CG 3.97Å; F128-M186 HydrophobicContact CG-CB 4.03Å; F128-M186 HydrophobicContact CG-CG 3.64Å; F128-M186 HydrophobicContact CG-SD 3.88Å; F128-M186 HydrophobicContact CZ-CG 3.99Å
129	H	94.6	Very high	90.7	Very high	15 Å²	15	25.1 Å²	25.1	7%	0.069	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	152.6	-168	-61.2	96.5	0	0	0	112.6	W41 Y119 V120 H121 P126 T127 Y146 L147	W41-H129 HydrophobicContact CH2-CB 3.84Å; W41-H129 HydrophobicContact CZ2-CB 3.8Å; Y119-H129 HydrophobicContact CE2-CB 3.88Å; Y119-H129 AromaticContact CE2-CD2 3.21Å; Y119-H129 WeakPolarHBondContact CE2-CD2 3.28Å; Y119-H129 AromaticContact CE2-CG 3.67Å; Y119-H129 AromaticContact CE2-NE2 3.96Å; Y119-H129 AromaticContact CZ-CD2 3.44Å; Y119-H129 VanDerWaalsContact CZ-CD2 3.44Å; Y119-H129 AromaticContact CZ-NE2 3.73Å; Y119-H129 PolarHBondContact OH-CD2 3.22Å; Y119-H129 PolarHBondContact OH-NE2 3.41Å; V120-H129 WeakPolarHBondContact O-CA 3.18Å; H121-H129 AromaticContact CD2-CD2 3.59Å; H121-H129 AromaticContact CD2-NE2 3.12Å; H121-H129 PolarHBondContact CD2-NE2 3.17Å; H121-H129 AromaticContact CG-CD2 3.67Å; H121-H129 AromaticContact CG-NE2 3.7Å; H121-H129 AromaticContact NE2-NE2 3.82Å; P126-H129 PolarHBondContact O-CE1 2.79Å; P126-H129 VanDerWaalsContact O-CE1 3.28Å; P126-H129 PolarHBondContact O-NE2 3.02Å; T127-H129 VanDerWaalsContact C-CE1 3.49Å; T127-H129 PolarHBondContact O-CE1 3.04Å; T127-H129 VanDerWaalsContact O-CE1 3.28Å; T127-H129 PolarHBondContact O-ND1 2.7Å; H129-Y146 WeakPolarHBondContact O-CA 3.25Å; H129-L147 PolarHBondContact N-O 2.87Å; H129-L147 PolarHBondContact O-N 3.47Å
130	R	96.2	Very high	90.5	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.015	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133	161.7	-176.1	-172.7	78.7	-152.7	-2.1	108.9	D87 W91 E102 V120 C132 V144 H145 Y146	D87-R130 WeakPolarHBondContact OD2-CD 3.1Å; D87-R130 IonicContact OD2-CZ 3.34Å; D87-R130 IonicContact OD2-NE 2.66Å; D87-R130 IonicContact OD2-NH1 2.81Å; D87-R130 PolarHBondContact OD2-NH1 3.24Å; W91-R130 HydrophobicContact CH2-CB 3.44Å; W91-R130 VanDerWaalsContact CH2-CB 3.44Å; W91-R130 HydrophobicContact CZ2-CB 3.65Å; W91-R130 HydrophobicContact CZ2-CG 4.48Å; W91-R130 HydrophobicContact CZ3-CB 4.07Å; E102-R130 IonicContact OE1-NH2 3.04Å; E102-R130 PolarHBondContact OE1-NH2 3.25Å; V120-R130 HydrophobicContact CG1-CB 3.79Å; V120-R130 PolarHBondContact N-O 3.28Å; V120-R130 PolarHBondContact O-N 3.32Å; V120-R130 VanDerWaalsContact O-N 3.08Å; R130-C132 PolarHBondContact NE-SG 2.94Å; R130-V144 HydrophobicContact CG-CG1 3.61Å; R130-H145 WeakPolarHBondContact CA-O 3.46Å; R130-Y146 HydrophobicContact CB-CD1 4.01Å; R130-Y146 HydrophobicContact CB-CE1 4.02Å; R130-Y146 HydrophobicContact CG-CD1 3.96Å; R130-Y146 HydrophobicContact CG-CE1 3.62Å
131	R	96.6	Very high	90.4	Very high	64 Å²	64	24.4 Å²	24.4	24%	0.242	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.1	164	-69.4	-176.3	-172.1	169	6.3	109.3	W41 C118 Y119 Y133 V144 H145	W41-R131 VanDerWaalsContact CE2-CZ 3.44Å; W41-R131 HydrophobicContact CE3-CB 4.49Å; W41-R131 HydrophobicContact CE3-CG 4.28Å; W41-R131 HydrophobicContact CH2-CB 4.27Å; W41-R131 HydrophobicContact CH2-CG 3.72Å; W41-R131 HydrophobicContact CZ2-CG 4.35Å; W41-R131 HydrophobicContact CZ3-CB 3.83Å; W41-R131 HydrophobicContact CZ3-CG 3.68Å; C118-R131 WeakPolarHBondContact O-CA 3.08Å; Y119-R131 HydrophobicContact CD2-CG 3.59Å; Y119-R131 HydrophobicContact CE2-CG 4.4Å; Y119-R131 HydrophobicContact CG-CG 4.34Å; R131-Y133 HydrophobicContact CB-CE1 4.45Å; R131-Y133 HydrophobicContact CB-CE2 3.82Å; R131-Y133 WeakPolarHBondContact CD-OH 3.44Å; R131-V144 WeakPolarHBondContact O-CA 3.24Å; R131-H145 PolarHBondContact N-O 2.83Å; R131-H145 PolarHBondContact O-N 2.97Å
132	C	96.4	Very high	90.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.3	176	-47.8	0	0	0	0	108.5	Y84 G117 C118 R130 W134 V142 L143 V144	Y84-C132 HydrophobicContact CE2-CB 4.26Å; G117-C132 CarbonylContact C-O 3.57Å; G117-C132 WeakPolarHBondContact CA-O 3.36Å; C118-C132 PolarHBondContact N-O 3.03Å; C118-C132 PolarHBondContact O-N 3.44Å; R130-C132 PolarHBondContact NE-SG 2.94Å; C132-W134 HydrophobicContact CB-CZ3 4.28Å; C132-V142 HydrophobicContact CB-CG1 3.85Å; C132-L143 CarbonylContact C-O 3.54Å; C132-L143 VanDerWaalsContact CA-O 3.31Å; C132-L143 WeakPolarHBondContact CA-O 3.5Å; C132-V144 HydrophobicContact CB-CG2 4.29Å
133	Y	96.5	Very high	90.7	Very high	10 Å²	10	22.1 Å²	22.1	4%	0.039	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.2	-176.3	-49.3	-82.7	0	0	0	111	I47 L107 Y116 R131 V142 L143	I47-Y133 HydrophobicContact CD1-CD1 3.96Å; I47-Y133 HydrophobicContact CD1-CD2 3.88Å; I47-Y133 HydrophobicContact CD1-CE1 3.68Å; I47-Y133 HydrophobicContact CD1-CE2 3.57Å; I47-Y133 HydrophobicContact CD1-CG 4.04Å; I47-Y133 VanDerWaalsContact CD1-CZ 3.43Å; I47-Y133 HydrophobicContact CG1-CD2 4.09Å; I47-Y133 HydrophobicContact CG1-CE2 4.11Å; I47-Y133 HydrophobicContact CG1-CG 4.41Å; I47-Y133 HydrophobicContact CG2-CD1 4.29Å; I47-Y133 HydrophobicContact CG2-CD2 4.11Å; I47-Y133 HydrophobicContact CG2-CG 3.76Å; L107-Y133 HydrophobicContact CD1-CD1 3.97Å; L107-Y133 HydrophobicContact CD1-CE1 3.9Å; Y116-Y133 VanDerWaalsContact O-CA 3.26Å; Y116-Y133 WeakPolarHBondContact O-CA 3.37Å; R131-Y133 HydrophobicContact CB-CE1 4.45Å; R131-Y133 HydrophobicContact CB-CE2 3.82Å; R131-Y133 WeakPolarHBondContact CD-OH 3.44Å; Y133-V142 CarbonylContact O-C 3.58Å; Y133-V142 WeakPolarHBondContact O-CA 3.43Å; Y133-L143 HydrophobicContact CD2-CD2 4.42Å; Y133-L143 PolarHBondContact N-O 3Å; Y133-L143 PolarHBondContact O-N 2.86Å
134	W	94.9	Very high	91.2	Very high	32 Å²	32	20.9 Å²	20.9	12%	0.121	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	160	173.7	57.3	89.2	0	0	0	110.8	Y116 C118 C132 P139 I141 V142	Y116-W134 HydrophobicContact CD1-CD2 4.48Å; Y116-W134 AromaticContact CD1-CE2 3.65Å; Y116-W134 AromaticContact CD1-CH2 3.62Å; Y116-W134 HydrophobicContact CD1-CH2 3.62Å; Y116-W134 AromaticContact CD1-CZ2 3.17Å; Y116-W134 HydrophobicContact CD1-CZ2 3.17Å; Y116-W134 HydrophobicContact CD1-CZ3 4.42Å; Y116-W134 AromaticContact CE1-CH2 3.91Å; Y116-W134 HydrophobicContact CE1-CH2 3.91Å; Y116-W134 AromaticContact CE1-CZ2 3.59Å; Y116-W134 HydrophobicContact CE1-CZ2 3.59Å; Y116-W134 AromaticContact CG-CE2 3.81Å; Y116-W134 AromaticContact CG-CZ2 3.77Å; Y116-W134 HydrophobicContact CG-CZ2 3.77Å; Y116-W134 AromaticContact CG-NE1 3.8Å; Y116-W134 PolarHBondContact N-O 2.69Å; Y116-W134 PolarHBondContact O-N 3.33Å; C118-W134 HydrophobicContact CB-CH2 4.36Å; C132-W134 HydrophobicContact CB-CZ3 4.28Å; W134-P139 VanDerWaalsContact CD1-CB 3.44Å; W134-P139 HydrophobicContact CG-CB 4.31Å; W134-I141 WeakPolarHBondContact CB-O 3.47Å; W134-V142 HydrophobicContact CB-CG2 4.28Å; W134-V142 HydrophobicContact CE3-CG1 4.1Å; W134-V142 HydrophobicContact CE3-CG2 4.28Å
135	L	91.8	Very high	91.7	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	143.1	173.5	-71.9	165	0	0	0	109.7	V18 V20 L51 I52 C114 L115 Q137 N138 P139	V18-L135 HydrophobicContact CG1-CD1 3.78Å; V20-L135 HydrophobicContact CG2-CD1 4.4Å; L51-L135 HydrophobicContact CB-CD1 4.16Å; L51-L135 HydrophobicContact CB-CG 4.04Å; L51-L135 WeakPolarHBondContact O-CD1 3.44Å; I52-L135 HydrophobicContact CG1-CD1 4.13Å; C114-L135 CarbonylContact O-C 3.58Å; C114-L135 WeakPolarHBondContact O-CA 3.39Å; L115-L135 HydrophobicContact CD2-CD2 3.95Å; L115-L135 HydrophobicContact CD2-CG 4.44Å; L135-Q137 VanDerWaalsContact C-N 3.28Å; L135-Q137 PolarHBondContact O-N 3.13Å; L135-N138 HydrophobicContact CB-CB 4.28Å; L135-N138 CarbonylContact O-C 3.09Å; L135-N138 PolarHBondContact O-N 2.91Å; L135-P139 WeakPolarHBondContact O-CA 3.41Å
136	L	88.2	Confident	92.1	Very high	54 Å²	54	20.9 Å²	20.9	28%	0.283	11%	0.105	S	C	.	.	S	Bend	trans	-61.8	-40.3	176.1	-70.7	170.1	0	0	0	111.1	E113 C114 Y116	E113-L136 HydrophobicContact CB-CD1 4.46Å; E113-L136 WeakPolarHBondContact O-CD1 3.48Å; C114-L136 PolarHBondContact O-N 2.74Å; Y116-L136 HydrophobicContact CD2-CD2 3.85Å; Y116-L136 HydrophobicContact CG-CD2 4.43Å
137	Q	82.1	Confident	92.6	Very high	88 Å²	88	18.7 Å²	18.7	41%	0.411	9%	0.091	S	C	.	.	S	Bend	trans	-83.2	-19.2	-179.9	-60.5	77.4	11.3	0	0	113.5	F19 L135	F19-Q137 VanDerWaalsContact O-CB 3.24Å; F19-Q137 WeakPolarHBondContact O-CB 3.42Å; F19-Q137 WeakPolarHBondContact O-CG 3.32Å; L135-Q137 VanDerWaalsContact C-N 3.28Å; L135-Q137 PolarHBondContact O-N 3.13Å
138	N	82.9	Confident	92.8	Very high	28 Å²	28	18.1 Å²	18.1	15%	0.15	9%	0.087	C	C	.	.			trans	-133.6	80.8	170.1	-177.7	-0.2	0	0	0	110.2	V18 F54 L135 D140	V18-N138 HydrophobicContact CG1-CB 3.88Å; F54-N138 WeakPolarHBondContact CE1-ND2 3.39Å; L135-N138 HydrophobicContact CB-CB 4.28Å; L135-N138 CarbonylContact O-C 3.09Å; L135-N138 PolarHBondContact O-N 2.91Å; N138-D140 PolarHBondContact O-N 3.32Å; N138-D140 PolarHBondContact OD1-N 3.12Å
139	P	87.2	Confident	92.4	Very high	38 Å²	38	21.1 Å²	21.1	25%	0.247	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	3.8	-178.3	33.2	-35.2	0	0	0	113.5	R79 W134 L135	R79-P139 WeakPolarHBondContact CD-O 3.28Å; R79-P139 PolarHBondContact NE-O 2.94Å; R79-P139 VanDerWaalsContact NE-O 3.08Å; R79-P139 PolarHBondContact NH1-O 3.03Å; R79-P139 VanDerWaalsContact NH1-O 3.17Å; W134-P139 VanDerWaalsContact CD1-CB 3.44Å; W134-P139 HydrophobicContact CG-CB 4.31Å; L135-P139 WeakPolarHBondContact O-CA 3.41Å
140	D	88.8	Confident	91.2	Very high	28 Å²	28	23.7 Å²	23.7	15%	0.15	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.6	179.6	-85	-15.3	0	0	0	114	R79 K80 N138	R79-D140 IonicContact CZ-OD1 2.69Å; R79-D140 PolarHBondContact N-O 3.32Å; R79-D140 IonicContact NE-OD1 2.74Å; R79-D140 PolarHBondContact NE-OD1 2.83Å; R79-D140 IonicContact NH2-OD1 3.65Å; R79-D140 PolarHBondContact NH2-OD1 3.3Å; K80-D140 WeakPolarHBondContact CD-OD2 3.39Å; K80-D140 VanDerWaalsContact CE-OD1 3.23Å; K80-D140 WeakPolarHBondContact CE-OD1 3.26Å; K80-D140 WeakPolarHBondContact CE-OD2 3.41Å; K80-D140 IonicContact NZ-OD1 2.7Å; K80-D140 IonicContact NZ-OD2 2.68Å; K80-D140 PolarHBondContact NZ-OD2 3.41Å; N138-D140 PolarHBondContact O-N 3.32Å; N138-D140 PolarHBondContact OD1-N 3.12Å
141	I	92.8	Very high	89.2	Confident	4 Å²	4	25 Å²	25	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.5	177.5	-53.3	-53.4	0	0	0	108.9	L51 F54 L61 L76 N78 W134	L51-I141 HydrophobicContact CD2-CG2 4.13Å; F54-I141 HydrophobicContact CD1-CG1 4.21Å; F54-I141 HydrophobicContact CD1-CG2 4.3Å; F54-I141 HydrophobicContact CD2-CD1 4.32Å; F54-I141 HydrophobicContact CD2-CG1 4.05Å; F54-I141 HydrophobicContact CE1-CG1 3.88Å; F54-I141 HydrophobicContact CE2-CD1 4.03Å; F54-I141 HydrophobicContact CE2-CG1 3.73Å; F54-I141 HydrophobicContact CG-CG1 4.3Å; F54-I141 HydrophobicContact CG-CG2 4.2Å; F54-I141 HydrophobicContact CZ-CD1 4.4Å; F54-I141 HydrophobicContact CZ-CG1 3.65Å; L61-I141 HydrophobicContact CD2-CD1 4.02Å; L61-I141 HydrophobicContact CD2-CG2 4.08Å; L76-I141 HydrophobicContact CD1-CG2 3.69Å; L76-I141 HydrophobicContact CD2-CG2 3.99Å; L76-I141 HydrophobicContact CG-CG2 3.77Å; N78-I141 HydrophobicContact CB-CD1 4.08Å; W134-I141 WeakPolarHBondContact CB-O 3.47Å
142	V	94.9	Very high	87.1	Confident	2 Å²	2	27 Å²	27	1%	0.012	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	117.7	-173.9	-176.8	0	0	0	0	109.9	Y77 R79 Y84 C132 Y133 W134 V144	Y77-V142 PolarHBondContact N-O 3.29Å; Y77-V142 PolarHBondContact O-N 2.91Å; R79-V142 HydrophobicContact CB-CG2 4.21Å; Y84-V142 HydrophobicContact CE1-CB 4.2Å; Y84-V142 HydrophobicContact CE1-CG1 4.07Å; Y84-V142 HydrophobicContact CE1-CG2 4.02Å; Y84-V142 HydrophobicContact CE2-CG1 4.38Å; C132-V142 HydrophobicContact CB-CG1 3.85Å; Y133-V142 CarbonylContact O-C 3.58Å; Y133-V142 WeakPolarHBondContact O-CA 3.43Å; W134-V142 HydrophobicContact CB-CG2 4.28Å; W134-V142 HydrophobicContact CE3-CG1 4.1Å; W134-V142 HydrophobicContact CE3-CG2 4.28Å; V142-V144 HydrophobicContact CG1-CG2 3.87Å
143	L	96.1	Very high	84.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	120.2	170.2	-175.6	74.4	0	0	0	108.8	L34 I47 Y50 L51 I74 L76 C132 Y133	L34-L143 HydrophobicContact CD1-CD1 3.94Å; I47-L143 HydrophobicContact CB-CD2 4.39Å; I47-L143 HydrophobicContact CG1-CD2 4.18Å; I47-L143 HydrophobicContact CG2-CD2 4.19Å; Y50-L143 HydrophobicContact CD2-CD2 4.03Å; L51-L143 HydrophobicContact CD1-CB 4.4Å; L51-L143 HydrophobicContact CD2-CB 3.97Å; L51-L143 HydrophobicContact CG-CB 4.12Å; I74-L143 HydrophobicContact CG2-CD1 3.55Å; I74-L143 HydrophobicContact CG2-CG 4.28Å; L76-L143 HydrophobicContact CD1-CB 3.91Å; L76-L143 HydrophobicContact CD1-CD1 3.84Å; C132-L143 CarbonylContact C-O 3.54Å; C132-L143 VanDerWaalsContact CA-O 3.31Å; C132-L143 WeakPolarHBondContact CA-O 3.5Å; Y133-L143 HydrophobicContact CD2-CD2 4.42Å; Y133-L143 PolarHBondContact N-O 3Å; Y133-L143 PolarHBondContact O-N 2.86Å
144	V	96.6	Very high	82.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.6	-179.4	-173.7	0	0	0	0	110	I74 I75 Y77 Y84 R130 R131 C132 V142 Y146	I74-V144 CarbonylContact C-O 3.59Å; I74-V144 WeakPolarHBondContact CA-O 3.33Å; I75-V144 PolarHBondContact N-O 3.03Å; I75-V144 PolarHBondContact O-N 2.98Å; Y77-V144 HydrophobicContact CD2-CB 4.42Å; Y77-V144 HydrophobicContact CD2-CG2 3.92Å; Y84-V144 HydrophobicContact CD2-CG2 3.84Å; Y84-V144 HydrophobicContact CE2-CG2 4.25Å; Y84-V144 HydrophobicContact CG-CG2 4.27Å; R130-V144 HydrophobicContact CG-CG1 3.61Å; R131-V144 WeakPolarHBondContact O-CA 3.24Å; C132-V144 HydrophobicContact CB-CG2 4.29Å; V142-V144 HydrophobicContact CG1-CG2 3.87Å; V144-Y146 HydrophobicContact CB-CE2 4.29Å; V144-Y146 HydrophobicContact CG1-CD2 4.16Å; V144-Y146 HydrophobicContact CG1-CE1 4.44Å; V144-Y146 HydrophobicContact CG1-CE2 3.41Å; V144-Y146 VanDerWaalsContact CG1-CE2 3.41Å
145	H	96.4	Very high	79.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.3	-178.4	-169.1	174.5	0	0	0	110	R38 R40 W41 N42 S73 I74 R130 R131	R38-H145 PolarHBondContact O-NE2 2.79Å; R38-H145 VanDerWaalsContact O-NE2 3.09Å; R40-H145 PolarHBondContact O-CE1 2.98Å; W41-H145 HydrophobicContact CE3-CB 4.49Å; W41-H145 AromaticContact CE3-CG 3.98Å; W41-H145 AromaticContact CE3-ND1 3.6Å; W41-H145 HydrophobicContact CZ3-CB 4.08Å; W41-H145 AromaticContact CZ3-CG 3.86Å; W41-H145 AromaticContact CZ3-ND1 3.99Å; N42-H145 PolarHBondContact ND2-CE1 3.1Å; N42-H145 VanDerWaalsContact ND2-CE1 3.35Å; N42-H145 PolarHBondContact ND2-ND1 2.91Å; N42-H145 VanDerWaalsContact ND2-ND1 3.12Å; S73-H145 WeakPolarHBondContact O-CA 3.35Å; I74-H145 HydrophobicContact CG1-CB 4.3Å; R130-H145 WeakPolarHBondContact CA-O 3.46Å; R131-H145 PolarHBondContact N-O 2.83Å; R131-H145 PolarHBondContact O-N 2.97Å
146	Y	96.3	Very high	77.7	Confident	1 Å²	1	44 Å²	44	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.4	176	-59.5	-93.8	0	0	0	109.3	P69 G72 S73 I75 D87 Y89 W91 F128 H129 R130 V144	P69-Y146 HydrophobicContact CB-CD2 3.65Å; P69-Y146 HydrophobicContact CB-CE2 3.71Å; P69-Y146 HydrophobicContact CB-CG 4.09Å; P69-Y146 HydrophobicContact CG-CD2 4.07Å; P69-Y146 HydrophobicContact CG-CE1 4.29Å; P69-Y146 HydrophobicContact CG-CE2 3.59Å; G72-Y146 CarbonylContact C-O 3.54Å; G72-Y146 VanDerWaalsContact CA-O 3.23Å; G72-Y146 WeakPolarHBondContact CA-O 3.42Å; G72-Y146 PolarHBondContact N-O 3.32Å; S73-Y146 PolarHBondContact N-O 3.32Å; S73-Y146 PolarHBondContact O-N 3.31Å; I75-Y146 HydrophobicContact CD1-CE2 4.29Å; D87-Y146 HydrophobicContact CB-CE1 4.25Å; D87-Y146 WeakPolarHBondContact CB-OH 3.39Å; D87-Y146 PolarHBondContact OD2-OH 3.42Å; Y89-Y146 HydrophobicContact CD2-CD1 4.13Å; Y89-Y146 HydrophobicContact CD2-CE1 4.04Å; Y89-Y146 AromaticContact CE2-CD1 3.9Å; Y89-Y146 HydrophobicContact CE2-CD1 3.9Å; Y89-Y146 HydrophobicContact CE2-CE1 4.17Å; W91-Y146 HydrophobicContact CH2-CD1 4.44Å; W91-Y146 HydrophobicContact CZ2-CD1 4.32Å; W91-Y146 HydrophobicContact CZ2-CE1 4.09Å; F128-Y146 HydrophobicContact CZ-CD1 4.27Å; H129-Y146 WeakPolarHBondContact O-CA 3.25Å; R130-Y146 HydrophobicContact CB-CD1 4.01Å; R130-Y146 HydrophobicContact CB-CE1 4.02Å; R130-Y146 HydrophobicContact CG-CD1 3.96Å; R130-Y146 HydrophobicContact CG-CE1 3.62Å; V144-Y146 HydrophobicContact CB-CE2 4.29Å; V144-Y146 HydrophobicContact CG1-CD2 4.16Å; V144-Y146 HydrophobicContact CG1-CE1 4.44Å; V144-Y146 HydrophobicContact CG1-CE2 3.41Å; V144-Y146 VanDerWaalsContact CG1-CE2 3.41Å
147	L	94.7	Very high	75.5	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	133.1	-177.7	-171.4	63	0	0	0	112.6	L39 W41 H129 V149	L39-L147 HydrophobicContact CD2-CD1 4.47Å; W41-L147 HydrophobicContact CD2-CD2 3.79Å; W41-L147 HydrophobicContact CE3-CB 4.37Å; W41-L147 HydrophobicContact CE3-CD2 4.18Å; W41-L147 HydrophobicContact CG-CD2 4.05Å; W41-L147 HydrophobicContact CH2-CB 3.7Å; W41-L147 HydrophobicContact CZ2-CB 3.91Å; W41-L147 HydrophobicContact CZ2-CD2 4.28Å; W41-L147 HydrophobicContact CZ3-CB 3.95Å; H129-L147 PolarHBondContact N-O 2.87Å; H129-L147 PolarHBondContact O-N 3.47Å; L147-V149 HydrophobicContact CD2-CG2 3.65Å; L147-V149 HydrophobicContact CG-CG2 3.72Å
148	N	91.9	Very high	73.5	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.043	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.2	164.4	-155.5	-15.6	0	0	0	108.8	N71 T127 F128 M186 I190	N71-N148 WeakPolarHBondContact OD1-CB 3.49Å; N71-N148 PolarHBondContact OD1-N 2.79Å; T127-N148 WeakPolarHBondContact CB-OD1 3.49Å; T127-N148 CarbonylContact O-C 3.48Å; T127-N148 WeakPolarHBondContact O-CA 3.3Å; T127-N148 PolarHBondContact O-OD1 3.24Å; T127-N148 PolarHBondContact OG1-OD1 3.33Å; F128-N148 HydrophobicContact CD2-CB 3.94Å; N148-M186 WeakPolarHBondContact CB-O 3.19Å; N148-M186 PolarHBondContact ND2-O 2.92Å; N148-I190 HydrophobicContact CB-CD1 3.82Å; N148-I190 WeakPolarHBondContact ND2-CD1 3.48Å
149	V	84.5	Confident	71.9	Confident	63 Å²	63	47.4 Å²	47.4	38%	0.382	28%	0.277	S	S	.	.			trans	-125.9	95.5	177.6	-174.6	0	0	0	0	108.8	W41 T127 L147	W41-V149 HydrophobicContact CZ2-CG2 4.5Å; T127-V149 VanDerWaalsContact CB-O 3.28Å; T127-V149 WeakPolarHBondContact CB-O 3.38Å; T127-V149 WeakPolarHBondContact CG2-O 3.46Å; T127-V149 PolarHBondContact O-N 2.87Å; L147-V149 HydrophobicContact CD2-CG2 3.65Å; L147-V149 HydrophobicContact CG-CG2 3.72Å
150	P	69.6	Low	70	Confident	69 Å²	69	47.9 Å²	47.9	45%	0.448	28%	0.28	S	S	.	.			trans	-57.4	153.2	170.6	-23.4	34.6	0	0	0	111.9
151	S	54.6	Low	68.1	Low	32 Å²	32	52.5 Å²	52.5	22%	0.224	30%	0.304	C	S	.	.			trans	-69.2	138.4	169.2	-168.5	0	0	0	0	109.3	E153 D154	S151-E153 PolarHBondContact O-N 3.06Å; S151-E153 PolarHBondContact OG-N 3.4Å; S151-E153 PolarHBondContact OG-OE2 2.91Å; S151-D154 PolarHBondContact O-N 3.06Å
152	P	52.2	Low	66.1	Low	106 Å²	106	54.1 Å²	54.1	69%	0.688	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-60.2	-22.1	170.1	26.1	-35.1	0	0	0	112.4	D154 S155	P152-D154 VanDerWaalsContact C-N 3.27Å; P152-D154 PolarHBondContact O-N 3.42Å; P152-S155 VanDerWaalsContact O-CB 3.27Å; P152-S155 WeakPolarHBondContact O-CB 3.38Å; P152-S155 PolarHBondContact O-N 3.44Å; P152-S155 PolarHBondContact O-OG 2.91Å
153	E	49.8	Very low	64.1	Low	176 Å²	176	54.2 Å²	54.2	82%	0.822	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-68.5	-23.9	175.9	-62.3	158	151.2	0	0	112.7	S151	S151-E153 PolarHBondContact O-N 3.06Å; S151-E153 PolarHBondContact OG-N 3.4Å; S151-E153 PolarHBondContact OG-OE2 2.91Å
154	D	47.4	Very low	62.1	Low	61 Å²	61	57.8 Å²	57.8	33%	0.326	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-101.8	8.6	178.5	-65.5	-58.2	0	0	0	112.8	S151 P152 G156 R157	S151-D154 PolarHBondContact O-N 3.06Å; P152-D154 VanDerWaalsContact C-N 3.27Å; P152-D154 PolarHBondContact O-N 3.42Å; D154-G156 PolarHBondContact O-N 3.15Å; D154-R157 CarbonylContact O-C 3.44Å; D154-R157 PolarHBondContact O-N 3.42Å
155	S	39.2	Very low	60	Low	106 Å²	106	60.4 Å²	60.4	74%	0.741	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.1	-164.7	51.1	0	0	0	0	116.3	P152	P152-S155 VanDerWaalsContact O-CB 3.27Å; P152-S155 WeakPolarHBondContact O-CB 3.38Å; P152-S155 PolarHBondContact O-N 3.44Å; P152-S155 PolarHBondContact O-OG 2.91Å
156	G	45.9	Very low	57.5	Low	59 Å²	59	63 Å²	63	61%	0.608	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-1.2	171.2	0	0	0	0	0	115.7	D154	D154-G156 PolarHBondContact O-N 3.15Å
157	R	40.8	Very low	54.9	Low	181 Å²	181	70.4 Å²	70.4	68%	0.683	40%	0.404	S	S	*	.			trans	-149.4	85.9	-176.5	-72.3	-168.1	-75.4	-154.1	-5.7	112.8	D154 S159 M194	D154-R157 CarbonylContact O-C 3.44Å; D154-R157 PolarHBondContact O-N 3.42Å; R157-S159 PolarHBondContact O-N 2.97Å; R157-S159 PolarHBondContact O-OG 3.03Å; R157-S159 VanDerWaalsContact O-OG 3.07Å; R157-M194 HydrophobicContact CB-CE 4.07Å; R157-M194 HydrophobicContact CB-SD 4.02Å; R157-M194 HydrophobicContact CG-SD 3.89Å
158	C	41.6	Very low	52.5	Low	28 Å²	28	80.9 Å²	80.9	19%	0.189	44%	0.444	C	S	.	.			trans	-66.1	78.4	171.5	-176.2	0	0	0	0	111.7	C192 M194	C158-C192 HydrophobicContact CB-CB 4.06Å; C158-C192 VanDerWaalsContact SG-SG 3.67Å; C158-M194 VanDerWaalsContact C-CE 3.46Å; C158-M194 VanDerWaalsContact O-CE 3.27Å; C158-M194 WeakPolarHBondContact O-CE 3.34Å
159	S	48.3	Very low	50.5	Low	32 Å²	32	85 Å²	85	22%	0.224	46%	0.463	C	S	.	.			trans	-76.8	142.6	-167.5	-62	0	0	0	0	112.3	R157 L161 L162	R157-S159 PolarHBondContact O-N 2.97Å; R157-S159 PolarHBondContact O-OG 3.03Å; R157-S159 VanDerWaalsContact O-OG 3.07Å; S159-L161 PolarHBondContact O-N 3.44Å; S159-L162 WeakPolarHBondContact O-CB 3.46Å; S159-L162 WeakPolarHBondContact O-CG 3.48Å; S159-L162 PolarHBondContact O-N 2.94Å
160	P	48.3	Very low	48.5	Very low	47 Å²	47	87.9 Å²	87.9	31%	0.305	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-57.3	-14.3	176.1	-25.4	33.4	0	0	0	115	L162 C163 F199 L204	P160-L162 PolarHBondContact O-N 3.48Å; P160-C163 PolarHBondContact O-N 3.22Å; P160-F199 HydrophobicContact CG-CE2 4.26Å; P160-L204 HydrophobicContact CB-CD1 4.46Å
161	L	48.1	Very low	47.5	Very low	126 Å²	126	91.2 Å²	91.2	66%	0.66	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-62.2	-24.2	171.7	-61.2	177	0	0	0	113.6	S159 C163 T164	S159-L161 PolarHBondContact O-N 3.44Å; L161-C163 PolarHBondContact O-N 3.15Å; L161-T164 VanDerWaalsContact O-CG2 3.31Å; L161-T164 WeakPolarHBondContact O-CG2 3.22Å
162	L	51.3	Low	47.6	Very low	37 Å²	37	94.8 Å²	94.8	19%	0.194	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-59	-32.5	178.1	-70.5	171.3	0	0	0	112.2	P126 T127 S159 P160 T164	P126-L162 WeakPolarHBondContact CD-O 3.47Å; P126-L162 VanDerWaalsContact CG-O 3.3Å; P126-L162 WeakPolarHBondContact CG-O 3.18Å; T127-L162 HydrophobicContact CG2-CD2 4.47Å; S159-L162 WeakPolarHBondContact O-CB 3.46Å; S159-L162 WeakPolarHBondContact O-CG 3.48Å; S159-L162 PolarHBondContact O-N 2.94Å; P160-L162 PolarHBondContact O-N 3.48Å; L162-T164 PolarHBondContact O-N 3.06Å
163	C	53	Low	48.4	Very low	5 Å²	5	96.7 Å²	96.7	3%	0.034	50%	0.504	C	S	.	.			trans	-78.4	65.9	174.1	-77.5	0	0	0	0	112.2	P160 L161 V165 L204 I208	P160-C163 PolarHBondContact O-N 3.22Å; L161-C163 PolarHBondContact O-N 3.15Å; C163-V165 PolarHBondContact O-N 3.44Å; C163-L204 HydrophobicContact CB-CD1 4.15Å; C163-I208 HydrophobicContact CB-CD1 3.77Å; C163-I208 HydrophobicContact CB-CG1 4.09Å
164	T	52.6	Low	49.7	Very low	74 Å²	74	90.3 Å²	90.3	45%	0.454	47%	0.473	S	S	.	.			trans	-73.7	71.6	168.8	66	0	0	0	0	110.8	P126 L161 L162 S166	P126-T164 WeakPolarHBondContact CG-OG1 3.41Å; L161-T164 VanDerWaalsContact O-CG2 3.31Å; L161-T164 WeakPolarHBondContact O-CG2 3.22Å; L162-T164 PolarHBondContact O-N 3.06Å; T164-S166 PolarHBondContact O-N 3.02Å
165	V	52.5	Low	51.6	Low	55 Å²	55	89.6 Å²	89.6	33%	0.333	47%	0.472	S	S	.	.			trans	-54.1	113.1	168	-179.9	0	0	0	0	107.6	I124 C163 E167 I208	I124-V165 HydrophobicContact CG2-CG2 4.49Å; C163-V165 PolarHBondContact O-N 3.44Å; V165-E167 PolarHBondContact O-N 3.41Å; V165-I208 HydrophobicContact CG2-CG2 4.08Å
166	S	45.1	Very low	53.8	Low	56 Å²	56	89.2 Å²	89.2	39%	0.392	46%	0.455	S	S	.	.			trans	-69.2	124.6	-173.2	-68.4	0	0	0	0	110.5	T164 R168	T164-S166 PolarHBondContact O-N 3.02Å; S166-R168 PolarHBondContact O-N 3.5Å
167	E	42.3	Very low	55.8	Low	156 Å²	156	91.8 Å²	91.8	73%	0.729	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	7.7	-175.3	-55.6	179.1	111.3	0	0	116	V165	V165-E167 PolarHBondContact O-N 3.41Å
168	R	44.4	Very low	58	Low	222 Å²	222	86.8 Å²	86.8	84%	0.838	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	11.4	-171.1	-59.5	-169.7	179.6	-155.8	-1.5	114.2	S166	S166-R168 PolarHBondContact O-N 3.5Å
169	H	48.9	Very low	60.2	Low	95 Å²	95	85.5 Å²	85.5	44%	0.44	43%	0.433	S	S	.	.			trans	-124.3	49	173.1	-70	-57.9	0	0	0	111.3	T171 L172	H169-T171 PolarHBondContact O-N 3Å; H169-L172 PolarHBondContact O-N 3.3Å
170	D	42.9	Very low	62.2	Low	122 Å²	122	85.3 Å²	85.3	65%	0.652	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	23.4	-177.2	-105.5	6.6	0	0	0	115.3	K215	D170-K215 IonicContact OD1-NZ 3.1Å; D170-K215 PolarHBondContact OD1-NZ 3.01Å; D170-K215 IonicContact OD2-NZ 3.83Å; D170-K215 PolarHBondContact OD2-NZ 3.24Å
171	T	47.8	Very low	64.2	Low	140 Å²	140	84.2 Å²	84.2	86%	0.859	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-15.9	176.3	55.7	0	0	0	0	114.1	H169	H169-T171 PolarHBondContact O-N 3Å
172	L	57.4	Low	66.3	Low	106 Å²	106	78.4 Å²	78.4	56%	0.555	40%	0.396	S	S	*	.			trans	-100.2	98.2	179.1	-167.4	67.7	0	0	0	110.6	H169 W174	H169-L172 PolarHBondContact O-N 3.3Å; L172-W174 HydrophobicContact CD2-CH2 4.42Å; L172-W174 HydrophobicContact CD2-CZ2 4.06Å; L172-W174 VanDerWaalsContact O-CD1 3.29Å; L172-W174 PolarHBondContact O-N 2.92Å
173	R	68.2	Low	68.1	Low	147 Å²	147	76.7 Å²	76.7	56%	0.555	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-63.8	127.7	160.6	-74	-57.7	-49.3	-168.5	10.8	108.4	Q212	R173-Q212 PolarHBondContact NH1-O 2.88Å
174	W	78.4	Confident	69.9	Low	41 Å²	41	81 Å²	81	16%	0.155	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-89	139.2	173.4	-61.9	75.7	0	0	0	110	C90 I124 L172 D178 L179 Q182 L209 Q212	C90-W174 HydrophobicContact CB-CH2 3.94Å; C90-W174 VanDerWaalsContact SG-CH2 3.6Å; I124-W174 HydrophobicContact CD1-CH2 3.74Å; I124-W174 HydrophobicContact CD1-CZ2 4.46Å; I124-W174 HydrophobicContact CD1-CZ3 3.83Å; I124-W174 HydrophobicContact CG1-CH2 4.16Å; I124-W174 HydrophobicContact CG1-CZ2 4.48Å; L172-W174 HydrophobicContact CD2-CH2 4.42Å; L172-W174 HydrophobicContact CD2-CZ2 4.06Å; L172-W174 VanDerWaalsContact O-CD1 3.29Å; L172-W174 PolarHBondContact O-N 2.92Å; W174-D178 HydrophobicContact CE3-CB 4.16Å; W174-L179 HydrophobicContact CB-CD1 3.6Å; W174-L179 HydrophobicContact CB-CG 3.85Å; W174-L179 HydrophobicContact CD2-CG 4.33Å; W174-L179 HydrophobicContact CE3-CD2 4.44Å; W174-L179 HydrophobicContact CE3-CG 4.19Å; W174-L179 HydrophobicContact CG-CD1 4.23Å; W174-L179 HydrophobicContact CG-CG 4.22Å; W174-Q182 HydrophobicContact CZ3-CG 4.32Å; W174-L209 WeakPolarHBondContact O-CD2 3.44Å; W174-Q212 VanDerWaalsContact CD1-NE2 3.34Å
175	S	85.8	Confident	71.8	Confident	46 Å²	46	79 Å²	79	32%	0.322	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-76.2	167	163.6	74.2	0	0	0	0	110.5	D177 D178 L179	S175-D177 VanDerWaalsContact C-N 3.29Å; S175-D177 PolarHBondContact OG-N 2.83Å; S175-D178 WeakPolarHBondContact CB-OD2 3.41Å; S175-D178 VanDerWaalsContact OG-CB 3.31Å; S175-D178 WeakPolarHBondContact OG-CB 3.27Å; S175-D178 PolarHBondContact OG-N 3.32Å; S175-D178 PolarHBondContact OG-OD2 2.87Å; S175-L179 PolarHBondContact O-N 3.32Å
176	R	86.3	Confident	73.7	Confident	99 Å²	99	76.3 Å²	76.3	37%	0.374	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-42.9	172.2	-171.2	-176.8	-177.6	88.2	-0.4	110.3	L179 L180 V205 L209	R176-L179 PolarHBondContact O-N 2.73Å; R176-L180 VanDerWaalsContact O-CB 3.27Å; R176-L180 WeakPolarHBondContact O-CB 3.27Å; R176-L180 PolarHBondContact O-N 3.38Å; R176-V205 HydrophobicContact CG-CG1 3.81Å; R176-L209 HydrophobicContact CB-CD1 4.04Å; R176-L209 HydrophobicContact CG-CD1 4.21Å
177	D	88.1	Confident	75.8	Confident	113 Å²	113	74.5 Å²	74.5	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-78.2	-31.5	-171.1	-47.6	-63.4	0	0	0	112.6	S175 G181	S175-D177 VanDerWaalsContact C-N 3.29Å; S175-D177 PolarHBondContact OG-N 2.83Å; D177-G181 WeakPolarHBondContact O-CA 3.46Å; D177-G181 PolarHBondContact O-N 2.95Å
178	D	87.2	Confident	77.9	Confident	75 Å²	75	70.7 Å²	70.7	40%	0.401	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-49.4	168.1	-76.3	-58.2	0	0	0	111.1	W174 S175 Q182	W174-D178 HydrophobicContact CE3-CB 4.16Å; S175-D178 WeakPolarHBondContact CB-OD2 3.41Å; S175-D178 VanDerWaalsContact OG-CB 3.31Å; S175-D178 WeakPolarHBondContact OG-CB 3.27Å; S175-D178 PolarHBondContact OG-N 3.32Å; S175-D178 PolarHBondContact OG-OD2 2.87Å; D178-Q182 WeakPolarHBondContact O-CG 3.46Å; D178-Q182 PolarHBondContact O-N 3.07Å
179	L	88.2	Confident	79.6	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-49.3	178.9	-89.2	163.2	0	0	0	111.4	I124 W174 S175 R176 G181 Q182 L183 V205 I208 L209	I124-L179 HydrophobicContact CG2-CD2 4.26Å; W174-L179 HydrophobicContact CB-CD1 3.6Å; W174-L179 HydrophobicContact CB-CG 3.85Å; W174-L179 HydrophobicContact CD2-CG 4.33Å; W174-L179 HydrophobicContact CE3-CD2 4.44Å; W174-L179 HydrophobicContact CE3-CG 4.19Å; W174-L179 HydrophobicContact CG-CD1 4.23Å; W174-L179 HydrophobicContact CG-CG 4.22Å; S175-L179 PolarHBondContact O-N 3.32Å; R176-L179 PolarHBondContact O-N 2.73Å; L179-G181 VanDerWaalsContact C-N 3.32Å; L179-G181 PolarHBondContact O-N 3.09Å; L179-Q182 PolarHBondContact O-N 2.97Å; L179-Q182 VanDerWaalsContact O-N 3.07Å; L179-L183 WeakPolarHBondContact O-CD2 3.38Å; L179-L183 VanDerWaalsContact O-CG 3.31Å; L179-L183 WeakPolarHBondContact O-CG 3.21Å; L179-L183 PolarHBondContact O-N 3.17Å; L179-V205 HydrophobicContact CB-CG1 3.94Å; L179-V205 HydrophobicContact CB-CG2 4.07Å; L179-V205 HydrophobicContact CD1-CG1 4.49Å; L179-I208 HydrophobicContact CD1-CB 4.37Å; L179-I208 HydrophobicContact CD1-CG2 3.73Å; L179-I208 HydrophobicContact CD2-CD1 4.25Å; L179-I208 HydrophobicContact CD2-CG2 3.95Å; L179-L209 HydrophobicContact CD1-CD2 3.82Å; L179-L209 HydrophobicContact CD1-CG 4.03Å
180	L	89.8	Confident	81	Confident	28 Å²	28	61 Å²	61	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-59.5	-45.1	179.4	-163	70.9	0	0	0	111	R176 Q182 L183 K184 I201 E202 V205	R176-L180 VanDerWaalsContact O-CB 3.27Å; R176-L180 WeakPolarHBondContact O-CB 3.27Å; R176-L180 PolarHBondContact O-N 3.38Å; L180-Q182 VanDerWaalsContact C-N 3.29Å; L180-Q182 PolarHBondContact O-N 3.35Å; L180-L183 PolarHBondContact O-N 2.87Å; L180-K184 HydrophobicContact CD1-CD 4.31Å; L180-K184 HydrophobicContact CD1-CG 4.29Å; L180-K184 HydrophobicContact CG-CD 4.01Å; L180-K184 HydrophobicContact CG-CG 4.25Å; L180-K184 WeakPolarHBondContact O-CB 3.48Å; L180-K184 PolarHBondContact O-N 2.94Å; L180-I201 HydrophobicContact CD1-CG2 4.33Å; L180-E202 HydrophobicContact CD1-CG 3.97Å; L180-V205 HydrophobicContact CB-CG2 4.21Å; L180-V205 HydrophobicContact CD1-CG2 3.81Å
181	G	89.7	Confident	81.9	Confident	25 Å²	25	65.2 Å²	65.2	26%	0.258	33%	0.329	S	S	.	.	H	α-helix	trans	-71	-17.4	176.6	0	0	0	0	0	114.5	R68 D177 L179	R68-G181 WeakPolarHBondContact CD-O 3.47Å; R68-G181 PolarHBondContact NH1-O 3.31Å; D177-G181 WeakPolarHBondContact O-CA 3.46Å; D177-G181 PolarHBondContact O-N 2.95Å; L179-G181 VanDerWaalsContact C-N 3.32Å; L179-G181 PolarHBondContact O-N 3.09Å
182	Q	91.5	Very high	82	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.019	30%	0.296	C	S	.	.	H	α-helix	trans	-80.5	-51.2	168.7	-73	-77	-39.1	0	0	110.7	R68 G88 C90 I124 W174 D178 L179 L180 M186	R68-Q182 VanDerWaalsContact NE-NE2 3.19Å; G88-Q182 PolarHBondContact O-NE2 3.43Å; C90-Q182 PolarHBondContact SG-NE2 3.44Å; C90-Q182 VanDerWaalsContact SG-NE2 3.42Å; I124-Q182 HydrophobicContact CD1-CB 3.77Å; I124-Q182 HydrophobicContact CD1-CG 3.72Å; W174-Q182 HydrophobicContact CZ3-CG 4.32Å; D178-Q182 WeakPolarHBondContact O-CG 3.46Å; D178-Q182 PolarHBondContact O-N 3.07Å; L179-Q182 PolarHBondContact O-N 2.97Å; L179-Q182 VanDerWaalsContact O-N 3.07Å; L180-Q182 VanDerWaalsContact C-N 3.29Å; L180-Q182 PolarHBondContact O-N 3.35Å; Q182-M186 HydrophobicContact CB-CE 4.34Å; Q182-M186 WeakPolarHBondContact O-CG 3.29Å
183	L	90.6	Very high	81.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-93.8	-17.2	-169.2	26.1	-170.4	0	0	0	116.5	I124 V125 L179 L180 M186 F187 I201 L204 V205 I208	I124-L183 HydrophobicContact CG2-CD1 3.95Å; V125-L183 HydrophobicContact CG2-CD1 4.26Å; L179-L183 WeakPolarHBondContact O-CD2 3.38Å; L179-L183 VanDerWaalsContact O-CG 3.31Å; L179-L183 WeakPolarHBondContact O-CG 3.21Å; L179-L183 PolarHBondContact O-N 3.17Å; L180-L183 PolarHBondContact O-N 2.87Å; L183-M186 HydrophobicContact CB-CB 4.45Å; L183-M186 HydrophobicContact CB-SD 4.47Å; L183-M186 PolarHBondContact O-N 3.13Å; L183-M186 VanDerWaalsContact O-N 3.11Å; L183-F187 HydrophobicContact CB-CD2 4.03Å; L183-F187 HydrophobicContact CB-CE2 4.13Å; L183-F187 WeakPolarHBondContact O-CD2 3.35Å; L183-F187 PolarHBondContact O-N 3.07Å; L183-F187 VanDerWaalsContact O-N 3.1Å; L183-I201 HydrophobicContact CD2-CG2 3.69Å; L183-L204 HydrophobicContact CD1-CD2 4.12Å; L183-L204 HydrophobicContact CD1-CG 4.44Å; L183-V205 HydrophobicContact CD2-CG2 3.61Å; L183-I208 HydrophobicContact CD1-CD1 3.92Å
184	K	90.9	Very high	80.1	Confident	97 Å²	97	53.9 Å²	53.9	42%	0.422	28%	0.282	S	S	.	.	H	α-helix	trans	-54.8	-47.5	167.9	-84.1	-170.4	172	178.1	0	112.9	L180 H188 I201 E202	L180-K184 HydrophobicContact CD1-CD 4.31Å; L180-K184 HydrophobicContact CD1-CG 4.29Å; L180-K184 HydrophobicContact CG-CD 4.01Å; L180-K184 HydrophobicContact CG-CG 4.25Å; L180-K184 WeakPolarHBondContact O-CB 3.48Å; L180-K184 PolarHBondContact O-N 2.94Å; K184-H188 PolarHBondContact O-N 3.42Å; K184-I201 HydrophobicContact CG-CD1 4.17Å; K184-I201 HydrophobicContact CG-CG2 4.03Å; K184-E202 WeakPolarHBondContact CE-OE1 3.36Å; K184-E202 IonicContact NZ-OE1 3.63Å; K184-E202 PolarHBondContact NZ-OE1 3.1Å
185	P	92.5	Very high	78.4	Confident	30 Å²	30	56.5 Å²	56.5	20%	0.195	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-33.4	173.3	-26.3	38.3	0	0	0	114.4	R68 N71 Y89 F187 H188	R68-P185 HydrophobicContact CB-CB 4.49Å; R68-P185 HydrophobicContact CB-CG 4.24Å; R68-P185 WeakPolarHBondContact O-CB 3.42Å; N71-P185 PolarHBondContact N-O 2.75Å; Y89-P185 HydrophobicContact CE1-CB 4.49Å; Y89-P185 VanDerWaalsContact OH-CB 3.27Å; Y89-P185 WeakPolarHBondContact OH-CB 3.42Å; P185-F187 VanDerWaalsContact C-N 3.33Å; P185-F187 PolarHBondContact O-N 3.35Å; P185-H188 PolarHBondContact O-N 3Å
186	M	91.9	Very high	76.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-69.6	-25.6	-179.4	-65.1	-178.1	-167.9	0	0	113.9	Y89 V125 F128 N148 Q182 L183	Y89-M186 HydrophobicContact CD1-CE 3.32Å; Y89-M186 HydrophobicContact CE1-CE 3.49Å; Y89-M186 VanDerWaalsContact CE1-CE 3.49Å; Y89-M186 HydrophobicContact CE1-CG 3.79Å; Y89-M186 HydrophobicContact CG-CE 4.29Å; V125-M186 HydrophobicContact CB-SD 4.01Å; V125-M186 HydrophobicContact CG2-SD 4.19Å; F128-M186 HydrophobicContact CB-CB 4.47Å; F128-M186 HydrophobicContact CB-CG 4.29Å; F128-M186 HydrophobicContact CB-SD 4.03Å; F128-M186 HydrophobicContact CD1-CE 3.96Å; F128-M186 HydrophobicContact CD1-CG 3.67Å; F128-M186 HydrophobicContact CD1-SD 3.77Å; F128-M186 HydrophobicContact CD2-CB 3.82Å; F128-M186 HydrophobicContact CD2-CG 3.79Å; F128-M186 HydrophobicContact CE1-CE 4.24Å; F128-M186 HydrophobicContact CE1-CG 3.84Å; F128-M186 HydrophobicContact CE1-SD 4.39Å; F128-M186 HydrophobicContact CE2-CB 4.15Å; F128-M186 HydrophobicContact CE2-CG 3.97Å; F128-M186 HydrophobicContact CG-CB 4.03Å; F128-M186 HydrophobicContact CG-CG 3.64Å; F128-M186 HydrophobicContact CG-SD 3.88Å; F128-M186 HydrophobicContact CZ-CG 3.99Å; N148-M186 WeakPolarHBondContact CB-O 3.19Å; N148-M186 PolarHBondContact ND2-O 2.92Å; Q182-M186 HydrophobicContact CB-CE 4.34Å; Q182-M186 WeakPolarHBondContact O-CG 3.29Å; L183-M186 HydrophobicContact CB-CB 4.45Å; L183-M186 HydrophobicContact CB-SD 4.47Å; L183-M186 PolarHBondContact O-N 3.13Å; L183-M186 VanDerWaalsContact O-N 3.11Å
187	F	88.8	Confident	74.4	Confident	18 Å²	18	57.5 Å²	57.5	8%	0.079	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	10.7	179.1	-73.9	-88.2	0	0	0	113.8	V125 L183 P185 I190 I201 L204	V125-F187 HydrophobicContact CG1-CE2 4.48Å; V125-F187 HydrophobicContact CG1-CZ 4.25Å; V125-F187 HydrophobicContact CG2-CE2 4.1Å; L183-F187 HydrophobicContact CB-CD2 4.03Å; L183-F187 HydrophobicContact CB-CE2 4.13Å; L183-F187 WeakPolarHBondContact O-CD2 3.35Å; L183-F187 PolarHBondContact O-N 3.07Å; L183-F187 VanDerWaalsContact O-N 3.1Å; P185-F187 VanDerWaalsContact C-N 3.33Å; P185-F187 PolarHBondContact O-N 3.35Å; F187-I190 HydrophobicContact CD1-CD1 3.95Å; F187-I190 WeakPolarHBondContact O-CB 3.34Å; F187-I190 PolarHBondContact O-N 2.78Å; F187-I201 HydrophobicContact CB-CD1 3.85Å; F187-L204 HydrophobicContact CE2-CD2 4.06Å; F187-L204 HydrophobicContact CZ-CD2 4.27Å
188	H	87.6	Confident	72.6	Confident	76 Å²	76	58.9 Å²	58.9	35%	0.352	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	142.3	173.4	-167.3	82.7	0	0	0	111.5	K70 N71 K184 P185 I190	K70-H188 HydrophobicContact CB-CB 4.01Å; K70-H188 PolarHBondContact NZ-CD2 3.14Å; K70-H188 PolarHBondContact NZ-NE2 3.11Å; N71-H188 HydrophobicContact CB-CB 4.12Å; N71-H188 VanDerWaalsContact CB-O 3.29Å; N71-H188 WeakPolarHBondContact CB-O 3.43Å; N71-H188 PolarHBondContact ND2-O 2.81Å; K184-H188 PolarHBondContact O-N 3.42Å; P185-H188 PolarHBondContact O-N 3Å; H188-I190 PolarHBondContact O-N 3.26Å; H188-I190 VanDerWaalsContact O-N 3.14Å
189	S	79	Confident	71.4	Confident	64 Å²	64	57.3 Å²	57.3	45%	0.448	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	10.8	-176	-50.2	0	0	0	0	115.9	E37	E37-S189 WeakPolarHBondContact OE1-CB 3.36Å; E37-S189 PolarHBondContact OE1-OG 3.41Å
190	I	79.1	Confident	70.9	Confident	50 Å²	50	59.1 Å²	59.1	26%	0.256	36%	0.36	S	S	.	.			trans	-104.5	120.1	176.5	-47.4	-176	0	0	0	110.2	N71 N148 F187 H188	N71-I190 WeakPolarHBondContact ND2-CG1 3.17Å; N148-I190 HydrophobicContact CB-CD1 3.82Å; N148-I190 WeakPolarHBondContact ND2-CD1 3.48Å; F187-I190 HydrophobicContact CD1-CD1 3.95Å; F187-I190 WeakPolarHBondContact O-CB 3.34Å; F187-I190 PolarHBondContact O-N 2.78Å; H188-I190 PolarHBondContact O-N 3.26Å; H188-I190 VanDerWaalsContact O-N 3.14Å
191	K	60.3	Low	70.6	Confident	209 Å²	209	59.4 Å²	59.4	91%	0.909	36%	0.362	S	S	*	.			trans	-92.6	114.1	170.7	-65.9	-172.6	178.3	-173.8	0	109.8
192	C	51	Low	70.3	Confident	24 Å²	24	61.1 Å²	61.1	16%	0.162	36%	0.363	C	S	.	.			trans	-106.9	83.6	179.7	-62.5	0	0	0	0	110.1	C158 F199	C158-C192 HydrophobicContact CB-CB 4.06Å; C158-C192 VanDerWaalsContact SG-SG 3.67Å; C192-F199 HydrophobicContact CB-CB 4Å; C192-F199 HydrophobicContact CB-CD1 3.8Å; C192-F199 HydrophobicContact CB-CG 4.3Å; C192-F199 WeakPolarHBondContact O-CB 3.5Å; C192-F199 PolarHBondContact O-N 2.69Å
193	S	44.8	Very low	69.8	Low	84 Å²	84	66 Å²	66	59%	0.587	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.4	171.9	-174.7	0	0	0	0	110
194	M	40.5	Very low	69.3	Low	47 Å²	47	66.2 Å²	66.2	23%	0.232	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	149.8	160.9	-70.9	-74.7	-172	0	0	108	R157 C158 S196 G197	R157-M194 HydrophobicContact CB-CE 4.07Å; R157-M194 HydrophobicContact CB-SD 4.02Å; R157-M194 HydrophobicContact CG-SD 3.89Å; C158-M194 VanDerWaalsContact C-CE 3.46Å; C158-M194 VanDerWaalsContact O-CE 3.27Å; C158-M194 WeakPolarHBondContact O-CE 3.34Å; M194-S196 PolarHBondContact O-N 2.89Å; M194-G197 PolarHBondContact N-O 3.34Å; M194-G197 PolarHBondContact O-N 2.95Å; M194-G197 VanDerWaalsContact O-N 3.13Å
195	G	42.2	Very low	69	Low	97 Å²	97	61.6 Å²	61.6	100%	1	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	19.1	-176.7	0	0	0	0	0	116.9
196	S	41	Very low	68.6	Low	124 Å²	124	63.1 Å²	63.1	87%	0.867	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.3	20.5	173.2	71.9	0	0	0	0	113.4	M194	M194-S196 PolarHBondContact O-N 2.89Å
197	G	48.3	Very low	68	Low	41 Å²	41	66.9 Å²	66.9	42%	0.423	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	161.8	153.2	177.8	0	0	0	0	0	115	M194	M194-G197 PolarHBondContact N-O 3.34Å; M194-G197 PolarHBondContact O-N 2.95Å; M194-G197 VanDerWaalsContact O-N 3.13Å
198	D	49.3	Very low	67.6	Low	143 Å²	143	66.3 Å²	66.3	77%	0.765	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.5	173.6	-75.9	-39	0	0	0	111.2
199	F	62.6	Low	67.3	Low	42 Å²	42	63.6 Å²	63.6	18%	0.184	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-82.6	116.9	-178	173.8	-103.2	0	0	0	112	P160 C192 L204	P160-F199 HydrophobicContact CG-CE2 4.26Å; C192-F199 HydrophobicContact CB-CB 4Å; C192-F199 HydrophobicContact CB-CD1 3.8Å; C192-F199 HydrophobicContact CB-CG 4.3Å; C192-F199 WeakPolarHBondContact O-CB 3.5Å; C192-F199 PolarHBondContact O-N 2.69Å; F199-L204 HydrophobicContact CE1-CB 4.41Å; F199-L204 HydrophobicContact CE1-CD2 4.26Å; F199-L204 HydrophobicContact CE2-CB 4.41Å; F199-L204 HydrophobicContact CZ-CB 3.77Å; F199-L204 HydrophobicContact CZ-CD1 4.12Å; F199-L204 HydrophobicContact CZ-CD2 3.97Å; F199-L204 HydrophobicContact CZ-CG 4.16Å
200	S	78.3	Confident	67.3	Low	38 Å²	38	63.2 Å²	63.2	27%	0.266	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-90.7	142.4	179.1	162.8	0	0	0	0	113	E202 E203 L204	S200-E202 VanDerWaalsContact C-N 3.25Å; S200-E202 PolarHBondContact O-N 3.23Å; S200-E202 WeakPolarHBondContact OG-CB 3.31Å; S200-E202 PolarHBondContact OG-N 2.92Å; S200-E202 VanDerWaalsContact OG-N 3.11Å; S200-E202 PolarHBondContact OG-OE2 2.89Å; S200-E203 WeakPolarHBondContact CB-OE2 3.45Å; S200-E203 PolarHBondContact N-OE2 2.82Å; S200-E203 WeakPolarHBondContact O-CB 3.4Å; S200-E203 PolarHBondContact O-N 3.3Å; S200-L204 PolarHBondContact O-N 2.93Å
201	I	81.8	Confident	66.8	Low	35 Å²	35	67.3 Å²	67.3	18%	0.179	38%	0.38	C	S	.	.	H	α-helix	trans	-66.5	-32.5	175.1	-58	179.3	0	0	0	110.3	L180 L183 K184 F187 E203 L204 V205	L180-I201 HydrophobicContact CD1-CG2 4.33Å; L183-I201 HydrophobicContact CD2-CG2 3.69Å; K184-I201 HydrophobicContact CG-CD1 4.17Å; K184-I201 HydrophobicContact CG-CG2 4.03Å; F187-I201 HydrophobicContact CB-CD1 3.85Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.27Å; I201-L204 WeakPolarHBondContact O-CB 3.22Å; I201-L204 PolarHBondContact O-N 2.83Å; I201-V205 WeakPolarHBondContact O-CG2 3.48Å; I201-V205 PolarHBondContact O-N 2.7Å
202	E	84	Confident	67.1	Low	60 Å²	60	59.3 Å²	59.3	28%	0.28	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-35.8	174.2	-70.1	68.4	-164.8	0	0	112.4	L180 K184 S200 V205 Q206	L180-E202 HydrophobicContact CD1-CG 3.97Å; K184-E202 WeakPolarHBondContact CE-OE1 3.36Å; K184-E202 IonicContact NZ-OE1 3.63Å; K184-E202 PolarHBondContact NZ-OE1 3.1Å; S200-E202 VanDerWaalsContact C-N 3.25Å; S200-E202 PolarHBondContact O-N 3.23Å; S200-E202 WeakPolarHBondContact OG-CB 3.31Å; S200-E202 PolarHBondContact OG-N 2.92Å; S200-E202 VanDerWaalsContact OG-N 3.11Å; S200-E202 PolarHBondContact OG-OE2 2.89Å; E202-V205 PolarHBondContact O-N 3.01Å; E202-Q206 WeakPolarHBondContact O-CB 3.43Å; E202-Q206 PolarHBondContact O-N 3.45Å
203	E	80.6	Confident	67.7	Low	108 Å²	108	66 Å²	66	51%	0.505	37%	0.367	S	S	.	.	H	α-helix	trans	-68.6	-41.2	173.4	-63	172.6	131.6	0	0	111.3	S200 I201 V205 Q206 H207	S200-E203 WeakPolarHBondContact CB-OE2 3.45Å; S200-E203 PolarHBondContact N-OE2 2.82Å; S200-E203 WeakPolarHBondContact O-CB 3.4Å; S200-E203 PolarHBondContact O-N 3.3Å; I201-E203 VanDerWaalsContact C-N 3.33Å; I201-E203 PolarHBondContact O-N 3.27Å; E203-V205 VanDerWaalsContact C-N 3.33Å; E203-V205 PolarHBondContact O-N 3.49Å; E203-Q206 WeakPolarHBondContact O-CB 3.35Å; E203-Q206 PolarHBondContact O-N 2.96Å; E203-Q206 VanDerWaalsContact O-N 3.16Å; E203-H207 WeakPolarHBondContact O-CB 3.22Å; E203-H207 PolarHBondContact O-N 3.36Å
204	L	80.4	Confident	67.9	Low	4 Å²	4	67 Å²	67	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-61.7	-41.5	174.3	-177.5	57.7	0	0	0	111.6	P160 C163 L183 F187 F199 S200 I201 I208	P160-L204 HydrophobicContact CB-CD1 4.46Å; C163-L204 HydrophobicContact CB-CD1 4.15Å; L183-L204 HydrophobicContact CD1-CD2 4.12Å; L183-L204 HydrophobicContact CD1-CG 4.44Å; F187-L204 HydrophobicContact CE2-CD2 4.06Å; F187-L204 HydrophobicContact CZ-CD2 4.27Å; F199-L204 HydrophobicContact CE1-CB 4.41Å; F199-L204 HydrophobicContact CE1-CD2 4.26Å; F199-L204 HydrophobicContact CE2-CB 4.41Å; F199-L204 HydrophobicContact CZ-CB 3.77Å; F199-L204 HydrophobicContact CZ-CD1 4.12Å; F199-L204 HydrophobicContact CZ-CD2 3.97Å; F199-L204 HydrophobicContact CZ-CG 4.16Å; S200-L204 PolarHBondContact O-N 2.93Å; I201-L204 WeakPolarHBondContact O-CB 3.22Å; I201-L204 PolarHBondContact O-N 2.83Å; L204-I208 HydrophobicContact CD1-CD1 4.21Å; L204-I208 HydrophobicContact CG-CD1 4.1Å; L204-I208 WeakPolarHBondContact O-CD1 3.4Å; L204-I208 WeakPolarHBondContact O-CG1 3.49Å; L204-I208 PolarHBondContact O-N 2.97Å
205	V	85.3	Confident	67.9	Low	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-60.7	-46.3	171.9	172.3	0	0	0	0	110.6	R176 L179 L180 L183 I201 E202 E203 I208 L209	R176-V205 HydrophobicContact CG-CG1 3.81Å; L179-V205 HydrophobicContact CB-CG1 3.94Å; L179-V205 HydrophobicContact CB-CG2 4.07Å; L179-V205 HydrophobicContact CD1-CG1 4.49Å; L180-V205 HydrophobicContact CB-CG2 4.21Å; L180-V205 HydrophobicContact CD1-CG2 3.81Å; L183-V205 HydrophobicContact CD2-CG2 3.61Å; I201-V205 WeakPolarHBondContact O-CG2 3.48Å; I201-V205 PolarHBondContact O-N 2.7Å; E202-V205 PolarHBondContact O-N 3.01Å; E203-V205 VanDerWaalsContact C-N 3.33Å; E203-V205 PolarHBondContact O-N 3.49Å; V205-I208 PolarHBondContact O-N 3.28Å; V205-L209 HydrophobicContact CG1-CD1 3.85Å; V205-L209 HydrophobicContact CG1-CG 4.32Å; V205-L209 WeakPolarHBondContact O-CG 3.19Å; V205-L209 PolarHBondContact O-N 3.34Å
206	Q	83.2	Confident	67.5	Low	61 Å²	61	70.1 Å²	70.1	29%	0.285	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-48.8	179.6	-169.1	58.2	45.3	0	0	111.6	E202 E203 I208 L209 D210	E202-Q206 WeakPolarHBondContact O-CB 3.43Å; E202-Q206 PolarHBondContact O-N 3.45Å; E203-Q206 WeakPolarHBondContact O-CB 3.35Å; E203-Q206 PolarHBondContact O-N 2.96Å; E203-Q206 VanDerWaalsContact O-N 3.16Å; Q206-I208 VanDerWaalsContact C-N 3.32Å; Q206-I208 PolarHBondContact O-N 2.86Å; Q206-L209 PolarHBondContact O-N 3.27Å; Q206-L209 VanDerWaalsContact O-N 3.12Å; Q206-D210 VanDerWaalsContact NE2-CG 3.34Å; Q206-D210 PolarHBondContact NE2-OD1 3.12Å; Q206-D210 PolarHBondContact NE2-OD2 3.41Å; Q206-D210 PolarHBondContact O-N 3.45Å
207	H	79.6	Confident	67	Low	79 Å²	79	72.5 Å²	72.5	37%	0.366	36%	0.364	S	S	.	.	H	α-helix	trans	-58.3	-39.9	175.4	173.6	-110.4	0	0	0	112.5	E203 R211	E203-H207 WeakPolarHBondContact O-CB 3.22Å; E203-H207 PolarHBondContact O-N 3.36Å; H207-R211 VanDerWaalsContact O-CB 3.24Å; H207-R211 WeakPolarHBondContact O-CB 3.28Å; H207-R211 PolarHBondContact O-N 3.4Å
208	I	80.8	Confident	66.2	Low	7 Å²	7	76 Å²	76	4%	0.036	38%	0.378	C	S	.	.	H	α-helix	trans	-66.9	-41.8	174.9	-68.2	163.1	0	0	0	111.4	C163 V165 L179 L183 L204 V205 Q206 R211 Q212	C163-I208 HydrophobicContact CB-CD1 3.77Å; C163-I208 HydrophobicContact CB-CG1 4.09Å; V165-I208 HydrophobicContact CG2-CG2 4.08Å; L179-I208 HydrophobicContact CD1-CB 4.37Å; L179-I208 HydrophobicContact CD1-CG2 3.73Å; L179-I208 HydrophobicContact CD2-CD1 4.25Å; L179-I208 HydrophobicContact CD2-CG2 3.95Å; L183-I208 HydrophobicContact CD1-CD1 3.92Å; L204-I208 HydrophobicContact CD1-CD1 4.21Å; L204-I208 HydrophobicContact CG-CD1 4.1Å; L204-I208 WeakPolarHBondContact O-CD1 3.4Å; L204-I208 WeakPolarHBondContact O-CG1 3.49Å; L204-I208 PolarHBondContact O-N 2.97Å; V205-I208 PolarHBondContact O-N 3.28Å; Q206-I208 VanDerWaalsContact C-N 3.32Å; Q206-I208 PolarHBondContact O-N 2.86Å; I208-R211 PolarHBondContact O-N 3.13Å; I208-Q212 WeakPolarHBondContact O-CG 3.37Å; I208-Q212 PolarHBondContact O-N 2.9Å
209	L	82.1	Confident	65.4	Low	19 Å²	19	80.7 Å²	80.7	10%	0.099	39%	0.386	C	S	.	.	H	α-helix	trans	-67	-39.5	177.9	-72.3	172.1	0	0	0	112.3	W174 R176 L179 V205 Q206 Q212 R213	W174-L209 WeakPolarHBondContact O-CD2 3.44Å; R176-L209 HydrophobicContact CB-CD1 4.04Å; R176-L209 HydrophobicContact CG-CD1 4.21Å; L179-L209 HydrophobicContact CD1-CD2 3.82Å; L179-L209 HydrophobicContact CD1-CG 4.03Å; V205-L209 HydrophobicContact CG1-CD1 3.85Å; V205-L209 HydrophobicContact CG1-CG 4.32Å; V205-L209 WeakPolarHBondContact O-CG 3.19Å; V205-L209 PolarHBondContact O-N 3.34Å; Q206-L209 PolarHBondContact O-N 3.27Å; Q206-L209 VanDerWaalsContact O-N 3.12Å; L209-Q212 CarbonylContact O-C 3.6Å; L209-Q212 WeakPolarHBondContact O-CA 3.43Å; L209-Q212 WeakPolarHBondContact O-CB 3.04Å; L209-Q212 PolarHBondContact O-N 3.39Å; L209-Q212 VanDerWaalsContact O-N 3.15Å; L209-R213 WeakPolarHBondContact O-CG 3.48Å; L209-R213 PolarHBondContact O-N 3.25Å; L209-R213 VanDerWaalsContact O-N 3.09Å
210	D	77.7	Confident	64.1	Low	55 Å²	55	84.8 Å²	84.8	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-75.4	-29.3	177.4	-68.1	-33.5	0	0	0	111.8	Q206 Q212 R213 T214	Q206-D210 VanDerWaalsContact NE2-CG 3.34Å; Q206-D210 PolarHBondContact NE2-OD1 3.12Å; Q206-D210 PolarHBondContact NE2-OD2 3.41Å; Q206-D210 PolarHBondContact O-N 3.45Å; D210-Q212 VanDerWaalsContact C-N 3.27Å; D210-Q212 PolarHBondContact O-N 2.97Å; D210-R213 CarbonylContact O-C 3.53Å; D210-R213 PolarHBondContact O-N 3.11Å; D210-R213 WeakPolarHBondContact OD1-CD 3.36Å; D210-R213 IonicContact OD1-CZ 3.96Å; D210-R213 IonicContact OD1-NE 2.62Å; D210-R213 IonicContact OD1-NH1 2.97Å; D210-R213 PolarHBondContact OD1-NH1 3.09Å; D210-T214 WeakPolarHBondContact O-CB 3.44Å; D210-T214 WeakPolarHBondContact O-CG2 3.44Å; D210-T214 PolarHBondContact O-N 3.01Å; D210-T214 PolarHBondContact O-OG1 3.38Å
211	R	69.8	Low	62.3	Low	136 Å²	136	91.1 Å²	91.1	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-65.8	-29	165.1	-163.2	172.2	-176.5	-174.5	3.5	112.6	H207 I208 R213 T214	H207-R211 VanDerWaalsContact O-CB 3.24Å; H207-R211 WeakPolarHBondContact O-CB 3.28Å; H207-R211 PolarHBondContact O-N 3.4Å; I208-R211 PolarHBondContact O-N 3.13Å; R211-R213 VanDerWaalsContact C-N 3.32Å; R211-T214 WeakPolarHBondContact CA-OG1 3.39Å
212	Q	66.5	Low	60	Low	41 Å²	41	93.6 Å²	93.6	19%	0.192	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.9	167.8	-68.7	176.1	46.2	0	0	113.8	R173 W174 I208 L209 D210	R173-Q212 PolarHBondContact NH1-O 2.88Å; W174-Q212 VanDerWaalsContact CD1-NE2 3.34Å; I208-Q212 WeakPolarHBondContact O-CG 3.37Å; I208-Q212 PolarHBondContact O-N 2.9Å; L209-Q212 CarbonylContact O-C 3.6Å; L209-Q212 WeakPolarHBondContact O-CA 3.43Å; L209-Q212 WeakPolarHBondContact O-CB 3.04Å; L209-Q212 PolarHBondContact O-N 3.39Å; L209-Q212 VanDerWaalsContact O-N 3.15Å; D210-Q212 VanDerWaalsContact C-N 3.27Å; D210-Q212 PolarHBondContact O-N 2.97Å
213	R	63.7	Low	57.7	Low	165 Å²	165	93.9 Å²	93.9	62%	0.623	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-35.1	175.5	-72.8	158.5	159.3	-178.6	-6.6	112.6	L209 D210 R211 K215	L209-R213 WeakPolarHBondContact O-CG 3.48Å; L209-R213 PolarHBondContact O-N 3.25Å; L209-R213 VanDerWaalsContact O-N 3.09Å; D210-R213 CarbonylContact O-C 3.53Å; D210-R213 PolarHBondContact O-N 3.11Å; D210-R213 WeakPolarHBondContact OD1-CD 3.36Å; D210-R213 IonicContact OD1-CZ 3.96Å; D210-R213 IonicContact OD1-NE 2.62Å; D210-R213 IonicContact OD1-NH1 2.97Å; D210-R213 PolarHBondContact OD1-NH1 3.09Å; R211-R213 VanDerWaalsContact C-N 3.32Å; R213-K215 VanDerWaalsContact C-N 3.34Å
214	T	49	Very low	55.7	Low	105 Å²	105	97.2 Å²	97.2	64%	0.644	49%	0.493	S	S	*	.	S	Bend	trans	-85.2	-0.5	-177.4	51.8	0	0	0	0	114.1	D210 R211 P216	D210-T214 WeakPolarHBondContact O-CB 3.44Å; D210-T214 WeakPolarHBondContact O-CG2 3.44Å; D210-T214 PolarHBondContact O-N 3.01Å; D210-T214 PolarHBondContact O-OG1 3.38Å; R211-T214 WeakPolarHBondContact CA-OG1 3.39Å; T214-P216 WeakPolarHBondContact O-CD 3.17Å
215	K	39.4	Very low	53.7	Low	99 Å²	99	100.9 Å²	100.9	43%	0.43	52%	0.518	S	S	.	.	S	Bend	trans	-59.9	108.4	164	-158.5	-179.3	-161.9	-175.8	0	106.8	D170 R213 Q217	D170-K215 IonicContact OD1-NZ 3.1Å; D170-K215 PolarHBondContact OD1-NZ 3.01Å; D170-K215 IonicContact OD2-NZ 3.83Å; D170-K215 PolarHBondContact OD2-NZ 3.24Å; R213-K215 VanDerWaalsContact C-N 3.34Å; K215-Q217 PolarHBondContact O-N 3.26Å
216	P	33.5	Very low	51.2	Low	110 Å²	110	106.4 Å²	106.4	71%	0.714	56%	0.557	S	S	*	*			trans	-62.6	142	-174.5	26.9	-34.2	0	0	0	108.6	T214	T214-P216 WeakPolarHBondContact O-CD 3.17Å
217	Q	30.3	Very low	48.7	Very low	175 Å²	175	109.8 Å²	109.8	82%	0.818	58%	0.582	S	S	*	*			trans	-51.5	136.9	163.4	-78.5	-168.9	-5.7	0	0	107.9	K215 R219	K215-Q217 PolarHBondContact O-N 3.26Å; Q217-R219 PolarHBondContact O-N 2.78Å
218	P	31.6	Very low	46.3	Very low	113 Å²	113	112.9 Å²	112.9	73%	0.734	60%	0.601	S	S	*	*			trans	-58.9	109.3	171.5	25.6	-32.5	0	0	0	106.9	T220	P218-T220 PolarHBondContact O-N 2.86Å
219	R	33	Very low	44.3	Very low	242 Å²	242	121.1 Å²	121.1	91%	0.913	64%	0.639	S	S	*	*			trans	-62.9	91.3	177.1	-90.1	-174.8	169.7	174.8	-2.8	108.2	Q217 H221	Q217-R219 PolarHBondContact O-N 2.78Å; R219-H221 VanDerWaalsContact C-N 3.31Å; R219-H221 PolarHBondContact O-N 3.17Å
220	T	36.2	Very low	41.8	Very low	128 Å²	128	127.2 Å²	127.2	79%	0.785	68%	0.677	S	S	*	*			trans	-59.2	98.9	161	38.1	0	0	0	0	106.4	P218 A222	P218-T220 PolarHBondContact O-N 2.86Å; T220-A222 PolarHBondContact O-N 3.26Å; T220-A222 VanDerWaalsContact O-N 3.12Å
221	H	39	Very low	39.5	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.796	70%	0.697	S	S	*	*			trans	-58.8	118.7	168	46.3	-88.2	0	0	0	106.7	R219 C223	R219-H221 VanDerWaalsContact C-N 3.31Å; R219-H221 PolarHBondContact O-N 3.17Å; H221-C223 PolarHBondContact O-N 3.21Å
222	A	34.3	Very low	37.7	Very low	87 Å²	87	129.8 Å²	129.8	72%	0.719	72%	0.717	S	S	*	*			trans	-61.3	114.7	179.2	0	0	0	0	0	108.5	T220 L224	T220-A222 PolarHBondContact O-N 3.26Å; T220-A222 VanDerWaalsContact O-N 3.12Å; A222-L224 PolarHBondContact O-N 2.93Å; A222-L224 VanDerWaalsContact O-N 3.15Å
223	C	35.9	Very low	36.4	Very low	65 Å²	65	130.8 Å²	130.8	44%	0.439	74%	0.738	S	S	.	*			trans	-61.8	115.8	164.6	-162.4	0	0	0	0	105.8	H221 C225	H221-C223 PolarHBondContact O-N 3.21Å; C223-C225 VanDerWaalsContact CA-SG 3.5Å; C223-C225 HydrophobicContact CB-CB 3.69Å; C223-C225 WeakPolarHBondContact CB-SG 3.38Å; C223-C225 PolarHBondContact O-N 3.25Å; C223-C225 WeakPolarHBondContact SG-CB 3.4Å; C223-C225 CovalentContact SG-SG 2.04Å; C223-C225 PolarHBondContact SG-SG 3.15Å
224	L	38.9	Very low	34.8	Very low	179 Å²	179	129.5 Å²	129.5	94%	0.937	75%	0.748	S	S	*	*			trans	-72.4	60.7	174.8	-68.8	172.1	0	0	0	110	A222	A222-L224 PolarHBondContact O-N 2.93Å; A222-L224 VanDerWaalsContact O-N 3.15Å
225	C	38.3	Very low	33.9	Very low	81 Å²	81	132.3 Å²	132.3	55%	0.547	76%	0.76	S	S	.	*			trans	-129.8	18.3	-154.9	-57.2	0	0	0	0	111.9	C223	C223-C225 VanDerWaalsContact CA-SG 3.5Å; C223-C225 HydrophobicContact CB-CB 3.69Å; C223-C225 WeakPolarHBondContact CB-SG 3.38Å; C223-C225 PolarHBondContact O-N 3.25Å; C223-C225 WeakPolarHBondContact SG-CB 3.4Å; C223-C225 CovalentContact SG-SG 2.04Å; C223-C225 PolarHBondContact SG-SG 3.15Å
226	S	31.6	Very low	33.8	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	77%	0.774	S	S	*	*			trans	-169	123.9	158.6	-80.1	0	0	0	0	110.5
227	T	30.6	Very low	33.8	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	78%	0.779	S	S	*	*			trans	-130.7	90.3	161.8	47.5	0	0	0	0	108.6
228	N	31.2	Very low	34.3	Very low	143 Å²	143	134.8 Å²	134.8	77%	0.765	78%	0.777	S	S	*	*	S	Bend		176.8	129.4	129.1	-88.3	-11.4	0	0	0	112.6
229	Q	37.1	Very low	34.3	Very low	180 Å²	180	141 Å²	141	84%	0.841	79%	0.785	S	S	*	*			trans	48.4	94.2	148	-54.6	-176.1	27.8	0	0	119.8
230	V	29.9	Very low	34.4	Very low	147 Å²	147	133.9 Å²	133.9	89%	0.891	77%	0.772	S	S	*	*			trans	-141.1	146.2	144.1	-176.2	0	0	0	0	108.5
231	S	30.4	Very low	34.5	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	77%	0.774	S	S	*	*			trans	-66.3	159.6	-176.7	-55.1	0	0	0	0	114.7	G233	S231-G233 PolarHBondContact O-N 3.28Å
232	P	32.1	Very low	34.2	Very low	142 Å²	142	131.5 Å²	131.5	92%	0.922	77%	0.768	S	S	*	*	S	Bend	trans	-78	111.8	-175.1	30.5	-35	0	0	0	113.4
233	G	37.5	Very low	34.5	Very low	62 Å²	62	133.6 Å²	133.6	64%	0.639	77%	0.772	S	S	*	*			trans	169.8	146	170.7	0	0	0	0	0	112.1	S231	S231-G233 PolarHBondContact O-N 3.28Å
234	V	31	Very low	34.8	Very low	138 Å²	138	139.3 Å²	139.3	84%	0.836	79%	0.789	S	S	*	*			trans	68.1	129.3	-177.9	-169.7	0	0	0	0	114.9	I236	V234-I236 HydrophobicContact CG1-CG1 4.22Å
235	N	29.7	Very low	34.5	Very low	165 Å²	165	140 Å²	140	88%	0.882	79%	0.787	S	S	*	*			trans	-97.4	125.7	174.2	-107.4	-84.4	0	0	0	110.5
236	I	36.7	Very low	34.2	Very low	143 Å²	143	147.7 Å²	147.7	73%	0.733	81%	0.805	S	S	*	*			trans	-129.9	123.9	170.8	-56.3	179.2	0	0	0	109	V234 H238	V234-I236 HydrophobicContact CG1-CG1 4.22Å; I236-H238 PolarHBondContact O-N 3.04Å
237	P	33.6	Very low	34.2	Very low	125 Å²	125	149.4 Å²	149.4	81%	0.812	80%	0.803	S	S	*	*			trans	-76.2	118.4	-177	29.3	-33.8	0	0	0	112.3
238	H	41.8	Very low	34.2	Very low	168 Å²	168	150.4 Å²	150.4	78%	0.778	80%	0.802	S	S	*	*			trans	-75.6	153.6	174.1	68.4	-90.5	0	0	0	111.9	I236	I236-H238 PolarHBondContact O-N 3.04Å
239	R	32	Very low	34.1	Very low	242 Å²	242	148.3 Å²	148.3	91%	0.913	80%	0.799	S	S	*	*			trans	-134.4	88.4	-175.2	-158.6	-179.6	-164.7	-165.9	7.2	113
240	C	35.4	Very low	33.7	Very low	94 Å²	94	145.7 Å²	145.7	64%	0.635	80%	0.797	S	S	*	*			trans	-77.8	146.7	171.7	-167.2	0	0	0	0	111.2
241	N	38.3	Very low	33.5	Very low	153 Å²	153	148.6 Å²	148.6	82%	0.818	80%	0.798	S	S	*	*			trans	-138.6	56	-172.2	-166.2	27.1	0	0	0	112.6
242	S	32.6	Very low	33.4	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	80%	0.803	S	S	*	*			trans	-115.1	127	178.4	-173.9	0	0	0	0	111.6
243	T	39.8	Very low	33.2	Very low	131 Å²	131	149.5 Å²	149.5	80%	0.804	79%	0.792	S	S	*	*			trans	-106.8	40.2	-166.7	-34.1	0	0	0	0	113.4
244	K	41.6	Very low	32.8	Very low	186 Å²	186	152.6 Å²	152.6	81%	0.809	80%	0.801	S	S	*	*			trans	-143.8	65.3	-176.8	-77.5	-161.4	172.8	-168.3	0	115.7
245	H	33.4	Very low	32.5	Very low	193 Å²	193	152.8 Å²	152.8	89%	0.894	80%	0.802	S	S	*	*			trans	-135.1	125.7	153.2	-72.1	-83.2	0	0	0	109.5
246	R	32.4	Very low	32.3	Very low	242 Å²	242	150.6 Å²	150.6	91%	0.913	80%	0.8	S	S	*	*			trans	-106.1	128.5	171.3	-172.8	179.9	-175.1	-174.6	1.1	107
247	I	30.7	Very low	31.7	Very low	152 Å²	152	149.6 Å²	149.6	78%	0.779	81%	0.805	S	S	*	*			trans	-70.5	131.4	-176	-59.5	170	0	0	0	109.4
248	I	31.3	Very low	31.5	Very low	153 Å²	153	147 Å²	147	79%	0.785	80%	0.801	S	S	*	*			trans	-124.8	124.8	163.9	-60.9	174.9	0	0	0	105.9
249	S	28.1	Very low	31.2	Very low	100 Å²	100	145.6 Å²	145.6	70%	0.699	81%	0.807	S	S	*	*			trans	-98.3	126.9	169.2	-62.9	0	0	0	0	108.6
250	P	29	Very low	30.8	Very low	124 Å²	124	138.8 Å²	138.8	81%	0.805	80%	0.803	S	S	*	*			trans	-67.5	149.7	169.7	30	-33.9	0	0	0	110
251	K	26.8	Very low	30.3	Very low	208 Å²	208	139 Å²	139	90%	0.904	81%	0.811	S	S	*	*			trans	-114.5	126	178.2	-162	177.8	-176.5	-173.8	0	107.8
252	L	27.9	Very low	29.8	Very low	160 Å²	160	137.2 Å²	137.2	84%	0.838	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-93.8	155.7	-177.9	-76.2	170.9	0	0	0	111.5
253	P	27.5	Very low	30.4	Very low	104 Å²	104	138.2 Å²	138.2	68%	0.675	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78	164.1	-172.6	32.4	-37	0	0	0	113.4
254	P	29.4	Very low	30	Very low	128 Å²	128	138.2 Å²	138.2	83%	0.831	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.4	150.4	173.2	34.4	-34.6	0	0	0	112
255	T	24.9	Very low	29.2	Very low	141 Å²	141	134.4 Å²	134.4	87%	0.865	81%	0.814	S	S	*	*			trans	-132.9	136.6	168.3	49.6	0	0	0	0	109.8
256	S	24.4	Very low	28.9	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	81%	0.81	S	S	*	*			trans	-128.3	123.7	-171.6	54.1	0	0	0	0	111.9
257	S	25.8	Very low	28.7	Very low	121 Å²	121	127.3 Å²	127.3	85%	0.846	80%	0.804	S	S	*	*			trans	-165.3	129.4	163.1	54	0	0	0	0	111.1
258	G	27.4	Very low	29	Very low	70 Å²	70	125.7 Å²	125.7	72%	0.722	80%	0.804	S	S	*	*			trans	-74.4	-165.2	154.6	0	0	0	0	0	111
259	P	35.6	Very low	28.8	Very low	139 Å²	139	121.8 Å²	121.8	90%	0.903	80%	0.801	S	S	*	*				-133.9	-168.2	51.6	38.8	-22.3	0	0	0	114.4
260	A	24.8	Very low	28.7	Very low	100 Å²	100	126 Å²	126	83%	0.826	81%	0.81	S	S	*	*			trans	-110.7	164.1	-175.6	0	0	0	0	0	113.3
261	A	25.2	Very low	28.7	Very low	98 Å²	98	126 Å²	126	81%	0.81	81%	0.813	S	S	*	*			trans	-153.8	161.8	163.8	0	0	0	0	0	110.5
262	S	26.3	Very low	28.7	Very low	115 Å²	115	119.5 Å²	119.5	80%	0.804	81%	0.805	S	S	*	*			trans	-163.2	176.1	179.1	-57.5	0	0	0	0	109.4
263	P	45.1	Very low	28.7	Very low	117 Å²	117	123.9 Å²	123.9	76%	0.76	81%	0.81	S	S	*	*				-90.9	-170	-68.3	38.9	-28.7	0	0	0	111
264	P	32.3	Very low	28.6	Very low	131 Å²	131	123 Å²	123	85%	0.851	82%	0.82	S	S	*	*				-144.4	-176.4	104.9	40	-26.1	0	0	0	114
265	S	25.4	Very low	28.4	Very low	107 Å²	107	121 Å²	121	75%	0.748	82%	0.823	S	S	*	*			trans	-116.8	176.4	179.2	62	0	0	0	0	112.8
266	S	27.5	Very low	28.4	Very low	114 Å²	114	117.8 Å²	117.8	80%	0.797	82%	0.817	S	S	*	*			trans	98.1	123	161.7	-45.8	0	0	0	0	118
267	E	26.7	Very low	28.4	Very low	171 Å²	171	121.4 Å²	121.4	80%	0.799	82%	0.821	S	S	*	*			trans	-55.5	172.9	153.7	-73.9	-77.7	146.7	0	0	112.4
268	P	37.6	Very low	28.5	Very low	119 Å²	119	120.7 Å²	120.7	77%	0.773	82%	0.815	S	S	*	*			cis	-135.7	-176.5	9.1	42.8	-26.8	0	0	0	115.9
269	G	26.7	Very low	28.3	Very low	70 Å²	70	126.1 Å²	126.1	72%	0.722	82%	0.819	S	S	*	*			trans	111.9	125.3	132.4	0	0	0	0	0	118.5
270	E	27.4	Very low	27.7	Very low	190 Å²	190	126.6 Å²	126.6	89%	0.888	81%	0.813	S	S	*	*			trans	-57.3	146.3	-178.9	-56.7	172.4	87.2	0	0	116.5
271	S	28.9	Very low	27.6	Very low	124 Å²	124	125.8 Å²	125.8	87%	0.867	80%	0.802	S	S	*	*				154.1	167.8	106.1	60.6	0	0	0	0	113.6
272	G	26.9	Very low	27.6	Very low	71 Å²	71	128.9 Å²	128.9	73%	0.732	80%	0.799	S	S	*	*			trans	100.9	81.8	153	0	0	0	0	0	119.7
273	R	27.8	Very low	27.4	Very low	252 Å²	252	130.8 Å²	130.8	95%	0.951	80%	0.8	S	S	*	*			trans	14	109.2	144.5	-63.3	176.3	173.8	-133.4	-1	119.9
274	G	24.3	Very low	26.4	Very low	86 Å²	86	133.3 Å²	133.3	89%	0.887	80%	0.801	S	S	*	*				44.9	140.8	110.2	0	0	0	0	0	123
275	G	24.9	Very low	26.5	Very low	86 Å²	86	132.2 Å²	132.2	89%	0.887	79%	0.794	S	S	*	*			trans	146.1	159.6	172.9	0	0	0	0	0	111.1
276	G	24.8	Very low	26.5	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	80%	0.8	S	S	*	*			trans	-172.2	-164.7	179.3	0	0	0	0	0	115.1
277	E	25.1	Very low	26.4	Very low	197 Å²	197	135.4 Å²	135.4	92%	0.921	80%	0.797	S	S	*	*			trans	81.3	156.6	178.9	-55.5	-153.5	92.3	0	0	119.4
278	S	27.1	Very low	26.8	Very low	105 Å²	105	133 Å²	133	73%	0.734	80%	0.796	S	S	*	*			trans	91.3	85.4	154.2	-60.6	0	0	0	0	122.5
279	K	24.4	Very low	26.2	Very low	184 Å²	184	131.6 Å²	131.6	80%	0.8	79%	0.794	S	S	*	*				63.6	147.8	109.8	-95.5	178.9	174.9	174.5	0	123.4
280	L	22.1	Very low	26.1	Very low	149 Å²	149	134 Å²	134	78%	0.78	80%	0.8	S	S	*	*			trans	68.5	152.6	159.8	-87.8	74.6	0	0	0	116.7
281	S	23	Very low	25.9	Very low	83 Å²	83	130 Å²	130	58%	0.58	79%	0.793	S	S	*	*			cis	-173.1	178.5	-26.2	48.1	0	0	0	0	112.6
282	Q	24.9	Very low	26	Very low	163 Å²	163	129.9 Å²	129.9	76%	0.762	79%	0.789	S	S	*	*			trans	91.8	124.9	145.2	-84.5	-178.6	-55.8	0	0	122
283	L	23.5	Very low	26	Very low	155 Å²	155	131.8 Å²	131.8	81%	0.812	79%	0.791	S	S	*	*			trans	92.9	134.5	133.6	-71.2	167.9	0	0	0	122.4
284	Q	22.7	Very low	26.3	Very low	170 Å²	170	125.5 Å²	125.5	79%	0.794	78%	0.783	S	S	*	*			trans	-92.6	178.4	170.8	-142.6	-176.2	-21.2	0	0	107.8
285	P	35.5	Very low	26.2	Very low	109 Å²	109	126.1 Å²	126.1	71%	0.708	77%	0.774	S	S	*	*				-162.1	173.1	72.4	46	-24.8	0	0	0	119.5
286	Q	24.6	Very low	26.1	Very low	183 Å²	183	127 Å²	127	86%	0.855	77%	0.766	S	S	*	*			trans	76	163.5	153.2	-51.4	-130.7	12.2	0	0	121
287	S	24.8	Very low	26	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	76%	0.763	S	S	*	*			trans	-153.1	179.1	-170.5	60.4	0	0	0	0	109.3
288	P	36.2	Very low	25.9	Very low	120 Å²	120	129 Å²	129	78%	0.779	76%	0.755	S	S	*	*				-150.1	159.7	107.6	38.2	-22.4	0	0	0	116.9
289	A	24.3	Very low	25.7	Very low	89 Å²	89	130.7 Å²	130.7	74%	0.736	75%	0.751	S	S	*	*			trans	31.7	152.2	138.6	0	0	0	0	0	122.3
290	S	24.3	Very low	25.6	Very low	121 Å²	121	129.7 Å²	129.7	85%	0.846	75%	0.747	S	S	*	*			cis	-146.2	165.9	22.7	-54.5	0	0	0	0	113.4
291	S	24.6	Very low	25.6	Very low	107 Å²	107	129.7 Å²	129.7	75%	0.748	74%	0.743	S	S	*	*			trans	-101	179.7	171.3	62.3	0	0	0	0	111.6
292	P	30.5	Very low	25.5	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	75%	0.753	S	S	*	*				-144.4	159.1	79	38	-20.8	0	0	0	116.6
293	S	26.9	Very low	25.4	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	75%	0.754	S	S	*	*			trans	-96.6	159.1	159.3	-51	0	0	0	0	110.1
294	P	33.1	Very low	25.4	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	75%	0.753	S	S	*	*				-134.5	149	108.6	12.7	8.4	0	0	0	111.4
295	S	22.3	Very low	25.3	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	75%	0.752	S	S	*	*			cis	113.2	128.4	18.5	78.8	0	0	0	0	112.2
296	S	23	Very low	24.6	Very low	104 Å²	104	126.1 Å²	126.1	73%	0.727	75%	0.748	S	S	*	*			trans	74.5	156.5	150.6	-130.3	0	0	0	0	117.4
297	T	23.9	Very low	24.5	Very low	109 Å²	109	127.5 Å²	127.5	67%	0.669	75%	0.745	S	S	*	*			cis	-150.5	139	11.7	-32.3	0	0	0	0	114.2
298	R	22.8	Very low	24.4	Very low	203 Å²	203	126.8 Å²	126.8	77%	0.766	74%	0.74	S	S	*	*			trans	55	144.3	138.8	-90.4	169.7	158.1	-139.7	15.8	124.3
299	Q	22.8	Very low	23.8	Very low	139 Å²	139	125.7 Å²	125.7	65%	0.65	74%	0.735	S	S	*	*			trans	73.1	159.8	139.6	-75.1	172.9	-106.1	0	0	119.7
300	K	22.7	Very low	23.7	Very low	163 Å²	163	129.8 Å²	129.8	71%	0.709	74%	0.739	S	S	*	*			cis	-177.1	150.7	-42.8	-116.6	-171.2	-177.8	-176.2	0	107.2
301	H	21.6	Very low	23.5	Very low	150 Å²	150	128.6 Å²	128.6	69%	0.694	74%	0.737	S	S	*	*			trans	73.8	115.8	150.9	-73	6.9	0	0	0	121.5
302	C	21.6	Very low	23.9	Very low	116 Å²	116	132.8 Å²	132.8	78%	0.784	74%	0.742	S	S	*	*				55.8	88.3	116	-52.8	0	0	0	0	121.1
303	G	22.1	Very low	23.8	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	74%	0.744	S	S	*	*				95.4	-168.9	96.3	0	0	0	0	0	120.4
304	N	22.8	Very low	23.7	Very low	147 Å²	147	132 Å²	132	79%	0.786	74%	0.742	S	S	*	*			trans	81.8	125.5	168.7	-75.5	-14.3	0	0	0	122.4
305	F	21.2	Very low	25	Very low	177 Å²	177	131.9 Å²	131.9	78%	0.776	74%	0.741	S	S	*	*				96	107.1	129.4	-87.8	-130.7	0	0	0	122.9
306	S	20.6	Very low	26	Very low	88 Å²	88	133.1 Å²	133.1	62%	0.615	75%	0.747	S	S	*	*				66.8	97.4	108.3	-56.5	0	0	0	0	122.6
307	R	22.4	Very low	26.2	Very low	211 Å²	211	132.8 Å²	132.8	80%	0.796	75%	0.75	S	S	*	*				66.2	126.4	100.6	-157.2	-151.9	-177.7	-176.2	-5.5	121
308	S	23.4	Very low	26.3	Very low	91 Å²	91	132.4 Å²	132.4	64%	0.636	76%	0.758	S	S	*	*			trans	84.2	148.9	141.1	42.2	0	0	0	0	122.8
309	S	22.7	Very low	26.5	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	76%	0.764	S	S	*	*			trans	82.8	142.3	154.6	-72.1	0	0	0	0	117.8
310	E	22.5	Very low	27.5	Very low	175 Å²	175	130 Å²	130	82%	0.818	77%	0.77	S	S	*	*			cis	-163.1	-178.3	-14.5	-132.2	160	142	0	0	113.7
311	A	21	Very low	27.8	Very low	96 Å²	96	125.9 Å²	125.9	79%	0.793	77%	0.774	S	S	*	*			trans	79.2	152.5	155	0	0	0	0	0	121.5
312	F	32.2	Very low	28.1	Very low	195 Å²	195	124 Å²	124	86%	0.855	79%	0.785	S	S	*	*			trans	-101.5	168.6	170.9	-85.5	-96.9	0	0	0	109.9
313	P	27.6	Very low	28.4	Very low	127 Å²	127	121.7 Å²	121.7	83%	0.825	78%	0.781	S	S	*	*				-131.2	-175.3	110.2	38.9	-32.5	0	0	0	113.9
314	A	25.6	Very low	28.7	Very low	88 Å²	88	130.1 Å²	130.1	73%	0.727	79%	0.788	S	S	*	*			trans	-145	-159.1	175.7	0	0	0	0	0	109.4
315	P	61.3	Low	29	Very low	117 Å²	117	127.5 Å²	127.5	76%	0.76	79%	0.787	S	S	*	*				-108.2	-179.3	-96	40.9	-29.5	0	0	0	113.6
316	P	42.3	Very low	29.4	Very low	126 Å²	126	123 Å²	123	82%	0.818	79%	0.791	S	S	*	*				-144.5	-172.3	116.9	30.3	-11.5	0	0	0	113
317	A	27.4	Very low	29.8	Very low	96 Å²	96	122.3 Å²	122.3	79%	0.793	80%	0.798	S	S	*	*				170.9	126.4	-50.9	0	0	0	0	0	109
318	A	25.2	Very low	30.1	Very low	102 Å²	102	118.3 Å²	118.3	84%	0.843	80%	0.796	S	S	*	*			trans	-165.9	160.9	165.9	0	0	0	0	0	112.9
319	L	27.9	Very low	30.3	Very low	170 Å²	170	123.8 Å²	123.8	89%	0.89	80%	0.803	S	S	*	*			trans	-140.7	-175.2	-177.6	-83.6	171.4	0	0	0	108.2
320	P	44.4	Very low	30.5	Very low	121 Å²	121	129 Å²	129	79%	0.786	81%	0.808	S	S	*	*			cis	-122.2	172	0.7	42.7	-27.2	0	0	0	113.7
321	G	28.4	Very low	30.7	Very low	76 Å²	76	123.5 Å²	123.5	78%	0.784	80%	0.799	S	S	*	*				107.8	153	80.5	0	0	0	0	0	109.7
322	A	27.9	Very low	31	Very low	111 Å²	111	127.4 Å²	127.4	92%	0.917	80%	0.8	S	S	*	*			cis	-154.5	173.3	-7.4	0	0	0	0	0	107.3
323	G	28.5	Very low	30.7	Very low	68 Å²	68	121.8 Å²	121.8	70%	0.701	80%	0.797	S	S	*	*			cis	158.2	162.1	-4.7	0	0	0	0	0	111.3
324	R	28.3	Very low	30.7	Very low	254 Å²	254	119 Å²	119	96%	0.958	79%	0.792	S	S	*	*			trans	64.8	156	176.6	-73	176.4	157.4	175.7	-7.5	116.4
325	A	27.6	Very low	30.9	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	80%	0.798	S	S	*	*			cis	-152.8	152.6	-23.6	0	0	0	0	0	106.8
326	G	29.4	Very low	30.2	Very low	83 Å²	83	121 Å²	121	86%	0.856	79%	0.794	S	S	*	*				79.4	128.7	71.7	0	0	0	0	0	110.8
327	G	30.1	Very low	29.5	Very low	74 Å²	74	120.7 Å²	120.7	76%	0.763	79%	0.791	S	S	*	*			cis	-163.3	-146.2	1.9	0	0	0	0	0	109.4
328	V	28.7	Very low	29.6	Very low	126 Å²	126	120.7 Å²	120.7	76%	0.764	79%	0.785	S	S	*	*			cis	-159.5	134.3	-9.4	103.4	0	0	0	0	110.5
329	R	27.5	Very low	29.8	Very low	207 Å²	207	124.7 Å²	124.7	78%	0.781	79%	0.785	S	S	*	*			trans	35.4	135.7	147.1	-63.6	173	176.9	-155.2	-0.7	123.5
330	R	26.9	Very low	30	Very low	205 Å²	205	120.7 Å²	120.7	77%	0.774	78%	0.777	S	S	*	*			trans	63.1	153.5	131.2	-67.1	179.5	175.8	-142.7	3.7	119.2	E332	R330-E332 IonicContact NH1-OE1 2.83Å; R330-E332 PolarHBondContact NH1-OE1 3.19Å
331	G	26.3	Very low	30	Very low	61 Å²	61	121.2 Å²	121.2	63%	0.629	78%	0.78	S	S	*	*			cis	146.9	177	-4.4	0	0	0	0	0	112.8
332	E	27.1	Very low	30.4	Very low	177 Å²	177	122.3 Å²	122.3	83%	0.827	78%	0.776	S	S	*	*			trans	69.5	153.1	176.8	-60.2	159.3	-174.3	0	0	114	R330	R330-E332 IonicContact NH1-OE1 2.83Å; R330-E332 PolarHBondContact NH1-OE1 3.19Å
333	G	26.5	Very low	30.7	Very low	77 Å²	77	122.6 Å²	122.6	79%	0.794	77%	0.771	S	S	*	*			cis	175.7	160.7	-7.3	0	0	0	0	0	111.7
334	G	28.1	Very low	31.6	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	78%	0.776	S	S	*	*			trans	98.2	122	179.9	0	0	0	0	0	114.4
335	V	29.3	Very low	31.7	Very low	140 Å²	140	118.3 Å²	118.3	85%	0.848	77%	0.767	S	S	*	*			cis	74	132.7	9.4	-176	0	0	0	0	113
336	P	45.6	Very low	32.7	Very low	105 Å²	105	120.3 Å²	120.3	68%	0.682	77%	0.772	S	S	*	*			cis	-137.9	178.7	20.7	31.9	-7.9	0	0	0	119.7
337	T	28.5	Very low	33	Very low	121 Å²	121	126.4 Å²	126.4	74%	0.742	77%	0.769	S	S	*	*			trans	64.9	108.7	143.1	44.5	0	0	0	0	125
338	S	29.8	Very low	33	Very low	95 Å²	95	131.3 Å²	131.3	66%	0.664	77%	0.773	S	S	*	*				88.6	150.4	115	75.4	0	0	0	0	123.3
339	H	28.1	Very low	33.2	Very low	186 Å²	186	132.3 Å²	132.3	86%	0.861	77%	0.769	S	S	*	*			trans	71.8	143.9	168.1	-61.9	-74.3	0	0	0	120.3
340	A	32.8	Very low	33.3	Very low	87 Å²	87	127.3 Å²	127.3	72%	0.719	76%	0.761	S	S	*	*			trans	-102	162.6	160.8	0	0	0	0	0	108.6
341	P	45.3	Very low	33.3	Very low	131 Å²	131	124.5 Å²	124.5	85%	0.851	76%	0.762	S	S	*	*				-146.5	-145.2	94.1	40.4	-22.7	0	0	0	113.2
342	S	36.5	Very low	33.4	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	77%	0.771	S	S	*	*			trans	-138.5	162	-161.4	50.3	0	0	0	0	114.6
343	S	34.5	Very low	33.3	Very low	117 Å²	117	122.3 Å²	122.3	82%	0.818	77%	0.767	S	S	*	*			trans	72.8	166.2	173.7	85.3	0	0	0	0	114.9
344	P	46.4	Very low	33.4	Very low	122 Å²	122	124.3 Å²	124.3	79%	0.792	77%	0.769	S	S	*	*			cis	-138	-164.2	22.3	44.4	-24.5	0	0	0	117.6
345	S	30.6	Very low	33.2	Very low	110 Å²	110	125.6 Å²	125.6	77%	0.769	77%	0.773	S	S	*	*			trans	-70.5	176.2	-177.1	-33	0	0	0	0	115.7
346	P	49.8	Very low	34.2	Very low	134 Å²	134	124.3 Å²	124.3	87%	0.87	77%	0.768	S	S	*	*				-145	-160	73.5	37.8	-16	0	0	0	116.7
347	R	34.1	Very low	33.2	Very low	210 Å²	210	126.6 Å²	126.6	79%	0.792	77%	0.773	S	S	*	*			trans	-120.5	166	-160.9	-57.9	167.4	161.4	-178.8	-5.8	115.5
348	Q	31	Very low	33	Very low	178 Å²	178	127.9 Å²	127.9	83%	0.832	78%	0.775	S	S	*	*				-169.9	125	121.4	-98.2	162.8	39.9	0	0	110.5
349	H	31.8	Very low	33.1	Very low	147 Å²	147	131.2 Å²	131.2	68%	0.681	78%	0.784	S	S	*	*				70.4	133.3	90.7	-80.9	-84	0	0	0	114.6
350	T	29.9	Very low	32.9	Very low	101 Å²	101	127 Å²	127	62%	0.62	78%	0.782	S	S	*	*			cis	-157.7	155.2	8	24	0	0	0	0	112.4
351	D	26.5	Very low	32.6	Very low	147 Å²	147	128 Å²	128	79%	0.786	78%	0.784	S	S	*	*			trans	51.3	158.3	140.8	-54.1	-17.1	0	0	0	122.5
352	S	29.6	Very low	32	Very low	118 Å²	118	130.6 Å²	130.6	83%	0.825	78%	0.784	S	S	*	*			cis	-171.2	175.3	-24.2	61.4	0	0	0	0	110
353	G	24.7	Very low	31.6	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	79%	0.787	S	S	*	*			trans	121.4	153.7	157	0	0	0	0	0	118.9
354	S	28.1	Very low	31.5	Very low	120 Å²	120	137.4 Å²	137.4	84%	0.839	79%	0.787	S	S	*	*			trans	-148.2	136.1	-170.9	-53.9	0	0	0	0	115.1
355	A	24.8	Very low	31.6	Very low	97 Å²	97	137.8 Å²	137.8	80%	0.802	79%	0.79	S	S	*	*			trans	57.4	-172.4	159.1	0	0	0	0	0	116.6
356	P	48.9	Very low	31.3	Very low	112 Å²	112	135.9 Å²	135.9	73%	0.727	79%	0.787	S	S	*	*			cis	-134.3	-179.3	-12.2	43.3	-26.5	0	0	0	116
357	L	25.2	Very low	30.2	Very low	153 Å²	153	138.4 Å²	138.4	80%	0.801	79%	0.788	S	S	*	*			trans	32.3	133.8	146.2	-66.3	170.1	0	0	0	124.9
358	L	25.5	Very low	31.2	Very low	149 Å²	149	133.1 Å²	133.1	78%	0.78	78%	0.781	S	S	*	*			trans	65.7	111.7	136.8	-71.4	169.4	0	0	0	123.6
359	L	29.9	Very low	31.2	Very low	165 Å²	165	130.8 Å²	130.8	86%	0.864	78%	0.779	S	S	*	*				56.6	104.8	120.9	-157.4	84.1	0	0	0	121
360	A	24.8	Very low	31.3	Very low	98 Å²	98	132 Å²	132	81%	0.81	79%	0.785	S	S	*	*			trans	-153.2	177.2	154.2	0	0	0	0	0	111
361	S	27.4	Very low	32.6	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	79%	0.787	S	S	*	*			trans	-138.1	178.8	-172.4	-59.3	0	0	0	0	112.9
362	Q	32.2	Very low	32.8	Very low	184 Å²	184	130.7 Å²	130.7	86%	0.86	78%	0.784	S	S	*	*			trans	80.4	148.1	174.1	-57.5	170.9	-20	0	0	114.9
363	D	28.3	Very low	33.1	Very low	140 Å²	140	131 Å²	131	75%	0.749	78%	0.777	S	S	*	*			cis	-150.6	-169.7	-0.8	-137.1	-41.4	0	0	0	114.9
364	R	31.4	Very low	33.2	Very low	219 Å²	219	135.2 Å²	135.2	83%	0.826	78%	0.777	S	S	*	*			trans	-75.1	-168.2	-175.1	-113.5	178.6	170.4	-174	-4.2	115.5
365	P	49.4	Very low	33.3	Very low	130 Å²	130	135.7 Å²	135.7	84%	0.844	78%	0.775	S	S	*	*			cis	-142.5	-178.3	24.1	43.2	-21.9	0	0	0	119.6
366	G	24.5	Very low	34.7	Very low	70 Å²	70	137.2 Å²	137.2	72%	0.722	78%	0.776	S	S	*	*			trans	170.5	148.1	169.7	0	0	0	0	0	114.1
367	E	26.9	Very low	33.7	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	78%	0.776	S	S	*	*			trans	-131.3	177.9	-171.1	-111.6	-159.1	114.3	0	0	112.4
368	P	54	Low	35.1	Very low	99 Å²	99	134.5 Å²	134.5	64%	0.643	78%	0.775	S	S	*	*			cis	-118.6	-140.4	-5	21.4	5.7	0	0	0	111
369	T	31.1	Very low	36.7	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	77%	0.772	S	S	*	*			cis	-152.9	-146.4	6.1	-28.2	0	0	0	0	111.9
370	Q	34.2	Very low	36.7	Very low	173 Å²	173	134 Å²	134	81%	0.808	77%	0.774	S	S	*	*			trans	-160.5	-178.7	-163.9	-98.8	-156.3	26.6	0	0	113.6
371	P	56.8	Low	36.8	Very low	103 Å²	103	132.7 Å²	132.7	67%	0.669	77%	0.77	S	S	*	*			cis	-118.6	-162.4	-3.8	42.7	-28.6	0	0	0	111.6
372	T	32	Very low	36.9	Very low	117 Å²	117	136.8 Å²	136.8	72%	0.718	78%	0.777	S	S	*	*			cis	-151.2	-169.5	-5.3	-15.7	0	0	0	0	105.9
373	N	34	Very low	36.7	Very low	126 Å²	126	136.5 Å²	136.5	67%	0.674	78%	0.776	S	S	*	*			cis	-159.4	-177.3	-4.1	-141.1	-4.9	0	0	0	105.9
374	Q	28.8	Very low	37.9	Very low	161 Å²	161	134.7 Å²	134.7	75%	0.752	77%	0.771	S	S	*	*			cis	-159	-177.8	-7.5	-154.8	162.6	-3.4	0	0	107.6
375	T	30.2	Very low	37.6	Very low	130 Å²	130	131.4 Å²	131.4	80%	0.798	77%	0.77	S	S	*	*			trans	-148.1	152.5	-177.1	6.8	0	0	0	0	114.7
376	P	53.6	Low	36.4	Very low	129 Å²	129	131.5 Å²	131.5	84%	0.838	77%	0.767	S	S	*	*				-147.1	-155.2	115	41.7	-25.3	0	0	0	114.8
377	A	26.5	Very low	36.6	Very low	88 Å²	88	135.6 Å²	135.6	73%	0.727	77%	0.772	S	S	*	*			trans	-154.1	-147.7	-177.5	0	0	0	0	0	109
378	P	56	Low	37	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	77%	0.768	S	S	*	*			cis	-125.4	-124.4	-30.6	25.5	0.8	0	0	0	113.9
379	P	58.8	Low	35.6	Very low	112 Å²	112	133.1 Å²	133.1	73%	0.727	78%	0.775	S	S	*	*				-125.1	-160.8	-98.2	41.5	-24.4	0	0	0	118.9
380	E	28.9	Very low	35.3	Very low	193 Å²	193	131.6 Å²	131.6	90%	0.902	77%	0.77	S	S	*	*			trans	90.4	146.4	173	-54	-158	139.2	0	0	118.9
381	G	28.4	Very low	35	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	76%	0.764	S	S	*	*			cis	177.6	171.3	-8.4	0	0	0	0	0	116.6
382	Q	28.7	Very low	33.5	Very low	193 Å²	193	132.8 Å²	132.8	90%	0.902	77%	0.77	S	S	*	*			trans	78.4	152.1	157	-54.5	-171.8	21.5	0	0	124.9
383	Q	28.6	Very low	33.4	Very low	179 Å²	179	134.2 Å²	134.2	84%	0.836	77%	0.773	S	S	*	*			trans	-137.6	-171.5	162.4	-52.9	-177.6	-12.7	0	0	106.9
384	P	53.2	Low	33.4	Very low	101 Å²	101	134.1 Å²	134.1	66%	0.656	78%	0.779	S	S	*	*			cis	-133.5	-158.8	-14.2	27.8	-1.9	0	0	0	113.2
385	L	24.2	Very low	33.4	Very low	151 Å²	151	129 Å²	129	79%	0.791	77%	0.769	S	S	*	*			trans	116.1	126	146.5	-63.3	168.3	0	0	0	121.5
386	V	24.2	Very low	34.1	Very low	131 Å²	131	128 Å²	128	79%	0.794	77%	0.765	S	S	*	*			trans	76.9	139.5	131	172.2	0	0	0	0	122.6
387	L	28.7	Very low	32.7	Very low	157 Å²	157	129.9 Å²	129.9	82%	0.822	76%	0.763	S	S	*	*			trans	-87.1	156.1	170.5	-71.4	161.9	0	0	0	111.8
388	P	36.3	Very low	32.8	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	76%	0.762	S	S	*	*				-149.1	175.5	104.6	38.3	-22	0	0	0	116.6
389	S	23.7	Very low	31.9	Very low	111 Å²	111	129.9 Å²	129.9	78%	0.776	76%	0.762	S	S	*	*			trans	-59.6	176.5	169.3	-43.5	0	0	0	0	113.1
390	S	26.3	Very low	31.6	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	76%	0.762	S	S	*	*			cis	-175.7	-178.6	38.5	-161.3	0	0	0	0	113.2
391	N	26.8	Very low	32.4	Very low	128 Å²	128	126.5 Å²	126.5	68%	0.684	76%	0.757	S	S	*	*			trans	80.4	143.5	159.2	-59.4	-5.6	0	0	0	116.9
392	Q	26.3	Very low	32.3	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.804	76%	0.756	S	S	*	*			cis	-146.8	147.6	1.9	-133.8	160.1	50.1	0	0	113.2
393	L	29.1	Very low	32	Very low	147 Å²	147	126.6 Å²	126.6	77%	0.77	75%	0.753	S	S	*	*			trans	-80.9	156.1	164.6	-107.4	159.5	0	0	0	109.3
394	P	34.5	Very low	31.8	Very low	125 Å²	125	122.9 Å²	122.9	81%	0.812	75%	0.747	S	S	*	*				-144.2	142.4	89.9	29.3	-9.3	0	0	0	116.7
395	G	29.2	Very low	30.4	Very low	53 Å²	53	122.3 Å²	122.3	55%	0.546	75%	0.746	S	S	.	*			trans	-93.8	-168.2	136.1	0	0	0	0	0	109.2
396	P	44.6	Very low	30.5	Very low	108 Å²	108	122.4 Å²	122.4	70%	0.701	74%	0.741	S	S	*	*			cis	-128.7	-142.5	24.3	30.4	-4.3	0	0	0	110.5
397	E	23.5	Very low	30.4	Very low	170 Å²	170	123.9 Å²	123.9	79%	0.794	74%	0.74	S	S	*	*			cis	-159.1	135.8	5.2	-159.4	110.6	77.7	0	0	114
398	A	27.9	Very low	30.1	Very low	85 Å²	85	123.3 Å²	123.3	70%	0.702	73%	0.732	S	S	*	*			trans	59.4	-171	145.3	0	0	0	0	0	119.3
399	P	38.1	Very low	29.5	Very low	122 Å²	122	123.8 Å²	123.8	79%	0.792	73%	0.728	S	S	*	*				-133.5	-131.1	-102	46.1	-23.9	0	0	0	115.1
400	P	52.2	Low	29.5	Very low	110 Å²	110	124 Å²	124	71%	0.714	72%	0.717	S	S	*	*			trans	-105.8	-160.2	-151.8	41.4	-19.8	0	0	0	111.8
401	P	46.6	Very low	29.4	Very low	123 Å²	123	127.1 Å²	127.1	80%	0.799	73%	0.725	S	S	*	*			cis	-143	-139.5	9.2	45.1	-22.1	0	0	0	115
402	A	25.5	Very low	29.3	Very low	85 Å²	85	126.8 Å²	126.8	70%	0.702	72%	0.722	S	S	*	*			trans	98.5	87.6	161	0	0	0	0	0	120
403	E	23.2	Very low	29.2	Very low	181 Å²	181	123.6 Å²	123.6	85%	0.846	72%	0.719	S	S	*	*				48.7	100.6	116	-63.8	-173.4	161.8	0	0	123.2
404	S	24.3	Very low	29.2	Very low	101 Å²	101	121.5 Å²	121.5	71%	0.706	72%	0.717	S	S	*	*				91.1	143.8	107.7	93.8	0	0	0	0	123
405	S	23.9	Very low	28.9	Very low	89 Å²	89	120.3 Å²	120.3	62%	0.622	71%	0.711	S	S	*	*			trans	82.4	155.9	138.8	-51.5	0	0	0	0	121.4
406	H	25.6	Very low	28.9	Very low	152 Å²	152	122.4 Å²	122.4	70%	0.704	72%	0.724	S	S	*	*			trans	70.1	124.7	171	-62.8	-70.8	0	0	0	116.5
407	Q	22.8	Very low	28	Very low	163 Å²	163	121.3 Å²	121.3	76%	0.762	72%	0.723	S	S	*	*				72.5	142.8	59.5	-75.1	-178.8	-5.4	0	0	112.3
408	H	22.8	Very low	28.1	Very low	144 Å²	144	119.9 Å²	119.9	67%	0.667	73%	0.726	S	S	*	*			cis	-167.5	-163.8	-8.7	-179.7	-113.6	0	0	0	106.4	E410	H408-E410 IonicContact CE1-OE1 3.34Å
409	L	23.8	Very low	28	Very low	133 Å²	133	119.7 Å²	119.7	70%	0.696	73%	0.725	S	S	*	*			trans	71.1	156.2	161.4	-57.1	172.4	0	0	0	117.6
410	E	23.1	Very low	27.4	Very low	117 Å²	117	123 Å²	123	55%	0.547	73%	0.732	S	S	.	*			cis	-164.9	161.8	-45.7	-135.7	173.7	-130.6	0	0	109.4	H408 L412	H408-E410 IonicContact CE1-OE1 3.34Å; E410-L412 HydrophobicContact CG-CG 4.41Å
411	L	23	Very low	26.2	Very low	162 Å²	162	126 Å²	126	85%	0.848	74%	0.736	S	S	*	*			trans	163.1	77.3	147.6	-91.1	155.3	0	0	0	106.6
412	L	24.5	Very low	25.1	Very low	120 Å²	120	127.2 Å²	127.2	63%	0.628	74%	0.742	S	S	*	*				92.9	129.5	74.4	-90.9	167.7	0	0	0	113.1	E410	E410-L412 HydrophobicContact CG-CG 4.41Å
413	S	24.9	Very low	25.1	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	75%	0.746	S	S	*	*			trans	67.4	153.8	159.4	-80.7	0	0	0	0	118.8
414	S	30.2	Very low	25.1	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	75%	0.746	S	S	*	*			cis	178.4	164.8	-23.8	-106.2	0	0	0	0	108.1
415	S	27.9	Very low	25.1	Very low	99 Å²	99	127 Å²	127	69%	0.692	75%	0.749	S	S	*	*			cis	-165.3	153.5	-12.7	-111	0	0	0	0	109.9
416	A	28.8	Very low	25.1	Very low	98 Å²	98	128 Å²	128	81%	0.81	76%	0.762	S	S	*	*			trans	60.9	167.5	144.8	0	0	0	0	0	119
417	A	25.6	Very low	25.1	Very low	84 Å²	84	126.1 Å²	126.1	69%	0.694	76%	0.761	S	S	*	*			cis	-139.7	142.8	3.2	0	0	0	0	0	110.2
418	V	25.4	Very low	25.1	Very low	140 Å²	140	125.7 Å²	125.7	85%	0.848	77%	0.769	S	S	*	*				63.9	134.1	91.1	178.1	0	0	0	0	113.9
419	A	26.5	Very low	25.1	Very low	82 Å²	82	126.8 Å²	126.8	68%	0.678	78%	0.775	S	S	*	*			cis	-173.4	-170.2	-20.4	0	0	0	0	0	108.9
420	M	24.2	Very low	25.2	Very low	191 Å²	191	126 Å²	126	94%	0.941	78%	0.775	S	S	*	*			trans	107.9	151.3	156.9	-69.8	-98.8	165.6	0	0	119
421	E	26.8	Very low	25.1	Very low	173 Å²	173	130.6 Å²	130.6	81%	0.808	79%	0.793	S	S	*	*			trans	-142.8	141.8	-163.8	165.6	-177.4	-138.8	0	0	107.3
422	T	23.7	Very low	25.2	Very low	149 Å²	149	129.9 Å²	129.9	91%	0.914	79%	0.786	S	S	*	*			trans	-171.4	164.2	157.7	7	0	0	0	0	110.8
423	A	25.8	Very low	25.1	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	79%	0.789	S	S	*	*			trans	-118.7	167.5	-165.3	0	0	0	0	0	114.1
424	S	24	Very low	25.1	Very low	122 Å²	122	134 Å²	134	85%	0.853	78%	0.783	S	S	*	*			trans	-158.7	160.7	134.8	-160.8	0	0	0	0	112
425	L	24.5	Very low	24.8	Very low	146 Å²	146	138.5 Å²	138.5	76%	0.764	78%	0.784	S	S	*	*			trans	-99.3	154.2	-179.5	-77.5	76.7	0	0	0	112.1
426	A	24.1	Very low	24.7	Very low	108 Å²	108	145.1 Å²	145.1	89%	0.893	79%	0.794	S	S	*	*			trans	-148.7	107.7	147.1	0	0	0	0	0	110.1
427	T	25.2	Very low	24.4	Very low	113 Å²	113	149.7 Å²	149.7	69%	0.693	79%	0.791	S	S	*	*			trans	-109.7	134.6	178.4	49.7	0	0	0	0	111.6
428	V	22.7	Very low	24.5	Very low	154 Å²	154	154.3 Å²	154.3	93%	0.933	79%	0.791	S	S	*	*			trans	-132	143.6	157.1	-179	0	0	0	0	108.3
429	Q	22.5	Very low	24.5	Very low	167 Å²	167	153.6 Å²	153.6	78%	0.78	78%	0.783	S	S	*	*			trans	-103.2	147.8	-158.4	-68.3	176.9	-41.2	0	0	114.8
430	V	25.9	Very low	24.4	Very low	117 Å²	117	153.9 Å²	153.9	71%	0.709	78%	0.779	S	S	*	*			trans	32.8	128.9	130.1	-173.5	0	0	0	0	118.8	E432	V430-E432 HydrophobicContact CG1-CB 3.96Å
431	K	21.7	Very low	24.5	Very low	213 Å²	213	153.8 Å²	153.8	93%	0.926	78%	0.777	S	S	*	*				-118.4	133.4	128.8	-173	161.7	-176.1	170.4	0	110
432	E	23.9	Very low	24.3	Very low	147 Å²	147	153.4 Å²	153.4	69%	0.687	78%	0.78	S	S	*	*			trans	-97.5	176.6	-173.5	-156.7	-177.4	144.4	0	0	111.9	V430	V430-E432 HydrophobicContact CG1-CB 3.96Å
433	E	22.9	Very low	24.4	Very low	149 Å²	149	151.4 Å²	151.4	70%	0.696	78%	0.779	S	S	*	*			trans	100.7	130.1	142.5	-151.8	161	-149.5	0	0	118.1
434	R	25	Very low	24.5	Very low	163 Å²	163	152.3 Å²	152.3	62%	0.615	78%	0.778	S	S	*	*			cis	178.7	137.7	-25.2	165.5	-175.1	-165	-175.2	9.6	111.1
435	R	24.1	Very low	24.5	Very low	198 Å²	198	155 Å²	155	75%	0.747	78%	0.779	S	S	*	*			trans	49.3	142.2	155.9	-59.2	170.8	-178.2	-178.5	-2.7	118.2
436	R	25	Very low	24.4	Very low	238 Å²	238	154.5 Å²	154.5	90%	0.898	78%	0.778	S	S	*	*				-179.1	161.2	73.6	-83.3	-176.1	-169.5	-165.5	3.9	107.3
437	R	23.7	Very low	24.6	Very low	195 Å²	195	155.3 Å²	155.3	74%	0.736	78%	0.777	S	S	*	*			cis	-177.9	159.3	-25.5	-140.7	-169.2	-177.6	-169.5	3.5	105.5
438	Y	28	Very low	24.6	Very low	180 Å²	180	158 Å²	158	71%	0.706	78%	0.781	S	S	*	*			trans	68.5	147.5	166.2	-81.4	-118.4	0	0	0	117
439	D	24.5	Very low	24.7	Very low	126 Å²	126	159.9 Å²	159.9	67%	0.674	78%	0.78	S	S	*	*			cis	-155.2	179.9	-26.6	-140.1	-14	0	0	0	114
440	S	23.9	Very low	24.9	Very low	87 Å²	87	160.1 Å²	160.1	61%	0.608	78%	0.781	S	S	*	*			trans	-22.8	145.2	165.5	-159.5	0	0	0	0	119.8
441	E	26	Very low	24.8	Very low	190 Å²	190	159.4 Å²	159.4	89%	0.888	79%	0.787	S	S	*	*				-177.5	157.7	99	-93.7	-175.5	169.1	0	0	114
442	D	23.9	Very low	24.9	Very low	165 Å²	165	158.2 Å²	158.2	88%	0.882	79%	0.785	S	S	*	*			trans	-102.1	154.8	-179.7	-85.5	-59.8	0	0	0	112
443	A	26.1	Very low	25.6	Very low	107 Å²	107	156.1 Å²	156.1	88%	0.884	78%	0.784	S	S	*	*			trans	-160.6	148	150.4	0	0	0	0	0	112.3
444	C	26.5	Very low	25.7	Very low	113 Å²	113	158.5 Å²	158.5	76%	0.764	80%	0.795	S	S	*	*			trans	-130.9	149.4	171.6	-179	0	0	0	0	108.8
445	M	23.9	Very low	25.9	Very low	179 Å²	179	159.6 Å²	159.6	88%	0.882	81%	0.807	S	S	*	*			trans	-151	126.1	151.8	-95.8	-52.8	175.1	0	0	110.8
446	D	23.3	Very low	25.9	Very low	136 Å²	136	158.4 Å²	158.4	73%	0.727	82%	0.815	S	S	*	*			trans	-72.3	156	146	-78.7	-59.3	0	0	0	107.5
447	S	28.8	Very low	26.1	Very low	125 Å²	125	154 Å²	154	87%	0.874	81%	0.809	S	S	*	*				-166.9	167.8	88.7	-68.1	0	0	0	0	112.1
448	Q	24.7	Very low	26.2	Very low	168 Å²	168	152.4 Å²	152.4	79%	0.785	81%	0.814	S	S	*	*			trans	-119.8	135.9	-176.4	171.5	-164.9	-53.9	0	0	109.4
449	E	25.1	Very low	26.1	Very low	195 Å²	195	148.7 Å²	148.7	91%	0.911	81%	0.814	S	S	*	*			trans	-148.9	160.5	155.9	-157.1	156.4	-151.3	0	0	109.9
450	E	25.4	Very low	26.1	Very low	172 Å²	172	151.9 Å²	151.9	80%	0.804	82%	0.822	S	S	*	*			trans	-117.6	150	-169	-62.2	-164	160.6	0	0	113.3
451	A	24.1	Very low	26	Very low	101 Å²	101	153.5 Å²	153.5	84%	0.835	82%	0.824	S	S	*	*			trans	-151.9	133.9	156.4	0	0	0	0	0	109.5
452	E	24.3	Very low	26.3	Very low	189 Å²	189	148.6 Å²	148.6	88%	0.883	81%	0.811	S	S	*	*			trans	-83.3	165.5	170.7	-89.8	-81.2	112.9	0	0	110.8
453	P	39.3	Very low	26.3	Very low	102 Å²	102	149.8 Å²	149.8	66%	0.662	81%	0.811	S	S	*	*			trans	-98.5	156.2	-156.1	37.2	-36.4	0	0	0	115.6
454	E	23.4	Very low	26.3	Very low	199 Å²	199	154 Å²	154	93%	0.93	81%	0.809	S	S	*	*			trans	-125.7	165.1	150.5	-75.3	-155.6	138.7	0	0	111.1
455	E	29.3	Very low	26.8	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	81%	0.809	S	S	*	*			trans	-84.3	154.6	-171	-54.4	-178.8	132.1	0	0	112.6
456	L	25.3	Very low	27.1	Very low	173 Å²	173	153.5 Å²	153.5	91%	0.906	81%	0.809	S	S	*	*				-164.6	151.4	129.3	-107.7	167.9	0	0	0	111.7
457	D	29.1	Very low	27.4	Very low	145 Å²	145	154.7 Å²	154.7	78%	0.775	82%	0.815	S	S	*	*			trans	-98.2	130.2	-175.2	-178.4	24.5	0	0	0	111.1
458	I	25.1	Very low	27.4	Very low	162 Å²	162	157 Å²	157	83%	0.831	82%	0.815	S	S	*	*			trans	-149.1	124.4	165.3	10.7	174.2	0	0	0	113.1
459	S	26.7	Very low	27.4	Very low	101 Å²	101	153.8 Å²	153.8	71%	0.706	81%	0.811	S	S	*	*			trans	-51.1	149.5	167.9	179.8	0	0	0	0	114.1
460	F	23.1	Very low	27.6	Very low	193 Å²	193	151.3 Å²	151.3	85%	0.846	80%	0.804	S	S	*	*			trans	-140.2	120.5	151.1	-156	-92.9	0	0	0	111.7
461	D	23.6	Very low	27.6	Very low	122 Å²	122	151.3 Å²	151.3	65%	0.652	81%	0.809	S	S	*	*			trans	-104.8	151.8	177.1	-170.5	14	0	0	0	111.1
462	S	30.5	Very low	27.7	Very low	87 Å²	87	154.1 Å²	154.1	61%	0.608	81%	0.809	S	S	*	*			trans	27.4	95.5	155.6	-64.3	0	0	0	0	119.6
463	Q	25.7	Very low	27.8	Very low	190 Å²	190	151.2 Å²	151.2	89%	0.888	80%	0.804	S	S	*	*				-161.5	150.4	129.1	-111.8	153.4	78.3	0	0	114.9
464	F	26	Very low	27.2	Very low	195 Å²	195	154 Å²	154	86%	0.855	81%	0.813	S	S	*	*			trans	-136.2	129.3	176	-119	-84	0	0	0	107.5
465	P	35.3	Very low	27.6	Very low	116 Å²	116	152.5 Å²	152.5	75%	0.753	81%	0.806	S	S	*	*			trans	-94.7	125.8	162.6	-6.1	25.6	0	0	0	110.8
466	D	30.4	Very low	28.1	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	80%	0.798	S	S	*	*			trans	-82.3	127.9	162.1	-87.6	-46.6	0	0	0	108.9
467	L	30.5	Very low	28.1	Very low	160 Å²	160	144 Å²	144	84%	0.838	79%	0.791	S	S	*	*			trans	-149.8	121	169.1	-106.5	170.3	0	0	0	111.3
468	I	28.3	Very low	28.8	Very low	173 Å²	173	142.8 Å²	142.8	89%	0.887	79%	0.79	S	S	*	*			trans	153.2	95.5	149.5	-79.4	158.8	0	0	0	108.2
469	S	25.8	Very low	29	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	79%	0.789	S	S	*	*			trans	-155.9	145.6	147.5	-168.3	0	0	0	0	107.3
470	D	27.8	Very low	29.1	Very low	143 Å²	143	143.9 Å²	143.9	77%	0.765	80%	0.795	S	S	*	*			trans	106.4	157.5	162.2	-54.9	1.7	0	0	0	116.7
471	L	26.8	Very low	29.4	Very low	172 Å²	172	138.7 Å²	138.7	90%	0.901	79%	0.788	S	S	*	*			trans	64.6	129.6	-148.6	-50.3	177.6	0	0	0	112.1
472	I	26.3	Very low	30.7	Very low	161 Å²	161	138.5 Å²	138.5	83%	0.826	79%	0.793	S	S	*	*			cis	-121.2	151.6	17.1	-63.4	162.9	0	0	0	111
473	T	25.7	Very low	31	Very low	127 Å²	127	140.7 Å²	140.7	78%	0.779	81%	0.806	S	S	*	*			trans	-151.7	133.2	163.4	-62.1	0	0	0	0	108.5
474	D	27.5	Very low	31	Very low	161 Å²	161	136.3 Å²	136.3	86%	0.861	80%	0.801	S	S	*	*			trans	-165.3	164.2	156.9	-103.3	-34.4	0	0	0	111.4
475	E	29.9	Very low	32.7	Very low	167 Å²	167	132.5 Å²	132.5	78%	0.78	80%	0.796	S	S	*	*			trans	-147.3	-169.2	-168.8	-91.3	-84.7	155.4	0	0	107.9
476	P	40.8	Very low	33.1	Very low	110 Å²	110	133 Å²	133	71%	0.714	80%	0.8	S	S	*	*			cis	-135.7	154.7	-14.6	29.2	-7.7	0	0	0	117.6
477	G	24.3	Very low	32.9	Very low	72 Å²	72	130.7 Å²	130.7	74%	0.742	80%	0.796	S	S	*	*			trans	52.9	-171.8	147.5	0	0	0	0	0	122.3
478	P	45.1	Very low	32.7	Very low	119 Å²	119	127.3 Å²	127.3	77%	0.773	79%	0.792	S	S	*	*			cis	-131.9	-160.3	-21.1	41.7	-23.4	0	0	0	114.3
479	T	29	Very low	32.7	Very low	129 Å²	129	124.6 Å²	124.6	79%	0.791	79%	0.788	S	S	*	*			trans	72.5	150.6	-178.4	81.9	0	0	0	0	116.9
480	D	28	Very low	32.7	Very low	157 Å²	157	123 Å²	123	84%	0.84	79%	0.787	S	S	*	*			cis	-142	-175.8	11.7	-139.1	-39	0	0	0	114.4
481	A	29.2	Very low	33.4	Very low	84 Å²	84	122.1 Å²	122.1	69%	0.694	79%	0.79	S	S	*	*			trans	-105.6	172	-163	0	0	0	0	0	117.1
482	P	50.8	Low	33.4	Very low	119 Å²	119	118.3 Å²	118.3	77%	0.773	78%	0.783	S	S	*	*			trans	-110.7	169.8	-169.1	41.5	-34.8	0	0	0	116.3
483	P	37.7	Very low	33.5	Very low	133 Å²	133	117 Å²	117	86%	0.864	78%	0.782	S	S	*	*			trans	-133.2	-177.9	147.5	38.5	-25.1	0	0	0	114.2
484	A	26.7	Very low	33.7	Very low	97 Å²	97	120.2 Å²	120.2	80%	0.802	79%	0.786	S	S	*	*			trans	-136.5	-137	-171	0	0	0	0	0	115.5
485	P	60.3	Low	34.4	Very low	115 Å²	115	118 Å²	118	75%	0.747	78%	0.78	S	S	*	*			trans	-98.8	178.1	-138.5	45.5	-37.8	0	0	0	115.1
486	P	44	Very low	34.4	Very low	127 Å²	127	116.9 Å²	116.9	83%	0.825	78%	0.784	S	S	*	*				-135	-161	91.9	37.9	-21.9	0	0	0	111.4
487	S	26.6	Very low	33.9	Very low	117 Å²	117	114.7 Å²	114.7	82%	0.818	78%	0.782	S	S	*	*			cis	-152.1	-138.3	11.5	68.4	0	0	0	0	113.7
488	A	26.9	Very low	34.1	Very low	89 Å²	89	118.4 Å²	118.4	74%	0.736	79%	0.79	S	S	*	*			trans	-129.3	-177.7	-176.4	0	0	0	0	0	110.1
489	S	27.2	Very low	33.3	Very low	117 Å²	117	121.9 Å²	121.9	82%	0.818	79%	0.788	S	S	*	*			cis	-165.4	-179.5	28.6	54.5	0	0	0	0	112.8
490	G	26	Very low	33.2	Very low	66 Å²	66	124 Å²	124	68%	0.68	78%	0.782	S	S	*	*			trans	-85	-152.9	175	0	0	0	0	0	114.2
491	P	41.8	Very low	33.2	Very low	126 Å²	126	122.4 Å²	122.4	82%	0.818	78%	0.778	S	S	*	*			cis	-148.1	175.8	26.6	44.7	-25.5	0	0	0	119.5
492	A	27.8	Very low	33.5	Very low	91 Å²	91	124.3 Å²	124.3	75%	0.752	78%	0.781	S	S	*	*			trans	59.9	165.9	149	0	0	0	0	0	120.4
493	V	27.8	Very low	32.4	Very low	135 Å²	135	124.4 Å²	124.4	82%	0.818	78%	0.781	S	S	*	*			cis	-141.2	161.2	18.1	179.4	0	0	0	0	111.7
494	F	29.3	Very low	32.6	Very low	194 Å²	194	123.4 Å²	123.4	85%	0.851	78%	0.775	S	S	*	*			trans	-106.7	175.4	178.8	-76.4	-90.6	0	0	0	113.9
495	P	42.7	Very low	32.8	Very low	114 Å²	114	126.8 Å²	126.8	74%	0.74	77%	0.774	S	S	*	*				-145.3	150.8	97.2	30.8	-11.3	0	0	0	118.2
496	T	29.9	Very low	31.4	Very low	143 Å²	143	127 Å²	127	88%	0.877	78%	0.776	S	S	*	*			trans	31.6	143.4	135.2	-38.8	0	0	0	0	121.6
497	G	30.4	Very low	30.7	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	77%	0.77	S	S	*	*			cis	-170.8	177	3.6	0	0	0	0	0	109
498	V	28.8	Very low	32.1	Very low	151 Å²	151	125.5 Å²	125.5	92%	0.915	77%	0.766	S	S	*	*				-155.6	170.2	52.3	168.6	0	0	0	0	111.4
499	R	28.5	Very low	32	Very low	191 Å²	191	126.3 Å²	126.3	72%	0.721	77%	0.766	S	S	*	*			trans	-87.2	177	-170.4	-80.8	161	165.2	-170.7	-3.4	114.8
500	Y	26.3	Very low	32	Very low	174 Å²	174	126.2 Å²	126.2	68%	0.682	77%	0.765	S	S	*	*			cis	-163.6	163.4	8.4	-121.3	-29.8	0	0	0	114.7
501	V	28	Very low	32.2	Very low	124 Å²	124	127.6 Å²	127.6	75%	0.752	76%	0.764	S	S	*	*			trans	72.8	150.4	147	173.1	0	0	0	0	121.4
502	V	35.7	Very low	31.5	Very low	124 Å²	124	131.9 Å²	131.9	75%	0.752	77%	0.77	S	S	*	*			trans	-141.3	144.5	-175.2	170.4	0	0	0	0	110.5
503	P	28.8	Very low	31.9	Very low	120 Å²	120	135.1 Å²	135.1	78%	0.779	77%	0.774	S	S	*	*			trans	-131.6	166.2	140.1	11.4	11.3	0	0	0	114.3
504	P	41.5	Very low	32.4	Very low	112 Å²	112	134.6 Å²	134.6	73%	0.727	77%	0.773	S	S	*	*			trans	-121.3	162.7	-171.9	41.4	-30.1	0	0	0	116.9
505	Q	30.3	Very low	32.6	Very low	168 Å²	168	134.1 Å²	134.1	79%	0.785	77%	0.771	S	S	*	*			trans	68.4	160.6	163.6	-72.7	-65.4	-15	0	0	115.4
506	P	30.9	Very low	32.1	Very low	120 Å²	120	134.6 Å²	134.6	78%	0.779	77%	0.774	S	S	*	*			cis	-143.2	-161.3	37.7	45.4	-24.6	0	0	0	117.6
507	S	29.8	Very low	32.3	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	77%	0.77	S	S	*	*			trans	-146.8	173	168.9	61.4	0	0	0	0	108
508	P	55.1	Low	32.5	Very low	113 Å²	113	138.5 Å²	138.5	73%	0.734	78%	0.776	S	S	*	*			cis	-131.6	-163.1	-10.7	37.8	-18.1	0	0	0	113
509	S	26.3	Very low	32.6	Very low	106 Å²	106	139 Å²	139	74%	0.741	77%	0.773	S	S	*	*			trans	118.9	149.3	144.7	-49.4	0	0	0	0	119.4
510	S	27.2	Very low	33.2	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	78%	0.775	S	S	*	*			trans	59.6	153	165.4	-86.6	0	0	0	0	119.6
511	S	29.7	Very low	33.5	Very low	95 Å²	95	132 Å²	132	66%	0.664	78%	0.782	S	S	*	*			cis	155.3	119.3	-17.4	-88.9	0	0	0	0	105.3
512	F	27.7	Very low	34.2	Very low	217 Å²	217	130.4 Å²	130.4	95%	0.952	78%	0.782	S	S	*	*			trans	-174.5	152.3	150.7	-106.8	-69.8	0	0	0	111.4
513	L	34.4	Very low	34.8	Very low	158 Å²	158	129.1 Å²	129.1	83%	0.827	78%	0.784	S	S	*	*			trans	-130.4	156.5	174.4	-75.5	-179.9	0	0	0	106.7
514	P	39.6	Very low	36.2	Very low	124 Å²	124	135 Å²	135	81%	0.805	79%	0.79	S	S	*	*				-148.5	-167.3	55.8	40.7	-18	0	0	0	117.7
515	F	32.6	Very low	37.8	Very low	184 Å²	184	134.2 Å²	134.2	81%	0.807	78%	0.78	S	S	*	*			trans	-56.2	156.3	-178.2	-96.3	-101	0	0	0	116.1
516	P	33.5	Very low	40.2	Very low	124 Å²	124	127.1 Å²	127.1	81%	0.805	75%	0.75	S	S	*	*				-129.3	-178.1	87.6	36.7	-26	0	0	0	115.7
517	Q	33.2	Very low	42.5	Very low	170 Å²	170	124.1 Å²	124.1	79%	0.794	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-76.9	154.7	-163.4	-59.8	161.6	-59	0	0	115.4
518	P	34.8	Very low	45.3	Very low	120 Å²	120	120.1 Å²	120.1	78%	0.779	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-80.6	128.8	156.2	2	16.5	0	0	0	111.3
519	L	29.8	Very low	46.7	Very low	162 Å²	162	119.6 Å²	119.6	85%	0.848	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-74.6	166.2	164.7	-87.4	167	0	0	0	110.9
520	P	41.2	Very low	49.5	Very low	117 Å²	117	119.8 Å²	119.8	76%	0.76	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-70.8	147.3	-146.8	25.8	-35.4	0	0	0	115.1	A522	P520-A522 PolarHBondContact O-N 3.22Å
521	A	34.4	Very low	52.6	Low	100 Å²	100	116 Å²	116	83%	0.826	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-67.7	129.9	176.2	0	0	0	0	0	111.4	A523	A521-A523 PolarHBondContact O-N 3.02Å
522	A	41	Very low	55.3	Low	91 Å²	91	115.2 Å²	115.2	75%	0.752	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-57.1	130	165	0	0	0	0	0	109.7	P520 R524	P520-A522 PolarHBondContact O-N 3.22Å; A522-R524 PolarHBondContact O-N 2.69Å; A522-R524 VanDerWaalsContact O-N 3.11Å
523	A	48.7	Very low	58.2	Low	96 Å²	96	106.7 Å²	106.7	79%	0.793	62%	0.623	S	S	*	*			trans	-59.6	116	-173	0	0	0	0	0	111.1	A521 L525	A521-A523 PolarHBondContact O-N 3.02Å; A523-L525 PolarHBondContact O-N 3.01Å
524	R	59.3	Low	60.6	Low	243 Å²	243	104.8 Å²	104.8	92%	0.917	61%	0.61	S	S	*	*			trans	-78.1	107.6	177.2	-71.3	-175.5	63.6	177.7	-0.8	109.4	A522 A526	A522-R524 PolarHBondContact O-N 2.69Å; A522-R524 VanDerWaalsContact O-N 3.11Å; R524-A526 PolarHBondContact O-N 2.99Å
525	L	75.1	Confident	62.9	Low	97 Å²	97	102.8 Å²	102.8	51%	0.508	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-50.7	136.8	173.4	-60.6	177.2	0	0	0	111.5	A523 S598 V599	A523-L525 PolarHBondContact O-N 3.01Å; L525-S598 WeakPolarHBondContact CD2-O 3.09Å; L525-V599 CarbonylContact C-O 3.5Å; L525-V599 WeakPolarHBondContact CA-O 3.44Å
526	A	78.9	Confident	65.5	Low	19 Å²	19	94 Å²	94	16%	0.157	55%	0.548	C	S	.	.	B	Isolated β-bridge	trans	-64.3	140.9	173.4	0	0	0	0	0	111.3	R524 P549 W550 V599 S600 S601	R524-A526 PolarHBondContact O-N 2.99Å; A526-P549 HydrophobicContact CB-CG 3.59Å; A526-W550 HydrophobicContact CB-CH2 4.27Å; A526-W550 HydrophobicContact CB-CZ3 3.68Å; A526-V599 HydrophobicContact CB-CG1 4.26Å; A526-V599 WeakPolarHBondContact CB-O 3.45Å; A526-V599 PolarHBondContact N-O 3.14Å; A526-S600 CarbonylContact O-C 3.59Å; A526-S600 WeakPolarHBondContact O-CA 3.3Å; A526-S600 WeakPolarHBondContact O-CB 3.47Å; A526-S601 PolarHBondContact O-N 3.31Å; A526-S601 PolarHBondContact O-OG 2.97Å
527	A	80.3	Confident	67.9	Low	56 Å²	56	92.7 Å²	92.7	46%	0.463	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-84.3	128.3	171.2	0	0	0	0	0	110.2	T529 P549	A527-T529 PolarHBondContact O-N 2.66Å; A527-P549 VanDerWaalsContact O-CD 3.23Å; A527-P549 WeakPolarHBondContact O-CD 3.43Å
528	I	88.5	Confident	70.4	Confident	16 Å²	16	86.4 Å²	86.4	8%	0.082	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-64.4	121.4	158.5	-64.8	165.9	0	0	0	106.4	F531 I546 T547 W550 V592 V603	I528-F531 HydrophobicContact CG2-CB 4.46Å; I528-F531 HydrophobicContact CG2-CD1 3.87Å; I528-I546 HydrophobicContact CD1-CG2 4.38Å; I528-I546 HydrophobicContact CG1-CG2 4.12Å; I528-I546 HydrophobicContact CG2-CG2 3.9Å; I528-T547 CarbonylContact C-O 3.5Å; I528-T547 WeakPolarHBondContact CA-O 3.44Å; I528-W550 HydrophobicContact CB-CZ2 4.49Å; I528-W550 HydrophobicContact CG1-CH2 3.85Å; I528-W550 HydrophobicContact CG1-CZ2 3.82Å; I528-V592 HydrophobicContact CD1-CG2 4.35Å; I528-V592 HydrophobicContact CG1-CG2 4.4Å; I528-V603 HydrophobicContact CB-CG1 3.94Å; I528-V603 HydrophobicContact CD1-CB 4.47Å; I528-V603 HydrophobicContact CD1-CG1 4.1Å; I528-V603 HydrophobicContact CD1-CG2 3.64Å; I528-V603 HydrophobicContact CG2-CG1 4.34Å; I528-V603 HydrophobicContact CG2-CG2 4.37Å
529	T	85.2	Confident	72.6	Confident	102 Å²	102	85.3 Å²	85.3	63%	0.626	49%	0.486	S	S	*	.			trans	-87.7	-32.3	-174	45.7	0	0	0	0	113.6	A527 T547 G548	A527-T529 PolarHBondContact O-N 2.66Å; T529-T547 PolarHBondContact N-O 2.93Å; T529-T547 PolarHBondContact OG1-O 3.23Å; T529-T547 PolarHBondContact OG1-OG1 3.48Å; T529-G548 WeakPolarHBondContact OG1-CA 3.31Å; T529-G548 PolarHBondContact OG1-N 2.87Å
530	D	84.6	Confident	75.2	Confident	111 Å²	111	78 Å²	78	59%	0.594	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-170	152.3	178.9	-162.9	0	0	0	0	108.3	T547	D530-T547 WeakPolarHBondContact CA-OG1 3.44Å; D530-T547 WeakPolarHBondContact CB-OG1 3.42Å; D530-T547 PolarHBondContact N-OG1 3.02Å; D530-T547 WeakPolarHBondContact O-CA 3.21Å; D530-T547 WeakPolarHBondContact O-CB 3.48Å; D530-T547 PolarHBondContact O-N 3.29Å; D530-T547 PolarHBondContact O-OG1 3.05Å
531	F	91.3	Very high	77.2	Confident	34 Å²	34	75.1 Å²	75.1	15%	0.149	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	147	175.6	59.9	-79.3	0	0	0	111.5	I528 E534 L545 I546 L590 V603 L604 F605	I528-F531 HydrophobicContact CG2-CB 4.46Å; I528-F531 HydrophobicContact CG2-CD1 3.87Å; F531-E534 HydrophobicContact CE2-CB 4.16Å; F531-L545 CarbonylContact C-O 3.51Å; F531-L545 WeakPolarHBondContact CA-O 3.35Å; F531-L545 WeakPolarHBondContact CB-O 3.38Å; F531-I546 HydrophobicContact CB-CB 4.43Å; F531-I546 HydrophobicContact CB-CG1 3.97Å; F531-L590 HydrophobicContact CD2-CD2 3.95Å; F531-L590 HydrophobicContact CE2-CD2 4.24Å; F531-L590 HydrophobicContact CG-CD2 4.27Å; F531-V603 HydrophobicContact CD1-CG2 3.9Å; F531-V603 HydrophobicContact CE1-CB 3.89Å; F531-V603 HydrophobicContact CE1-CG1 4.49Å; F531-V603 HydrophobicContact CE1-CG2 3.45Å; F531-V603 VanDerWaalsContact CE1-CG2 3.45Å; F531-V603 HydrophobicContact CZ-CB 4.37Å; F531-V603 HydrophobicContact CZ-CG2 3.85Å; F531-L604 WeakPolarHBondContact CZ-O 3.26Å; F531-F605 HydrophobicContact CD2-CD2 4.08Å; F531-F605 HydrophobicContact CE2-CB 4.31Å; F531-F605 AromaticContact CE2-CD2 3.84Å; F531-F605 HydrophobicContact CE2-CD2 3.84Å
532	S	88.3	Confident	79.7	Confident	78 Å²	78	72.7 Å²	72.7	55%	0.545	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	131	-172.2	-154.8	0	0	0	0	112.9	L545	S532-L545 PolarHBondContact N-O 3.39Å; S532-L545 PolarHBondContact O-N 3.29Å
533	P	87.9	Confident	82.2	Confident	38 Å²	38	73.7 Å²	73.7	25%	0.247	40%	0.404	C	S	.	.	S	Bend	cis	-67.1	160.3	-7.2	30.7	-35.5	0	0	0	112.4	W535 V542 F605	P533-W535 WeakPolarHBondContact CG-O 3.47Å; P533-W535 PolarHBondContact O-N 3.28Å; P533-V542 HydrophobicContact CG-CG1 3.71Å; P533-F605 WeakPolarHBondContact O-CE2 3.45Å
534	E	84.4	Confident	84.4	Confident	119 Å²	119	69.1 Å²	69.1	56%	0.556	37%	0.366	S	S	*	.	S	Bend	trans	-78.2	-4.5	175.1	66.9	-171.2	175.4	0	0	113.2	F531 E606	F531-E534 HydrophobicContact CE2-CB 4.16Å; E534-E606 PolarHBondContact O-N 2.86Å
535	W	88.9	Confident	86	Confident	81 Å²	81	60.7 Å²	60.7	31%	0.307	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	159	-172.9	65.9	-89.9	0	0	0	112.6	P533 Y537 E606 R608	P533-W535 WeakPolarHBondContact CG-O 3.47Å; P533-W535 PolarHBondContact O-N 3.28Å; W535-Y537 HydrophobicContact CH2-CE2 4.29Å; W535-Y537 HydrophobicContact CZ3-CD1 4.47Å; W535-Y537 HydrophobicContact CZ3-CD2 4.25Å; W535-Y537 HydrophobicContact CZ3-CE1 4.1Å; W535-Y537 AromaticContact CZ3-CE2 3.87Å; W535-Y537 HydrophobicContact CZ3-CE2 3.87Å; W535-Y537 AromaticContact CZ3-CZ 3.79Å; W535-E606 CarbonylContact C-O 3.56Å; W535-E606 WeakPolarHBondContact CA-O 3.5Å; W535-E606 HydrophobicContact CB-CB 3.93Å; W535-E606 WeakPolarHBondContact CB-O 3.29Å; W535-R608 HydrophobicContact CB-CG 4.46Å; W535-R608 HydrophobicContact CE3-CB 4.44Å; W535-R608 HydrophobicContact CE3-CG 4.41Å; W535-R608 VanDerWaalsContact CG-NH1 3.3Å
536	S	85.9	Confident	86.8	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.007	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	-176.3	166.4	66	0	0	0	0	111.9	C580 F605 E606 Y607 R608	S536-C580 PolarHBondContact OG-SG 3.13Å; S536-F605 WeakPolarHBondContact OG-CE1 3.47Å; S536-E606 PolarHBondContact N-O 3.31Å; S536-Y607 CarbonylContact O-C 3.6Å; S536-Y607 WeakPolarHBondContact O-CA 3.46Å; S536-Y607 WeakPolarHBondContact OG-CD1 3.34Å; S536-Y607 VanDerWaalsContact OG-CE1 3.26Å; S536-Y607 WeakPolarHBondContact OG-CE1 3.26Å; S536-R608 PolarHBondContact O-N 3.07Å
537	Y	84.6	Confident	87.4	Confident	95 Å²	95	57 Å²	57	37%	0.373	32%	0.319	S	S	.	.			trans	-96.8	164.8	169.7	-66	-65.5	0	0	0	111.1	W535 E539 G540 Y607 R608 R610	W535-Y537 HydrophobicContact CH2-CE2 4.29Å; W535-Y537 HydrophobicContact CZ3-CD1 4.47Å; W535-Y537 HydrophobicContact CZ3-CD2 4.25Å; W535-Y537 HydrophobicContact CZ3-CE1 4.1Å; W535-Y537 AromaticContact CZ3-CE2 3.87Å; W535-Y537 HydrophobicContact CZ3-CE2 3.87Å; W535-Y537 AromaticContact CZ3-CZ 3.79Å; Y537-E539 VanDerWaalsContact C-N 3.25Å; Y537-E539 WeakPolarHBondContact CB-OE1 3.36Å; Y537-E539 VanDerWaalsContact CB-OE2 3.24Å; Y537-E539 WeakPolarHBondContact CB-OE2 3.41Å; Y537-E539 PolarHBondContact O-N 2.98Å; Y537-G540 PolarHBondContact O-N 3.29Å; Y537-G540 VanDerWaalsContact O-N 3.08Å; Y537-Y607 WeakPolarHBondContact O-CD1 3.43Å; Y537-R608 WeakPolarHBondContact CD1-O 3.42Å; Y537-R610 HydrophobicContact CD1-CG 3.85Å; Y537-R610 HydrophobicContact CE1-CG 3.99Å
538	P	85.6	Confident	87.7	Confident	39 Å²	39	55 Å²	55	25%	0.253	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.9	-174.2	-28	39.7	0	0	0	115	G540 A582 H583 A585 R608	P538-G540 PolarHBondContact O-N 3.23Å; P538-G540 VanDerWaalsContact O-N 3.16Å; P538-A582 CarbonylContact O-C 3.6Å; P538-A582 VanDerWaalsContact O-CA 3.23Å; P538-A582 WeakPolarHBondContact O-CA 3.34Å; P538-A582 WeakPolarHBondContact O-CB 3.41Å; P538-H583 WeakPolarHBondContact CA-O 3.29Å; P538-H583 VanDerWaalsContact CB-O 3.25Å; P538-H583 WeakPolarHBondContact CB-O 3.28Å; P538-H583 PolarHBondContact O-N 3.42Å; P538-A585 HydrophobicContact CG-CB 4.25Å; P538-R608 WeakPolarHBondContact CD-O 3.43Å
539	E	81.6	Confident	87.6	Confident	96 Å²	96	58.2 Å²	58.2	45%	0.449	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.3	174.7	55.5	-96.3	-141.9	0	0	114.7	Y537 R610	Y537-E539 VanDerWaalsContact C-N 3.25Å; Y537-E539 WeakPolarHBondContact CB-OE1 3.36Å; Y537-E539 VanDerWaalsContact CB-OE2 3.24Å; Y537-E539 WeakPolarHBondContact CB-OE2 3.41Å; Y537-E539 PolarHBondContact O-N 2.98Å; E539-R610 IonicContact OE1-CZ 3Å; E539-R610 IonicContact OE1-NE 3.28Å; E539-R610 PolarHBondContact OE1-NE 2.92Å; E539-R610 IonicContact OE1-NH2 4Å; E539-R610 PolarHBondContact OE1-NH2 3.41Å
540	G	83.4	Confident	87.7	Confident	8 Å²	8	53.7 Å²	53.7	8%	0.082	30%	0.296	C	S	.	.			trans	68.6	-147.6	179	0	0	0	0	0	113.4	Y537 P538 V542 P581	Y537-G540 PolarHBondContact O-N 3.29Å; Y537-G540 VanDerWaalsContact O-N 3.08Å; P538-G540 PolarHBondContact O-N 3.23Å; P538-G540 VanDerWaalsContact O-N 3.16Å; G540-V542 PolarHBondContact O-N 3.48Å; G540-V542 VanDerWaalsContact O-N 3.07Å; G540-P581 WeakPolarHBondContact CA-O 3.5Å
541	G	83.1	Confident	87.3	Confident	57 Å²	57	51.4 Å²	51.4	59%	0.588	29%	0.289	S	S	*	.			trans	71.5	-0	173.7	0	0	0	0	0	115.5	Y579 C580	G541-Y579 WeakPolarHBondContact O-CD1 3.36Å; G541-C580 PolarHBondContact N-O 2.78Å
542	V	87.9	Confident	86.2	Confident	50 Å²	50	57.1 Å²	57.1	30%	0.303	32%	0.316	S	S	.	.			trans	-79	128.2	178.5	-176.7	0	0	0	0	109.8	P533 G540 V544 Y579 C580	P533-V542 HydrophobicContact CG-CG1 3.71Å; G540-V542 PolarHBondContact O-N 3.48Å; G540-V542 VanDerWaalsContact O-N 3.07Å; V542-V544 PolarHBondContact O-N 2.84Å; V542-Y579 WeakPolarHBondContact O-CA 3.39Å; V542-C580 PolarHBondContact N-SG 3.22Å; V542-C580 VanDerWaalsContact N-SG 3.42Å; V542-C580 PolarHBondContact O-N 3.43Å
543	K	93.5	Very high	84.6	Confident	111 Å²	111	58.3 Å²	58.3	48%	0.483	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	111.7	174	-177.2	-175.4	67.1	-176.1	0	110.2	R577 C578 Y579	K543-R577 HydrophobicContact CD-CG 4.12Å; K543-R577 HydrophobicContact CG-CG 3.83Å; K543-C578 CarbonylContact C-O 3.59Å; K543-C578 WeakPolarHBondContact CA-O 3.25Å; K543-Y579 HydrophobicContact CB-CD1 4.06Å; K543-Y579 HydrophobicContact CB-CE1 3.71Å; K543-Y579 HydrophobicContact CG-CE1 4.25Å; K543-Y579 HydrophobicContact CG-CE2 4.37Å
544	V	93.4	Very high	83.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.7	176.6	-169.1	0	0	0	0	109.9	V542 I546 F561 R577 C578 C580 F605	V542-V544 PolarHBondContact O-N 2.84Å; V544-I546 HydrophobicContact CG1-CD1 4.4Å; V544-I546 HydrophobicContact CG1-CG1 3.98Å; V544-F561 HydrophobicContact CG2-CZ 4.24Å; V544-R577 WeakPolarHBondContact O-CA 3.42Å; V544-C578 PolarHBondContact N-O 2.89Å; V544-C578 PolarHBondContact O-N 2.76Å; V544-C580 HydrophobicContact CG2-CB 4.2Å; V544-F605 HydrophobicContact CG1-CE2 4.14Å; V544-F605 HydrophobicContact CG2-CE2 3.73Å; V544-F605 HydrophobicContact CG2-CZ 3.98Å
545	L	94.4	Very high	82.2	Confident	67 Å²	67	57 Å²	57	35%	0.351	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128	170.8	-60.8	179.5	0	0	0	109.2	F531 S532 L576 R577	F531-L545 CarbonylContact C-O 3.51Å; F531-L545 WeakPolarHBondContact CA-O 3.35Å; F531-L545 WeakPolarHBondContact CB-O 3.38Å; S532-L545 PolarHBondContact N-O 3.39Å; S532-L545 PolarHBondContact O-N 3.29Å; L545-L576 CarbonylContact C-O 3.53Å; L545-L576 VanDerWaalsContact CA-O 3.32Å; L545-L576 WeakPolarHBondContact CA-O 3.42Å; L545-R577 HydrophobicContact CD2-CB 3.81Å; L545-R577 HydrophobicContact CD2-CG 4.03Å
546	I	91.6	Very high	81.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118.7	-173.5	-63.7	163.4	0	0	0	108.8	I528 F531 V544 W550 C559 L576 L590 V592	I528-I546 HydrophobicContact CD1-CG2 4.38Å; I528-I546 HydrophobicContact CG1-CG2 4.12Å; I528-I546 HydrophobicContact CG2-CG2 3.9Å; F531-I546 HydrophobicContact CB-CB 4.43Å; F531-I546 HydrophobicContact CB-CG1 3.97Å; V544-I546 HydrophobicContact CG1-CD1 4.4Å; V544-I546 HydrophobicContact CG1-CG1 3.98Å; I546-W550 HydrophobicContact CG2-CZ2 4.01Å; I546-W550 PolarHBondContact O-NE1 2.9Å; I546-C559 HydrophobicContact CD1-CB 4.2Å; I546-C559 WeakPolarHBondContact CD1-SG 3.35Å; I546-L576 HydrophobicContact CB-CB 4.4Å; I546-L576 PolarHBondContact N-O 3.24Å; I546-L576 PolarHBondContact O-N 3.37Å; I546-L590 HydrophobicContact CD1-CD1 4.01Å; I546-L590 HydrophobicContact CD1-CD2 4Å; I546-L590 HydrophobicContact CD1-CG 4.42Å; I546-L590 HydrophobicContact CG1-CD2 4.34Å; I546-V592 HydrophobicContact CG2-CG2 4Å
547	T	90.6	Very high	81.6	Confident	39 Å²	39	63.9 Å²	63.9	24%	0.239	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	149	-178.7	74.2	0	0	0	0	111.6	I528 T529 D530 G574 V575	I528-T547 CarbonylContact C-O 3.5Å; I528-T547 WeakPolarHBondContact CA-O 3.44Å; T529-T547 PolarHBondContact N-O 2.93Å; T529-T547 PolarHBondContact OG1-O 3.23Å; T529-T547 PolarHBondContact OG1-OG1 3.48Å; D530-T547 WeakPolarHBondContact CA-OG1 3.44Å; D530-T547 WeakPolarHBondContact CB-OG1 3.42Å; D530-T547 PolarHBondContact N-OG1 3.02Å; D530-T547 WeakPolarHBondContact O-CA 3.21Å; D530-T547 WeakPolarHBondContact O-CB 3.48Å; D530-T547 PolarHBondContact O-N 3.29Å; D530-T547 PolarHBondContact O-OG1 3.05Å; T547-G574 VanDerWaalsContact CA-O 3.25Å; T547-G574 WeakPolarHBondContact CA-O 3.43Å; T547-V575 HydrophobicContact CG2-CG2 4.2Å
548	G	88.1	Confident	81.8	Confident	12 Å²	12	60.7 Å²	60.7	12%	0.124	35%	0.347	C	S	.	.	S	Bend	trans	171.7	-166.7	-179	0	0	0	0	0	111	T529 W550 G574	T529-G548 WeakPolarHBondContact OG1-CA 3.31Å; T529-G548 PolarHBondContact OG1-N 2.87Å; G548-W550 PolarHBondContact O-N 3.39Å; G548-W550 VanDerWaalsContact O-N 3.11Å; G548-G574 PolarHBondContact N-O 3.38Å; G548-G574 VanDerWaalsContact N-O 3.1Å; G548-G574 WeakPolarHBondContact O-CA 3.29Å
549	P	84.8	Confident	82.1	Confident	84 Å²	84	58.8 Å²	58.8	55%	0.545	34%	0.335	S	S	.	.	S	Bend	trans	-83.4	33.6	179.9	36.6	-37.3	0	0	0	113.1	A526 A527 S551	A526-P549 HydrophobicContact CB-CG 3.59Å; A527-P549 VanDerWaalsContact O-CD 3.23Å; A527-P549 WeakPolarHBondContact O-CD 3.43Å; P549-S551 PolarHBondContact O-N 3.26Å
550	W	87.1	Confident	82.6	Confident	7 Å²	7	55 Å²	55	3%	0.027	32%	0.319	C	S	.	.			trans	-65.8	132.5	178.9	-30.5	126	0	0	0	109.9	A526 I528 I546 G548 L570 G574 L576 V592	A526-W550 HydrophobicContact CB-CH2 4.27Å; A526-W550 HydrophobicContact CB-CZ3 3.68Å; I528-W550 HydrophobicContact CB-CZ2 4.49Å; I528-W550 HydrophobicContact CG1-CH2 3.85Å; I528-W550 HydrophobicContact CG1-CZ2 3.82Å; I546-W550 HydrophobicContact CG2-CZ2 4.01Å; I546-W550 PolarHBondContact O-NE1 2.9Å; G548-W550 PolarHBondContact O-N 3.39Å; G548-W550 VanDerWaalsContact O-N 3.11Å; W550-L570 HydrophobicContact CB-CD1 3.79Å; W550-G574 WeakPolarHBondContact O-CA 3.4Å; W550-G574 PolarHBondContact O-N 3.13Å; W550-L576 HydrophobicContact CB-CD1 4.43Å; W550-L576 HydrophobicContact CB-CG 4.35Å; W550-L576 HydrophobicContact CD2-CD1 3.82Å; W550-L576 HydrophobicContact CD2-CG 4.47Å; W550-L576 HydrophobicContact CG-CD1 3.72Å; W550-L576 HydrophobicContact CG-CG 3.88Å; W550-V592 HydrophobicContact CE3-CG1 4.38Å; W550-V592 HydrophobicContact CH2-CB 4.07Å; W550-V592 HydrophobicContact CH2-CG2 3.88Å; W550-V592 HydrophobicContact CZ2-CG2 3.87Å; W550-V592 HydrophobicContact CZ3-CB 4.16Å; W550-V592 HydrophobicContact CZ3-CG1 4.26Å; W550-V592 HydrophobicContact CZ3-CG2 4.4Å
551	S	77.1	Confident	82.9	Confident	64 Å²	64	54.7 Å²	54.7	45%	0.448	32%	0.315	S	S	.	.			trans	-134	167.1	178.6	67.1	0	0	0	0	110.8	P549 P553 Y557	P549-S551 PolarHBondContact O-N 3.26Å; S551-P553 VanDerWaalsContact C-CD 3.48Å; S551-P553 WeakPolarHBondContact O-CD 3.35Å; S551-Y557 PolarHBondContact N-OH 3.26Å; S551-Y557 PolarHBondContact O-OH 3.37Å
552	E	67.7	Low	83.1	Confident	154 Å²	154	55.2 Å²	55.2	72%	0.72	30%	0.304	S	S	*	.			trans	-112.7	90.1	-172.8	-159.2	159.5	-129.3	0	0	111.1	L570	E552-L570 HydrophobicContact CB-CD2 3.72Å; E552-L570 HydrophobicContact CG-CD2 4.08Å
553	P	55.9	Low	82.7	Confident	103 Å²	103	61 Å²	61	67%	0.669	33%	0.328	S	S	*	.	S	Bend	trans	-114	-34.2	159.5	-3	24.3	0	0	0	114.1	S551	S551-P553 VanDerWaalsContact C-CD 3.48Å; S551-P553 WeakPolarHBondContact O-CD 3.35Å
554	S	59.1	Low	82.4	Confident	109 Å²	109	58 Å²	58	76%	0.762	32%	0.321	S	S	*	.	S	Bend	trans	-167	-14.7	-178.6	51.4	0	0	0	0	117.2	R556	S554-R556 PolarHBondContact O-N 3.4Å
555	G	61.5	Low	82.1	Confident	19 Å²	19	61.3 Å²	61.3	20%	0.196	35%	0.348	C	S	.	.			trans	-67.1	124.7	-170.9	0	0	0	0	0	116.7	Y557 E594	G555-Y557 PolarHBondContact O-N 3.06Å; G555-E594 WeakPolarHBondContact CA-OE1 3.39Å
556	R	74.7	Confident	82	Confident	211 Å²	211	59.1 Å²	59.1	80%	0.796	34%	0.338	S	S	*	.			trans	-80.6	94.9	156.3	-74.7	-73.7	-73	-163.5	-5.8	108.2	S554	S554-R556 PolarHBondContact O-N 3.4Å
557	Y	88.5	Confident	81.9	Confident	16 Å²	16	63.9 Å²	63.9	6%	0.063	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	143.3	177	-65	-77.1	0	0	0	112.1	S551 G555 A568 L576 V592 L593 E594	S551-Y557 PolarHBondContact N-OH 3.26Å; S551-Y557 PolarHBondContact O-OH 3.37Å; G555-Y557 PolarHBondContact O-N 3.06Å; Y557-A568 PolarHBondContact O-N 3.07Å; Y557-L576 HydrophobicContact CD1-CD1 4.23Å; Y557-L576 HydrophobicContact CD2-CD2 3.65Å; Y557-L576 HydrophobicContact CE2-CD2 4.41Å; Y557-L576 HydrophobicContact CG-CD1 4.14Å; Y557-L576 HydrophobicContact CG-CD2 3.7Å; Y557-V592 HydrophobicContact CD1-CG1 3.85Å; Y557-L593 WeakPolarHBondContact CA-O 3.28Å; Y557-E594 HydrophobicContact CD1-CB 4.11Å; Y557-E594 HydrophobicContact CD1-CG 3.98Å; Y557-E594 HydrophobicContact CE1-CB 4.11Å; Y557-E594 HydrophobicContact CE1-CG 3.79Å; Y557-E594 WeakPolarHBondContact CE1-OE2 3.37Å
558	S	89	Confident	81.9	Confident	28 Å²	28	62.7 Å²	62.7	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.8	167.8	52.9	0	0	0	0	109.6	V566 L593	S558-V566 CarbonylContact C-O 3.35Å; S558-V566 VanDerWaalsContact CA-O 3.27Å; S558-V566 WeakPolarHBondContact CA-O 3.34Å; S558-V566 WeakPolarHBondContact CB-O 3.26Å; S558-L593 PolarHBondContact N-O 3.22Å; S558-L593 PolarHBondContact O-N 2.81Å
559	C	91.3	Very high	81.9	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.5	173.3	-61.8	0	0	0	0	108.9	I546 F561 V566 C578 L590 Q591	I546-C559 HydrophobicContact CD1-CB 4.2Å; I546-C559 WeakPolarHBondContact CD1-SG 3.35Å; C559-F561 HydrophobicContact CB-CE2 4.08Å; C559-V566 HydrophobicContact CB-CG2 4.14Å; C559-V566 PolarHBondContact N-O 2.76Å; C559-V566 WeakPolarHBondContact O-CG2 3.15Å; C559-V566 PolarHBondContact O-N 3.04Å; C559-C578 HydrophobicContact CB-CB 4Å; C559-L590 HydrophobicContact CB-CD1 4.22Å; C559-Q591 CarbonylContact C-O 3.41Å; C559-Q591 VanDerWaalsContact CA-O 3.27Å; C559-Q591 WeakPolarHBondContact CA-O 3.33Å
560	V	91.1	Very high	82	Confident	17 Å²	17	61.8 Å²	61.8	10%	0.103	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.7	176.1	172.9	0	0	0	0	108.6	D562 S564 A565 L590 Q591 L593	V560-D562 WeakPolarHBondContact CG1-O 3.47Å; V560-S564 WeakPolarHBondContact CA-O 3.45Å; V560-A565 HydrophobicContact CG2-CB 3.89Å; V560-L590 WeakPolarHBondContact O-CA 3.46Å; V560-Q591 PolarHBondContact N-O 2.98Å; V560-Q591 PolarHBondContact O-N 3.32Å; V560-L593 HydrophobicContact CB-CD1 4.06Å; V560-L593 HydrophobicContact CG2-CD1 3.56Å; V560-L593 HydrophobicContact CG2-CD2 3.64Å; V560-L593 HydrophobicContact CG2-CG 4.18Å
561	F	90.9	Very high	82	Confident	0 Å²	0	66 Å²	66	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	101	170.8	-66.7	-104.1	0	0	0	107.3	V544 C559 Q563 S564 V566 C580 P581 V588 L590 F605 Y607	V544-F561 HydrophobicContact CG2-CZ 4.24Å; C559-F561 HydrophobicContact CB-CE2 4.08Å; F561-Q563 PolarHBondContact O-N 2.96Å; F561-S564 PolarHBondContact N-O 2.89Å; F561-S564 PolarHBondContact O-N 3.47Å; F561-V566 HydrophobicContact CD2-CG2 3.88Å; F561-V566 HydrophobicContact CE2-CG2 3.67Å; F561-C580 HydrophobicContact CD1-CB 4.27Å; F561-C580 HydrophobicContact CE1-CB 3.72Å; F561-C580 HydrophobicContact CE2-CB 4.24Å; F561-C580 HydrophobicContact CZ-CB 3.7Å; F561-P581 HydrophobicContact CB-CG 3.86Å; F561-P581 HydrophobicContact CD2-CG 4.14Å; F561-P581 HydrophobicContact CG-CG 4.15Å; F561-V588 HydrophobicContact CB-CG2 4.35Å; F561-V588 HydrophobicContact CD1-CG2 4.2Å; F561-L590 HydrophobicContact CD1-CD1 4.16Å; F561-L590 HydrophobicContact CD2-CD1 4.18Å; F561-L590 HydrophobicContact CE1-CD1 3.88Å; F561-L590 HydrophobicContact CE1-CD2 4.42Å; F561-L590 HydrophobicContact CE2-CD1 3.89Å; F561-L590 HydrophobicContact CG-CD1 4.31Å; F561-L590 HydrophobicContact CZ-CD1 3.74Å; F561-F605 AromaticContact CD1-CD1 3.89Å; F561-F605 HydrophobicContact CD1-CD1 3.89Å; F561-F605 HydrophobicContact CD1-CE1 4.19Å; F561-F605 HydrophobicContact CD1-CG 4.17Å; F561-F605 AromaticContact CE1-CD1 3.8Å; F561-F605 HydrophobicContact CE1-CD1 3.8Å; F561-F605 AromaticContact CE1-CD2 3.96Å; F561-F605 HydrophobicContact CE1-CD2 3.96Å; F561-F605 AromaticContact CE1-CE1 3.86Å; F561-F605 HydrophobicContact CE1-CE1 3.86Å; F561-F605 HydrophobicContact CE1-CE2 4.03Å; F561-F605 AromaticContact CE1-CG 3.85Å; F561-F605 HydrophobicContact CE1-CG 3.85Å; F561-F605 AromaticContact CE1-CZ 3.97Å; F561-F605 HydrophobicContact CE1-CZ 3.97Å; F561-Y607 HydrophobicContact CD1-CE2 4.08Å
562	D	87.3	Confident	82.3	Confident	69 Å²	69	68.6 Å²	68.6	37%	0.369	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	-91.9	-166.4	-161.6	68.7	0	0	0	113.6	V560 V588 C589	V560-D562 WeakPolarHBondContact CG1-O 3.47Å; D562-V588 HydrophobicContact CB-CB 4.19Å; D562-V588 HydrophobicContact CB-CG1 4.49Å; D562-C589 PolarHBondContact N-O 3.17Å
563	Q	79.4	Confident	83.1	Confident	172 Å²	172	66.1 Å²	66.1	80%	0.804	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-12	176.5	-70.7	159.4	84.3	0	0	112.9	F561	F561-Q563 PolarHBondContact O-N 2.96Å
564	S	86.8	Confident	84.5	Confident	48 Å²	48	61.9 Å²	61.9	34%	0.336	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	106.7	-172.9	-69.1	0	0	0	0	112.4	V560 F561	V560-S564 WeakPolarHBondContact CA-O 3.45Å; F561-S564 PolarHBondContact N-O 2.89Å; F561-S564 PolarHBondContact O-N 3.47Å
565	A	87.8	Confident	86	Confident	69 Å²	69	58 Å²	58	57%	0.57	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.9	175.6	0	0	0	0	0	112.2	V560	V560-A565 HydrophobicContact CG2-CB 3.89Å
566	V	91.3	Very high	87.4	Confident	21 Å²	21	57 Å²	57	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144	174.6	-68.4	0	0	0	0	111.3	S558 C559 F561 C578 Y579 P581	S558-V566 CarbonylContact C-O 3.35Å; S558-V566 VanDerWaalsContact CA-O 3.27Å; S558-V566 WeakPolarHBondContact CA-O 3.34Å; S558-V566 WeakPolarHBondContact CB-O 3.26Å; C559-V566 HydrophobicContact CB-CG2 4.14Å; C559-V566 PolarHBondContact N-O 2.76Å; C559-V566 WeakPolarHBondContact O-CG2 3.15Å; C559-V566 PolarHBondContact O-N 3.04Å; F561-V566 HydrophobicContact CD2-CG2 3.88Å; F561-V566 HydrophobicContact CE2-CG2 3.67Å; V566-C578 HydrophobicContact CG2-CB 4.13Å; V566-Y579 WeakPolarHBondContact CG2-O 3.26Å; V566-P581 HydrophobicContact CG1-CB 3.96Å; V566-P581 HydrophobicContact CG1-CG 4.09Å
567	P	89.1	Confident	88.2	Confident	100 Å²	100	51 Å²	51	65%	0.649	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	138.9	179.6	27.7	-34.7	0	0	0	111.5
568	A	90.4	Very high	88.4	Confident	14 Å²	14	50.3 Å²	50.3	12%	0.116	29%	0.29	C	S	.	.			trans	-115.9	135.1	177.6	0	0	0	0	0	111	Y557 L576 R577 C578	Y557-A568 PolarHBondContact O-N 3.07Å; A568-L576 HydrophobicContact CB-CD2 4.16Å; A568-R577 CarbonylContact C-O 3.58Å; A568-R577 WeakPolarHBondContact CA-O 3.16Å; A568-C578 HydrophobicContact CB-CB 4.18Å
569	S	88.6	Confident	88.6	Confident	46 Å²	46	54.5 Å²	54.5	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.9	172.4	-40.2	0	0	0	0	109.4	L576 R577	S569-L576 CarbonylContact O-C 3.48Å; S569-L576 WeakPolarHBondContact O-CA 3.42Å; S569-R577 PolarHBondContact N-O 3.49Å; S569-R577 PolarHBondContact O-N 3.24Å; S569-R577 PolarHBondContact OG-NH2 2.96Å
570	L	88	Confident	88.6	Confident	30 Å²	30	54.7 Å²	54.7	16%	0.157	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	132.2	162.1	-162.8	70.2	0	0	0	108.2	W550 E552 Q572 L576	W550-L570 HydrophobicContact CB-CD1 3.79Å; E552-L570 HydrophobicContact CB-CD2 3.72Å; E552-L570 HydrophobicContact CG-CD2 4.08Å; L570-Q572 WeakPolarHBondContact CD1-O 3.41Å; L570-L576 HydrophobicContact CB-CD2 4.16Å; L570-L576 HydrophobicContact CD1-CD2 3.84Å; L570-L576 HydrophobicContact CD1-CG 4.16Å
571	I	85.7	Confident	88.6	Confident	96 Å²	96	55 Å²	55	49%	0.492	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-33.9	178.9	-58.1	-58.4	0	0	0	110.5	V575 R577	I571-V575 PolarHBondContact N-O 2.88Å; I571-R577 HydrophobicContact CD1-CB 3.81Å; I571-R577 HydrophobicContact CG1-CB 3.61Å
572	Q	83.5	Confident	88.3	Confident	118 Å²	118	58.2 Å²	58.2	55%	0.551	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-161.5	162.3	172.5	58.9	179.9	15.6	0	0	107.4	L570 G574 V575	L570-Q572 WeakPolarHBondContact CD1-O 3.41Å; Q572-G574 PolarHBondContact O-N 3.16Å; Q572-G574 VanDerWaalsContact O-N 3.15Å; Q572-V575 HydrophobicContact CG-CB 3.89Å; Q572-V575 HydrophobicContact CG-CG2 3.89Å; Q572-V575 PolarHBondContact O-N 3.5Å
573	P	85.1	Confident	88.3	Confident	102 Å²	102	57.4 Å²	57.4	66%	0.662	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	124.2	172.4	-30.2	36.9	0	0	0	111.8
574	G	85.4	Confident	88.2	Confident	15 Å²	15	57.3 Å²	57.3	16%	0.155	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	7.2	-178.3	0	0	0	0	0	117.4	T547 G548 W550 Q572	T547-G574 VanDerWaalsContact CA-O 3.25Å; T547-G574 WeakPolarHBondContact CA-O 3.43Å; G548-G574 PolarHBondContact N-O 3.38Å; G548-G574 VanDerWaalsContact N-O 3.1Å; G548-G574 WeakPolarHBondContact O-CA 3.29Å; W550-G574 WeakPolarHBondContact O-CA 3.4Å; W550-G574 PolarHBondContact O-N 3.13Å; Q572-G574 PolarHBondContact O-N 3.16Å; Q572-G574 VanDerWaalsContact O-N 3.15Å
575	V	90.6	Very high	88	Confident	26 Å²	26	57.8 Å²	57.8	16%	0.158	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	112.9	174.1	-171	0	0	0	0	112.5	T547 I571 Q572	T547-V575 HydrophobicContact CG2-CG2 4.2Å; I571-V575 PolarHBondContact N-O 2.88Å; Q572-V575 HydrophobicContact CG-CB 3.89Å; Q572-V575 HydrophobicContact CG-CG2 3.89Å; Q572-V575 PolarHBondContact O-N 3.5Å
576	L	91.2	Very high	87.8	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	153.4	170.5	-71.8	167	0	0	0	111.4	L545 I546 W550 Y557 A568 S569 L570 V592	L545-L576 CarbonylContact C-O 3.53Å; L545-L576 VanDerWaalsContact CA-O 3.32Å; L545-L576 WeakPolarHBondContact CA-O 3.42Å; I546-L576 HydrophobicContact CB-CB 4.4Å; I546-L576 PolarHBondContact N-O 3.24Å; I546-L576 PolarHBondContact O-N 3.37Å; W550-L576 HydrophobicContact CB-CD1 4.43Å; W550-L576 HydrophobicContact CB-CG 4.35Å; W550-L576 HydrophobicContact CD2-CD1 3.82Å; W550-L576 HydrophobicContact CD2-CG 4.47Å; W550-L576 HydrophobicContact CG-CD1 3.72Å; W550-L576 HydrophobicContact CG-CG 3.88Å; Y557-L576 HydrophobicContact CD1-CD1 4.23Å; Y557-L576 HydrophobicContact CD2-CD2 3.65Å; Y557-L576 HydrophobicContact CE2-CD2 4.41Å; Y557-L576 HydrophobicContact CG-CD1 4.14Å; Y557-L576 HydrophobicContact CG-CD2 3.7Å; A568-L576 HydrophobicContact CB-CD2 4.16Å; S569-L576 CarbonylContact O-C 3.48Å; S569-L576 WeakPolarHBondContact O-CA 3.42Å; L570-L576 HydrophobicContact CB-CD2 4.16Å; L570-L576 HydrophobicContact CD1-CD2 3.84Å; L570-L576 HydrophobicContact CD1-CG 4.16Å; L576-V592 HydrophobicContact CD1-CB 4.46Å; L576-V592 HydrophobicContact CD1-CG1 3.53Å; L576-V592 HydrophobicContact CD1-CG2 4.04Å
577	R	91.9	Very high	87.6	Confident	84 Å²	84	60.4 Å²	60.4	32%	0.317	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.4	169.9	175.5	-162.4	66.7	-177.9	-2.8	109.2	K543 V544 L545 A568 S569 I571	K543-R577 HydrophobicContact CD-CG 4.12Å; K543-R577 HydrophobicContact CG-CG 3.83Å; V544-R577 WeakPolarHBondContact O-CA 3.42Å; L545-R577 HydrophobicContact CD2-CB 3.81Å; L545-R577 HydrophobicContact CD2-CG 4.03Å; A568-R577 CarbonylContact C-O 3.58Å; A568-R577 WeakPolarHBondContact CA-O 3.16Å; S569-R577 PolarHBondContact N-O 3.49Å; S569-R577 PolarHBondContact O-N 3.24Å; S569-R577 PolarHBondContact OG-NH2 2.96Å; I571-R577 HydrophobicContact CD1-CB 3.81Å; I571-R577 HydrophobicContact CG1-CB 3.61Å
578	C	92.7	Very high	87.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	176.9	167.1	65.8	0	0	0	0	110.1	K543 V544 C559 V566 A568	K543-C578 CarbonylContact C-O 3.59Å; K543-C578 WeakPolarHBondContact CA-O 3.25Å; V544-C578 PolarHBondContact N-O 2.89Å; V544-C578 PolarHBondContact O-N 2.76Å; C559-C578 HydrophobicContact CB-CB 4Å; V566-C578 HydrophobicContact CG2-CB 4.13Å; A568-C578 HydrophobicContact CB-CB 4.18Å
579	Y	92.4	Very high	87.5	Confident	117 Å²	117	56.7 Å²	56.7	46%	0.459	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.6	169.5	-72.3	-102.5	0	0	0	106.9	G541 V542 K543 V566	G541-Y579 WeakPolarHBondContact O-CD1 3.36Å; V542-Y579 WeakPolarHBondContact O-CA 3.39Å; K543-Y579 HydrophobicContact CB-CD1 4.06Å; K543-Y579 HydrophobicContact CB-CE1 3.71Å; K543-Y579 HydrophobicContact CG-CE1 4.25Å; K543-Y579 HydrophobicContact CG-CE2 4.37Å; V566-Y579 WeakPolarHBondContact CG2-O 3.26Å
580	C	90.8	Very high	87.7	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.027	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-66.4	140	-177.5	63.9	0	0	0	0	110.9	S536 G541 V542 V544 F561 F605 Y607	S536-C580 PolarHBondContact OG-SG 3.13Å; G541-C580 PolarHBondContact N-O 2.78Å; V542-C580 PolarHBondContact N-SG 3.22Å; V542-C580 VanDerWaalsContact N-SG 3.42Å; V542-C580 PolarHBondContact O-N 3.43Å; V544-C580 HydrophobicContact CG2-CB 4.2Å; F561-C580 HydrophobicContact CD1-CB 4.27Å; F561-C580 HydrophobicContact CE1-CB 3.72Å; F561-C580 HydrophobicContact CE2-CB 4.24Å; F561-C580 HydrophobicContact CZ-CB 3.7Å; C580-F605 HydrophobicContact CB-CE1 4.44Å; C580-F605 HydrophobicContact CB-CZ 4.29Å; C580-Y607 WeakPolarHBondContact CB-OH 3.47Å
581	P	90.7	Very high	87.8	Confident	22 Å²	22	55.3 Å²	55.3	14%	0.143	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-69.2	172.9	174.8	30.2	-34.5	0	0	0	111.1	G540 F561 V566 Y607	G540-P581 WeakPolarHBondContact CA-O 3.5Å; F561-P581 HydrophobicContact CB-CG 3.86Å; F561-P581 HydrophobicContact CD2-CG 4.14Å; F561-P581 HydrophobicContact CG-CG 4.15Å; V566-P581 HydrophobicContact CG1-CB 3.96Å; V566-P581 HydrophobicContact CG1-CG 4.09Å; P581-Y607 WeakPolarHBondContact CD-OH 3.38Å; P581-Y607 WeakPolarHBondContact O-CE1 3.46Å; P581-Y607 PolarHBondContact O-OH 2.99Å
582	A	86	Confident	88.1	Confident	68 Å²	68	50.8 Å²	50.8	56%	0.562	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-71.3	141.7	163.9	0	0	0	0	0	109.7	P538	P538-A582 CarbonylContact O-C 3.6Å; P538-A582 VanDerWaalsContact O-CA 3.23Å; P538-A582 WeakPolarHBondContact O-CA 3.34Å; P538-A582 WeakPolarHBondContact O-CB 3.41Å
583	H	87.2	Confident	88.3	Confident	53 Å²	53	46.4 Å²	46.4	25%	0.245	26%	0.263	C	S	.	.			trans	-158	151.6	-178.4	-165.7	-76.2	0	0	0	110.7	P538 V588 Y607	P538-H583 WeakPolarHBondContact CA-O 3.29Å; P538-H583 VanDerWaalsContact CB-O 3.25Å; P538-H583 WeakPolarHBondContact CB-O 3.28Å; P538-H583 PolarHBondContact O-N 3.42Å; H583-V588 WeakPolarHBondContact CE1-CG1 3.23Å; H583-V588 WeakPolarHBondContact ND1-CG1 3.41Å; H583-Y607 HydrophobicContact CB-CD1 3.85Å; H583-Y607 HydrophobicContact CB-CD2 3.97Å; H583-Y607 HydrophobicContact CB-CE1 3.64Å; H583-Y607 HydrophobicContact CB-CE2 3.75Å; H583-Y607 HydrophobicContact CB-CG 3.99Å
584	E	77.1	Confident	88.2	Confident	169 Å²	169	43.9 Å²	43.9	79%	0.79	24%	0.243	S	C	*	.			trans	-61.6	156.5	172.5	-63.9	-160.8	155.9	0	0	112.8	G586 Y607	E584-G586 PolarHBondContact O-N 3.23Å; E584-Y607 WeakPolarHBondContact O-CB 3.45Å
585	A	81.4	Confident	87.5	Confident	58 Å²	58	48 Å²	48	48%	0.479	27%	0.269	S	S	.	.	S	Bend	trans	-70.8	118.7	-176.9	0	0	0	0	0	112.4	P538 Y607 A609	P538-A585 HydrophobicContact CG-CB 4.25Å; A585-Y607 CarbonylContact C-O 3.6Å; A585-Y607 VanDerWaalsContact CA-O 3.24Å; A585-Y607 WeakPolarHBondContact CA-O 3.15Å; A585-A609 HydrophobicContact CB-CB 3.65Å
586	G	84.3	Confident	86.3	Confident	32 Å²	32	50.4 Å²	50.4	33%	0.33	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-174.7	-177.4	0	0	0	0	0	112.6	E584 Y607	E584-G586 PolarHBondContact O-N 3.23Å; G586-Y607 PolarHBondContact N-O 3.31Å; G586-Y607 PolarHBondContact O-N 2.99Å
587	L	86.8	Confident	85.3	Confident	114 Å²	114	52.1 Å²	52.1	60%	0.597	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.2	168.2	-70	166.5	0	0	0	108.5	E606	L587-E606 HydrophobicContact CD2-CB 3.83Å; L587-E606 HydrophobicContact CD2-CG 3.84Å
588	V	90.2	Very high	84.4	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.024	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	159	179.3	-56	0	0	0	0	112.3	F561 D562 H583 L590 L604 F605 Y607	F561-V588 HydrophobicContact CB-CG2 4.35Å; F561-V588 HydrophobicContact CD1-CG2 4.2Å; D562-V588 HydrophobicContact CB-CB 4.19Å; D562-V588 HydrophobicContact CB-CG1 4.49Å; H583-V588 WeakPolarHBondContact CE1-CG1 3.23Å; H583-V588 WeakPolarHBondContact ND1-CG1 3.41Å; V588-L590 PolarHBondContact O-N 2.75Å; V588-L604 WeakPolarHBondContact O-CA 3.31Å; V588-F605 HydrophobicContact CG2-CB 3.99Å; V588-F605 HydrophobicContact CG2-CD1 4.06Å; V588-F605 WeakPolarHBondContact CG2-O 3.42Å; V588-F605 PolarHBondContact N-O 3.11Å; V588-F605 PolarHBondContact O-N 2.84Å; V588-Y607 HydrophobicContact CB-CD2 4.4Å; V588-Y607 HydrophobicContact CB-CE2 4.48Å; V588-Y607 HydrophobicContact CG1-CD2 3.69Å; V588-Y607 HydrophobicContact CG1-CE2 4.04Å; V588-Y607 HydrophobicContact CG2-CD2 3.81Å; V588-Y607 HydrophobicContact CG2-CE2 3.65Å
589	C	88.6	Confident	83.7	Confident	32 Å²	32	52.8 Å²	52.8	22%	0.216	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	107.8	173.3	-168.4	0	0	0	0	110.9	D562 Q591 S602	D562-C589 PolarHBondContact N-O 3.17Å; C589-Q591 PolarHBondContact SG-NE2 3.04Å; C589-S602 WeakPolarHBondContact SG-CB 3.32Å
590	L	91.9	Very high	83.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.4	171.2	174.9	58	0	0	0	110.5	F531 I546 C559 V560 F561 V588 S602 V603 F605	F531-L590 HydrophobicContact CD2-CD2 3.95Å; F531-L590 HydrophobicContact CE2-CD2 4.24Å; F531-L590 HydrophobicContact CG-CD2 4.27Å; I546-L590 HydrophobicContact CD1-CD1 4.01Å; I546-L590 HydrophobicContact CD1-CD2 4Å; I546-L590 HydrophobicContact CD1-CG 4.42Å; I546-L590 HydrophobicContact CG1-CD2 4.34Å; C559-L590 HydrophobicContact CB-CD1 4.22Å; V560-L590 WeakPolarHBondContact O-CA 3.46Å; F561-L590 HydrophobicContact CD1-CD1 4.16Å; F561-L590 HydrophobicContact CD2-CD1 4.18Å; F561-L590 HydrophobicContact CE1-CD1 3.88Å; F561-L590 HydrophobicContact CE1-CD2 4.42Å; F561-L590 HydrophobicContact CE2-CD1 3.89Å; F561-L590 HydrophobicContact CG-CD1 4.31Å; F561-L590 HydrophobicContact CZ-CD1 3.74Å; V588-L590 PolarHBondContact O-N 2.75Å; L590-S602 WeakPolarHBondContact O-CA 3.36Å; L590-V603 HydrophobicContact CB-CG2 3.86Å; L590-V603 HydrophobicContact CD2-CG2 4.07Å; L590-V603 HydrophobicContact CG-CG2 4.06Å; L590-V603 PolarHBondContact N-O 3.4Å; L590-V603 PolarHBondContact O-N 2.96Å; L590-F605 HydrophobicContact CB-CB 3.93Å; L590-F605 HydrophobicContact CD2-CB 4.24Å; L590-F605 HydrophobicContact CD2-CD2 4.15Å
591	Q	91	Very high	82.9	Confident	47 Å²	47	49.1 Å²	49.1	22%	0.22	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	157	174.6	-66.5	-178.7	37	0	0	111.5	C559 V560 C589 L593 S598	C559-Q591 CarbonylContact C-O 3.41Å; C559-Q591 VanDerWaalsContact CA-O 3.27Å; C559-Q591 WeakPolarHBondContact CA-O 3.33Å; V560-Q591 PolarHBondContact N-O 2.98Å; V560-Q591 PolarHBondContact O-N 3.32Å; C589-Q591 PolarHBondContact SG-NE2 3.04Å; Q591-L593 HydrophobicContact CB-CD1 3.99Å; Q591-S598 PolarHBondContact OE1-OG 3.32Å
592	V	90.4	Very high	82.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.2	166.1	-177.9	0	0	0	0	108.8	I528 I546 W550 Y557 L576 V599 S600	I528-V592 HydrophobicContact CD1-CG2 4.35Å; I528-V592 HydrophobicContact CG1-CG2 4.4Å; I546-V592 HydrophobicContact CG2-CG2 4Å; W550-V592 HydrophobicContact CE3-CG1 4.38Å; W550-V592 HydrophobicContact CH2-CB 4.07Å; W550-V592 HydrophobicContact CH2-CG2 3.88Å; W550-V592 HydrophobicContact CZ2-CG2 3.87Å; W550-V592 HydrophobicContact CZ3-CB 4.16Å; W550-V592 HydrophobicContact CZ3-CG1 4.26Å; W550-V592 HydrophobicContact CZ3-CG2 4.4Å; Y557-V592 HydrophobicContact CD1-CG1 3.85Å; L576-V592 HydrophobicContact CD1-CB 4.46Å; L576-V592 HydrophobicContact CD1-CG1 3.53Å; L576-V592 HydrophobicContact CD1-CG2 4.04Å; V592-V599 PolarHBondContact O-N 3.28Å; V592-S600 PolarHBondContact N-OG 3.34Å; V592-S600 PolarHBondContact O-N 2.72Å
593	L	88.1	Confident	82.7	Confident	26 Å²	26	49.8 Å²	49.8	14%	0.136	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.6	174	-79.7	58.8	0	0	0	109.4	Y557 S558 V560 Q591 G597	Y557-L593 WeakPolarHBondContact CA-O 3.28Å; S558-L593 PolarHBondContact N-O 3.22Å; S558-L593 PolarHBondContact O-N 2.81Å; V560-L593 HydrophobicContact CB-CD1 4.06Å; V560-L593 HydrophobicContact CG2-CD1 3.56Å; V560-L593 HydrophobicContact CG2-CD2 3.64Å; V560-L593 HydrophobicContact CG2-CG 4.18Å; Q591-L593 HydrophobicContact CB-CD1 3.99Å; L593-G597 CarbonylContact C-O 3.57Å; L593-G597 WeakPolarHBondContact CA-O 3.5Å; L593-G597 WeakPolarHBondContact CB-O 3.47Å
594	E	84.1	Confident	82.8	Confident	49 Å²	49	52.8 Å²	52.8	23%	0.229	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.8	171.5	-160.7	176	173.3	0	0	107.6	G555 Y557 G596 G597 V599	G555-E594 WeakPolarHBondContact CA-OE1 3.39Å; Y557-E594 HydrophobicContact CD1-CB 4.11Å; Y557-E594 HydrophobicContact CD1-CG 3.98Å; Y557-E594 HydrophobicContact CE1-CB 4.11Å; Y557-E594 HydrophobicContact CE1-CG 3.79Å; Y557-E594 WeakPolarHBondContact CE1-OE2 3.37Å; E594-G596 PolarHBondContact O-N 2.82Å; E594-G597 PolarHBondContact N-O 2.73Å; E594-G597 PolarHBondContact O-N 2.82Å; E594-G597 VanDerWaalsContact O-N 3.11Å; E594-V599 HydrophobicContact CB-CB 4.21Å; E594-V599 HydrophobicContact CB-CG2 3.48Å; E594-V599 VanDerWaalsContact CB-CG2 3.48Å
595	S	71	Confident	83.4	Confident	102 Å²	102	44.8 Å²	44.8	71%	0.713	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	35.6	174.1	-57.2	0	0	0	0	115.6
596	G	64.6	Low	83.8	Confident	77 Å²	77	45 Å²	45	79%	0.794	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	-5.7	175	0	0	0	0	0	116.4	E594	E594-G596 PolarHBondContact O-N 2.82Å
597	G	69.8	Low	83.8	Confident	35 Å²	35	43.6 Å²	43.6	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.4	174.2	0	0	0	0	0	112.7	L593 E594 V599	L593-G597 CarbonylContact C-O 3.57Å; L593-G597 WeakPolarHBondContact CA-O 3.5Å; L593-G597 WeakPolarHBondContact CB-O 3.47Å; E594-G597 PolarHBondContact N-O 2.73Å; E594-G597 PolarHBondContact O-N 2.82Å; E594-G597 VanDerWaalsContact O-N 3.11Å; G597-V599 PolarHBondContact O-N 2.86Å
598	S	72.9	Confident	83.5	Confident	57 Å²	57	41.9 Å²	41.9	40%	0.399	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	117.4	168.4	-67.3	0	0	0	0	109.3	L525 Q591	L525-S598 WeakPolarHBondContact CD2-O 3.09Å; Q591-S598 PolarHBondContact OE1-OG 3.32Å
599	V	78.3	Confident	82.1	Confident	43 Å²	43	44 Å²	44	26%	0.261	28%	0.283	S	S	.	.			trans	-98.6	-25.9	176.4	165.4	0	0	0	0	111.1	L525 A526 V592 E594 G597	L525-V599 CarbonylContact C-O 3.5Å; L525-V599 WeakPolarHBondContact CA-O 3.44Å; A526-V599 HydrophobicContact CB-CG1 4.26Å; A526-V599 WeakPolarHBondContact CB-O 3.45Å; A526-V599 PolarHBondContact N-O 3.14Å; V592-V599 PolarHBondContact O-N 3.28Å; E594-V599 HydrophobicContact CB-CB 4.21Å; E594-V599 HydrophobicContact CB-CG2 3.48Å; E594-V599 VanDerWaalsContact CB-CG2 3.48Å; G597-V599 PolarHBondContact O-N 2.86Å
600	S	86.1	Confident	80.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.007	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-102.1	157.2	176.1	88.7	0	0	0	0	115.4	A526 V592	A526-S600 CarbonylContact O-C 3.59Å; A526-S600 WeakPolarHBondContact O-CA 3.3Å; A526-S600 WeakPolarHBondContact O-CB 3.47Å; V592-S600 PolarHBondContact N-OG 3.34Å; V592-S600 PolarHBondContact O-N 2.72Å
601	S	80.6	Confident	78	Confident	42 Å²	42	55.1 Å²	55.1	29%	0.294	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-60.7	148.5	156.6	59.2	0	0	0	0	111	A526	A526-S601 PolarHBondContact O-N 3.31Å; A526-S601 PolarHBondContact O-OG 2.97Å
602	S	84.9	Confident	75.6	Confident	72 Å²	72	56.4 Å²	56.4	50%	0.503	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-66.1	136.4	168.5	54.1	0	0	0	0	113.1	C589 L590	C589-S602 WeakPolarHBondContact SG-CB 3.32Å; L590-S602 WeakPolarHBondContact O-CA 3.36Å
603	V	87.9	Confident	73	Confident	32 Å²	32	61.6 Å²	61.6	19%	0.194	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	161.2	163.8	-59.9	0	0	0	0	110	I528 F531 L590	I528-V603 HydrophobicContact CB-CG1 3.94Å; I528-V603 HydrophobicContact CD1-CB 4.47Å; I528-V603 HydrophobicContact CD1-CG1 4.1Å; I528-V603 HydrophobicContact CD1-CG2 3.64Å; I528-V603 HydrophobicContact CG2-CG1 4.34Å; I528-V603 HydrophobicContact CG2-CG2 4.37Å; F531-V603 HydrophobicContact CD1-CG2 3.9Å; F531-V603 HydrophobicContact CE1-CB 3.89Å; F531-V603 HydrophobicContact CE1-CG1 4.49Å; F531-V603 HydrophobicContact CE1-CG2 3.45Å; F531-V603 VanDerWaalsContact CE1-CG2 3.45Å; F531-V603 HydrophobicContact CZ-CB 4.37Å; F531-V603 HydrophobicContact CZ-CG2 3.85Å; L590-V603 HydrophobicContact CB-CG2 3.86Å; L590-V603 HydrophobicContact CD2-CG2 4.07Å; L590-V603 HydrophobicContact CG-CG2 4.06Å; L590-V603 PolarHBondContact N-O 3.4Å; L590-V603 PolarHBondContact O-N 2.96Å
604	L	89.2	Confident	70.5	Confident	117 Å²	117	65.1 Å²	65.1	61%	0.613	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.1	179.2	-65	175.7	0	0	0	110.6	F531 V588	F531-L604 WeakPolarHBondContact CZ-O 3.26Å; V588-L604 WeakPolarHBondContact O-CA 3.31Å
605	F	89	Confident	68.1	Low	0 Å²	0	67.4 Å²	67.4	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.6	173.7	178.6	-82.5	0	0	0	109.1	F531 P533 S536 V544 F561 C580 V588 L590 Y607	F531-F605 HydrophobicContact CD2-CD2 4.08Å; F531-F605 HydrophobicContact CE2-CB 4.31Å; F531-F605 AromaticContact CE2-CD2 3.84Å; F531-F605 HydrophobicContact CE2-CD2 3.84Å; P533-F605 WeakPolarHBondContact O-CE2 3.45Å; S536-F605 WeakPolarHBondContact OG-CE1 3.47Å; V544-F605 HydrophobicContact CG1-CE2 4.14Å; V544-F605 HydrophobicContact CG2-CE2 3.73Å; V544-F605 HydrophobicContact CG2-CZ 3.98Å; F561-F605 AromaticContact CD1-CD1 3.89Å; F561-F605 HydrophobicContact CD1-CD1 3.89Å; F561-F605 HydrophobicContact CD1-CE1 4.19Å; F561-F605 HydrophobicContact CD1-CG 4.17Å; F561-F605 AromaticContact CE1-CD1 3.8Å; F561-F605 HydrophobicContact CE1-CD1 3.8Å; F561-F605 AromaticContact CE1-CD2 3.96Å; F561-F605 HydrophobicContact CE1-CD2 3.96Å; F561-F605 AromaticContact CE1-CE1 3.86Å; F561-F605 HydrophobicContact CE1-CE1 3.86Å; F561-F605 HydrophobicContact CE1-CE2 4.03Å; F561-F605 AromaticContact CE1-CG 3.85Å; F561-F605 HydrophobicContact CE1-CG 3.85Å; F561-F605 AromaticContact CE1-CZ 3.97Å; F561-F605 HydrophobicContact CE1-CZ 3.97Å; C580-F605 HydrophobicContact CB-CE1 4.44Å; C580-F605 HydrophobicContact CB-CZ 4.29Å; V588-F605 HydrophobicContact CG2-CB 3.99Å; V588-F605 HydrophobicContact CG2-CD1 4.06Å; V588-F605 WeakPolarHBondContact CG2-O 3.42Å; V588-F605 PolarHBondContact N-O 3.11Å; V588-F605 PolarHBondContact O-N 2.84Å; L590-F605 HydrophobicContact CB-CB 3.93Å; L590-F605 HydrophobicContact CD2-CB 4.24Å; L590-F605 HydrophobicContact CD2-CD2 4.15Å; F605-Y607 AromaticContact CD1-CD2 3.93Å; F605-Y607 HydrophobicContact CD1-CD2 3.93Å; F605-Y607 AromaticContact CD1-CE2 3.71Å; F605-Y607 HydrophobicContact CD1-CE2 3.71Å; F605-Y607 HydrophobicContact CE1-CD2 4.05Å; F605-Y607 AromaticContact CE1-CE2 3.73Å; F605-Y607 HydrophobicContact CE1-CE2 3.73Å
606	E	90.5	Very high	66.2	Low	64 Å²	64	67.6 Å²	67.6	30%	0.299	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.8	-170	-166.1	-173.4	158.5	0	0	112.4	E534 W535 S536 L587 R608	E534-E606 PolarHBondContact O-N 2.86Å; W535-E606 CarbonylContact C-O 3.56Å; W535-E606 WeakPolarHBondContact CA-O 3.5Å; W535-E606 HydrophobicContact CB-CB 3.93Å; W535-E606 WeakPolarHBondContact CB-O 3.29Å; S536-E606 PolarHBondContact N-O 3.31Å; L587-E606 HydrophobicContact CD2-CB 3.83Å; L587-E606 HydrophobicContact CD2-CG 3.84Å; E606-R608 HydrophobicContact CG-CG 3.8Å; E606-R608 PolarHBondContact O-N 3.18Å; E606-R608 WeakPolarHBondContact OE1-CG 3.23Å; E606-R608 IonicContact OE1-CZ 3.34Å; E606-R608 IonicContact OE1-NE 3.45Å; E606-R608 PolarHBondContact OE1-NE 3.4Å; E606-R608 IonicContact OE1-NH2 3.29Å; E606-R608 IonicContact OE2-CZ 2.66Å; E606-R608 VanDerWaalsContact OE2-CZ 3.28Å; E606-R608 IonicContact OE2-NE 3.47Å; E606-R608 PolarHBondContact OE2-NE 3.29Å; E606-R608 VanDerWaalsContact OE2-NE 3.14Å; E606-R608 IonicContact OE2-NH2 2.73Å; E606-R608 PolarHBondContact OE2-NH2 3.11Å
607	Y	84.1	Confident	64.5	Low	2 Å²	2	70.5 Å²	70.5	1%	0.008	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	98.5	163.2	-77.3	-94.9	0	0	0	108.6	S536 Y537 F561 C580 P581 H583 E584 A585 G586 V588 F605 A609	S536-Y607 CarbonylContact O-C 3.6Å; S536-Y607 WeakPolarHBondContact O-CA 3.46Å; S536-Y607 WeakPolarHBondContact OG-CD1 3.34Å; S536-Y607 VanDerWaalsContact OG-CE1 3.26Å; S536-Y607 WeakPolarHBondContact OG-CE1 3.26Å; Y537-Y607 WeakPolarHBondContact O-CD1 3.43Å; F561-Y607 HydrophobicContact CD1-CE2 4.08Å; C580-Y607 WeakPolarHBondContact CB-OH 3.47Å; P581-Y607 WeakPolarHBondContact CD-OH 3.38Å; P581-Y607 WeakPolarHBondContact O-CE1 3.46Å; P581-Y607 PolarHBondContact O-OH 2.99Å; H583-Y607 HydrophobicContact CB-CD1 3.85Å; H583-Y607 HydrophobicContact CB-CD2 3.97Å; H583-Y607 HydrophobicContact CB-CE1 3.64Å; H583-Y607 HydrophobicContact CB-CE2 3.75Å; H583-Y607 HydrophobicContact CB-CG 3.99Å; E584-Y607 WeakPolarHBondContact O-CB 3.45Å; A585-Y607 CarbonylContact C-O 3.6Å; A585-Y607 VanDerWaalsContact CA-O 3.24Å; A585-Y607 WeakPolarHBondContact CA-O 3.15Å; G586-Y607 PolarHBondContact N-O 3.31Å; G586-Y607 PolarHBondContact O-N 2.99Å; V588-Y607 HydrophobicContact CB-CD2 4.4Å; V588-Y607 HydrophobicContact CB-CE2 4.48Å; V588-Y607 HydrophobicContact CG1-CD2 3.69Å; V588-Y607 HydrophobicContact CG1-CE2 4.04Å; V588-Y607 HydrophobicContact CG2-CD2 3.81Å; V588-Y607 HydrophobicContact CG2-CE2 3.65Å; F605-Y607 AromaticContact CD1-CD2 3.93Å; F605-Y607 HydrophobicContact CD1-CD2 3.93Å; F605-Y607 AromaticContact CD1-CE2 3.71Å; F605-Y607 HydrophobicContact CD1-CE2 3.71Å; F605-Y607 HydrophobicContact CE1-CD2 4.05Å; F605-Y607 AromaticContact CE1-CE2 3.73Å; F605-Y607 HydrophobicContact CE1-CE2 3.73Å; Y607-A609 PolarHBondContact O-N 3.19Å
608	R	81.3	Confident	63	Low	77 Å²	77	73.1 Å²	73.1	29%	0.291	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-77.2	121	179.2	-73.1	-174.8	176	141.3	14	109.9	W535 S536 Y537 P538 E606 R610	W535-R608 HydrophobicContact CB-CG 4.46Å; W535-R608 HydrophobicContact CE3-CB 4.44Å; W535-R608 HydrophobicContact CE3-CG 4.41Å; W535-R608 VanDerWaalsContact CG-NH1 3.3Å; S536-R608 PolarHBondContact O-N 3.07Å; Y537-R608 WeakPolarHBondContact CD1-O 3.42Å; P538-R608 WeakPolarHBondContact CD-O 3.43Å; E606-R608 HydrophobicContact CG-CG 3.8Å; E606-R608 PolarHBondContact O-N 3.18Å; E606-R608 WeakPolarHBondContact OE1-CG 3.23Å; E606-R608 IonicContact OE1-CZ 3.34Å; E606-R608 IonicContact OE1-NE 3.45Å; E606-R608 PolarHBondContact OE1-NE 3.4Å; E606-R608 IonicContact OE1-NH2 3.29Å; E606-R608 IonicContact OE2-CZ 2.66Å; E606-R608 VanDerWaalsContact OE2-CZ 3.28Å; E606-R608 IonicContact OE2-NE 3.47Å; E606-R608 PolarHBondContact OE2-NE 3.29Å; E606-R608 VanDerWaalsContact OE2-NE 3.14Å; E606-R608 IonicContact OE2-NH2 2.73Å; E606-R608 PolarHBondContact OE2-NH2 3.11Å; R608-R610 PolarHBondContact O-N 3.29Å
609	A	60.2	Low	61.3	Low	50 Å²	50	78.5 Å²	78.5	41%	0.413	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-52.3	140.8	159.3	0	0	0	0	0	109.1	A585 Y607 N611	A585-A609 HydrophobicContact CB-CB 3.65Å; Y607-A609 PolarHBondContact O-N 3.19Å; A609-N611 PolarHBondContact O-N 3.49Å; A609-N611 VanDerWaalsContact O-N 3.13Å
610	R	55.3	Low	59.7	Low	147 Å²	147	84.8 Å²	84.8	56%	0.555	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-60.1	120.5	166.4	-66.3	-177.6	179.7	-161.9	2.7	107	Y537 E539 R608 A612	Y537-R610 HydrophobicContact CD1-CG 3.85Å; Y537-R610 HydrophobicContact CE1-CG 3.99Å; E539-R610 IonicContact OE1-CZ 3Å; E539-R610 IonicContact OE1-NE 3.28Å; E539-R610 PolarHBondContact OE1-NE 2.92Å; E539-R610 IonicContact OE1-NH2 4Å; E539-R610 PolarHBondContact OE1-NH2 3.41Å; R608-R610 PolarHBondContact O-N 3.29Å; R610-A612 VanDerWaalsContact C-N 3.32Å; R610-A612 PolarHBondContact O-N 3.42Å
611	N	38.3	Very low	58.2	Low	118 Å²	118	86.4 Å²	86.4	63%	0.631	50%	0.503	S	S	*	.			trans	-67.1	81.5	-169.5	-83.7	-27.5	0	0	0	113.1	A609 S613	A609-N611 PolarHBondContact O-N 3.49Å; A609-N611 VanDerWaalsContact O-N 3.13Å; N611-S613 PolarHBondContact O-N 2.95Å
612	A	42.1	Very low	57.3	Low	73 Å²	73	85.2 Å²	85.2	60%	0.603	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-66.2	-22.3	167.3	0	0	0	0	0	112.2	R610 S614 L615	R610-A612 VanDerWaalsContact C-N 3.32Å; R610-A612 PolarHBondContact O-N 3.42Å; A612-S614 PolarHBondContact O-N 3.41Å; A612-S614 VanDerWaalsContact O-N 3.15Å; A612-L615 PolarHBondContact O-N 2.82Å
613	S	34	Very low	56	Low	109 Å²	109	83.6 Å²	83.6	76%	0.762	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-73.8	4.2	-177.8	53.7	0	0	0	0	115.5	N611	N611-S613 PolarHBondContact O-N 2.95Å
614	S	35.3	Very low	54.5	Low	101 Å²	101	86.3 Å²	86.3	71%	0.706	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-107.3	14.7	165	67	0	0	0	0	113.8	A612	A612-S614 PolarHBondContact O-N 3.41Å; A612-S614 VanDerWaalsContact O-N 3.15Å
615	L	34.7	Very low	53	Low	97 Å²	97	82.9 Å²	82.9	51%	0.508	48%	0.48	S	S	.	.	S	Bend	trans	-110.2	142	167.2	-70.4	160.5	0	0	0	108.9	A612	A612-L615 PolarHBondContact O-N 2.82Å
616	P	30.9	Very low	51.7	Low	105 Å²	105	86 Å²	86	68%	0.682	50%	0.497	S	S	*	.			trans	-59.6	137.8	167.9	-19.8	32.5	0	0	0	110.2	S618	P616-S618 PolarHBondContact O-N 3.34Å
617	S	29.8	Very low	50.5	Low	138 Å²	138	86.2 Å²	86.2	97%	0.965	50%	0.5	S	S	*	.	S	Bend	trans	-72.5	27.4	-178.3	-52.2	0	0	0	0	114.7
618	S	37.8	Very low	49.5	Very low	90 Å²	90	89.6 Å²	89.6	63%	0.629	52%	0.518	S	S	*	.	S	Bend	trans	-118.9	113.1	175.3	57.4	0	0	0	0	109.6	P616	P616-S618 PolarHBondContact O-N 3.34Å
619	Q	37.6	Very low	48.6	Very low	171 Å²	171	91.6 Å²	91.6	80%	0.799	53%	0.53	S	S	*	.			trans	76.4	99.8	167.9	-153.5	163.9	-1.5	0	0	116.6	D621	Q619-D621 HydrophobicContact CG-CB 4.38Å; Q619-D621 PolarHBondContact O-N 2.88Å
620	L	45.1	Very low	49	Very low	174 Å²	174	90 Å²	90	91%	0.911	51%	0.514	S	S	*	.			trans	-68.3	71.9	164.3	-87.9	162.9	0	0	0	110.7
621	D	53.8	Low	49.5	Very low	36 Å²	36	87.8 Å²	87.8	19%	0.193	51%	0.506	C	S	.	.			trans	-133.2	114.6	167.7	-151.4	-26	0	0	0	112.2	Q619 L623 S624 R792	Q619-D621 HydrophobicContact CG-CB 4.38Å; Q619-D621 PolarHBondContact O-N 2.88Å; D621-L623 PolarHBondContact O-N 2.87Å; D621-L623 VanDerWaalsContact OD1-CB 3.28Å; D621-L623 WeakPolarHBondContact OD1-CB 3.31Å; D621-L623 VanDerWaalsContact OD1-CG 3.25Å; D621-L623 WeakPolarHBondContact OD1-CG 3.25Å; D621-L623 PolarHBondContact OD1-N 3.33Å; D621-S624 VanDerWaalsContact O-CB 3.31Å; D621-S624 WeakPolarHBondContact O-CB 3.25Å; D621-S624 PolarHBondContact O-N 2.68Å; D621-S624 PolarHBondContact O-OG 2.96Å; D621-R792 VanDerWaalsContact CG-NH2 3.29Å; D621-R792 IonicContact OD1-CZ 3.62Å; D621-R792 IonicContact OD1-NH2 2.69Å; D621-R792 PolarHBondContact OD1-NH2 3.06Å; D621-R792 IonicContact OD2-CZ 3.32Å; D621-R792 IonicContact OD2-NE 2.89Å; D621-R792 PolarHBondContact OD2-NE 3.46Å; D621-R792 IonicContact OD2-NH2 3.22Å; D621-R792 PolarHBondContact OD2-NH2 3.09Å; D621-R792 VanDerWaalsContact OD2-NH2 3.14Å
622	W	60.5	Low	50.5	Low	16 Å²	16	85.9 Å²	85.9	6%	0.061	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.3	173.6	41.2	-105.6	0	0	0	112.6	S624 F747 C749 M753 W754 A757	W622-S624 PolarHBondContact O-N 2.69Å; W622-F747 HydrophobicContact CB-CD1 4.42Å; W622-F747 HydrophobicContact CB-CD2 3.75Å; W622-F747 HydrophobicContact CB-CE1 4.41Å; W622-F747 HydrophobicContact CB-CE2 3.73Å; W622-F747 HydrophobicContact CB-CG 4.1Å; W622-F747 HydrophobicContact CB-CZ 4.08Å; W622-F747 HydrophobicContact CG-CD2 4.3Å; W622-F747 HydrophobicContact CG-CG 4.35Å; W622-C749 WeakPolarHBondContact CZ2-SG 3.43Å; W622-M753 HydrophobicContact CH2-CG 4Å; W622-M753 HydrophobicContact CZ2-CG 4.02Å; W622-W754 HydrophobicContact CB-CZ2 4.5Å; W622-W754 HydrophobicContact CD2-CH2 4.43Å; W622-W754 HydrophobicContact CD2-CZ2 4.24Å; W622-W754 HydrophobicContact CE3-CD2 4.06Å; W622-W754 AromaticContact CE3-CE2 3.78Å; W622-W754 HydrophobicContact CE3-CE3 4.01Å; W622-W754 AromaticContact CE3-CH2 3.44Å; W622-W754 HydrophobicContact CE3-CH2 3.44Å; W622-W754 VanDerWaalsContact CE3-CH2 3.44Å; W622-W754 AromaticContact CE3-CZ2 3.45Å; W622-W754 HydrophobicContact CE3-CZ2 3.45Å; W622-W754 VanDerWaalsContact CE3-CZ2 3.45Å; W622-W754 AromaticContact CE3-CZ3 3.73Å; W622-W754 HydrophobicContact CE3-CZ3 3.73Å; W622-W754 AromaticContact CZ3-CD2 3.6Å; W622-W754 HydrophobicContact CZ3-CD2 3.6Å; W622-W754 AromaticContact CZ3-CE2 3.72Å; W622-W754 AromaticContact CZ3-CE3 3.68Å; W622-W754 HydrophobicContact CZ3-CE3 3.68Å; W622-W754 HydrophobicContact CZ3-CG 4.18Å; W622-W754 AromaticContact CZ3-CH2 4Å; W622-W754 HydrophobicContact CZ3-CH2 4Å; W622-W754 AromaticContact CZ3-CZ2 3.9Å; W622-W754 HydrophobicContact CZ3-CZ2 3.9Å; W622-W754 AromaticContact CZ3-CZ3 3.89Å; W622-W754 HydrophobicContact CZ3-CZ3 3.89Å; W622-W754 WeakPolarHBondContact O-CH2 3.49Å; W622-A757 HydrophobicContact CH2-CB 3.25Å; W622-A757 HydrophobicContact CZ2-CB 4.19Å; W622-A757 HydrophobicContact CZ3-CB 3.65Å
623	L	59.4	Low	51.6	Low	38 Å²	38	82.6 Å²	82.6	20%	0.199	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.5	169	-61.2	-174.1	0	0	0	114.9	D621 L625 W754 A757 L758	D621-L623 PolarHBondContact O-N 2.87Å; D621-L623 VanDerWaalsContact OD1-CB 3.28Å; D621-L623 WeakPolarHBondContact OD1-CB 3.31Å; D621-L623 VanDerWaalsContact OD1-CG 3.25Å; D621-L623 WeakPolarHBondContact OD1-CG 3.25Å; D621-L623 PolarHBondContact OD1-N 3.33Å; L623-L625 PolarHBondContact O-N 2.73Å; L623-W754 HydrophobicContact CD2-CE3 4.14Å; L623-W754 HydrophobicContact CD2-CZ3 3.81Å; L623-A757 HydrophobicContact CD2-CB 4.27Å; L623-L758 HydrophobicContact CD1-CD2 3.98Å; L623-L758 HydrophobicContact CD1-CG 4.41Å; L623-L758 HydrophobicContact CD2-CD1 3.93Å; L623-L758 HydrophobicContact CD2-CD2 3.76Å; L623-L758 HydrophobicContact CD2-CG 3.61Å; L623-L758 HydrophobicContact CG-CD2 4.4Å
624	S	55	Low	53.4	Low	90 Å²	90	77.9 Å²	77.9	63%	0.629	43%	0.433	S	S	*	.			trans	-72.4	35.4	-177.1	84	0	0	0	0	114.6	D621 W622	D621-S624 VanDerWaalsContact O-CB 3.31Å; D621-S624 WeakPolarHBondContact O-CB 3.25Å; D621-S624 PolarHBondContact O-N 2.68Å; D621-S624 PolarHBondContact O-OG 2.96Å; W622-S624 PolarHBondContact O-N 2.69Å
625	L	58.7	Low	54.8	Low	45 Å²	45	76.5 Å²	76.5	24%	0.236	42%	0.417	C	S	.	.			trans	-108.9	143	-171.3	-70.7	174.8	0	0	0	111.9	L623 D627 F630 M704 W754	L623-L625 PolarHBondContact O-N 2.73Å; L625-D627 PolarHBondContact O-N 2.9Å; L625-F630 HydrophobicContact CB-CE1 4.25Å; L625-F630 HydrophobicContact CB-CE2 3.7Å; L625-F630 HydrophobicContact CB-CZ 3.5Å; L625-F630 VanDerWaalsContact CB-CZ 3.5Å; L625-F630 HydrophobicContact CD1-CE1 3.83Å; L625-F630 HydrophobicContact CD1-CZ 3.57Å; L625-F630 HydrophobicContact CG-CZ 4.17Å; L625-M704 HydrophobicContact CD1-CE 3.68Å; L625-W754 HydrophobicContact CD1-CH2 4.04Å
626	D	60.7	Low	56	Low	66 Å²	66	76.4 Å²	76.4	35%	0.353	41%	0.414	S	S	.	.			trans	-73.9	117.4	-178.3	169.3	22.3	0	0	0	111.6	N628 Q629 F630	D626-N628 PolarHBondContact O-N 2.74Å; D626-N628 VanDerWaalsContact OD1-CB 3.27Å; D626-N628 WeakPolarHBondContact OD1-CB 3.34Å; D626-N628 PolarHBondContact OD1-N 3.36Å; D626-N628 PolarHBondContact OD1-ND2 3.46Å; D626-Q629 HydrophobicContact CB-CB 4.44Å; D626-Q629 HydrophobicContact CB-CG 4.17Å; D626-Q629 WeakPolarHBondContact O-CA 3.46Å; D626-Q629 WeakPolarHBondContact O-CB 3.13Å; D626-Q629 PolarHBondContact O-N 2.99Å; D626-Q629 PolarHBondContact OD2-NE2 2.77Å; D626-F630 PolarHBondContact O-N 2.74Å
627	D	65.2	Low	57.7	Low	67 Å²	67	72.3 Å²	72.3	36%	0.358	39%	0.385	S	S	.	.	H	α-helix	trans	-43.8	-35.7	170.9	-118.4	10.2	0	0	0	113.9	L625 R631 Q713	L625-D627 PolarHBondContact O-N 2.9Å; D627-R631 WeakPolarHBondContact O-CB 3.22Å; D627-R631 WeakPolarHBondContact O-CD 3.35Å; D627-R631 VanDerWaalsContact O-CG 3.23Å; D627-R631 WeakPolarHBondContact O-CG 3.36Å; D627-R631 PolarHBondContact O-N 2.91Å; D627-R631 IonicContact OD1-NH2 3.86Å; D627-R631 PolarHBondContact OD1-NH2 3.26Å; D627-R631 IonicContact OD2-CZ 3.02Å; D627-R631 VanDerWaalsContact OD2-CZ 3.27Å; D627-R631 IonicContact OD2-NH1 3.01Å; D627-R631 PolarHBondContact OD2-NH1 2.9Å; D627-R631 IonicContact OD2-NH2 3.82Å; D627-R631 PolarHBondContact OD2-NH2 3.39Å; D627-Q713 PolarHBondContact OD1-NE2 3.48Å
628	N	64.8	Low	59.6	Low	73 Å²	73	66.4 Å²	66.4	39%	0.39	34%	0.343	S	S	.	.	H	α-helix	trans	-70.1	-33.6	177.9	-64.6	-95.9	0	0	0	112.1	D626 M632 K1074	D626-N628 PolarHBondContact O-N 2.74Å; D626-N628 VanDerWaalsContact OD1-CB 3.27Å; D626-N628 WeakPolarHBondContact OD1-CB 3.34Å; D626-N628 PolarHBondContact OD1-N 3.36Å; D626-N628 PolarHBondContact OD1-ND2 3.46Å; N628-M632 VanDerWaalsContact O-CG 3.27Å; N628-M632 WeakPolarHBondContact O-CG 3.42Å; N628-M632 PolarHBondContact O-N 2.74Å; N628-M632 VanDerWaalsContact O-N 3.12Å; N628-K1074 PolarHBondContact OD1-NZ 2.79Å
629	Q	62.4	Low	60.7	Low	119 Å²	119	65.3 Å²	65.3	56%	0.556	33%	0.328	S	S	*	.	H	α-helix	trans	-69.2	-53	177.3	-70.5	172.2	53.5	0	0	109.4	D626 R631 M632 S633	D626-Q629 HydrophobicContact CB-CB 4.44Å; D626-Q629 HydrophobicContact CB-CG 4.17Å; D626-Q629 WeakPolarHBondContact O-CA 3.46Å; D626-Q629 WeakPolarHBondContact O-CB 3.13Å; D626-Q629 PolarHBondContact O-N 2.99Å; D626-Q629 PolarHBondContact OD2-NE2 2.77Å; Q629-R631 VanDerWaalsContact C-N 3.26Å; Q629-R631 PolarHBondContact O-N 3.14Å; Q629-M632 CarbonylContact O-C 3.53Å; Q629-M632 WeakPolarHBondContact O-CA 3.36Å; Q629-M632 PolarHBondContact O-N 3.09Å; Q629-S633 PolarHBondContact O-N 3.05Å; Q629-S633 PolarHBondContact O-OG 3.44Å
630	F	68	Low	61.8	Low	16 Å²	16	59.3 Å²	59.3	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-48.7	-46.9	175.3	-69.4	-47.9	0	0	0	112.7	L625 D626 M632 S633 I634 M704 L709 Q713 W754	L625-F630 HydrophobicContact CB-CE1 4.25Å; L625-F630 HydrophobicContact CB-CE2 3.7Å; L625-F630 HydrophobicContact CB-CZ 3.5Å; L625-F630 VanDerWaalsContact CB-CZ 3.5Å; L625-F630 HydrophobicContact CD1-CE1 3.83Å; L625-F630 HydrophobicContact CD1-CZ 3.57Å; L625-F630 HydrophobicContact CG-CZ 4.17Å; D626-F630 PolarHBondContact O-N 2.74Å; F630-M632 PolarHBondContact O-N 3.39Å; F630-S633 WeakPolarHBondContact O-CB 3.48Å; F630-S633 PolarHBondContact O-N 3.49Å; F630-I634 VanDerWaalsContact O-CG1 3.31Å; F630-I634 WeakPolarHBondContact O-CG1 3.48Å; F630-I634 PolarHBondContact O-N 3.12Å; F630-M704 HydrophobicContact CE1-CE 4.19Å; F630-M704 HydrophobicContact CE1-SD 3.87Å; F630-L709 HydrophobicContact CD1-CD2 3.61Å; F630-L709 HydrophobicContact CE1-CD2 4.21Å; F630-Q713 HydrophobicContact CB-CG 4.1Å; F630-W754 HydrophobicContact CZ-CH2 4.27Å; F630-W754 AromaticContact CZ-CZ3 3.93Å; F630-W754 HydrophobicContact CZ-CZ3 3.93Å
631	R	66.1	Low	62.5	Low	101 Å²	101	52 Å²	52	38%	0.381	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-38	179	-70.1	169.6	-172.5	151.1	15.5	112.9	D627 Q629 L635 Q713	D627-R631 WeakPolarHBondContact O-CB 3.22Å; D627-R631 WeakPolarHBondContact O-CD 3.35Å; D627-R631 VanDerWaalsContact O-CG 3.23Å; D627-R631 WeakPolarHBondContact O-CG 3.36Å; D627-R631 PolarHBondContact O-N 2.91Å; D627-R631 IonicContact OD1-NH2 3.86Å; D627-R631 PolarHBondContact OD1-NH2 3.26Å; D627-R631 IonicContact OD2-CZ 3.02Å; D627-R631 VanDerWaalsContact OD2-CZ 3.27Å; D627-R631 IonicContact OD2-NH1 3.01Å; D627-R631 PolarHBondContact OD2-NH1 2.9Å; D627-R631 IonicContact OD2-NH2 3.82Å; D627-R631 PolarHBondContact OD2-NH2 3.39Å; Q629-R631 VanDerWaalsContact C-N 3.26Å; Q629-R631 PolarHBondContact O-N 3.14Å; R631-L635 VanDerWaalsContact O-CG 3.3Å; R631-L635 WeakPolarHBondContact O-CG 3.24Å; R631-L635 PolarHBondContact O-N 3.27Å; R631-Q713 VanDerWaalsContact CZ-OE1 3.3Å
632	M	58.7	Low	62.8	Low	79 Å²	79	54.4 Å²	54.4	39%	0.389	27%	0.271	S	S	.	.	H	α-helix	trans	-70.3	-37.2	173.4	-69	-58.7	-53.7	0	0	112.1	N628 Q629 F630 L635 E636 Y1078	N628-M632 VanDerWaalsContact O-CG 3.27Å; N628-M632 WeakPolarHBondContact O-CG 3.42Å; N628-M632 PolarHBondContact O-N 2.74Å; N628-M632 VanDerWaalsContact O-N 3.12Å; Q629-M632 CarbonylContact O-C 3.53Å; Q629-M632 WeakPolarHBondContact O-CA 3.36Å; Q629-M632 PolarHBondContact O-N 3.09Å; F630-M632 PolarHBondContact O-N 3.39Å; M632-L635 PolarHBondContact O-N 3.07Å; M632-E636 WeakPolarHBondContact O-CB 3.41Å; M632-E636 PolarHBondContact O-N 3.31Å; M632-Y1078 HydrophobicContact CE-CE2 4.12Å
633	S	65.3	Low	62.4	Low	4 Å²	4	58.7 Å²	58.7	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-42.5	177.1	-48.8	0	0	0	0	112.5	Q629 F630 E636 R637 H701	Q629-S633 PolarHBondContact O-N 3.05Å; Q629-S633 PolarHBondContact O-OG 3.44Å; F630-S633 WeakPolarHBondContact O-CB 3.48Å; F630-S633 PolarHBondContact O-N 3.49Å; S633-E636 PolarHBondContact O-N 3.3Å; S633-R637 WeakPolarHBondContact O-CG 3.26Å; S633-R637 PolarHBondContact O-N 3.36Å; S633-H701 WeakPolarHBondContact CB-NE2 3.25Å; S633-H701 PolarHBondContact OG-CD2 3.33Å; S633-H701 PolarHBondContact OG-NE2 3.23Å
634	I	71.6	Confident	62.1	Low	9 Å²	9	60.2 Å²	60.2	5%	0.046	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-47.6	175.3	-67.3	165	0	0	0	109.9	F630 R637 L638 L706 L709 Q713 Y715 L718	F630-I634 VanDerWaalsContact O-CG1 3.31Å; F630-I634 WeakPolarHBondContact O-CG1 3.48Å; F630-I634 PolarHBondContact O-N 3.12Å; I634-R637 PolarHBondContact O-N 3.27Å; I634-L638 HydrophobicContact CG2-CD1 3.74Å; I634-L638 HydrophobicContact CG2-CG 4.43Å; I634-L638 WeakPolarHBondContact O-CB 3.39Å; I634-L638 VanDerWaalsContact O-CG 3.29Å; I634-L638 WeakPolarHBondContact O-CG 3.34Å; I634-L638 PolarHBondContact O-N 3.43Å; I634-L706 HydrophobicContact CG2-CD1 4.3Å; I634-L709 HydrophobicContact CD1-CB 4.04Å; I634-L709 HydrophobicContact CG1-CB 3.56Å; I634-L709 HydrophobicContact CG1-CD1 4.3Å; I634-L709 HydrophobicContact CG1-CG 4.5Å; I634-Q713 HydrophobicContact CD1-CB 4.46Å; I634-Q713 HydrophobicContact CD1-CG 4.05Å; I634-Y715 HydrophobicContact CD1-CD2 4.04Å; I634-Y715 HydrophobicContact CD1-CE2 3.8Å; I634-L718 HydrophobicContact CG2-CD2 3.95Å
635	L	64.9	Low	62	Low	72 Å²	72	59.6 Å²	59.6	38%	0.377	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-41.6	178.8	-69.6	170.1	0	0	0	112.4	R631 M632 L638 E639 L675	R631-L635 VanDerWaalsContact O-CG 3.3Å; R631-L635 WeakPolarHBondContact O-CG 3.24Å; R631-L635 PolarHBondContact O-N 3.27Å; M632-L635 PolarHBondContact O-N 3.07Å; L635-L638 PolarHBondContact O-N 3.07Å; L635-E639 WeakPolarHBondContact O-CB 3.3Å; L635-E639 PolarHBondContact O-N 3.41Å; L635-L675 HydrophobicContact CD2-CD2 4.41Å
636	E	60.3	Low	61.7	Low	95 Å²	95	60.2 Å²	60.2	44%	0.444	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-44.7	177.8	-178.4	173.9	-118.4	0	0	111.9	M632 S633 Q640	M632-E636 WeakPolarHBondContact O-CB 3.41Å; M632-E636 PolarHBondContact O-N 3.31Å; S633-E636 PolarHBondContact O-N 3.3Å; E636-Q640 WeakPolarHBondContact O-CB 3.24Å; E636-Q640 PolarHBondContact O-N 2.99Å
637	R	67.1	Low	61.1	Low	19 Å²	19	62.9 Å²	62.9	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-70.7	-37.2	178	-68.3	-168	-155.3	-162.4	13.8	112.9	S633 I634 Q640 M641 M704 L706 E738	S633-R637 WeakPolarHBondContact O-CG 3.26Å; S633-R637 PolarHBondContact O-N 3.36Å; I634-R637 PolarHBondContact O-N 3.27Å; R637-Q640 PolarHBondContact O-N 3.05Å; R637-M641 WeakPolarHBondContact O-CB 3.48Å; R637-M641 PolarHBondContact O-N 3.33Å; R637-M704 VanDerWaalsContact CZ-O 3.22Å; R637-M704 PolarHBondContact NH1-O 3.05Å; R637-M704 PolarHBondContact NH2-O 3.13Å; R637-L706 HydrophobicContact CB-CD1 4.28Å; R637-E738 IonicContact CZ-OE1 3.38Å; R637-E738 IonicContact CZ-OE2 2.7Å; R637-E738 VanDerWaalsContact NH1-CD 3.27Å; R637-E738 IonicContact NH1-OE1 2.74Å; R637-E738 PolarHBondContact NH1-OE1 3.35Å; R637-E738 IonicContact NH1-OE2 3.52Å; R637-E738 PolarHBondContact NH1-OE2 3.3Å
638	L	69	Low	60.1	Low	15 Å²	15	64 Å²	64	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-43.5	173.9	-71.2	172.9	0	0	0	111.4	I634 L635 Q640 M641 E642 L675 L706 L718	I634-L638 HydrophobicContact CG2-CD1 3.74Å; I634-L638 HydrophobicContact CG2-CG 4.43Å; I634-L638 WeakPolarHBondContact O-CB 3.39Å; I634-L638 VanDerWaalsContact O-CG 3.29Å; I634-L638 WeakPolarHBondContact O-CG 3.34Å; I634-L638 PolarHBondContact O-N 3.43Å; L635-L638 PolarHBondContact O-N 3.07Å; L638-Q640 PolarHBondContact O-N 3.08Å; L638-M641 PolarHBondContact O-N 2.97Å; L638-E642 VanDerWaalsContact O-CB 3.27Å; L638-E642 WeakPolarHBondContact O-CB 3.41Å; L638-E642 PolarHBondContact O-N 3.49Å; L638-L675 HydrophobicContact CB-CD2 4.35Å; L638-L675 HydrophobicContact CD1-CD2 3.9Å; L638-L706 HydrophobicContact CD2-CD2 3.93Å; L638-L706 HydrophobicContact CG-CD1 4.35Å; L638-L718 HydrophobicContact CD1-CD1 4.37Å; L638-L718 HydrophobicContact CD2-CD1 4.48Å
639	E	61.6	Low	59.3	Low	67 Å²	67	63.3 Å²	63.3	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-32	173.4	-157.8	-159.5	118.4	0	0	111.1	L635 R643 K1082	L635-E639 WeakPolarHBondContact O-CB 3.3Å; L635-E639 PolarHBondContact O-N 3.41Å; E639-R643 VanDerWaalsContact CD-NH2 3.25Å; E639-R643 WeakPolarHBondContact O-CB 3.35Å; E639-R643 VanDerWaalsContact O-CG 3.29Å; E639-R643 WeakPolarHBondContact O-CG 3.41Å; E639-R643 VanDerWaalsContact O-CZ 3.29Å; E639-R643 PolarHBondContact O-N 3.43Å; E639-R643 VanDerWaalsContact O-N 3.09Å; E639-R643 PolarHBondContact O-NE 2.89Å; E639-R643 IonicContact OE1-CZ 2.76Å; E639-R643 VanDerWaalsContact OE1-CZ 3.29Å; E639-R643 IonicContact OE1-NE 2.67Å; E639-R643 PolarHBondContact OE1-NE 3.37Å; E639-R643 IonicContact OE1-NH2 3.76Å; E639-R643 PolarHBondContact OE1-NH2 3.1Å; E639-K1082 IonicContact OE1-NZ 2.75Å; E639-K1082 PolarHBondContact OE1-NZ 3.42Å; E639-K1082 IonicContact OE2-NZ 3.17Å; E639-K1082 PolarHBondContact OE2-NZ 3Å
640	Q	59.2	Low	58.4	Low	45 Å²	45	61.3 Å²	61.3	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-74.3	-38.3	175.4	-178.1	173.2	-15	0	0	113.5	E636 R637 L638 R644 L695	E636-Q640 WeakPolarHBondContact O-CB 3.24Å; E636-Q640 PolarHBondContact O-N 2.99Å; R637-Q640 PolarHBondContact O-N 3.05Å; L638-Q640 PolarHBondContact O-N 3.08Å; Q640-R644 WeakPolarHBondContact O-CG 3.35Å; Q640-R644 PolarHBondContact O-N 3.34Å; Q640-L695 HydrophobicContact CG-CD2 4.22Å
641	M	61.1	Low	57.3	Low	21 Å²	21	70.6 Å²	70.6	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-69.2	-46.5	174.4	-162.6	72.9	78.4	0	0	110.7	R637 L638 R643 R644 M645 L695 L735	R637-M641 WeakPolarHBondContact O-CB 3.48Å; R637-M641 PolarHBondContact O-N 3.33Å; L638-M641 PolarHBondContact O-N 2.97Å; M641-R643 PolarHBondContact O-N 2.85Å; M641-R644 PolarHBondContact O-N 3.32Å; M641-M645 HydrophobicContact CG-CE 3.98Å; M641-M645 HydrophobicContact CG-SD 4.31Å; M641-M645 WeakPolarHBondContact O-CG 3.43Å; M641-M645 PolarHBondContact O-N 2.93Å; M641-L695 HydrophobicContact CE-CD1 3.63Å; M641-L695 HydrophobicContact SD-CD1 4.15Å; M641-L735 HydrophobicContact CE-CD1 3.68Å; M641-L735 HydrophobicContact SD-CD1 4.34Å
642	E	58.4	Low	55.9	Low	86 Å²	86	71.6 Å²	71.6	40%	0.402	36%	0.36	S	S	.	.	H	α-helix	trans	-55.4	-50	175.7	-178	-175.3	-168.8	0	0	111.5	L638 R644 M645 A646	L638-E642 VanDerWaalsContact O-CB 3.27Å; L638-E642 WeakPolarHBondContact O-CB 3.41Å; L638-E642 PolarHBondContact O-N 3.49Å; E642-R644 VanDerWaalsContact C-N 3.32Å; E642-R644 PolarHBondContact O-N 3.11Å; E642-M645 PolarHBondContact O-N 3.31Å; E642-A646 WeakPolarHBondContact O-CB 3.46Å; E642-A646 PolarHBondContact O-N 3.47Å
643	R	52.6	Low	55	Low	106 Å²	106	71.1 Å²	71.1	40%	0.4	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-41.9	177.2	-79.6	-173.5	-98.2	93.3	-1.9	112.2	E639 M641 A646 E647	E639-R643 VanDerWaalsContact CD-NH2 3.25Å; E639-R643 WeakPolarHBondContact O-CB 3.35Å; E639-R643 VanDerWaalsContact O-CG 3.29Å; E639-R643 WeakPolarHBondContact O-CG 3.41Å; E639-R643 VanDerWaalsContact O-CZ 3.29Å; E639-R643 PolarHBondContact O-N 3.43Å; E639-R643 VanDerWaalsContact O-N 3.09Å; E639-R643 PolarHBondContact O-NE 2.89Å; E639-R643 IonicContact OE1-CZ 2.76Å; E639-R643 VanDerWaalsContact OE1-CZ 3.29Å; E639-R643 IonicContact OE1-NE 2.67Å; E639-R643 PolarHBondContact OE1-NE 3.37Å; E639-R643 IonicContact OE1-NH2 3.76Å; E639-R643 PolarHBondContact OE1-NH2 3.1Å; M641-R643 PolarHBondContact O-N 2.85Å; R643-A646 PolarHBondContact O-N 3.28Å; R643-E647 WeakPolarHBondContact O-CB 3.33Å; R643-E647 WeakPolarHBondContact O-CG 3.41Å; R643-E647 PolarHBondContact O-N 3.19Å
644	R	54.2	Low	53.4	Low	70 Å²	70	80.2 Å²	80.2	26%	0.264	41%	0.41	S	S	.	.	H	α-helix	trans	-67.3	-41.4	176.5	-77.6	178.2	164.9	-146.3	-4.8	113.5	Q640 M641 E642 A646 E647 M648 G693 D734	Q640-R644 WeakPolarHBondContact O-CG 3.35Å; Q640-R644 PolarHBondContact O-N 3.34Å; M641-R644 PolarHBondContact O-N 3.32Å; E642-R644 VanDerWaalsContact C-N 3.32Å; E642-R644 PolarHBondContact O-N 3.11Å; R644-A646 VanDerWaalsContact C-N 3.33Å; R644-E647 PolarHBondContact O-N 3.06Å; R644-M648 WeakPolarHBondContact O-CG 3.17Å; R644-M648 PolarHBondContact O-N 3.22Å; R644-G693 PolarHBondContact NH1-O 3.36Å; R644-G693 PolarHBondContact NH2-O 2.79Å; R644-D734 IonicContact CZ-OD2 3.48Å; R644-D734 IonicContact NH1-OD2 3.6Å; R644-D734 PolarHBondContact NH1-OD2 2.96Å
645	M	52.4	Low	51.6	Low	77 Å²	77	84.6 Å²	84.6	38%	0.379	44%	0.441	S	S	.	.	H	α-helix	trans	-64.7	-39.5	176.7	-68.1	-175.5	-61.8	0	0	111.2	M641 E642 M648 A649 W725	M641-M645 HydrophobicContact CG-CE 3.98Å; M641-M645 HydrophobicContact CG-SD 4.31Å; M641-M645 WeakPolarHBondContact O-CG 3.43Å; M641-M645 PolarHBondContact O-N 2.93Å; E642-M645 PolarHBondContact O-N 3.31Å; M645-M648 HydrophobicContact CG-CE 4.3Å; M645-M648 PolarHBondContact O-N 2.91Å; M645-A649 WeakPolarHBondContact O-CB 3.36Å; M645-A649 PolarHBondContact O-N 3.37Å; M645-W725 HydrophobicContact CE-CH2 4.44Å
646	A	51.6	Low	50.1	Low	58 Å²	58	86.7 Å²	86.7	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-67.1	-39.5	172.5	0	0	0	0	0	113	E642 R643 R644 M648 A649 A650	E642-A646 WeakPolarHBondContact O-CB 3.46Å; E642-A646 PolarHBondContact O-N 3.47Å; R643-A646 PolarHBondContact O-N 3.28Å; R644-A646 VanDerWaalsContact C-N 3.33Å; A646-M648 VanDerWaalsContact C-N 3.28Å; A646-M648 PolarHBondContact O-N 3.31Å; A646-A649 PolarHBondContact O-N 3.24Å; A646-A650 VanDerWaalsContact O-CB 3.23Å; A646-A650 WeakPolarHBondContact O-CB 3.01Å; A646-A650 PolarHBondContact O-N 2.83Å
647	E	49	Very low	49	Very low	121 Å²	121	85.2 Å²	85.2	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-65.9	-26.8	174.9	-77.5	163.5	-165.4	0	0	113	R643 R644 R651	R643-E647 WeakPolarHBondContact O-CB 3.33Å; R643-E647 WeakPolarHBondContact O-CG 3.41Å; R643-E647 PolarHBondContact O-N 3.19Å; R644-E647 PolarHBondContact O-N 3.06Å; E647-R651 WeakPolarHBondContact O-CD 3.37Å; E647-R651 WeakPolarHBondContact O-CG 3.15Å
648	M	44.7	Very low	47.3	Very low	91 Å²	91	90.2 Å²	90.2	45%	0.448	50%	0.502	S	S	.	.	H	α-helix	trans	-76.4	-54.4	169.8	-69.3	-175.7	-63.7	0	0	110.8	R644 M645 A646 A650 R651	R644-M648 WeakPolarHBondContact O-CG 3.17Å; R644-M648 PolarHBondContact O-N 3.22Å; M645-M648 HydrophobicContact CG-CE 4.3Å; M645-M648 PolarHBondContact O-N 2.91Å; A646-M648 VanDerWaalsContact C-N 3.28Å; A646-M648 PolarHBondContact O-N 3.31Å; M648-A650 PolarHBondContact O-N 2.77Å; M648-A650 VanDerWaalsContact O-N 3.15Å; M648-R651 WeakPolarHBondContact O-CB 3.38Å; M648-R651 PolarHBondContact O-N 2.94Å
649	A	47.6	Very low	45.7	Very low	59 Å²	59	97.7 Å²	97.7	49%	0.488	53%	0.533	S	S	.	.	H	α-helix	trans	-57.6	-32.7	-179.3	0	0	0	0	0	113.8	M645 A646 R651	M645-A649 WeakPolarHBondContact O-CB 3.36Å; M645-A649 PolarHBondContact O-N 3.37Å; A646-A649 PolarHBondContact O-N 3.24Å; A649-R651 PolarHBondContact O-N 2.69Å
650	A	44.1	Very low	44.4	Very low	76 Å²	76	100.1 Å²	100.1	63%	0.628	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.5	177.4	0	0	0	0	0	114.5	A646 M648	A646-A650 VanDerWaalsContact O-CB 3.23Å; A646-A650 WeakPolarHBondContact O-CB 3.01Å; A646-A650 PolarHBondContact O-N 2.83Å; M648-A650 PolarHBondContact O-N 2.77Å; M648-A650 VanDerWaalsContact O-N 3.15Å
651	R	43.4	Very low	43	Very low	212 Å²	212	101.7 Å²	101.7	80%	0.8	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-21.4	179.7	-67.4	171.7	69.1	172.8	-0.3	113	E647 M648 A649 G653	E647-R651 WeakPolarHBondContact O-CD 3.37Å; E647-R651 WeakPolarHBondContact O-CG 3.15Å; M648-R651 WeakPolarHBondContact O-CB 3.38Å; M648-R651 PolarHBondContact O-N 2.94Å; A649-R651 PolarHBondContact O-N 2.69Å; R651-G653 VanDerWaalsContact C-N 3.35Å
652	D	38.2	Very low	41.4	Very low	122 Å²	122	103.7 Å²	103.7	65%	0.652	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	14.7	-178.2	-58.6	-28.3	0	0	0	113	W654	D652-W654 VanDerWaalsContact C-N 3.35Å; D652-W654 PolarHBondContact O-N 3.28Å
653	G	39.6	Very low	40.4	Very low	69 Å²	69	104.2 Å²	104.2	71%	0.711	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.3	2.5	165.8	0	0	0	0	0	117	R651	R651-G653 VanDerWaalsContact C-N 3.35Å
654	W	31.3	Very low	39.3	Very low	195 Å²	195	110.3 Å²	110.3	74%	0.739	62%	0.62	S	S	*	*			trans	-78.5	122.8	178.4	-162.4	-49.7	0	0	0	111.5	D652 P656	D652-W654 VanDerWaalsContact C-N 3.35Å; D652-W654 PolarHBondContact O-N 3.28Å; W654-P656 WeakPolarHBondContact O-CD 3.39Å
655	S	32.8	Very low	38.3	Very low	101 Å²	101	118 Å²	118	71%	0.706	65%	0.649	S	S	*	*			trans	-93.6	110.8	168.7	51.1	0	0	0	0	111.1	G657	S655-G657 PolarHBondContact O-N 2.88Å
656	P	33.8	Very low	37.2	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	67%	0.669	S	S	*	*			trans	-73.7	90.4	-174.2	-20	35.1	0	0	0	112.5	W654	W654-P656 WeakPolarHBondContact O-CD 3.39Å
657	G	36.7	Very low	36.4	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	69%	0.688	S	S	*	*			trans	-62	151.7	170.4	0	0	0	0	0	112.6	S655	S655-G657 PolarHBondContact O-N 2.88Å
658	V	32.3	Very low	35.9	Very low	124 Å²	124	127.1 Å²	127.1	75%	0.752	70%	0.699	S	S	*	*	S	Bend	trans	79.5	95.9	169.9	-166.8	0	0	0	0	117.1	I660	V658-I660 PolarHBondContact O-N 3.21Å
659	K	36.2	Very low	35.5	Very low	172 Å²	172	125.7 Å²	125.7	75%	0.748	71%	0.707	S	S	*	*	S	Bend	trans	78.4	7.5	140.1	-64.5	176	-176.5	174.2	0	122.7	A661 A662	K659-A661 PolarHBondContact O-N 2.95Å; K659-A662 PolarHBondContact O-N 3.19Å
660	I	33.5	Very low	35	Very low	117 Å²	117	126.6 Å²	126.6	60%	0.6	71%	0.708	S	S	*	*	H	α-helix	trans	-61.6	-30	164.5	-65.1	179.6	0	0	0	111.9	V658 A662 V663 F682	V658-I660 PolarHBondContact O-N 3.21Å; I660-A662 PolarHBondContact O-N 3.13Å; I660-A662 VanDerWaalsContact O-N 3.14Å; I660-V663 PolarHBondContact O-N 3.05Å; I660-F682 HydrophobicContact CD1-CZ 4.2Å
661	A	28.8	Very low	34.6	Very low	78 Å²	78	124.7 Å²	124.7	65%	0.645	70%	0.695	S	S	*	*	H	α-helix	trans	-60.6	-23	178.9	0	0	0	0	0	114.9	K659	K659-A661 PolarHBondContact O-N 2.95Å
662	A	28.8	Very low	34.5	Very low	64 Å²	64	118.5 Å²	118.5	53%	0.529	68%	0.683	S	S	.	*	H	α-helix	trans	-70.7	-36	-177.1	0	0	0	0	0	112.9	K659 I660	K659-A662 PolarHBondContact O-N 3.19Å; I660-A662 PolarHBondContact O-N 3.13Å; I660-A662 VanDerWaalsContact O-N 3.14Å
663	V	36.6	Very low	34.6	Very low	96 Å²	96	121.3 Å²	121.3	58%	0.582	69%	0.689	S	S	*	*	H	α-helix	trans	-70.6	-38.2	178.4	-178.1	0	0	0	0	110.5	I660 R665 R666	I660-V663 PolarHBondContact O-N 3.05Å; V663-R665 PolarHBondContact O-N 3.32Å; V663-R666 PolarHBondContact O-N 2.74Å; V663-R666 VanDerWaalsContact O-N 3.15Å
664	R	30.7	Very low	34.6	Very low	234 Å²	234	122.3 Å²	122.3	88%	0.883	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-14.4	-179.8	-163	169.2	-177.6	158.8	-1.4	114
665	R	31.4	Very low	35.2	Very low	233 Å²	233	114.5 Å²	114.5	88%	0.879	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-1	178.7	-142.1	-173.1	-78.3	-158.1	-1	114.3	V663	V663-R665 PolarHBondContact O-N 3.32Å
666	R	30.8	Very low	35.9	Very low	210 Å²	210	111.4 Å²	111.4	79%	0.792	62%	0.623	S	S	*	*	S	Bend	trans	-116.6	115.7	168.8	-91.9	-176.7	-92.5	-149.4	-4.6	110.7	V663 L668	V663-R666 PolarHBondContact O-N 2.74Å; V663-R666 VanDerWaalsContact O-N 3.15Å; R666-L668 PolarHBondContact O-N 2.94Å
667	G	35.3	Very low	36.3	Very low	86 Å²	86	111.2 Å²	111.2	89%	0.887	62%	0.615	S	S	*	*			trans	-73.5	37	-165.8	0	0	0	0	0	117.8
668	L	36.9	Very low	36.4	Very low	151 Å²	151	110.8 Å²	110.8	79%	0.791	60%	0.6	S	S	*	*			trans	-81.4	130.1	163.1	-86.5	69.4	0	0	0	108.6	R666	R666-L668 PolarHBondContact O-N 2.94Å
669	G	36.4	Very low	36.9	Very low	60 Å²	60	106.6 Å²	106.6	62%	0.619	57%	0.573	S	S	*	*			trans	-68.3	142.9	165	0	0	0	0	0	109.9	G671	G669-G671 PolarHBondContact O-N 3.45Å
670	P	38.2	Very low	37.1	Very low	79 Å²	79	108 Å²	108	51%	0.513	57%	0.574	S	S	.	*			trans	-66.5	111.3	-179.9	26.9	-33.5	0	0	0	110.4	Q674 L675	P670-Q674 HydrophobicContact CB-CB 4.23Å; P670-Q674 HydrophobicContact CB-CG 4.48Å; P670-L675 HydrophobicContact CB-CD1 4.48Å
671	G	35.7	Very low	37.1	Very low	35 Å²	35	105.4 Å²	105.4	36%	0.361	58%	0.575	S	S	.	*			trans	-65.4	162.9	161	0	0	0	0	0	110.4	G669 K673 Q674 L675	G669-G671 PolarHBondContact O-N 3.45Å; G671-K673 PolarHBondContact O-N 3.28Å; G671-K673 VanDerWaalsContact O-N 3.16Å; G671-Q674 WeakPolarHBondContact O-CA 3.22Å; G671-Q674 VanDerWaalsContact O-CB 3.31Å; G671-Q674 WeakPolarHBondContact O-CB 3.4Å; G671-Q674 PolarHBondContact O-N 3.37Å; G671-L675 PolarHBondContact O-N 3.36Å
672	P	41.6	Very low	37.5	Very low	83 Å²	83	107 Å²	107	54%	0.539	57%	0.568	S	S	.	*	H	α-helix	trans	-57.2	-35.6	-176.9	20.7	-32	0	0	0	113.2	Q674 L675 L676	P672-Q674 VanDerWaalsContact C-N 3.35Å; P672-Q674 PolarHBondContact O-N 3.45Å; P672-L675 PolarHBondContact O-N 3.23Å; P672-L676 WeakPolarHBondContact O-CB 3.41Å; P672-L676 PolarHBondContact O-N 3.39Å
673	K	39.6	Very low	37.8	Very low	181 Å²	181	110 Å²	110	79%	0.787	58%	0.582	S	S	*	*	H	α-helix	trans	-65.5	-33.8	172.6	-63.1	-169.8	177.2	-170.2	0	113.2	G671 L677	G671-K673 PolarHBondContact O-N 3.28Å; G671-K673 VanDerWaalsContact O-N 3.16Å; K673-L677 PolarHBondContact O-N 3.32Å
674	Q	40.3	Very low	38	Very low	90 Å²	90	111 Å²	111	42%	0.421	58%	0.583	S	S	.	*	H	α-helix	trans	-73.7	-38.5	177.7	-160.1	73.5	46.2	0	0	111.5	P670 G671 P672 L677 V678	P670-Q674 HydrophobicContact CB-CB 4.23Å; P670-Q674 HydrophobicContact CB-CG 4.48Å; G671-Q674 WeakPolarHBondContact O-CA 3.22Å; G671-Q674 VanDerWaalsContact O-CB 3.31Å; G671-Q674 WeakPolarHBondContact O-CB 3.4Å; G671-Q674 PolarHBondContact O-N 3.37Å; P672-Q674 VanDerWaalsContact C-N 3.35Å; P672-Q674 PolarHBondContact O-N 3.45Å; Q674-L677 WeakPolarHBondContact O-CB 3.32Å; Q674-L677 PolarHBondContact O-N 3.13Å; Q674-V678 PolarHBondContact O-N 3.32Å; Q674-V678 VanDerWaalsContact O-N 3.12Å
675	L	42.8	Very low	38.1	Very low	31 Å²	31	109.1 Å²	109.1	16%	0.162	58%	0.582	C	S	.	*	H	α-helix	trans	-66.4	-41.5	175.2	-163.3	73	0	0	0	110.8	L635 L638 P670 G671 P672 L677 V678 L679	L635-L675 HydrophobicContact CD2-CD2 4.41Å; L638-L675 HydrophobicContact CB-CD2 4.35Å; L638-L675 HydrophobicContact CD1-CD2 3.9Å; P670-L675 HydrophobicContact CB-CD1 4.48Å; G671-L675 PolarHBondContact O-N 3.36Å; P672-L675 PolarHBondContact O-N 3.23Å; L675-L677 PolarHBondContact O-N 3.48Å; L675-V678 WeakPolarHBondContact O-CB 3.26Å; L675-V678 PolarHBondContact O-N 2.98Å; L675-V678 VanDerWaalsContact O-N 3.09Å; L675-L679 WeakPolarHBondContact O-CG 3.49Å; L675-L679 PolarHBondContact O-N 2.88Å
676	L	47	Very low	38.1	Very low	36 Å²	36	103.3 Å²	103.3	19%	0.188	57%	0.572	C	S	.	*	H	α-helix	trans	-58.4	-36.3	173.1	-162.9	86.9	0	0	0	112.4	P672 L679 R680 H717	P672-L676 WeakPolarHBondContact O-CB 3.41Å; P672-L676 PolarHBondContact O-N 3.39Å; L676-L679 PolarHBondContact O-N 3.06Å; L676-R680 PolarHBondContact O-N 2.85Å; L676-R680 VanDerWaalsContact O-N 3.09Å; L676-H717 HydrophobicContact CD1-CB 4.24Å; L676-H717 HydrophobicContact CD2-CB 3.64Å
677	L	42.1	Very low	38	Very low	111 Å²	111	99.7 Å²	99.7	58%	0.581	57%	0.568	S	S	*	*	H	α-helix	trans	-68.1	-36.4	175.2	-165.6	72.1	0	0	0	112.3	K673 Q674 L675	K673-L677 PolarHBondContact O-N 3.32Å; Q674-L677 WeakPolarHBondContact O-CB 3.32Å; Q674-L677 PolarHBondContact O-N 3.13Å; L675-L677 PolarHBondContact O-N 3.48Å
678	V	39.7	Very low	37.7	Very low	55 Å²	55	101.1 Å²	101.1	33%	0.333	56%	0.559	S	S	.	*	H	α-helix	trans	-67.1	-42.9	173.2	172	0	0	0	0	111	Q674 L675 R680 G681 F682	Q674-V678 PolarHBondContact O-N 3.32Å; Q674-V678 VanDerWaalsContact O-N 3.12Å; L675-V678 WeakPolarHBondContact O-CB 3.26Å; L675-V678 PolarHBondContact O-N 2.98Å; L675-V678 VanDerWaalsContact O-N 3.09Å; V678-R680 VanDerWaalsContact C-N 3.27Å; V678-R680 PolarHBondContact O-N 2.86Å; V678-G681 PolarHBondContact O-N 3.46Å; V678-F682 HydrophobicContact CG1-CE2 4.36Å
679	L	42	Very low	37.2	Very low	37 Å²	37	102 Å²	102	19%	0.194	56%	0.559	C	S	.	*	H	α-helix	trans	-68	-23.9	178.7	-64	175	0	0	0	113.3	L675 L676 G681 W725	L675-L679 WeakPolarHBondContact O-CG 3.49Å; L675-L679 PolarHBondContact O-N 2.88Å; L676-L679 PolarHBondContact O-N 3.06Å; L679-G681 VanDerWaalsContact C-N 3.26Å; L679-G681 PolarHBondContact O-N 2.73Å; L679-W725 HydrophobicContact CB-CZ2 4.25Å; L679-W725 HydrophobicContact CD1-CH2 3.79Å; L679-W725 HydrophobicContact CD1-CZ2 3.93Å; L679-W725 HydrophobicContact CD2-CH2 3.98Å; L679-W725 HydrophobicContact CD2-CZ2 3.92Å; L679-W725 HydrophobicContact CG-CH2 4.41Å; L679-W725 HydrophobicContact CG-CZ2 4.24Å
680	R	40.4	Very low	36.7	Very low	201 Å²	201	106.1 Å²	106.1	76%	0.758	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-9.5	170.4	-91.4	-174.2	164.3	-168.6	-6.5	114.4	L676 V678	L676-R680 PolarHBondContact O-N 2.85Å; L676-R680 VanDerWaalsContact O-N 3.09Å; V678-R680 VanDerWaalsContact C-N 3.27Å; V678-R680 PolarHBondContact O-N 2.86Å
681	G	33.7	Very low	36.3	Very low	62 Å²	62	105.8 Å²	105.8	64%	0.639	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	0.4	-172.8	0	0	0	0	0	116.5	V678 L679	V678-G681 PolarHBondContact O-N 3.46Å; L679-G681 VanDerWaalsContact C-N 3.26Å; L679-G681 PolarHBondContact O-N 2.73Å
682	F	38.1	Very low	36.3	Very low	113 Å²	113	110.6 Å²	110.6	50%	0.496	61%	0.608	S	S	.	*			trans	-96.2	122.3	-176.1	-80.6	-92.4	0	0	0	112.2	I660 V678 L684	I660-F682 HydrophobicContact CD1-CZ 4.2Å; V678-F682 HydrophobicContact CG1-CE2 4.36Å; F682-L684 PolarHBondContact O-N 3.03Å
683	P	34.3	Very low	35.8	Very low	126 Å²	126	108.6 Å²	108.6	82%	0.818	60%	0.603	S	S	*	*			trans	-75.3	111.5	169.2	29.8	-31.6	0	0	0	110.1	K685	P683-K685 PolarHBondContact O-N 3.08Å
684	L	41.4	Very low	35.7	Very low	116 Å²	116	108.2 Å²	108.2	61%	0.607	60%	0.596	S	S	*	*			trans	-76.5	114.3	174.1	-89.4	76.4	0	0	0	111	F682 M728	F682-L684 PolarHBondContact O-N 3.03Å; L684-M728 HydrophobicContact CD2-CB 4.33Å; L684-M728 HydrophobicContact CD2-SD 3.88Å
685	K	32.6	Very low	35.9	Very low	195 Å²	195	104.4 Å²	104.4	85%	0.848	58%	0.579	S	S	*	*			trans	-152.9	156.7	152.4	-123.4	176.6	-177.2	179.3	0	109.5	P683	P683-K685 PolarHBondContact O-N 3.08Å
686	V	31.7	Very low	35.8	Very low	111 Å²	111	113.6 Å²	113.6	67%	0.673	61%	0.612	S	S	*	*			trans	70.4	101.6	-171.8	-169.2	0	0	0	0	113.9
687	L	27.9	Very low	35.8	Very low	135 Å²	135	115.3 Å²	115.3	71%	0.707	62%	0.618	S	S	*	*			trans	-158.3	105.6	153.6	-112.2	178.5	0	0	0	108.8
688	T	29.3	Very low	35.7	Very low	115 Å²	115	112.4 Å²	112.4	71%	0.706	61%	0.607	S	S	*	*			trans	-149.4	142.2	165.1	52.2	0	0	0	0	109.6
689	Q	25.9	Very low	35.8	Very low	171 Å²	171	115.1 Å²	115.1	80%	0.799	64%	0.636	S	S	*	*	S	Bend	trans	86.1	88	170.4	-50.3	-168.6	24.8	0	0	119.5
690	T	27.1	Very low	36.1	Very low	146 Å²	146	116.4 Å²	116.4	90%	0.896	66%	0.657	S	S	*	*			trans	71.3	126.5	131.5	64.3	0	0	0	0	122.2
691	G	28.9	Very low	36.8	Very low	72 Å²	72	108.8 Å²	108.8	74%	0.742	63%	0.63	S	S	*	*			trans	157.8	98.3	159.7	0	0	0	0	0	114.2
692	P	35.2	Very low	38.3	Very low	136 Å²	136	109.1 Å²	109.1	88%	0.883	61%	0.612	S	S	*	*			trans	-80.4	124.7	-173	31	-34.1	0	0	0	113
693	G	31	Very low	39.8	Very low	41 Å²	41	104.6 Å²	104.6	42%	0.423	60%	0.598	S	S	.	*			trans	-141.8	56.7	-174.4	0	0	0	0	0	114.1	R644	R644-G693 PolarHBondContact NH1-O 3.36Å; R644-G693 PolarHBondContact NH2-O 2.79Å
694	R	38	Very low	41.9	Very low	172 Å²	172	98.9 Å²	98.9	65%	0.649	56%	0.56	S	S	*	*			trans	-36.8	131	-158.9	-152.1	-178.7	-169.4	-167.1	12.6	118.2	R696 D734 Q737	R694-R696 PolarHBondContact O-N 3.42Å; R694-D734 VanDerWaalsContact CA-OD1 3.26Å; R694-D734 WeakPolarHBondContact CA-OD1 3.48Å; R694-D734 WeakPolarHBondContact CA-OD2 3.44Å; R694-Q737 VanDerWaalsContact NH2-CD 3.27Å; R694-Q737 VanDerWaalsContact NH2-NE2 3.13Å
695	L	44	Very low	43.9	Very low	10 Å²	10	93.3 Å²	93.3	5%	0.052	53%	0.531	C	S	.	.			trans	-60.4	101.4	169.7	-82.1	175.5	0	0	0	111.5	Q640 M641 H697 D734 E738	Q640-L695 HydrophobicContact CG-CD2 4.22Å; M641-L695 HydrophobicContact CE-CD1 3.63Å; M641-L695 HydrophobicContact SD-CD1 4.15Å; L695-H697 PolarHBondContact O-N 2.87Å; L695-H697 PolarHBondContact O-ND1 3.01Å; L695-D734 HydrophobicContact CD1-CB 4.14Å; L695-D734 HydrophobicContact CG-CB 4.13Å; L695-D734 PolarHBondContact N-OD1 3.32Å; L695-D734 PolarHBondContact N-OD2 3.23Å; L695-E738 HydrophobicContact CD1-CG 3.87Å
696	R	40.9	Very low	46.2	Very low	225 Å²	225	84.1 Å²	84.1	85%	0.849	49%	0.491	S	S	*	.			trans	-76.4	114.1	-177.8	-135	177.9	180	173	0.7	110.5	R694 S698	R694-R696 PolarHBondContact O-N 3.42Å; R696-S698 PolarHBondContact O-N 3.45Å
697	H	47.5	Very low	48.8	Very low	72 Å²	72	78.9 Å²	78.9	33%	0.333	46%	0.459	S	S	.	.			trans	-66.9	124.6	-177.8	-57.3	14.2	0	0	0	111	L695 A699 Q737	L695-H697 PolarHBondContact O-N 2.87Å; L695-H697 PolarHBondContact O-ND1 3.01Å; H697-A699 PolarHBondContact O-N 3.48Å; H697-Q737 PolarHBondContact CE1-NE2 3.48Å; H697-Q737 PolarHBondContact NE2-NE2 3.06Å
698	S	40.7	Very low	51.6	Low	49 Å²	49	72.4 Å²	72.4	34%	0.343	43%	0.426	S	S	.	.			trans	-63.8	120.8	173.1	-70.9	0	0	0	0	110.7	R696 G700 H701	R696-S698 PolarHBondContact O-N 3.45Å; S698-G700 PolarHBondContact O-N 3.3Å; S698-H701 PolarHBondContact O-N 3.36Å; S698-H701 PolarHBondContact O-ND1 3.43Å; S698-H701 VanDerWaalsContact O-ND1 3.11Å
699	A	41.1	Very low	54.3	Low	113 Å²	113	67 Å²	67	93%	0.934	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	1.1	-164	0	0	0	0	0	117.3	H697	H697-A699 PolarHBondContact O-N 3.48Å
700	G	48.2	Very low	57.2	Low	63 Å²	63	58.9 Å²	58.9	65%	0.649	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-18.5	175.3	0	0	0	0	0	115	S698 R702	S698-G700 PolarHBondContact O-N 3.3Å; G700-R702 PolarHBondContact O-N 2.97Å
701	H	55.9	Low	60.1	Low	41 Å²	41	51.9 Å²	51.9	19%	0.19	31%	0.312	C	S	.	.	S	Bend	trans	-96.6	22.1	-160.7	-56.4	109.5	0	0	0	116.1	S633 S698 G703 M704	S633-H701 WeakPolarHBondContact CB-NE2 3.25Å; S633-H701 PolarHBondContact OG-CD2 3.33Å; S633-H701 PolarHBondContact OG-NE2 3.23Å; S698-H701 PolarHBondContact O-N 3.36Å; S698-H701 PolarHBondContact O-ND1 3.43Å; S698-H701 VanDerWaalsContact O-ND1 3.11Å; H701-G703 PolarHBondContact O-N 2.93Å; H701-M704 WeakPolarHBondContact O-CB 3.47Å; H701-M704 WeakPolarHBondContact O-CG 3.45Å; H701-M704 PolarHBondContact O-N 2.92Å
702	R	64.3	Low	62.9	Low	69 Å²	69	48.5 Å²	48.5	26%	0.26	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	35.4	172.4	-54.7	-176.4	179.6	173.2	-2.2	115.1	G700 M704 H746 F747	G700-R702 PolarHBondContact O-N 2.97Å; R702-M704 VanDerWaalsContact C-N 3.27Å; R702-M704 PolarHBondContact O-N 3.4Å; R702-H746 HydrophobicContact CB-CB 4.38Å; R702-H746 WeakPolarHBondContact O-CB 3.47Å; R702-H746 PolarHBondContact O-N 3.16Å; R702-H746 PolarHBondContact O-ND1 2.98Å; R702-F747 HydrophobicContact CB-CE2 4.46Å
703	G	69.4	Low	65.2	Low	19 Å²	19	42.7 Å²	42.7	20%	0.196	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-4.9	179.9	0	0	0	0	0	116.7	H701 H746	H701-G703 PolarHBondContact O-N 2.93Å; G703-H746 VanDerWaalsContact CA-CE1 3.43Å; G703-H746 WeakPolarHBondContact CA-CE1 3.46Å; G703-H746 PolarHBondContact N-CE1 3.02Å; G703-H746 VanDerWaalsContact N-CE1 3.34Å
704	M	77.9	Confident	67.8	Low	5 Å²	5	41.7 Å²	41.7	3%	0.025	23%	0.227	C	C	.	.			trans	-56.5	140.2	179.1	-63.6	173.6	-175.9	0	0	112	L625 F630 R637 H701 R702 H708 L709 D745 W754	L625-M704 HydrophobicContact CD1-CE 3.68Å; F630-M704 HydrophobicContact CE1-CE 4.19Å; F630-M704 HydrophobicContact CE1-SD 3.87Å; R637-M704 VanDerWaalsContact CZ-O 3.22Å; R637-M704 PolarHBondContact NH1-O 3.05Å; R637-M704 PolarHBondContact NH2-O 3.13Å; H701-M704 WeakPolarHBondContact O-CB 3.47Å; H701-M704 WeakPolarHBondContact O-CG 3.45Å; H701-M704 PolarHBondContact O-N 2.92Å; R702-M704 VanDerWaalsContact C-N 3.27Å; R702-M704 PolarHBondContact O-N 3.4Å; M704-H708 HydrophobicContact CB-CB 3.92Å; M704-H708 HydrophobicContact CG-CB 4.34Å; M704-L709 HydrophobicContact CB-CD2 4.44Å; M704-L709 HydrophobicContact CB-CG 4.49Å; M704-L709 HydrophobicContact SD-CD2 4.03Å; M704-D745 HydrophobicContact CG-CB 4.01Å; M704-W754 HydrophobicContact CE-CH2 3.55Å; M704-W754 HydrophobicContact CE-CZ2 3.23Å
705	T	83.8	Confident	70	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.			trans	-87.4	170.5	169.5	74.9	0	0	0	0	112.4	L707 H708 L709 Q737 E738 N743	T705-L707 PolarHBondContact O-N 3.44Å; T705-L707 PolarHBondContact OG1-N 2.81Å; T705-H708 PolarHBondContact N-ND1 3.12Å; T705-H708 WeakPolarHBondContact O-CB 3.47Å; T705-H708 PolarHBondContact O-N 3.47Å; T705-H708 VanDerWaalsContact O-N 3.13Å; T705-H708 PolarHBondContact OG1-N 2.75Å; T705-H708 PolarHBondContact OG1-ND1 3.15Å; T705-L709 WeakPolarHBondContact O-CG 3.46Å; T705-L709 PolarHBondContact O-N 2.92Å; T705-Q737 WeakPolarHBondContact CG2-O 3.31Å; T705-E738 VanDerWaalsContact CA-OE2 3.22Å; T705-E738 WeakPolarHBondContact CA-OE2 3.26Å; T705-E738 VanDerWaalsContact CB-O 3.25Å; T705-E738 WeakPolarHBondContact CB-O 3.27Å; T705-E738 WeakPolarHBondContact CB-OE2 3.49Å; T705-E738 PolarHBondContact OG1-O 3.48Å; T705-N743 HydrophobicContact CG2-CB 4.34Å; T705-N743 VanDerWaalsContact CG2-ND2 3.28Å; T705-N743 WeakPolarHBondContact CG2-ND2 3.48Å
706	L	81.9	Confident	71.9	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-54.5	-37.7	169.3	-179	59.4	0	0	0	111.7	I634 R637 L638 L709 A710 L722 E738	I634-L706 HydrophobicContact CG2-CD1 4.3Å; R637-L706 HydrophobicContact CB-CD1 4.28Å; L638-L706 HydrophobicContact CD2-CD2 3.93Å; L638-L706 HydrophobicContact CG-CD1 4.35Å; L706-L709 PolarHBondContact O-N 3.35Å; L706-A710 WeakPolarHBondContact O-CB 3.39Å; L706-A710 PolarHBondContact O-N 3.27Å; L706-L722 HydrophobicContact CD2-CD1 4.35Å; L706-L722 HydrophobicContact CD2-CD2 3.87Å; L706-L722 HydrophobicContact CG-CD1 4.14Å; L706-E738 HydrophobicContact CB-CB 4.4Å; L706-E738 PolarHBondContact N-OE2 3.02Å
707	L	86.3	Confident	73.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.6	-39.4	175.3	-171.7	62.2	0	0	0	113	T705 L709 A710 A711 I719 L722 E738 P741 P751 L767 W770	T705-L707 PolarHBondContact O-N 3.44Å; T705-L707 PolarHBondContact OG1-N 2.81Å; L707-L709 VanDerWaalsContact C-N 3.33Å; L707-L709 PolarHBondContact O-N 2.82Å; L707-A710 PolarHBondContact O-N 3.16Å; L707-A711 VanDerWaalsContact O-CB 3.31Å; L707-A711 WeakPolarHBondContact O-CB 3.33Å; L707-A711 PolarHBondContact O-N 2.92Å; L707-I719 HydrophobicContact CD1-CG1 4.17Å; L707-I719 HydrophobicContact CD1-CG2 4.25Å; L707-L722 HydrophobicContact CD1-CD1 4.26Å; L707-E738 PolarHBondContact N-O 2.85Å; L707-P741 HydrophobicContact CD2-CB 4.05Å; L707-P751 HydrophobicContact CB-CG 4.32Å; L707-P751 HydrophobicContact CD2-CB 4.31Å; L707-P751 HydrophobicContact CD2-CG 4Å; L707-P751 HydrophobicContact CG-CB 3.99Å; L707-P751 HydrophobicContact CG-CG 3.96Å; L707-L767 HydrophobicContact CD1-CD2 3.95Å; L707-L767 HydrophobicContact CD2-CD2 4.16Å; L707-L767 HydrophobicContact CG-CD2 4.17Å; L707-W770 HydrophobicContact CD1-CZ3 3.91Å; L707-W770 HydrophobicContact CD2-CE3 4.37Å; L707-W770 HydrophobicContact CD2-CH2 4.01Å; L707-W770 HydrophobicContact CD2-CZ3 3.48Å; L707-W770 VanDerWaalsContact CD2-CZ3 3.48Å; L707-W770 HydrophobicContact CG-CZ3 4.36Å
708	H	86.8	Confident	75.2	Confident	0 Å²	0	30 Å²	30	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-45.5	172.4	-69.7	72.6	0	0	0	111.1	M704 T705 A711 A712 N743 D745 C749 W754	M704-H708 HydrophobicContact CB-CB 3.92Å; M704-H708 HydrophobicContact CG-CB 4.34Å; T705-H708 PolarHBondContact N-ND1 3.12Å; T705-H708 WeakPolarHBondContact O-CB 3.47Å; T705-H708 PolarHBondContact O-N 3.47Å; T705-H708 VanDerWaalsContact O-N 3.13Å; T705-H708 PolarHBondContact OG1-N 2.75Å; T705-H708 PolarHBondContact OG1-ND1 3.15Å; H708-A711 PolarHBondContact O-N 2.83Å; H708-A712 WeakPolarHBondContact O-CB 3.29Å; H708-A712 PolarHBondContact O-N 2.73Å; H708-N743 PolarHBondContact CE1-O 2.96Å; H708-N743 PolarHBondContact NE2-O 3.12Å; H708-D745 PolarHBondContact NE2-N 2.94Å; H708-C749 PolarHBondContact CD2-O 3Å; H708-C749 PolarHBondContact NE2-O 3.04Å; H708-W754 AromaticContact CD2-CD1 3.88Å
709	L	85.6	Confident	77.2	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-41	179.8	-63.1	168.8	0	0	0	111.8	F630 I634 M704 T705 L706 L707 Q713	F630-L709 HydrophobicContact CD1-CD2 3.61Å; F630-L709 HydrophobicContact CE1-CD2 4.21Å; I634-L709 HydrophobicContact CD1-CB 4.04Å; I634-L709 HydrophobicContact CG1-CB 3.56Å; I634-L709 HydrophobicContact CG1-CD1 4.3Å; I634-L709 HydrophobicContact CG1-CG 4.5Å; M704-L709 HydrophobicContact CB-CD2 4.44Å; M704-L709 HydrophobicContact CB-CG 4.49Å; M704-L709 HydrophobicContact SD-CD2 4.03Å; T705-L709 WeakPolarHBondContact O-CG 3.46Å; T705-L709 PolarHBondContact O-N 2.92Å; L706-L709 PolarHBondContact O-N 3.35Å; L707-L709 VanDerWaalsContact C-N 3.33Å; L707-L709 PolarHBondContact O-N 2.82Å; L709-Q713 PolarHBondContact O-N 3.32Å
710	A	86.6	Confident	79.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-39.6	175.4	0	0	0	0	0	112.3	L706 L707 G714 Y715 L718 I719	L706-A710 WeakPolarHBondContact O-CB 3.39Å; L706-A710 PolarHBondContact O-N 3.27Å; L707-A710 PolarHBondContact O-N 3.16Å; A710-G714 PolarHBondContact O-N 3.3Å; A710-G714 VanDerWaalsContact O-N 3.16Å; A710-Y715 PolarHBondContact O-N 3.02Å; A710-L718 HydrophobicContact CB-CD2 3.85Å; A710-L718 HydrophobicContact CB-CG 4.17Å; A710-I719 HydrophobicContact CB-CG1 4.01Å
711	A	89.3	Confident	80.4	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.7	-45.1	176.1	0	0	0	0	0	112.4	L707 H708 Q713 G714 P751 A755 H760 L767	L707-A711 VanDerWaalsContact O-CB 3.31Å; L707-A711 WeakPolarHBondContact O-CB 3.33Å; L707-A711 PolarHBondContact O-N 2.92Å; H708-A711 PolarHBondContact O-N 2.83Å; A711-Q713 PolarHBondContact O-N 3.01Å; A711-G714 PolarHBondContact O-N 2.98Å; A711-P751 HydrophobicContact CB-CB 3.98Å; A711-P751 VanDerWaalsContact CB-O 3.25Å; A711-P751 WeakPolarHBondContact CB-O 3.37Å; A711-A755 HydrophobicContact CB-CB 4.41Å; A711-H760 PolarHBondContact O-CD2 3.47Å; A711-H760 VanDerWaalsContact O-CD2 3.25Å; A711-L767 HydrophobicContact CB-CD1 3.71Å
712	A	86.1	Confident	81.6	Confident	1 Å²	1	23 Å²	23	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-26.5	177.8	0	0	0	0	0	113.4	H708 W754 L758 H760	H708-A712 WeakPolarHBondContact O-CB 3.29Å; H708-A712 PolarHBondContact O-N 2.73Å; A712-W754 HydrophobicContact CB-CB 4.34Å; A712-W754 HydrophobicContact CB-CD2 4.19Å; A712-W754 HydrophobicContact CB-CE3 3.6Å; A712-W754 HydrophobicContact CB-CZ3 4.3Å; A712-L758 HydrophobicContact CB-CD1 4.24Å; A712-L758 VanDerWaalsContact O-CD1 3.25Å; A712-L758 WeakPolarHBondContact O-CD1 3.39Å; A712-H760 PolarHBondContact O-NE2 3.28Å
713	Q	84.8	Confident	82.4	Confident	14 Å²	14	21.6 Å²	21.6	7%	0.065	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	2.4	173.9	-67.4	-69.8	-75.4	0	0	113.7	D627 F630 R631 I634 L709 A711 Y715	D627-Q713 PolarHBondContact OD1-NE2 3.48Å; F630-Q713 HydrophobicContact CB-CG 4.1Å; R631-Q713 VanDerWaalsContact CZ-OE1 3.3Å; I634-Q713 HydrophobicContact CD1-CB 4.46Å; I634-Q713 HydrophobicContact CD1-CG 4.05Å; L709-Q713 PolarHBondContact O-N 3.32Å; A711-Q713 PolarHBondContact O-N 3.01Å; Q713-Y715 VanDerWaalsContact C-N 3.27Å; Q713-Y715 HydrophobicContact CB-CD1 3.9Å; Q713-Y715 HydrophobicContact CB-CD2 3.98Å; Q713-Y715 HydrophobicContact CB-CE1 3.77Å; Q713-Y715 HydrophobicContact CB-CE2 3.84Å; Q713-Y715 HydrophobicContact CB-CG 4.01Å; Q713-Y715 HydrophobicContact CG-CE2 4.36Å; Q713-Y715 WeakPolarHBondContact O-CD1 3.47Å; Q713-Y715 WeakPolarHBondContact O-CE1 3.49Å; Q713-Y715 PolarHBondContact O-N 2.91Å
714	G	84.9	Confident	82.7	Confident	19 Å²	19	25.7 Å²	25.7	20%	0.196	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	22.9	179.1	0	0	0	0	0	114.7	A710 A711 T716	A710-G714 PolarHBondContact O-N 3.3Å; A710-G714 VanDerWaalsContact O-N 3.16Å; A711-G714 PolarHBondContact O-N 2.98Å; G714-T716 VanDerWaalsContact C-N 3.28Å; G714-T716 PolarHBondContact O-N 3.43Å
715	Y	83.5	Confident	82.4	Confident	62 Å²	62	27 Å²	27	24%	0.243	13%	0.133	C	C	.	.			trans	-79.2	69.4	-172.7	-67.7	-12.2	0	0	0	112.6	I634 A710 Q713 H717 L718 I719	I634-Y715 HydrophobicContact CD1-CD2 4.04Å; I634-Y715 HydrophobicContact CD1-CE2 3.8Å; A710-Y715 PolarHBondContact O-N 3.02Å; Q713-Y715 VanDerWaalsContact C-N 3.27Å; Q713-Y715 HydrophobicContact CB-CD1 3.9Å; Q713-Y715 HydrophobicContact CB-CD2 3.98Å; Q713-Y715 HydrophobicContact CB-CE1 3.77Å; Q713-Y715 HydrophobicContact CB-CE2 3.84Å; Q713-Y715 HydrophobicContact CB-CG 4.01Å; Q713-Y715 HydrophobicContact CG-CE2 4.36Å; Q713-Y715 WeakPolarHBondContact O-CD1 3.47Å; Q713-Y715 WeakPolarHBondContact O-CE1 3.49Å; Q713-Y715 PolarHBondContact O-N 2.91Å; Y715-H717 VanDerWaalsContact C-N 3.33Å; Y715-H717 PolarHBondContact O-N 3.49Å; Y715-L718 HydrophobicContact CD2-CD2 4.28Å; Y715-L718 WeakPolarHBondContact O-CA 3.4Å; Y715-L718 WeakPolarHBondContact O-CB 3.37Å; Y715-L718 PolarHBondContact O-N 2.7Å; Y715-I719 PolarHBondContact O-N 3.01Å
716	T	84.4	Confident	81.8	Confident	34 Å²	34	29.9 Å²	29.9	21%	0.209	14%	0.144	C	C	.	.	H	α-helix	trans	-45.1	-48	179.9	54	0	0	0	0	114.2	G714 L718 I719 H720 R762 A763 L766	G714-T716 VanDerWaalsContact C-N 3.28Å; G714-T716 PolarHBondContact O-N 3.43Å; T716-L718 VanDerWaalsContact C-N 3.34Å; T716-L718 PolarHBondContact O-N 3.09Å; T716-I719 WeakPolarHBondContact O-CB 3.4Å; T716-I719 PolarHBondContact O-N 3.4Å; T716-H720 PolarHBondContact O-CD2 3.44Å; T716-H720 VanDerWaalsContact O-CD2 3.31Å; T716-H720 PolarHBondContact O-N 3.38Å; T716-R762 HydrophobicContact CG2-CB 3.72Å; T716-A763 HydrophobicContact CG2-CB 4.28Å; T716-L766 HydrophobicContact CG2-CD1 4.03Å
717	H	79.3	Confident	81.2	Confident	122 Å²	122	33.9 Å²	33.9	57%	0.565	18%	0.177	S	C	*	.	H	α-helix	trans	-65.4	-34.5	178.9	-60.2	-57.2	0	0	0	113.4	L676 Y715 H720 T721	L676-H717 HydrophobicContact CD1-CB 4.24Å; L676-H717 HydrophobicContact CD2-CB 3.64Å; Y715-H717 VanDerWaalsContact C-N 3.33Å; Y715-H717 PolarHBondContact O-N 3.49Å; H717-H720 PolarHBondContact O-N 3.46Å; H717-T721 PolarHBondContact O-N 2.89Å; H717-T721 PolarHBondContact O-OG1 2.97Å
718	L	78.8	Confident	79.9	Confident	16 Å²	16	38.9 Å²	38.9	8%	0.084	20%	0.201	C	C	.	.	H	α-helix	trans	-70	-39.9	174.6	179.3	60	0	0	0	110.2	I634 L638 A710 Y715 T716 H720 T721 L722	I634-L718 HydrophobicContact CG2-CD2 3.95Å; L638-L718 HydrophobicContact CD1-CD1 4.37Å; L638-L718 HydrophobicContact CD2-CD1 4.48Å; A710-L718 HydrophobicContact CB-CD2 3.85Å; A710-L718 HydrophobicContact CB-CG 4.17Å; Y715-L718 HydrophobicContact CD2-CD2 4.28Å; Y715-L718 WeakPolarHBondContact O-CA 3.4Å; Y715-L718 WeakPolarHBondContact O-CB 3.37Å; Y715-L718 PolarHBondContact O-N 2.7Å; T716-L718 VanDerWaalsContact C-N 3.34Å; T716-L718 PolarHBondContact O-N 3.09Å; L718-H720 PolarHBondContact O-N 2.87Å; L718-T721 PolarHBondContact O-N 3.22Å; L718-L722 HydrophobicContact CD1-CD1 4.41Å; L718-L722 HydrophobicContact CD1-CG 4.28Å; L718-L722 HydrophobicContact CG-CD1 4.13Å; L718-L722 HydrophobicContact CG-CG 4.45Å; L718-L722 VanDerWaalsContact O-CG 3.26Å; L718-L722 WeakPolarHBondContact O-CG 3.48Å; L718-L722 PolarHBondContact O-N 3.37Å
719	I	83.1	Confident	78.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-47	173.5	-63.3	166.9	0	0	0	110.2	L707 A710 Y715 T716 T721 L722 I723 A763 L767	L707-I719 HydrophobicContact CD1-CG1 4.17Å; L707-I719 HydrophobicContact CD1-CG2 4.25Å; A710-I719 HydrophobicContact CB-CG1 4.01Å; Y715-I719 PolarHBondContact O-N 3.01Å; T716-I719 WeakPolarHBondContact O-CB 3.4Å; T716-I719 PolarHBondContact O-N 3.4Å; I719-T721 PolarHBondContact O-N 3.17Å; I719-L722 PolarHBondContact O-N 2.85Å; I719-I723 HydrophobicContact CG2-CD1 3.88Å; I719-I723 HydrophobicContact CG2-CG1 4.44Å; I719-I723 VanDerWaalsContact O-CG1 3.26Å; I719-I723 WeakPolarHBondContact O-CG1 3.27Å; I719-I723 PolarHBondContact O-N 2.77Å; I719-A763 HydrophobicContact CD1-CB 3.79Å; I719-L767 HydrophobicContact CD1-CD1 4.42Å; I719-L767 HydrophobicContact CD1-CG 4.48Å; I719-L767 HydrophobicContact CG2-CD2 4.03Å; I719-L767 HydrophobicContact CG2-CG 4.39Å
720	H	79.9	Confident	76.8	Confident	94 Å²	94	44 Å²	44	44%	0.435	24%	0.237	S	C	.	.	H	α-helix	trans	-57	-45.8	172.9	-82.6	-72.6	0	0	0	113.4	T716 H717 L718 L722 I723 H724 L766	T716-H720 PolarHBondContact O-CD2 3.44Å; T716-H720 VanDerWaalsContact O-CD2 3.31Å; T716-H720 PolarHBondContact O-N 3.38Å; H717-H720 PolarHBondContact O-N 3.46Å; L718-H720 PolarHBondContact O-N 2.87Å; H720-L722 VanDerWaalsContact C-N 3.32Å; H720-L722 PolarHBondContact O-N 3.45Å; H720-I723 PolarHBondContact O-N 2.91Å; H720-H724 WeakPolarHBondContact O-CB 3.27Å; H720-H724 PolarHBondContact O-N 3.11Å; H720-L766 WeakPolarHBondContact CE1-CD2 3.46Å; H720-L766 WeakPolarHBondContact NE2-CD1 3.49Å; H720-L766 WeakPolarHBondContact NE2-CD2 3.27Å
721	T	76.8	Confident	75	Confident	25 Å²	25	51 Å²	51	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-38.8	177.5	-62	0	0	0	0	111.7	H717 L718 I719 H724 W725	H717-T721 PolarHBondContact O-N 2.89Å; H717-T721 PolarHBondContact O-OG1 2.97Å; L718-T721 PolarHBondContact O-N 3.22Å; I719-T721 PolarHBondContact O-N 3.17Å; T721-H724 PolarHBondContact O-N 2.96Å; T721-W725 HydrophobicContact CG2-CD2 4.04Å; T721-W725 HydrophobicContact CG2-CG 4.47Å; T721-W725 HydrophobicContact CG2-CH2 4.39Å; T721-W725 HydrophobicContact CG2-CZ2 3.72Å; T721-W725 WeakPolarHBondContact O-CB 3.41Å; T721-W725 VanDerWaalsContact O-CG 3.23Å; T721-W725 PolarHBondContact O-N 3.21Å
722	L	79.3	Confident	73.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-39.7	176.9	-66.9	173.2	0	0	0	112.4	L706 L707 L718 I719 H720 H724 W725 R726 V739	L706-L722 HydrophobicContact CD2-CD1 4.35Å; L706-L722 HydrophobicContact CD2-CD2 3.87Å; L706-L722 HydrophobicContact CG-CD1 4.14Å; L707-L722 HydrophobicContact CD1-CD1 4.26Å; L718-L722 HydrophobicContact CD1-CD1 4.41Å; L718-L722 HydrophobicContact CD1-CG 4.28Å; L718-L722 HydrophobicContact CG-CD1 4.13Å; L718-L722 HydrophobicContact CG-CG 4.45Å; L718-L722 VanDerWaalsContact O-CG 3.26Å; L718-L722 WeakPolarHBondContact O-CG 3.48Å; L718-L722 PolarHBondContact O-N 3.37Å; I719-L722 PolarHBondContact O-N 2.85Å; H720-L722 VanDerWaalsContact C-N 3.32Å; H720-L722 PolarHBondContact O-N 3.45Å; L722-H724 VanDerWaalsContact C-N 3.33Å; L722-H724 PolarHBondContact O-N 3.27Å; L722-W725 HydrophobicContact CD2-CE3 3.91Å; L722-W725 HydrophobicContact CD2-CZ3 4.18Å; L722-W725 PolarHBondContact O-N 2.82Å; L722-R726 PolarHBondContact O-N 3.3Å; L722-V739 HydrophobicContact CB-CG1 3.91Å; L722-V739 HydrophobicContact CD2-CG2 4.01Å; L722-V739 WeakPolarHBondContact O-CG1 3.45Å
723	I	82.4	Confident	72.1	Confident	40 Å²	40	59.4 Å²	59.4	21%	0.205	32%	0.323	C	S	.	.	H	α-helix	trans	-56	-50.1	170.7	-69.3	164.1	0	0	0	110.1	I719 H720 R726 A727 W770	I719-I723 HydrophobicContact CG2-CD1 3.88Å; I719-I723 HydrophobicContact CG2-CG1 4.44Å; I719-I723 VanDerWaalsContact O-CG1 3.26Å; I719-I723 WeakPolarHBondContact O-CG1 3.27Å; I719-I723 PolarHBondContact O-N 2.77Å; H720-I723 PolarHBondContact O-N 2.91Å; I723-R726 PolarHBondContact O-N 3.37Å; I723-A727 PolarHBondContact O-N 3.04Å; I723-W770 HydrophobicContact CB-CH2 4.45Å; I723-W770 HydrophobicContact CB-CZ2 4.35Å; I723-W770 HydrophobicContact CD1-CB 4.44Å; I723-W770 HydrophobicContact CD1-CD2 4.1Å; I723-W770 HydrophobicContact CD1-CE3 3.88Å; I723-W770 HydrophobicContact CD1-CG 4.39Å; I723-W770 HydrophobicContact CD1-CZ3 4.29Å; I723-W770 HydrophobicContact CG1-CD2 3.55Å; I723-W770 HydrophobicContact CG1-CE3 3.42Å; I723-W770 VanDerWaalsContact CG1-CE3 3.42Å; I723-W770 HydrophobicContact CG1-CG 4.19Å; I723-W770 HydrophobicContact CG1-CH2 3.68Å; I723-W770 HydrophobicContact CG1-CZ2 3.84Å; I723-W770 HydrophobicContact CG1-CZ3 3.48Å; I723-W770 VanDerWaalsContact CG1-CZ3 3.48Å
724	H	75.4	Confident	70.6	Confident	104 Å²	104	60 Å²	60	48%	0.481	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-44	-178.8	-172.1	66.7	0	0	0	112	H720 T721 L722 A727 M728	H720-H724 WeakPolarHBondContact O-CB 3.27Å; H720-H724 PolarHBondContact O-N 3.11Å; T721-H724 PolarHBondContact O-N 2.96Å; L722-H724 VanDerWaalsContact C-N 3.33Å; L722-H724 PolarHBondContact O-N 3.27Å; H724-A727 PolarHBondContact O-N 3.16Å; H724-M728 WeakPolarHBondContact CE1-CE 3.49Å; H724-M728 WeakPolarHBondContact NE2-CE 3.47Å; H724-M728 WeakPolarHBondContact O-CG 3.37Å; H724-M728 PolarHBondContact O-N 2.91Å; H724-M728 VanDerWaalsContact O-N 3.09Å
725	W	71	Confident	69.6	Low	34 Å²	34	59.7 Å²	59.7	13%	0.129	32%	0.32	C	S	.	.	H	α-helix	trans	-62.1	-42.7	174.7	-69.6	-6.5	0	0	0	112.6	M645 L679 T721 L722 A727 M728 S729 L735	M645-W725 HydrophobicContact CE-CH2 4.44Å; L679-W725 HydrophobicContact CB-CZ2 4.25Å; L679-W725 HydrophobicContact CD1-CH2 3.79Å; L679-W725 HydrophobicContact CD1-CZ2 3.93Å; L679-W725 HydrophobicContact CD2-CH2 3.98Å; L679-W725 HydrophobicContact CD2-CZ2 3.92Å; L679-W725 HydrophobicContact CG-CH2 4.41Å; L679-W725 HydrophobicContact CG-CZ2 4.24Å; T721-W725 HydrophobicContact CG2-CD2 4.04Å; T721-W725 HydrophobicContact CG2-CG 4.47Å; T721-W725 HydrophobicContact CG2-CH2 4.39Å; T721-W725 HydrophobicContact CG2-CZ2 3.72Å; T721-W725 WeakPolarHBondContact O-CB 3.41Å; T721-W725 VanDerWaalsContact O-CG 3.23Å; T721-W725 PolarHBondContact O-N 3.21Å; L722-W725 HydrophobicContact CD2-CE3 3.91Å; L722-W725 HydrophobicContact CD2-CZ3 4.18Å; L722-W725 PolarHBondContact O-N 2.82Å; W725-A727 VanDerWaalsContact C-N 3.35Å; W725-A727 PolarHBondContact O-N 3.3Å; W725-M728 CarbonylContact O-C 3.58Å; W725-M728 PolarHBondContact O-N 3.22Å; W725-M728 VanDerWaalsContact O-N 3.17Å; W725-S729 PolarHBondContact O-N 2.94Å; W725-S729 PolarHBondContact O-OG 3.46Å; W725-L735 HydrophobicContact CB-CD2 4.16Å
726	R	72.8	Confident	68.8	Low	60 Å²	60	59.8 Å²	59.8	23%	0.226	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-43.5	175.7	-168.5	-177.1	-175.7	175.5	5.1	111.3	L722 I723 M728 S729 S730 E736 V739 D740 W770	L722-R726 PolarHBondContact O-N 3.3Å; I723-R726 PolarHBondContact O-N 3.37Å; R726-M728 PolarHBondContact O-N 3.18Å; R726-S729 PolarHBondContact O-N 3.25Å; R726-S730 PolarHBondContact O-N 2.86Å; R726-E736 IonicContact CZ-OE1 2.79Å; R726-E736 IonicContact NE-OE1 2.69Å; R726-E736 IonicContact NH2-OE1 3.56Å; R726-E736 PolarHBondContact NH2-OE1 3.44Å; R726-V739 HydrophobicContact CB-CG1 4.04Å; R726-D740 IonicContact CZ-OD1 2.7Å; R726-D740 IonicContact NH1-OD1 3.61Å; R726-D740 PolarHBondContact NH1-OD1 3.25Å; R726-D740 IonicContact NH2-OD1 3.41Å; R726-W770 HydrophobicContact CB-CZ2 4.38Å
727	A	69.3	Low	68	Low	86 Å²	86	60.4 Å²	60.4	71%	0.711	32%	0.323	S	S	*	.	H	α-helix	trans	-64.1	-23.2	177.2	0	0	0	0	0	113.7	I723 H724 W725	I723-A727 PolarHBondContact O-N 3.04Å; H724-A727 PolarHBondContact O-N 3.16Å; W725-A727 VanDerWaalsContact C-N 3.35Å; W725-A727 PolarHBondContact O-N 3.3Å
728	M	58.6	Low	67.6	Low	104 Å²	104	55 Å²	55	51%	0.512	30%	0.298	S	S	.	.	H	α-helix	trans	-98.2	-7.4	178.1	-71.3	178.6	156.1	0	0	114.6	L684 H724 W725 R726	L684-M728 HydrophobicContact CD2-CB 4.33Å; L684-M728 HydrophobicContact CD2-SD 3.88Å; H724-M728 WeakPolarHBondContact CE1-CE 3.49Å; H724-M728 WeakPolarHBondContact NE2-CE 3.47Å; H724-M728 WeakPolarHBondContact O-CG 3.37Å; H724-M728 PolarHBondContact O-N 2.91Å; H724-M728 VanDerWaalsContact O-N 3.09Å; W725-M728 CarbonylContact O-C 3.58Å; W725-M728 PolarHBondContact O-N 3.22Å; W725-M728 VanDerWaalsContact O-N 3.17Å; R726-M728 PolarHBondContact O-N 3.18Å
729	S	54.6	Low	67.7	Low	31 Å²	31	54.3 Å²	54.3	22%	0.217	29%	0.294	C	S	.	.			trans	-148.9	55.2	-174.5	58.1	0	0	0	0	113	W725 R726 D731 S732 L735	W725-S729 PolarHBondContact O-N 2.94Å; W725-S729 PolarHBondContact O-OG 3.46Å; R726-S729 PolarHBondContact O-N 3.25Å; S729-D731 PolarHBondContact O-N 2.96Å; S729-D731 VanDerWaalsContact O-N 3.12Å; S729-S732 PolarHBondContact O-N 2.95Å; S729-L735 WeakPolarHBondContact OG-CD2 3.24Å
730	S	52.4	Low	67.5	Low	77 Å²	77	56 Å²	56	54%	0.538	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-36.4	172.2	43.5	0	0	0	0	114	R726 S732	R726-S730 PolarHBondContact O-N 2.86Å; S730-S732 PolarHBondContact O-N 3.29Å
731	D	49.3	Very low	67.7	Low	149 Å²	149	51.6 Å²	51.6	80%	0.797	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.7	-168.2	-58.5	19.2	0	0	0	112.7	S729 L733	S729-D731 PolarHBondContact O-N 2.96Å; S729-D731 VanDerWaalsContact O-N 3.12Å; D731-L733 PolarHBondContact O-N 3.48Å
732	S	58.5	Low	68.1	Low	48 Å²	48	52.9 Å²	52.9	34%	0.336	29%	0.289	S	S	.	.			trans	-94.1	83.5	-177.4	-170.5	0	0	0	0	111.8	S729 S730 D734 L735 E736	S729-S732 PolarHBondContact O-N 2.95Å; S730-S732 PolarHBondContact O-N 3.29Å; S732-D734 PolarHBondContact O-N 3.24Å; S732-L735 WeakPolarHBondContact O-CA 3.38Å; S732-L735 WeakPolarHBondContact O-CB 3.31Å; S732-L735 PolarHBondContact O-N 2.08Å; S732-E736 PolarHBondContact O-N 3.17Å
733	L	54.9	Low	68.4	Low	128 Å²	128	55 Å²	55	67%	0.67	30%	0.3	S	S	*	.	H	α-helix	trans	-50.7	-30.3	179.3	-160.3	81.1	0	0	0	114	D731 Q737	D731-L733 PolarHBondContact O-N 3.48Å; L733-Q737 PolarHBondContact O-N 3.24Å
734	D	53.9	Low	68.5	Low	28 Å²	28	55.7 Å²	55.7	15%	0.15	31%	0.307	C	S	.	.	H	α-helix	trans	-74.6	-35.9	176.1	-93.1	14.2	0	0	0	112.7	R644 R694 L695 S732	R644-D734 IonicContact CZ-OD2 3.48Å; R644-D734 IonicContact NH1-OD2 3.6Å; R644-D734 PolarHBondContact NH1-OD2 2.96Å; R694-D734 VanDerWaalsContact CA-OD1 3.26Å; R694-D734 WeakPolarHBondContact CA-OD1 3.48Å; R694-D734 WeakPolarHBondContact CA-OD2 3.44Å; L695-D734 HydrophobicContact CD1-CB 4.14Å; L695-D734 HydrophobicContact CG-CB 4.13Å; L695-D734 PolarHBondContact N-OD1 3.32Å; L695-D734 PolarHBondContact N-OD2 3.23Å; S732-D734 PolarHBondContact O-N 3.24Å
735	L	63.9	Low	68.8	Low	11 Å²	11	51.1 Å²	51.1	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-71.9	-43.1	174.5	-172.7	70.2	0	0	0	110.4	M641 W725 S729 S732 Q737 E738 V739	M641-L735 HydrophobicContact CE-CD1 3.68Å; M641-L735 HydrophobicContact SD-CD1 4.34Å; W725-L735 HydrophobicContact CB-CD2 4.16Å; S729-L735 WeakPolarHBondContact OG-CD2 3.24Å; S732-L735 WeakPolarHBondContact O-CA 3.38Å; S732-L735 WeakPolarHBondContact O-CB 3.31Å; S732-L735 PolarHBondContact O-N 2.08Å; L735-Q737 VanDerWaalsContact C-N 3.28Å; L735-Q737 PolarHBondContact O-N 2.84Å; L735-E738 PolarHBondContact O-N 2.75Å; L735-E738 VanDerWaalsContact O-N 3.08Å; L735-V739 HydrophobicContact CD1-CG2 3.63Å; L735-V739 HydrophobicContact CG-CB 4.41Å; L735-V739 HydrophobicContact CG-CG2 3.95Å; L735-V739 VanDerWaalsContact O-CB 3.26Å; L735-V739 WeakPolarHBondContact O-CB 3.4Å; L735-V739 WeakPolarHBondContact O-CG2 3Å; L735-V739 PolarHBondContact O-N 3.19Å
736	E	65.9	Low	69.1	Low	65 Å²	65	55.5 Å²	55.5	30%	0.304	31%	0.307	S	S	.	.	H	α-helix	trans	-51.8	-47.1	176.9	-69.6	-148.1	97.5	0	0	112	R726 S732 E738 V739 D740	R726-E736 IonicContact CZ-OE1 2.79Å; R726-E736 IonicContact NE-OE1 2.69Å; R726-E736 IonicContact NH2-OE1 3.56Å; R726-E736 PolarHBondContact NH2-OE1 3.44Å; S732-E736 PolarHBondContact O-N 3.17Å; E736-E738 VanDerWaalsContact C-N 3.29Å; E736-E738 PolarHBondContact O-N 2.99Å; E736-V739 PolarHBondContact O-N 2.9Å; E736-D740 VanDerWaalsContact O-CB 3.31Å; E736-D740 WeakPolarHBondContact O-CB 3.39Å; E736-D740 PolarHBondContact O-N 2.77Å
737	Q	67.6	Low	69.3	Low	46 Å²	46	54.9 Å²	54.9	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-31.9	-178.8	-172.5	173.8	-4.1	0	0	113.5	R694 H697 T705 L733 L735 N743	R694-Q737 VanDerWaalsContact NH2-CD 3.27Å; R694-Q737 VanDerWaalsContact NH2-NE2 3.13Å; H697-Q737 PolarHBondContact CE1-NE2 3.48Å; H697-Q737 PolarHBondContact NE2-NE2 3.06Å; T705-Q737 WeakPolarHBondContact CG2-O 3.31Å; L733-Q737 PolarHBondContact O-N 3.24Å; L735-Q737 VanDerWaalsContact C-N 3.28Å; L735-Q737 PolarHBondContact O-N 2.84Å; Q737-N743 PolarHBondContact O-ND2 2.84Å
738	E	72	Confident	69.9	Low	10 Å²	10	52.7 Å²	52.7	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-88	-16.7	179	-76.1	-79	-165.1	0	0	113.6	R637 L695 T705 L706 L707 L735 E736	R637-E738 IonicContact CZ-OE1 3.38Å; R637-E738 IonicContact CZ-OE2 2.7Å; R637-E738 VanDerWaalsContact NH1-CD 3.27Å; R637-E738 IonicContact NH1-OE1 2.74Å; R637-E738 PolarHBondContact NH1-OE1 3.35Å; R637-E738 IonicContact NH1-OE2 3.52Å; R637-E738 PolarHBondContact NH1-OE2 3.3Å; L695-E738 HydrophobicContact CD1-CG 3.87Å; T705-E738 VanDerWaalsContact CA-OE2 3.22Å; T705-E738 WeakPolarHBondContact CA-OE2 3.26Å; T705-E738 VanDerWaalsContact CB-O 3.25Å; T705-E738 WeakPolarHBondContact CB-O 3.27Å; T705-E738 WeakPolarHBondContact CB-OE2 3.49Å; T705-E738 PolarHBondContact OG1-O 3.48Å; L706-E738 HydrophobicContact CB-CB 4.4Å; L706-E738 PolarHBondContact N-OE2 3.02Å; L707-E738 PolarHBondContact N-O 2.85Å; L735-E738 PolarHBondContact O-N 2.75Å; L735-E738 VanDerWaalsContact O-N 3.08Å; E736-E738 VanDerWaalsContact C-N 3.29Å; E736-E738 PolarHBondContact O-N 2.99Å
739	V	79	Confident	71.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-123	3.2	-167.3	-176.9	0	0	0	0	113.2	L722 R726 L735 E736 W770	L722-V739 HydrophobicContact CB-CG1 3.91Å; L722-V739 HydrophobicContact CD2-CG2 4.01Å; L722-V739 WeakPolarHBondContact O-CG1 3.45Å; R726-V739 HydrophobicContact CB-CG1 4.04Å; L735-V739 HydrophobicContact CD1-CG2 3.63Å; L735-V739 HydrophobicContact CG-CB 4.41Å; L735-V739 HydrophobicContact CG-CG2 3.95Å; L735-V739 VanDerWaalsContact O-CB 3.26Å; L735-V739 WeakPolarHBondContact O-CB 3.4Å; L735-V739 WeakPolarHBondContact O-CG2 3Å; L735-V739 PolarHBondContact O-N 3.19Å; E736-V739 PolarHBondContact O-N 2.9Å; V739-W770 HydrophobicContact CG1-CH2 3.76Å; V739-W770 HydrophobicContact CG1-CZ2 4.35Å; V739-W770 WeakPolarHBondContact O-CH2 3.17Å
740	D	80.8	Confident	73	Confident	35 Å²	35	46.2 Å²	46.2	19%	0.187	25%	0.251	C	S	.	.			trans	-73.5	126.6	173.3	-179	52.4	0	0	0	113.4	R726 E736 L742 N743	R726-D740 IonicContact CZ-OD1 2.7Å; R726-D740 IonicContact NH1-OD1 3.61Å; R726-D740 PolarHBondContact NH1-OD1 3.25Å; R726-D740 IonicContact NH2-OD1 3.41Å; E736-D740 VanDerWaalsContact O-CB 3.31Å; E736-D740 WeakPolarHBondContact O-CB 3.39Å; E736-D740 PolarHBondContact O-N 2.77Å; D740-L742 VanDerWaalsContact C-N 3.32Å; D740-L742 PolarHBondContact O-N 3.06Å; D740-L742 PolarHBondContact OD2-N 2.85Å; D740-N743 HydrophobicContact CB-CB 4.16Å; D740-N743 PolarHBondContact OD2-N 2.83Å
741	P	84.1	Confident	74.8	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.013	23%	0.225	C	C	.	.	S	Bend	trans	-76.7	-9.1	177.2	31.3	-37.1	0	0	0	115	L707 W770 N771	L707-P741 HydrophobicContact CD2-CB 4.05Å; P741-W770 HydrophobicContact CB-CD2 4.43Å; P741-W770 HydrophobicContact CB-CE3 4.05Å; P741-W770 HydrophobicContact CB-CZ3 4.38Å; P741-W770 HydrophobicContact CG-CD2 3.99Å; P741-W770 HydrophobicContact CG-CE3 4.08Å; P741-W770 HydrophobicContact CG-CZ3 4.46Å; P741-N771 HydrophobicContact CB-CB 4.47Å; P741-N771 HydrophobicContact CG-CB 3.8Å
742	L	85.3	Confident	76.9	Confident	52 Å²	52	35.5 Å²	35.5	27%	0.272	19%	0.187	S	C	.	.	S	Bend	trans	-96.1	-16.6	175.7	-58.1	-173.1	0	0	0	113.5	D740 N771 L773 A774 I777	D740-L742 VanDerWaalsContact C-N 3.32Å; D740-L742 PolarHBondContact O-N 3.06Å; D740-L742 PolarHBondContact OD2-N 2.85Å; L742-N771 WeakPolarHBondContact CD1-ND2 3.35Å; L742-N771 WeakPolarHBondContact CG-ND2 3.29Å; L742-L773 HydrophobicContact CD1-CB 4.44Å; L742-L773 HydrophobicContact CD1-CD1 4.49Å; L742-L773 HydrophobicContact CD2-CB 3.99Å; L742-A774 HydrophobicContact CD2-CB 3.89Å; L742-I777 HydrophobicContact CB-CD1 4.26Å; L742-I777 HydrophobicContact CD2-CD1 4.03Å
743	N	84.4	Confident	78.4	Confident	45 Å²	45	33.2 Å²	33.2	24%	0.241	17%	0.171	C	C	.	.			trans	-58.5	150.3	174.8	-163.6	-1.5	0	0	0	111	T705 H708 Q737 D740 P751	T705-N743 HydrophobicContact CG2-CB 4.34Å; T705-N743 VanDerWaalsContact CG2-ND2 3.28Å; T705-N743 WeakPolarHBondContact CG2-ND2 3.48Å; H708-N743 PolarHBondContact CE1-O 2.96Å; H708-N743 PolarHBondContact NE2-O 3.12Å; Q737-N743 PolarHBondContact O-ND2 2.84Å; D740-N743 HydrophobicContact CB-CB 4.16Å; D740-N743 PolarHBondContact OD2-N 2.83Å; N743-P751 WeakPolarHBondContact O-CD 3.43Å
744	V	84.1	Confident	80.1	Confident	55 Å²	55	27.2 Å²	27.2	33%	0.333	14%	0.14	S	C	.	.			trans	-131.4	147.5	-171.1	-64.8	0	0	0	0	112.7	T750 I777	V744-T750 HydrophobicContact CG1-CG2 3.73Å; V744-I777 HydrophobicContact CG1-CG2 4.03Å
745	D	82.6	Confident	81.9	Confident	8 Å²	8	25.9 Å²	25.9	4%	0.043	13%	0.133	C	C	.	.			trans	-82.6	-172.9	176.9	76.5	10	0	0	0	113.7	M704 H708 F747 S748 C749 W754	M704-D745 HydrophobicContact CG-CB 4.01Å; H708-D745 PolarHBondContact NE2-N 2.94Å; D745-F747 PolarHBondContact O-N 3.4Å; D745-F747 VanDerWaalsContact O-N 3.14Å; D745-F747 WeakPolarHBondContact OD1-CA 3.39Å; D745-F747 WeakPolarHBondContact OD1-CB 3.21Å; D745-F747 PolarHBondContact OD1-N 3.42Å; D745-S748 WeakPolarHBondContact O-CA 3.38Å; D745-S748 PolarHBondContact O-N 3.32Å; D745-S748 PolarHBondContact OD1-N 3.48Å; D745-C749 PolarHBondContact N-O 2.94Å; D745-C749 VanDerWaalsContact N-O 3.11Å; D745-C749 WeakPolarHBondContact OD1-CB 3.31Å; D745-C749 PolarHBondContact OD1-N 2.93Å; D745-C749 VanDerWaalsContact OD1-N 3.07Å; D745-W754 PolarHBondContact OD2-NE1 3.33Å
746	H	76.9	Confident	83.3	Confident	126 Å²	126	25.3 Å²	25.3	58%	0.583	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.1	179.4	-68.5	6.6	0	0	0	115.1	R702 G703	R702-H746 HydrophobicContact CB-CB 4.38Å; R702-H746 WeakPolarHBondContact O-CB 3.47Å; R702-H746 PolarHBondContact O-N 3.16Å; R702-H746 PolarHBondContact O-ND1 2.98Å; G703-H746 VanDerWaalsContact CA-CE1 3.43Å; G703-H746 WeakPolarHBondContact CA-CE1 3.46Å; G703-H746 PolarHBondContact N-CE1 3.02Å; G703-H746 VanDerWaalsContact N-CE1 3.34Å
747	F	76.6	Confident	84.3	Confident	47 Å²	47	22.3 Å²	22.3	21%	0.206	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	13.7	172.8	-51.1	-72.7	0	0	0	112	W622 R702 D745 C749 S780	W622-F747 HydrophobicContact CB-CD1 4.42Å; W622-F747 HydrophobicContact CB-CD2 3.75Å; W622-F747 HydrophobicContact CB-CE1 4.41Å; W622-F747 HydrophobicContact CB-CE2 3.73Å; W622-F747 HydrophobicContact CB-CG 4.1Å; W622-F747 HydrophobicContact CB-CZ 4.08Å; W622-F747 HydrophobicContact CG-CD2 4.3Å; W622-F747 HydrophobicContact CG-CG 4.35Å; R702-F747 HydrophobicContact CB-CE2 4.46Å; D745-F747 PolarHBondContact O-N 3.4Å; D745-F747 VanDerWaalsContact O-N 3.14Å; D745-F747 WeakPolarHBondContact OD1-CA 3.39Å; D745-F747 WeakPolarHBondContact OD1-CB 3.21Å; D745-F747 PolarHBondContact OD1-N 3.42Å; F747-C749 PolarHBondContact O-N 3.44Å; F747-C749 VanDerWaalsContact O-N 3.13Å; F747-S780 VanDerWaalsContact O-CB 3.31Å; F747-S780 WeakPolarHBondContact O-CB 3.36Å; F747-S780 PolarHBondContact O-N 3.43Å; F747-S780 PolarHBondContact O-OG 3.48Å
748	S	81.8	Confident	85.2	Confident	39 Å²	39	22.9 Å²	22.9	27%	0.273	12%	0.12	S	C	.	.			trans	50	23.3	-167.4	75.8	0	0	0	0	115.3	D745 P778 D779 S780	D745-S748 WeakPolarHBondContact O-CA 3.38Å; D745-S748 PolarHBondContact O-N 3.32Å; D745-S748 PolarHBondContact OD1-N 3.48Å; S748-P778 PolarHBondContact OG-O 3.15Å; S748-P778 VanDerWaalsContact OG-O 3.1Å; S748-D779 WeakPolarHBondContact OG-CA 3.27Å; S748-S780 PolarHBondContact OG-N 2.97Å
749	C	87.3	Confident	86.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.			trans	-79.3	128.7	176	-68.2	0	0	0	0	110.3	W622 H708 D745 F747 M753	W622-C749 WeakPolarHBondContact CZ2-SG 3.43Å; H708-C749 PolarHBondContact CD2-O 3Å; H708-C749 PolarHBondContact NE2-O 3.04Å; D745-C749 PolarHBondContact N-O 2.94Å; D745-C749 VanDerWaalsContact N-O 3.11Å; D745-C749 WeakPolarHBondContact OD1-CB 3.31Å; D745-C749 PolarHBondContact OD1-N 2.93Å; D745-C749 VanDerWaalsContact OD1-N 3.07Å; F747-C749 PolarHBondContact O-N 3.44Å; F747-C749 VanDerWaalsContact O-N 3.13Å; C749-M753 HydrophobicContact CB-CB 4.03Å; C749-M753 HydrophobicContact CB-CG 3.89Å
750	T	90.8	Very high	86.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.			trans	-76.2	166.1	169.4	59.3	0	0	0	0	111.8	V744 L752 M753 W754 I777	V744-T750 HydrophobicContact CG1-CG2 3.73Å; T750-L752 PolarHBondContact O-N 2.76Å; T750-M753 VanDerWaalsContact O-CB 3.26Å; T750-M753 WeakPolarHBondContact O-CB 3.37Å; T750-M753 PolarHBondContact O-N 3.47Å; T750-M753 PolarHBondContact OG1-N 2.9Å; T750-W754 PolarHBondContact O-N 3Å; T750-W754 VanDerWaalsContact O-N 3.13Å; T750-I777 HydrophobicContact CG2-CB 3.78Å; T750-I777 HydrophobicContact CG2-CD1 3.85Å; T750-I777 HydrophobicContact CG2-CG1 4.37Å; T750-I777 HydrophobicContact CG2-CG2 3.72Å
751	P	91.9	Very high	87.1	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-55	-36.6	168.7	-25.3	34.2	0	0	0	113	L707 A711 N743 W754 A755 L767	L707-P751 HydrophobicContact CB-CG 4.32Å; L707-P751 HydrophobicContact CD2-CB 4.31Å; L707-P751 HydrophobicContact CD2-CG 4Å; L707-P751 HydrophobicContact CG-CB 3.99Å; L707-P751 HydrophobicContact CG-CG 3.96Å; A711-P751 HydrophobicContact CB-CB 3.98Å; A711-P751 VanDerWaalsContact CB-O 3.25Å; A711-P751 WeakPolarHBondContact CB-O 3.37Å; N743-P751 WeakPolarHBondContact O-CD 3.43Å; P751-W754 PolarHBondContact O-N 2.86Å; P751-A755 PolarHBondContact O-N 3.07Å; P751-L767 HydrophobicContact CB-CD1 4.2Å; P751-L767 HydrophobicContact CB-CD2 4.27Å
752	L	92.7	Very high	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-65.2	-41.2	175.6	-178.5	61	0	0	0	111.5	T750 W754 A755 C756 A764 L767 A774 L775 P785 L801	T750-L752 PolarHBondContact O-N 2.76Å; L752-W754 VanDerWaalsContact C-N 3.3Å; L752-W754 PolarHBondContact O-N 3.39Å; L752-A755 PolarHBondContact O-N 2.95Å; L752-C756 WeakPolarHBondContact O-CB 3.42Å; L752-C756 PolarHBondContact O-N 2.9Å; L752-C756 PolarHBondContact O-SG 3.26Å; L752-A764 HydrophobicContact CD1-CB 3.95Å; L752-A764 WeakPolarHBondContact CD1-O 3.49Å; L752-L767 HydrophobicContact CB-CB 4.44Å; L752-L767 HydrophobicContact CD1-CB 4.09Å; L752-A774 HydrophobicContact CB-CB 4.02Å; L752-A774 HydrophobicContact CD2-CB 3.82Å; L752-L775 HydrophobicContact CD2-CB 4.4Å; L752-L775 HydrophobicContact CD2-CD1 4.04Å; L752-P785 HydrophobicContact CG-CB 4.48Å; L752-L801 HydrophobicContact CD1-CD1 4.34Å
753	M	90.9	Very high	87.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56	-44.3	173.5	-169.1	69.2	73	0	0	111.4	W622 C749 T750 C756 A757 I777 D779 R783 P785 V788	W622-M753 HydrophobicContact CH2-CG 4Å; W622-M753 HydrophobicContact CZ2-CG 4.02Å; C749-M753 HydrophobicContact CB-CB 4.03Å; C749-M753 HydrophobicContact CB-CG 3.89Å; T750-M753 VanDerWaalsContact O-CB 3.26Å; T750-M753 WeakPolarHBondContact O-CB 3.37Å; T750-M753 PolarHBondContact O-N 3.47Å; T750-M753 PolarHBondContact OG1-N 2.9Å; M753-C756 PolarHBondContact O-N 2.88Å; M753-A757 WeakPolarHBondContact O-CB 3.32Å; M753-A757 PolarHBondContact O-N 3.26Å; M753-I777 WeakPolarHBondContact CE-O 3.43Å; M753-D779 HydrophobicContact CE-CB 4.1Å; M753-R783 WeakPolarHBondContact CE-O 3.38Å; M753-P785 HydrophobicContact CE-CB 4.42Å; M753-P785 HydrophobicContact CE-CG 3.68Å; M753-P785 VanDerWaalsContact SD-CA 3.58Å; M753-P785 HydrophobicContact SD-CB 4.15Å; M753-P785 HydrophobicContact SD-CG 4.04Å; M753-V788 HydrophobicContact SD-CB 3.93Å; M753-V788 HydrophobicContact SD-CG1 4.35Å; M753-V788 HydrophobicContact SD-CG2 3.62Å
754	W	90.5	Very high	87.9	Confident	1 Å²	1	32.4 Å²	32.4	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-64.3	-42.7	177	-83.1	91.8	0	0	0	113.2	W622 L623 L625 F630 M704 H708 A712 D745 T750 P751 L752 A757 L758	W622-W754 HydrophobicContact CB-CZ2 4.5Å; W622-W754 HydrophobicContact CD2-CH2 4.43Å; W622-W754 HydrophobicContact CD2-CZ2 4.24Å; W622-W754 HydrophobicContact CE3-CD2 4.06Å; W622-W754 AromaticContact CE3-CE2 3.78Å; W622-W754 HydrophobicContact CE3-CE3 4.01Å; W622-W754 AromaticContact CE3-CH2 3.44Å; W622-W754 HydrophobicContact CE3-CH2 3.44Å; W622-W754 VanDerWaalsContact CE3-CH2 3.44Å; W622-W754 AromaticContact CE3-CZ2 3.45Å; W622-W754 HydrophobicContact CE3-CZ2 3.45Å; W622-W754 VanDerWaalsContact CE3-CZ2 3.45Å; W622-W754 AromaticContact CE3-CZ3 3.73Å; W622-W754 HydrophobicContact CE3-CZ3 3.73Å; W622-W754 AromaticContact CZ3-CD2 3.6Å; W622-W754 HydrophobicContact CZ3-CD2 3.6Å; W622-W754 AromaticContact CZ3-CE2 3.72Å; W622-W754 AromaticContact CZ3-CE3 3.68Å; W622-W754 HydrophobicContact CZ3-CE3 3.68Å; W622-W754 HydrophobicContact CZ3-CG 4.18Å; W622-W754 AromaticContact CZ3-CH2 4Å; W622-W754 HydrophobicContact CZ3-CH2 4Å; W622-W754 AromaticContact CZ3-CZ2 3.9Å; W622-W754 HydrophobicContact CZ3-CZ2 3.9Å; W622-W754 AromaticContact CZ3-CZ3 3.89Å; W622-W754 HydrophobicContact CZ3-CZ3 3.89Å; W622-W754 WeakPolarHBondContact O-CH2 3.49Å; L623-W754 HydrophobicContact CD2-CE3 4.14Å; L623-W754 HydrophobicContact CD2-CZ3 3.81Å; L625-W754 HydrophobicContact CD1-CH2 4.04Å; F630-W754 HydrophobicContact CZ-CH2 4.27Å; F630-W754 AromaticContact CZ-CZ3 3.93Å; F630-W754 HydrophobicContact CZ-CZ3 3.93Å; M704-W754 HydrophobicContact CE-CH2 3.55Å; M704-W754 HydrophobicContact CE-CZ2 3.23Å; H708-W754 AromaticContact CD2-CD1 3.88Å; A712-W754 HydrophobicContact CB-CB 4.34Å; A712-W754 HydrophobicContact CB-CD2 4.19Å; A712-W754 HydrophobicContact CB-CE3 3.6Å; A712-W754 HydrophobicContact CB-CZ3 4.3Å; D745-W754 PolarHBondContact OD2-NE1 3.33Å; T750-W754 PolarHBondContact O-N 3Å; T750-W754 VanDerWaalsContact O-N 3.13Å; P751-W754 PolarHBondContact O-N 2.86Å; L752-W754 VanDerWaalsContact C-N 3.3Å; L752-W754 PolarHBondContact O-N 3.39Å; W754-A757 PolarHBondContact O-N 2.87Å; W754-L758 HydrophobicContact CE3-CD1 4.17Å; W754-L758 PolarHBondContact O-N 3.22Å
755	A	91.9	Very high	88.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-40	175.9	0	0	0	0	0	112.4	A711 P751 L752 G759 H760 A763 A764 L767	A711-A755 HydrophobicContact CB-CB 4.41Å; P751-A755 PolarHBondContact O-N 3.07Å; L752-A755 PolarHBondContact O-N 2.95Å; A755-G759 PolarHBondContact O-N 3.23Å; A755-H760 HydrophobicContact CB-CB 4.38Å; A755-H760 PolarHBondContact O-N 2.73Å; A755-A763 HydrophobicContact CB-CB 4.27Å; A755-A764 HydrophobicContact CB-CB 3.94Å; A755-L767 HydrophobicContact CB-CD1 4.04Å
756	C	91.8	Very high	88.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.6	-40.8	176	-69.1	0	0	0	0	112.4	L752 M753 L758 P785 A789 H794 L797	L752-C756 WeakPolarHBondContact O-CB 3.42Å; L752-C756 PolarHBondContact O-N 2.9Å; L752-C756 PolarHBondContact O-SG 3.26Å; M753-C756 PolarHBondContact O-N 2.88Å; C756-L758 VanDerWaalsContact C-N 3.33Å; C756-L758 PolarHBondContact O-N 3.25Å; C756-P785 HydrophobicContact CB-CB 4.17Å; C756-A789 HydrophobicContact CB-CB 4.16Å; C756-H794 PolarHBondContact O-CD2 2.89Å; C756-L797 HydrophobicContact CB-CD2 4.27Å
757	A	88.6	Confident	89.2	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-70.1	-24.5	-177.7	0	0	0	0	0	115	W622 L623 M753 W754 V788 R792	W622-A757 HydrophobicContact CH2-CB 3.25Å; W622-A757 HydrophobicContact CZ2-CB 4.19Å; W622-A757 HydrophobicContact CZ3-CB 3.65Å; L623-A757 HydrophobicContact CD2-CB 4.27Å; M753-A757 WeakPolarHBondContact O-CB 3.32Å; M753-A757 PolarHBondContact O-N 3.26Å; W754-A757 PolarHBondContact O-N 2.87Å; A757-V788 HydrophobicContact CB-CG1 3.81Å; A757-R792 VanDerWaalsContact CB-NH1 3.31Å
758	L	86.6	Confident	89.9	Confident	59 Å²	59	24.8 Å²	24.8	31%	0.309	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	4	-179.8	-75.2	166.2	0	0	0	113.4	L623 A712 W754 C756 H760	L623-L758 HydrophobicContact CD1-CD2 3.98Å; L623-L758 HydrophobicContact CD1-CG 4.41Å; L623-L758 HydrophobicContact CD2-CD1 3.93Å; L623-L758 HydrophobicContact CD2-CD2 3.76Å; L623-L758 HydrophobicContact CD2-CG 3.61Å; L623-L758 HydrophobicContact CG-CD2 4.4Å; A712-L758 HydrophobicContact CB-CD1 4.24Å; A712-L758 VanDerWaalsContact O-CD1 3.25Å; A712-L758 WeakPolarHBondContact O-CD1 3.39Å; W754-L758 HydrophobicContact CE3-CD1 4.17Å; W754-L758 PolarHBondContact O-N 3.22Å; C756-L758 VanDerWaalsContact C-N 3.33Å; C756-L758 PolarHBondContact O-N 3.25Å; L758-H760 VanDerWaalsContact C-N 3.33Å; L758-H760 WeakPolarHBondContact CD1-NE2 3.37Å; L758-H760 PolarHBondContact O-N 2.94Å
759	G	88.9	Confident	90.2	Very high	26 Å²	26	26.2 Å²	26.2	27%	0.268	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	17	175.5	0	0	0	0	0	114.9	A755 Q761 H794	A755-G759 PolarHBondContact O-N 3.23Å; G759-Q761 PolarHBondContact O-N 3.49Å; G759-H794 PolarHBondContact N-CD2 3.22Å; G759-H794 PolarHBondContact N-NE2 3.42Å
760	H	91.1	Very high	90.2	Very high	75 Å²	75	29.2 Å²	29.2	35%	0.347	14%	0.144	S	C	.	.			trans	-76.3	66.5	-177.6	-65.8	-52.2	0	0	0	111.7	A711 A712 A755 L758 R762 A763 A764	A711-H760 PolarHBondContact O-CD2 3.47Å; A711-H760 VanDerWaalsContact O-CD2 3.25Å; A712-H760 PolarHBondContact O-NE2 3.28Å; A755-H760 HydrophobicContact CB-CB 4.38Å; A755-H760 PolarHBondContact O-N 2.73Å; L758-H760 VanDerWaalsContact C-N 3.33Å; L758-H760 WeakPolarHBondContact CD1-NE2 3.37Å; L758-H760 PolarHBondContact O-N 2.94Å; H760-R762 PolarHBondContact O-N 3.11Å; H760-A763 HydrophobicContact CB-CB 3.98Å; H760-A763 WeakPolarHBondContact O-CA 3.36Å; H760-A763 WeakPolarHBondContact O-CB 3.38Å; H760-A763 PolarHBondContact O-N 3.48Å; H760-A764 PolarHBondContact O-N 2.85Å
761	Q	90.6	Very high	89.9	Confident	72 Å²	72	31 Å²	31	34%	0.336	15%	0.153	S	C	.	.	H	α-helix	trans	-46.5	-53.9	-170.5	176	174.9	-10.7	0	0	113.4	G759 A763 A764 E765 L797	G759-Q761 PolarHBondContact O-N 3.49Å; Q761-A763 VanDerWaalsContact C-N 3.27Å; Q761-A763 PolarHBondContact O-N 2.91Å; Q761-A764 PolarHBondContact O-N 3.38Å; Q761-A764 VanDerWaalsContact O-N 3.11Å; Q761-E765 HydrophobicContact CG-CG 4.34Å; Q761-E765 WeakPolarHBondContact CG-OE1 3.35Å; Q761-E765 PolarHBondContact NE2-OE1 3.42Å; Q761-E765 WeakPolarHBondContact O-CG 3.46Å; Q761-E765 PolarHBondContact O-N 3.39Å; Q761-L797 HydrophobicContact CB-CB 4.5Å; Q761-L797 HydrophobicContact CB-CD1 4.2Å; Q761-L797 HydrophobicContact CB-CG 4.28Å
762	R	88.1	Confident	89.5	Confident	170 Å²	170	31.9 Å²	31.9	64%	0.642	16%	0.162	S	C	*	.	H	α-helix	trans	-64.7	-27.3	-179.2	-60.7	-51.9	-162.3	164.5	4.1	113.8	T716 H760 E765 L766	T716-R762 HydrophobicContact CG2-CB 3.72Å; H760-R762 PolarHBondContact O-N 3.11Å; R762-E765 WeakPolarHBondContact CD-OE2 3.45Å; R762-E765 IonicContact CZ-OE2 3.82Å; R762-E765 IonicContact NE-OE2 2.71Å; R762-E765 IonicContact NH1-OE1 3.66Å; R762-E765 IonicContact NH1-OE2 2.7Å; R762-E765 PolarHBondContact NH1-OE2 3.26Å; R762-L766 WeakPolarHBondContact O-CD1 3.38Å; R762-L766 VanDerWaalsContact O-CG 3.22Å; R762-L766 WeakPolarHBondContact O-CG 3.46Å; R762-L766 PolarHBondContact O-N 2.93Å
763	A	90.5	Very high	89.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-77.2	-37.8	173.7	0	0	0	0	0	111.2	T716 I719 A755 H760 Q761 L766 L767	T716-A763 HydrophobicContact CG2-CB 4.28Å; I719-A763 HydrophobicContact CD1-CB 3.79Å; A755-A763 HydrophobicContact CB-CB 4.27Å; H760-A763 HydrophobicContact CB-CB 3.98Å; H760-A763 WeakPolarHBondContact O-CA 3.36Å; H760-A763 WeakPolarHBondContact O-CB 3.38Å; H760-A763 PolarHBondContact O-N 3.48Å; Q761-A763 VanDerWaalsContact C-N 3.27Å; Q761-A763 PolarHBondContact O-N 2.91Å; A763-L766 PolarHBondContact O-N 3.22Å; A763-L767 WeakPolarHBondContact O-CB 3.43Å; A763-L767 WeakPolarHBondContact O-CD1 3.32Å; A763-L767 VanDerWaalsContact O-CG 3.23Å; A763-L767 WeakPolarHBondContact O-CG 3.18Å; A763-L767 PolarHBondContact O-N 2.79Å
764	A	92.6	Very high	88.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-44.7	176.1	0	0	0	0	0	112.1	L752 A755 H760 Q761 L766 L767 Y768 L797 L801	L752-A764 HydrophobicContact CD1-CB 3.95Å; L752-A764 WeakPolarHBondContact CD1-O 3.49Å; A755-A764 HydrophobicContact CB-CB 3.94Å; H760-A764 PolarHBondContact O-N 2.85Å; Q761-A764 PolarHBondContact O-N 3.38Å; Q761-A764 VanDerWaalsContact O-N 3.11Å; A764-L766 VanDerWaalsContact C-N 3.33Å; A764-L766 PolarHBondContact O-N 2.94Å; A764-L767 PolarHBondContact O-N 3.47Å; A764-Y768 VanDerWaalsContact O-CB 3.29Å; A764-Y768 WeakPolarHBondContact O-CB 3.23Å; A764-Y768 PolarHBondContact O-N 2.59Å; A764-L797 HydrophobicContact CB-CD1 4.2Å; A764-L797 HydrophobicContact CB-CD2 4.05Å; A764-L797 HydrophobicContact CB-CG 4.28Å; A764-L801 HydrophobicContact CB-CD1 4.27Å
765	E	92.1	Very high	88.8	Confident	36 Å²	36	38.4 Å²	38.4	17%	0.168	20%	0.197	C	C	.	.	H	α-helix	trans	-53	-48.4	172.5	-74	168.6	-174.2	0	0	111.3	Q761 R762 S769 L804	Q761-E765 HydrophobicContact CG-CG 4.34Å; Q761-E765 WeakPolarHBondContact CG-OE1 3.35Å; Q761-E765 PolarHBondContact NE2-OE1 3.42Å; Q761-E765 WeakPolarHBondContact O-CG 3.46Å; Q761-E765 PolarHBondContact O-N 3.39Å; R762-E765 WeakPolarHBondContact CD-OE2 3.45Å; R762-E765 IonicContact CZ-OE2 3.82Å; R762-E765 IonicContact NE-OE2 2.71Å; R762-E765 IonicContact NH1-OE1 3.66Å; R762-E765 IonicContact NH1-OE2 2.7Å; R762-E765 PolarHBondContact NH1-OE2 3.26Å; E765-S769 WeakPolarHBondContact O-CB 3.46Å; E765-S769 PolarHBondContact O-N 2.87Å; E765-L804 HydrophobicContact CG-CD1 4.3Å
766	L	88.9	Confident	88.3	Confident	31 Å²	31	41 Å²	41	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-48.2	179.2	-72	171.5	0	0	0	112.7	T716 H720 R762 A763 A764 Y768 S769 W770	T716-L766 HydrophobicContact CG2-CD1 4.03Å; H720-L766 WeakPolarHBondContact CE1-CD2 3.46Å; H720-L766 WeakPolarHBondContact NE2-CD1 3.49Å; H720-L766 WeakPolarHBondContact NE2-CD2 3.27Å; R762-L766 WeakPolarHBondContact O-CD1 3.38Å; R762-L766 VanDerWaalsContact O-CG 3.22Å; R762-L766 WeakPolarHBondContact O-CG 3.46Å; R762-L766 PolarHBondContact O-N 2.93Å; A763-L766 PolarHBondContact O-N 3.22Å; A764-L766 VanDerWaalsContact C-N 3.33Å; A764-L766 PolarHBondContact O-N 2.94Å; L766-Y768 VanDerWaalsContact C-N 3.31Å; L766-Y768 PolarHBondContact O-N 2.59Å; L766-S769 PolarHBondContact O-N 3.23Å; L766-S769 PolarHBondContact O-OG 3.31Å; L766-W770 PolarHBondContact O-N 3.31Å
767	L	89.1	Confident	87.9	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-39	178.6	-70.3	165.4	0	0	0	111.9	L707 A711 I719 P751 L752 A755 A763 A764 W770 N771	L707-L767 HydrophobicContact CD1-CD2 3.95Å; L707-L767 HydrophobicContact CD2-CD2 4.16Å; L707-L767 HydrophobicContact CG-CD2 4.17Å; A711-L767 HydrophobicContact CB-CD1 3.71Å; I719-L767 HydrophobicContact CD1-CD1 4.42Å; I719-L767 HydrophobicContact CD1-CG 4.48Å; I719-L767 HydrophobicContact CG2-CD2 4.03Å; I719-L767 HydrophobicContact CG2-CG 4.39Å; P751-L767 HydrophobicContact CB-CD1 4.2Å; P751-L767 HydrophobicContact CB-CD2 4.27Å; L752-L767 HydrophobicContact CB-CB 4.44Å; L752-L767 HydrophobicContact CD1-CB 4.09Å; A755-L767 HydrophobicContact CB-CD1 4.04Å; A763-L767 WeakPolarHBondContact O-CB 3.43Å; A763-L767 WeakPolarHBondContact O-CD1 3.32Å; A763-L767 VanDerWaalsContact O-CG 3.23Å; A763-L767 WeakPolarHBondContact O-CG 3.18Å; A763-L767 PolarHBondContact O-N 2.79Å; A764-L767 PolarHBondContact O-N 3.47Å; L767-W770 HydrophobicContact CD2-CE3 4.22Å; L767-W770 HydrophobicContact CD2-CZ3 4.43Å; L767-W770 PolarHBondContact O-N 3.03Å; L767-N771 PolarHBondContact O-N 3.49Å
768	Y	91	Very high	87.6	Confident	8 Å²	8	45.9 Å²	45.9	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-43.2	174.6	177.1	-100.3	0	0	0	112.2	A764 L766 W770 N771 G772 L775 L801 L804 H805	A764-Y768 VanDerWaalsContact O-CB 3.29Å; A764-Y768 WeakPolarHBondContact O-CB 3.23Å; A764-Y768 PolarHBondContact O-N 2.59Å; L766-Y768 VanDerWaalsContact C-N 3.31Å; L766-Y768 PolarHBondContact O-N 2.59Å; Y768-W770 PolarHBondContact O-N 3.22Å; Y768-N771 CarbonylContact O-C 3.35Å; Y768-N771 PolarHBondContact O-N 2.91Å; Y768-G772 VanDerWaalsContact CE2-CA 3.45Å; Y768-G772 PolarHBondContact O-N 3.49Å; Y768-L775 HydrophobicContact CD2-CB 4.33Å; Y768-L775 HydrophobicContact CD2-CD1 4.34Å; Y768-L775 HydrophobicContact CD2-CD2 4.32Å; Y768-L775 HydrophobicContact CE2-CB 4.28Å; Y768-L775 HydrophobicContact CE2-CD2 3.87Å; Y768-L801 HydrophobicContact CD1-CD2 4.29Å; Y768-L801 HydrophobicContact CG-CD2 3.97Å; Y768-L804 HydrophobicContact CD1-CB 4.07Å; Y768-L804 HydrophobicContact CD1-CD1 4.49Å; Y768-L804 HydrophobicContact CE1-CB 3.8Å; Y768-H805 AromaticContact CZ-ND1 3.93Å; Y768-H805 WeakPolarHBondContact OH-CA 3.48Å; Y768-H805 PolarHBondContact OH-ND1 2.82Å
769	S	88.2	Confident	87.4	Confident	69 Å²	69	43.2 Å²	43.2	48%	0.483	24%	0.238	S	C	.	.	H	α-helix	trans	-59.6	-36.7	177.2	74.9	0	0	0	0	112.2	E765 L766 R808	E765-S769 WeakPolarHBondContact O-CB 3.46Å; E765-S769 PolarHBondContact O-N 2.87Å; L766-S769 PolarHBondContact O-N 3.23Å; L766-S769 PolarHBondContact O-OG 3.31Å; S769-R808 PolarHBondContact O-NH1 3.46Å
770	W	86.9	Confident	86.8	Confident	63 Å²	63	45.1 Å²	45.1	24%	0.239	25%	0.247	C	C	.	.	H	α-helix	trans	-71	-48.5	177.8	-175.8	17.7	0	0	0	112.8	L707 I723 R726 V739 P741 L766 L767 Y768	L707-W770 HydrophobicContact CD1-CZ3 3.91Å; L707-W770 HydrophobicContact CD2-CE3 4.37Å; L707-W770 HydrophobicContact CD2-CH2 4.01Å; L707-W770 HydrophobicContact CD2-CZ3 3.48Å; L707-W770 VanDerWaalsContact CD2-CZ3 3.48Å; L707-W770 HydrophobicContact CG-CZ3 4.36Å; I723-W770 HydrophobicContact CB-CH2 4.45Å; I723-W770 HydrophobicContact CB-CZ2 4.35Å; I723-W770 HydrophobicContact CD1-CB 4.44Å; I723-W770 HydrophobicContact CD1-CD2 4.1Å; I723-W770 HydrophobicContact CD1-CE3 3.88Å; I723-W770 HydrophobicContact CD1-CG 4.39Å; I723-W770 HydrophobicContact CD1-CZ3 4.29Å; I723-W770 HydrophobicContact CG1-CD2 3.55Å; I723-W770 HydrophobicContact CG1-CE3 3.42Å; I723-W770 VanDerWaalsContact CG1-CE3 3.42Å; I723-W770 HydrophobicContact CG1-CG 4.19Å; I723-W770 HydrophobicContact CG1-CH2 3.68Å; I723-W770 HydrophobicContact CG1-CZ2 3.84Å; I723-W770 HydrophobicContact CG1-CZ3 3.48Å; I723-W770 VanDerWaalsContact CG1-CZ3 3.48Å; R726-W770 HydrophobicContact CB-CZ2 4.38Å; V739-W770 HydrophobicContact CG1-CH2 3.76Å; V739-W770 HydrophobicContact CG1-CZ2 4.35Å; V739-W770 WeakPolarHBondContact O-CH2 3.17Å; P741-W770 HydrophobicContact CB-CD2 4.43Å; P741-W770 HydrophobicContact CB-CE3 4.05Å; P741-W770 HydrophobicContact CB-CZ3 4.38Å; P741-W770 HydrophobicContact CG-CD2 3.99Å; P741-W770 HydrophobicContact CG-CE3 4.08Å; P741-W770 HydrophobicContact CG-CZ3 4.46Å; L766-W770 PolarHBondContact O-N 3.31Å; L767-W770 HydrophobicContact CD2-CE3 4.22Å; L767-W770 HydrophobicContact CD2-CZ3 4.43Å; L767-W770 PolarHBondContact O-N 3.03Å; Y768-W770 PolarHBondContact O-N 3.22Å
771	N	84.6	Confident	86.1	Confident	38 Å²	38	46.6 Å²	46.6	20%	0.203	26%	0.257	C	S	.	.			trans	-148.9	101.2	174.4	-165	-18.2	0	0	0	112.9	P741 L742 L767 Y768 L773 A774	P741-N771 HydrophobicContact CB-CB 4.47Å; P741-N771 HydrophobicContact CG-CB 3.8Å; L742-N771 WeakPolarHBondContact CD1-ND2 3.35Å; L742-N771 WeakPolarHBondContact CG-ND2 3.29Å; L767-N771 PolarHBondContact O-N 3.49Å; Y768-N771 CarbonylContact O-C 3.35Å; Y768-N771 PolarHBondContact O-N 2.91Å; N771-L773 PolarHBondContact O-N 3.43Å; N771-L773 VanDerWaalsContact OD1-CB 3.29Å; N771-L773 WeakPolarHBondContact OD1-CB 3.5Å; N771-L773 WeakPolarHBondContact OD1-CG 3.3Å; N771-L773 PolarHBondContact OD1-N 2.99Å; N771-A774 WeakPolarHBondContact O-CB 3.36Å; N771-A774 PolarHBondContact O-N 2.96Å
772	G	84.6	Confident	85.5	Confident	18 Å²	18	46 Å²	46	19%	0.186	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-64.5	-17.8	179.1	0	0	0	0	0	115	Y768 A774 L775	Y768-G772 VanDerWaalsContact CE2-CA 3.45Å; Y768-G772 PolarHBondContact O-N 3.49Å; G772-A774 PolarHBondContact O-N 3.16Å; G772-L775 WeakPolarHBondContact O-CB 3.23Å; G772-L775 PolarHBondContact O-N 3.22Å; G772-L775 VanDerWaalsContact O-N 3.15Å
773	L	85.1	Confident	85.2	Confident	125 Å²	125	41.5 Å²	41.5	65%	0.654	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.1	176.6	-59.4	175.2	0	0	0	112.3	L742 N771 L775 G776	L742-L773 HydrophobicContact CD1-CB 4.44Å; L742-L773 HydrophobicContact CD1-CD1 4.49Å; L742-L773 HydrophobicContact CD2-CB 3.99Å; N771-L773 PolarHBondContact O-N 3.43Å; N771-L773 VanDerWaalsContact OD1-CB 3.29Å; N771-L773 WeakPolarHBondContact OD1-CB 3.5Å; N771-L773 WeakPolarHBondContact OD1-CG 3.3Å; N771-L773 PolarHBondContact OD1-N 2.99Å; L773-L775 PolarHBondContact O-N 3.4Å; L773-L775 VanDerWaalsContact O-N 3.09Å; L773-G776 PolarHBondContact O-N 3.31Å
774	A	86	Confident	85.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-60.9	-18.2	174.9	0	0	0	0	0	113.3	L742 L752 N771 G772 G776	L742-A774 HydrophobicContact CD2-CB 3.89Å; L752-A774 HydrophobicContact CB-CB 4.02Å; L752-A774 HydrophobicContact CD2-CB 3.82Å; N771-A774 WeakPolarHBondContact O-CB 3.36Å; N771-A774 PolarHBondContact O-N 2.96Å; G772-A774 PolarHBondContact O-N 3.16Å; A774-G776 VanDerWaalsContact C-N 3.33Å
775	L	87.2	Confident	84.9	Confident	13 Å²	13	45.1 Å²	45.1	7%	0.068	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-73.5	-23.6	177.1	-158.6	71.8	0	0	0	112.8	L752 Y768 G772 L773 P785 L786 L801 H805	L752-L775 HydrophobicContact CD2-CB 4.4Å; L752-L775 HydrophobicContact CD2-CD1 4.04Å; Y768-L775 HydrophobicContact CD2-CB 4.33Å; Y768-L775 HydrophobicContact CD2-CD1 4.34Å; Y768-L775 HydrophobicContact CD2-CD2 4.32Å; Y768-L775 HydrophobicContact CE2-CB 4.28Å; Y768-L775 HydrophobicContact CE2-CD2 3.87Å; G772-L775 WeakPolarHBondContact O-CB 3.23Å; G772-L775 PolarHBondContact O-N 3.22Å; G772-L775 VanDerWaalsContact O-N 3.15Å; L773-L775 PolarHBondContact O-N 3.4Å; L773-L775 VanDerWaalsContact O-N 3.09Å; L775-P785 WeakPolarHBondContact O-CD 3.48Å; L775-L786 HydrophobicContact CD1-CD1 4.18Å; L775-L786 HydrophobicContact CD1-CD2 4.08Å; L775-L786 HydrophobicContact CD1-CG 3.85Å; L775-L786 HydrophobicContact CD2-CD1 4.08Å; L775-L786 HydrophobicContact CG-CD1 4.17Å; L775-L786 HydrophobicContact CG-CG 4.33Å; L775-L801 HydrophobicContact CD1-CD1 4.32Å; L775-H805 HydrophobicContact CD2-CB 4.38Å
776	G	82.1	Confident	84.8	Confident	55 Å²	55	44.7 Å²	44.7	57%	0.567	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-92.9	-1.1	-178.9	0	0	0	0	0	115.1	L773 A774 P778	L773-G776 PolarHBondContact O-N 3.31Å; A774-G776 VanDerWaalsContact C-N 3.33Å; G776-P778 WeakPolarHBondContact O-CD 3.46Å
777	I	83.6	Confident	84.5	Confident	46 Å²	46	45.6 Å²	45.6	24%	0.236	28%	0.282	C	S	.	.			trans	-93.7	119.1	-176.2	-58.9	178.1	0	0	0	109.7	L742 V744 T750 M753	L742-I777 HydrophobicContact CB-CD1 4.26Å; L742-I777 HydrophobicContact CD2-CD1 4.03Å; V744-I777 HydrophobicContact CG1-CG2 4.03Å; T750-I777 HydrophobicContact CG2-CB 3.78Å; T750-I777 HydrophobicContact CG2-CD1 3.85Å; T750-I777 HydrophobicContact CG2-CG1 4.37Å; T750-I777 HydrophobicContact CG2-CG2 3.72Å; M753-I777 WeakPolarHBondContact CE-O 3.43Å
778	P	82.2	Confident	84.5	Confident	56 Å²	56	45.5 Å²	45.5	36%	0.364	28%	0.282	S	S	.	.			trans	-84.5	153.4	-179.9	33.4	-34.8	0	0	0	113.5	S748 G776 R783 L784	S748-P778 PolarHBondContact OG-O 3.15Å; S748-P778 VanDerWaalsContact OG-O 3.1Å; G776-P778 WeakPolarHBondContact O-CD 3.46Å; P778-R783 WeakPolarHBondContact CA-O 3.44Å; P778-L784 HydrophobicContact CB-CD2 4.31Å
779	D	81.6	Confident	84.5	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	28%	0.281	C	S	.	.			trans	-71.6	175	167.8	79.4	-6	0	0	0	112.2	S748 M753 L781 G782 R783	S748-D779 WeakPolarHBondContact OG-CA 3.27Å; M753-D779 HydrophobicContact CE-CB 4.1Å; D779-L781 PolarHBondContact O-N 2.93Å; D779-L781 WeakPolarHBondContact OD1-CA 3.27Å; D779-L781 WeakPolarHBondContact OD1-CB 3.38Å; D779-L781 PolarHBondContact OD1-N 3.43Å; D779-G782 PolarHBondContact O-N 3.21Å; D779-G782 PolarHBondContact OD1-N 2.87Å; D779-R783 PolarHBondContact N-O 2.94Å; D779-R783 WeakPolarHBondContact OD1-CB 3.3Å; D779-R783 PolarHBondContact OD1-N 3Å; D779-R783 IonicContact OD1-NE 3.27Å; D779-R783 IonicContact OD2-CZ 3.43Å; D779-R783 IonicContact OD2-NE 3.33Å; D779-R783 PolarHBondContact OD2-NE 2.85Å; D779-R783 IonicContact OD2-NH2 2.69Å; D779-R783 PolarHBondContact OD2-NH2 3.46Å
780	S	77.9	Confident	84.4	Confident	66 Å²	66	47.4 Å²	47.4	46%	0.462	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	5.3	-179	67.6	0	0	0	0	114.5	F747 S748	F747-S780 VanDerWaalsContact O-CB 3.31Å; F747-S780 WeakPolarHBondContact O-CB 3.36Å; F747-S780 PolarHBondContact O-N 3.43Å; F747-S780 PolarHBondContact O-OG 3.48Å; S748-S780 PolarHBondContact OG-N 2.97Å
781	L	76.3	Confident	84.3	Confident	106 Å²	106	48 Å²	48	56%	0.555	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	10.9	172.1	-56.2	175.8	0	0	0	111.4	D779 R783	D779-L781 PolarHBondContact O-N 2.93Å; D779-L781 WeakPolarHBondContact OD1-CA 3.27Å; D779-L781 WeakPolarHBondContact OD1-CB 3.38Å; D779-L781 PolarHBondContact OD1-N 3.43Å; L781-R783 HydrophobicContact CB-CG 4.25Å
782	G	77.3	Confident	84.2	Confident	59 Å²	59	49.3 Å²	49.3	61%	0.608	29%	0.294	S	S	*	.	S	Bend	trans	79.6	8.8	179.2	0	0	0	0	0	114.9	D779	D779-G782 PolarHBondContact O-N 3.21Å; D779-G782 PolarHBondContact OD1-N 2.87Å
783	R	81.6	Confident	84.1	Confident	75 Å²	75	51 Å²	51	28%	0.283	31%	0.312	S	S	.	.			trans	-92.9	132	-171.1	-52	178.8	-61.9	179	2.2	111.4	M753 P778 D779 L781 V788	M753-R783 WeakPolarHBondContact CE-O 3.38Å; P778-R783 WeakPolarHBondContact CA-O 3.44Å; D779-R783 PolarHBondContact N-O 2.94Å; D779-R783 WeakPolarHBondContact OD1-CB 3.3Å; D779-R783 PolarHBondContact OD1-N 3Å; D779-R783 IonicContact OD1-NE 3.27Å; D779-R783 IonicContact OD2-CZ 3.43Å; D779-R783 IonicContact OD2-NE 3.33Å; D779-R783 PolarHBondContact OD2-NE 2.85Å; D779-R783 IonicContact OD2-NH2 2.69Å; D779-R783 PolarHBondContact OD2-NH2 3.46Å; L781-R783 HydrophobicContact CB-CG 4.25Å; R783-V788 HydrophobicContact CB-CG2 3.62Å
784	L	87.8	Confident	84.3	Confident	77 Å²	77	47.8 Å²	47.8	40%	0.403	29%	0.293	S	S	.	.			trans	-78.9	156.7	174	-64.9	174.4	0	0	0	112.2	P778 L786 A787 V788	P778-L784 HydrophobicContact CB-CD2 4.31Å; L784-L786 VanDerWaalsContact C-N 3.28Å; L784-L786 PolarHBondContact O-N 2.9Å; L784-A787 WeakPolarHBondContact O-CB 3.22Å; L784-A787 PolarHBondContact O-N 3.33Å; L784-V788 PolarHBondContact O-N 2.86Å
785	P	89.1	Confident	84.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-54.7	-38	-178.1	-25.8	34.2	0	0	0	114.5	L752 M753 C756 L775 V788 A789	L752-P785 HydrophobicContact CG-CB 4.48Å; M753-P785 HydrophobicContact CE-CB 4.42Å; M753-P785 HydrophobicContact CE-CG 3.68Å; M753-P785 VanDerWaalsContact SD-CA 3.58Å; M753-P785 HydrophobicContact SD-CB 4.15Å; M753-P785 HydrophobicContact SD-CG 4.04Å; C756-P785 HydrophobicContact CB-CB 4.17Å; L775-P785 WeakPolarHBondContact O-CD 3.48Å; P785-V788 PolarHBondContact O-N 3.47Å; P785-A789 WeakPolarHBondContact O-CB 3.4Å; P785-A789 PolarHBondContact O-N 2.92Å
786	L	89.1	Confident	84.6	Confident	27 Å²	27	61.3 Å²	61.3	14%	0.141	35%	0.353	C	S	.	.	H	α-helix	trans	-66.5	-38.4	176.3	-64.1	172.2	0	0	0	112.7	L775 L784 R790 A798 L801 E802	L775-L786 HydrophobicContact CD1-CD1 4.18Å; L775-L786 HydrophobicContact CD1-CD2 4.08Å; L775-L786 HydrophobicContact CD1-CG 3.85Å; L775-L786 HydrophobicContact CD2-CD1 4.08Å; L775-L786 HydrophobicContact CG-CD1 4.17Å; L775-L786 HydrophobicContact CG-CG 4.33Å; L784-L786 VanDerWaalsContact C-N 3.28Å; L784-L786 PolarHBondContact O-N 2.9Å; L786-R790 WeakPolarHBondContact O-CG 3.03Å; L786-R790 PolarHBondContact O-N 3.26Å; L786-A798 HydrophobicContact CD2-CB 4.3Å; L786-L801 HydrophobicContact CD2-CB 3.8Å; L786-L801 HydrophobicContact CD2-CD1 4.26Å; L786-E802 HydrophobicContact CD1-CG 3.66Å; L786-E802 HydrophobicContact CD2-CG 3.93Å; L786-E802 HydrophobicContact CG-CG 4.4Å
787	A	84.3	Confident	85	Confident	50 Å²	50	59 Å²	59	41%	0.413	33%	0.328	S	S	.	.	H	α-helix	trans	-69.7	-40.4	175.6	0	0	0	0	0	110.9	L784 R790 S791	L784-A787 WeakPolarHBondContact O-CB 3.22Å; L784-A787 PolarHBondContact O-N 3.33Å; A787-R790 PolarHBondContact O-N 2.89Å; A787-S791 WeakPolarHBondContact O-CB 3.44Å; A787-S791 PolarHBondContact O-N 3.09Å; A787-S791 PolarHBondContact O-OG 3.36Å
788	V	87.7	Confident	85.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-44.7	175.7	176.6	0	0	0	0	111.3	M753 A757 R783 L784 P785 R790 S791 R792	M753-V788 HydrophobicContact SD-CB 3.93Å; M753-V788 HydrophobicContact SD-CG1 4.35Å; M753-V788 HydrophobicContact SD-CG2 3.62Å; A757-V788 HydrophobicContact CB-CG1 3.81Å; R783-V788 HydrophobicContact CB-CG2 3.62Å; L784-V788 PolarHBondContact O-N 2.86Å; P785-V788 PolarHBondContact O-N 3.47Å; V788-R790 PolarHBondContact O-N 3.45Å; V788-S791 WeakPolarHBondContact CA-OG 3.45Å; V788-S791 PolarHBondContact O-N 2.95Å; V788-S791 PolarHBondContact O-OG 2.66Å; V788-R792 VanDerWaalsContact CG1-NH1 3.33Å; V788-R792 PolarHBondContact O-N 3.47Å
789	A	90.5	Very high	85.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-48.5	174	0	0	0	0	0	112.2	C756 P785 S791 R792 G793 H794 L797 A798	C756-A789 HydrophobicContact CB-CB 4.16Å; P785-A789 WeakPolarHBondContact O-CB 3.4Å; P785-A789 PolarHBondContact O-N 2.92Å; A789-S791 PolarHBondContact O-N 2.87Å; A789-R792 PolarHBondContact O-N 3.28Å; A789-G793 PolarHBondContact O-N 2.73Å; A789-H794 HydrophobicContact CB-CB 4.29Å; A789-H794 WeakPolarHBondContact O-CA 3.18Å; A789-H794 WeakPolarHBondContact O-CB 3.31Å; A789-H794 PolarHBondContact O-N 3.34Å; A789-L797 HydrophobicContact CB-CD2 4.19Å; A789-A798 HydrophobicContact CB-CB 4.11Å
790	R	88	Confident	86	Confident	117 Å²	117	57.6 Å²	57.6	44%	0.442	33%	0.328	S	S	.	.	H	α-helix	trans	-58.5	-46.5	174.1	-78	-175.4	173.9	86.7	-1.5	112.2	L786 A787 V788 R792 G793 A798 E802	L786-R790 WeakPolarHBondContact O-CG 3.03Å; L786-R790 PolarHBondContact O-N 3.26Å; A787-R790 PolarHBondContact O-N 2.89Å; V788-R790 PolarHBondContact O-N 3.45Å; R790-R792 PolarHBondContact O-N 3Å; R790-R792 VanDerWaalsContact O-N 3.16Å; R790-G793 PolarHBondContact O-N 3.34Å; R790-A798 HydrophobicContact CG-CB 4.06Å; R790-E802 IonicContact CZ-OE1 3.69Å; R790-E802 VanDerWaalsContact CZ-OE1 3.27Å; R790-E802 IonicContact CZ-OE2 2.8Å; R790-E802 IonicContact NH1-OE1 3.25Å; R790-E802 PolarHBondContact NH1-OE1 2.7Å; R790-E802 IonicContact NH1-OE2 3.93Å; R790-E802 IonicContact NH2-OE1 2.79Å; R790-E802 PolarHBondContact NH2-OE1 2.98Å; R790-E802 IonicContact NH2-OE2 3.91Å; R790-E802 PolarHBondContact NH2-OE2 3.07Å
791	S	83.5	Confident	86.6	Confident	76 Å²	76	54.5 Å²	54.5	53%	0.531	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-22.5	-176.6	74.2	0	0	0	0	114.4	A787 V788 A789	A787-S791 WeakPolarHBondContact O-CB 3.44Å; A787-S791 PolarHBondContact O-N 3.09Å; A787-S791 PolarHBondContact O-OG 3.36Å; V788-S791 WeakPolarHBondContact CA-OG 3.45Å; V788-S791 PolarHBondContact O-N 2.95Å; V788-S791 PolarHBondContact O-OG 2.66Å; A789-S791 PolarHBondContact O-N 2.87Å
792	R	82.2	Confident	87.3	Confident	64 Å²	64	52.2 Å²	52.2	24%	0.242	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	15.4	173.7	-61.2	-148.8	-172.3	80.7	-9.6	114	D621 A757 V788 A789 R790 H794	D621-R792 VanDerWaalsContact CG-NH2 3.29Å; D621-R792 IonicContact OD1-CZ 3.62Å; D621-R792 IonicContact OD1-NH2 2.69Å; D621-R792 PolarHBondContact OD1-NH2 3.06Å; D621-R792 IonicContact OD2-CZ 3.32Å; D621-R792 IonicContact OD2-NE 2.89Å; D621-R792 PolarHBondContact OD2-NE 3.46Å; D621-R792 IonicContact OD2-NH2 3.22Å; D621-R792 PolarHBondContact OD2-NH2 3.09Å; D621-R792 VanDerWaalsContact OD2-NH2 3.14Å; A757-R792 VanDerWaalsContact CB-NH1 3.31Å; V788-R792 VanDerWaalsContact CG1-NH1 3.33Å; V788-R792 PolarHBondContact O-N 3.47Å; A789-R792 PolarHBondContact O-N 3.28Å; R790-R792 PolarHBondContact O-N 3Å; R790-R792 VanDerWaalsContact O-N 3.16Å; R792-H794 VanDerWaalsContact C-N 3.34Å; R792-H794 PolarHBondContact O-N 3.4Å
793	G	83.6	Confident	87.8	Confident	53 Å²	53	54.3 Å²	54.3	55%	0.546	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	6.7	174.7	0	0	0	0	0	115.4	A789 R790 T795	A789-G793 PolarHBondContact O-N 2.73Å; R790-G793 PolarHBondContact O-N 3.34Å; G793-T795 PolarHBondContact O-N 3.44Å
794	H	89.8	Confident	88.1	Confident	58 Å²	58	53.8 Å²	53.8	27%	0.269	29%	0.289	S	S	.	.			trans	-81.4	48.7	177.7	-54.9	-48.2	0	0	0	112.1	C756 G759 A789 R792 R796 L797 A798	C756-H794 PolarHBondContact O-CD2 2.89Å; G759-H794 PolarHBondContact N-CD2 3.22Å; G759-H794 PolarHBondContact N-NE2 3.42Å; A789-H794 HydrophobicContact CB-CB 4.29Å; A789-H794 WeakPolarHBondContact O-CA 3.18Å; A789-H794 WeakPolarHBondContact O-CB 3.31Å; A789-H794 PolarHBondContact O-N 3.34Å; R792-H794 VanDerWaalsContact C-N 3.34Å; R792-H794 PolarHBondContact O-N 3.4Å; H794-R796 VanDerWaalsContact C-N 3.33Å; H794-R796 PolarHBondContact O-N 2.94Å; H794-L797 HydrophobicContact CB-CB 4.18Å; H794-L797 WeakPolarHBondContact O-CB 3.18Å; H794-L797 PolarHBondContact O-N 2.71Å; H794-L797 VanDerWaalsContact O-N 3.1Å; H794-A798 PolarHBondContact O-N 3.44Å; H794-A798 VanDerWaalsContact O-N 3.11Å
795	T	88.7	Confident	88.1	Confident	87 Å²	87	54.6 Å²	54.6	53%	0.534	29%	0.291	S	S	.	.	H	α-helix	trans	-59.8	-38.6	-174.8	53.7	0	0	0	0	113.2	G793 L797 A798 A799	G793-T795 PolarHBondContact O-N 3.44Å; T795-L797 VanDerWaalsContact C-N 3.32Å; T795-L797 PolarHBondContact O-N 3.36Å; T795-A798 PolarHBondContact O-N 3.49Å; T795-A799 WeakPolarHBondContact O-CB 2.87Å; T795-A799 PolarHBondContact O-N 2.87Å
796	R	89.2	Confident	87.9	Confident	212 Å²	212	57.7 Å²	57.7	80%	0.8	31%	0.31	S	S	*	.	H	α-helix	trans	-62.4	-36.4	175.4	-66.1	-175.1	180	-174	-0.9	112.9	H794 A800	H794-R796 VanDerWaalsContact C-N 3.33Å; H794-R796 PolarHBondContact O-N 2.94Å; R796-A800 WeakPolarHBondContact O-CB 3.35Å; R796-A800 PolarHBondContact O-N 3.14Å
797	L	90.8	Very high	87.7	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-69.5	-46.1	176.2	-174.6	164.3	0	0	0	110.3	C756 Q761 A764 A789 H794 T795 A799 A800 L801	C756-L797 HydrophobicContact CB-CD2 4.27Å; Q761-L797 HydrophobicContact CB-CB 4.5Å; Q761-L797 HydrophobicContact CB-CD1 4.2Å; Q761-L797 HydrophobicContact CB-CG 4.28Å; A764-L797 HydrophobicContact CB-CD1 4.2Å; A764-L797 HydrophobicContact CB-CD2 4.05Å; A764-L797 HydrophobicContact CB-CG 4.28Å; A789-L797 HydrophobicContact CB-CD2 4.19Å; H794-L797 HydrophobicContact CB-CB 4.18Å; H794-L797 WeakPolarHBondContact O-CB 3.18Å; H794-L797 PolarHBondContact O-N 2.71Å; H794-L797 VanDerWaalsContact O-N 3.1Å; T795-L797 VanDerWaalsContact C-N 3.32Å; T795-L797 PolarHBondContact O-N 3.36Å; L797-A799 PolarHBondContact O-N 2.96Å; L797-A800 PolarHBondContact O-N 3.06Å; L797-L801 HydrophobicContact CD2-CD1 3.68Å; L797-L801 HydrophobicContact CD2-CG 4.2Å; L797-L801 WeakPolarHBondContact O-CG 3.46Å; L797-L801 PolarHBondContact O-N 3.22Å
798	A	90.3	Very high	87.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-47.5	176.9	0	0	0	0	0	111.8	L786 A789 R790 H794 T795 A800 L801 E802	L786-A798 HydrophobicContact CD2-CB 4.3Å; A789-A798 HydrophobicContact CB-CB 4.11Å; R790-A798 HydrophobicContact CG-CB 4.06Å; H794-A798 PolarHBondContact O-N 3.44Å; H794-A798 VanDerWaalsContact O-N 3.11Å; T795-A798 PolarHBondContact O-N 3.49Å; A798-A800 PolarHBondContact O-N 3.06Å; A798-L801 PolarHBondContact O-N 3.4Å; A798-E802 WeakPolarHBondContact O-CG 3.39Å; A798-E802 PolarHBondContact O-N 3.17Å
799	A	89.3	Confident	86.9	Confident	52 Å²	52	67.9 Å²	67.9	43%	0.43	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-42	177.4	0	0	0	0	0	112.6	T795 L797 L801 E802 E803	T795-A799 WeakPolarHBondContact O-CB 2.87Å; T795-A799 PolarHBondContact O-N 2.87Å; L797-A799 PolarHBondContact O-N 2.96Å; A799-L801 VanDerWaalsContact C-N 3.33Å; A799-L801 PolarHBondContact O-N 3.14Å; A799-E802 PolarHBondContact O-N 3.1Å; A799-E803 WeakPolarHBondContact O-CB 3.48Å; A799-E803 PolarHBondContact O-N 3.41Å
800	A	89.5	Confident	86	Confident	23 Å²	23	73.7 Å²	73.7	19%	0.19	38%	0.379	C	S	.	.	H	α-helix	trans	-62.9	-37.5	176.9	0	0	0	0	0	112.7	R796 L797 A798 L804	R796-A800 WeakPolarHBondContact O-CB 3.35Å; R796-A800 PolarHBondContact O-N 3.14Å; L797-A800 PolarHBondContact O-N 3.06Å; A798-A800 PolarHBondContact O-N 3.06Å; A800-L804 WeakPolarHBondContact O-CB 3.4Å; A800-L804 VanDerWaalsContact O-CG 3.26Å; A800-L804 WeakPolarHBondContact O-CG 3.49Å; A800-L804 PolarHBondContact O-N 2.97Å; A800-L804 VanDerWaalsContact O-N 3.14Å
801	L	90.3	Very high	84.9	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-72.5	-35.5	175.2	-69.3	-176.7	0	0	0	113	L752 A764 Y768 L775 L786 L797 A798 A799 H805	L752-L801 HydrophobicContact CD1-CD1 4.34Å; A764-L801 HydrophobicContact CB-CD1 4.27Å; Y768-L801 HydrophobicContact CD1-CD2 4.29Å; Y768-L801 HydrophobicContact CG-CD2 3.97Å; L775-L801 HydrophobicContact CD1-CD1 4.32Å; L786-L801 HydrophobicContact CD2-CB 3.8Å; L786-L801 HydrophobicContact CD2-CD1 4.26Å; L797-L801 HydrophobicContact CD2-CD1 3.68Å; L797-L801 HydrophobicContact CD2-CG 4.2Å; L797-L801 WeakPolarHBondContact O-CG 3.46Å; L797-L801 PolarHBondContact O-N 3.22Å; A798-L801 PolarHBondContact O-N 3.4Å; A799-L801 VanDerWaalsContact C-N 3.33Å; A799-L801 PolarHBondContact O-N 3.14Å; L801-H805 WeakPolarHBondContact O-CB 3.38Å; L801-H805 PolarHBondContact O-N 2.63Å
802	E	90.1	Very high	83.9	Confident	57 Å²	57	71 Å²	71	27%	0.266	39%	0.387	S	S	.	.	H	α-helix	trans	-70.4	-37.2	176.2	-76.2	170.2	170.6	0	0	112.6	L786 R790 A798 A799 H805 T806	L786-E802 HydrophobicContact CD1-CG 3.66Å; L786-E802 HydrophobicContact CD2-CG 3.93Å; L786-E802 HydrophobicContact CG-CG 4.4Å; R790-E802 IonicContact CZ-OE1 3.69Å; R790-E802 VanDerWaalsContact CZ-OE1 3.27Å; R790-E802 IonicContact CZ-OE2 2.8Å; R790-E802 IonicContact NH1-OE1 3.25Å; R790-E802 PolarHBondContact NH1-OE1 2.7Å; R790-E802 IonicContact NH1-OE2 3.93Å; R790-E802 IonicContact NH2-OE1 2.79Å; R790-E802 PolarHBondContact NH2-OE1 2.98Å; R790-E802 IonicContact NH2-OE2 3.91Å; R790-E802 PolarHBondContact NH2-OE2 3.07Å; A798-E802 WeakPolarHBondContact O-CG 3.39Å; A798-E802 PolarHBondContact O-N 3.17Å; A799-E802 PolarHBondContact O-N 3.1Å; E802-H805 WeakPolarHBondContact O-CB 3.3Å; E802-H805 PolarHBondContact O-N 3.03Å; E802-T806 WeakPolarHBondContact O-CB 3.31Å; E802-T806 PolarHBondContact O-N 3.36Å; E802-T806 PolarHBondContact O-OG1 3.37Å
803	E	88.9	Confident	82.6	Confident	103 Å²	103	73.3 Å²	73.3	48%	0.481	41%	0.408	S	S	.	.	H	α-helix	trans	-62.4	-49.8	172	-177.8	56.3	-146.3	0	0	110.5	A799 H805 T806 Q807	A799-E803 WeakPolarHBondContact O-CB 3.48Å; A799-E803 PolarHBondContact O-N 3.41Å; E803-H805 PolarHBondContact O-N 2.84Å; E803-T806 PolarHBondContact O-N 2.82Å; E803-T806 VanDerWaalsContact O-N 3.17Å; E803-Q807 WeakPolarHBondContact O-CB 3.4Å; E803-Q807 VanDerWaalsContact O-CG 3.3Å; E803-Q807 WeakPolarHBondContact O-CG 3.48Å; E803-Q807 PolarHBondContact O-N 3.32Å; E803-Q807 PolarHBondContact OE1-NE2 3.28Å
804	L	87.3	Confident	81.2	Confident	65 Å²	65	81 Å²	81	34%	0.34	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-28	174.3	-71.6	171	0	0	0	113.3	E765 Y768 A800 R808	E765-L804 HydrophobicContact CG-CD1 4.3Å; Y768-L804 HydrophobicContact CD1-CB 4.07Å; Y768-L804 HydrophobicContact CD1-CD1 4.49Å; Y768-L804 HydrophobicContact CE1-CB 3.8Å; A800-L804 WeakPolarHBondContact O-CB 3.4Å; A800-L804 VanDerWaalsContact O-CG 3.26Å; A800-L804 WeakPolarHBondContact O-CG 3.49Å; A800-L804 PolarHBondContact O-N 2.97Å; A800-L804 VanDerWaalsContact O-N 3.14Å; L804-R808 WeakPolarHBondContact O-CB 3.28Å; L804-R808 PolarHBondContact O-N 3.36Å
805	H	87.9	Confident	79.2	Confident	93 Å²	93	85.9 Å²	85.9	43%	0.431	45%	0.449	S	S	.	.	H	α-helix	trans	-73.7	-44.7	173.7	-166.9	84.6	0	0	0	111.8	Y768 L775 L801 E802 E803 R808 A809	Y768-H805 AromaticContact CZ-ND1 3.93Å; Y768-H805 WeakPolarHBondContact OH-CA 3.48Å; Y768-H805 PolarHBondContact OH-ND1 2.82Å; L775-H805 HydrophobicContact CD2-CB 4.38Å; L801-H805 WeakPolarHBondContact O-CB 3.38Å; L801-H805 PolarHBondContact O-N 2.63Å; E802-H805 WeakPolarHBondContact O-CB 3.3Å; E802-H805 PolarHBondContact O-N 3.03Å; E803-H805 PolarHBondContact O-N 2.84Å; H805-R808 PolarHBondContact O-N 3.09Å; H805-A809 PolarHBondContact O-N 3.45Å
806	T	85.1	Confident	76.9	Confident	65 Å²	65	84 Å²	84	40%	0.399	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-46.2	178.6	-55.7	0	0	0	0	111	E802 E803 R808 A809 Q810	E802-T806 WeakPolarHBondContact O-CB 3.31Å; E802-T806 PolarHBondContact O-N 3.36Å; E802-T806 PolarHBondContact O-OG1 3.37Å; E803-T806 PolarHBondContact O-N 2.82Å; E803-T806 VanDerWaalsContact O-N 3.17Å; T806-R808 VanDerWaalsContact C-N 3.31Å; T806-R808 PolarHBondContact O-N 3.35Å; T806-A809 PolarHBondContact O-N 3.05Å; T806-Q810 WeakPolarHBondContact O-CG 3.2Å; T806-Q810 PolarHBondContact O-N 3.05Å
807	Q	83.8	Confident	74.6	Confident	95 Å²	95	79.8 Å²	79.8	44%	0.444	45%	0.446	S	S	.	.	H	α-helix	trans	-59	-39.9	174	-70	176	9.4	0	0	112.2	E803 Q810 A811	E803-Q807 WeakPolarHBondContact O-CB 3.4Å; E803-Q807 VanDerWaalsContact O-CG 3.3Å; E803-Q807 WeakPolarHBondContact O-CG 3.48Å; E803-Q807 PolarHBondContact O-N 3.32Å; E803-Q807 PolarHBondContact OE1-NE2 3.28Å; Q807-Q810 PolarHBondContact O-N 3.31Å; Q807-A811 WeakPolarHBondContact O-CB 3.43Å; Q807-A811 PolarHBondContact O-N 3.09Å
808	R	80.7	Confident	72.2	Confident	139 Å²	139	85 Å²	85	53%	0.525	48%	0.481	S	S	.	.	H	α-helix	trans	-69.4	-35	178.5	-166	169.4	-171.2	142.6	5	112.7	S769 L804 H805 T806 A812	S769-R808 PolarHBondContact O-NH1 3.46Å; L804-R808 WeakPolarHBondContact O-CB 3.28Å; L804-R808 PolarHBondContact O-N 3.36Å; H805-R808 PolarHBondContact O-N 3.09Å; T806-R808 VanDerWaalsContact C-N 3.31Å; T806-R808 PolarHBondContact O-N 3.35Å; R808-A812 PolarHBondContact O-N 2.93Å; R808-A812 VanDerWaalsContact O-N 3.13Å
809	A	74.8	Confident	69.5	Low	57 Å²	57	90.9 Å²	90.9	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-68.4	-40.3	172.7	0	0	0	0	0	112.3	H805 T806 A812 T813	H805-A809 PolarHBondContact O-N 3.45Å; T806-A809 PolarHBondContact O-N 3.05Å; A809-A812 PolarHBondContact O-N 3.16Å; A809-T813 PolarHBondContact O-N 3.46Å; A809-T813 PolarHBondContact O-OG1 2.99Å; A809-T813 VanDerWaalsContact O-OG1 3.12Å
810	Q	72.6	Confident	66.7	Low	123 Å²	123	93.8 Å²	93.8	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-68.1	-31.8	174.7	-69.9	176.7	7.7	0	0	112.9	T806 Q807 T813	T806-Q810 WeakPolarHBondContact O-CG 3.2Å; T806-Q810 PolarHBondContact O-N 3.05Å; Q807-Q810 PolarHBondContact O-N 3.31Å; Q810-T813 WeakPolarHBondContact CA-OG1 3.41Å; Q810-T813 PolarHBondContact O-OG1 2.84Å
811	A	65.5	Low	64.7	Low	58 Å²	58	98.3 Å²	98.3	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-67.6	-45.4	172.3	0	0	0	0	0	111.6	Q807 T813 R814	Q807-A811 WeakPolarHBondContact O-CB 3.43Å; Q807-A811 PolarHBondContact O-N 3.09Å; A811-T813 PolarHBondContact O-N 3.5Å; A811-T813 VanDerWaalsContact O-N 3.09Å; A811-R814 PolarHBondContact O-N 3.19Å; A811-R814 VanDerWaalsContact O-N 3.11Å
812	A	61	Low	61.6	Low	79 Å²	79	105.9 Å²	105.9	65%	0.653	60%	0.603	S	S	*	*	H	α-helix	trans	-62.7	-16.7	-179.7	0	0	0	0	0	114.4	R808 A809	R808-A812 PolarHBondContact O-N 2.93Å; R808-A812 VanDerWaalsContact O-N 3.13Å; A809-A812 PolarHBondContact O-N 3.16Å
813	T	56.3	Low	58.6	Low	111 Å²	111	108.1 Å²	108.1	68%	0.681	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	5.8	177.7	39	0	0	0	0	114.2	A809 Q810 A811	A809-T813 PolarHBondContact O-N 3.46Å; A809-T813 PolarHBondContact O-OG1 2.99Å; A809-T813 VanDerWaalsContact O-OG1 3.12Å; Q810-T813 WeakPolarHBondContact CA-OG1 3.41Å; Q810-T813 PolarHBondContact O-OG1 2.84Å; A811-T813 PolarHBondContact O-N 3.5Å; A811-T813 VanDerWaalsContact O-N 3.09Å
814	R	53.3	Low	55.6	Low	214 Å²	214	109.7 Å²	109.7	81%	0.808	64%	0.642	S	S	*	*	S	Bend	trans	-100.9	-19.5	179	-63.5	-176.9	74.7	160	2.8	115.1	A811	A811-R814 PolarHBondContact O-N 3.19Å; A811-R814 VanDerWaalsContact O-N 3.11Å
815	D	47.3	Very low	52.6	Low	162 Å²	162	111.4 Å²	111.4	87%	0.866	66%	0.659	S	S	*	*	S	Bend	trans	-105.9	34.6	-176.4	-68	-37.3	0	0	0	113.4
816	G	41.7	Very low	49.8	Very low	47 Å²	47	113.7 Å²	113.7	49%	0.485	67%	0.674	S	S	.	*	S	Bend	trans	-150.6	148.8	176.2	0	0	0	0	0	113
817	P	40.8	Very low	46.8	Very low	123 Å²	123	117.9 Å²	117.9	80%	0.799	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-68.7	144.6	177.9	29.6	-34.8	0	0	0	111.1	P819	P817-P819 WeakPolarHBondContact O-CD 3.34Å
818	P	38.9	Very low	44.2	Very low	117 Å²	117	118.6 Å²	118.6	76%	0.76	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-77.4	125.6	-172.7	29.6	-34.5	0	0	0	112.5
819	P	35.1	Very low	42	Very low	123 Å²	123	115.5 Å²	115.5	80%	0.799	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.3	144	158.7	31	-32.4	0	0	0	109.9	P817	P817-P819 WeakPolarHBondContact O-CD 3.34Å
820	S	30.2	Very low	39.8	Very low	114 Å²	114	120.1 Å²	120.1	80%	0.797	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-76.6	153.4	-175.4	-58.3	0	0	0	0	113.1
821	P	46.9	Very low	37.6	Very low	118 Å²	118	119.5 Å²	119.5	77%	0.766	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-87.4	136.7	179.1	33.9	-33.4	0	0	0	112.8
822	L	26.3	Very low	35.7	Very low	161 Å²	161	122.3 Å²	122.3	84%	0.843	76%	0.757	S	S	*	*			trans	170.7	151.8	130.6	-94.8	167.1	0	0	0	110.9
823	S	25.5	Very low	34	Very low	103 Å²	103	123.5 Å²	123.5	72%	0.72	76%	0.761	S	S	*	*			trans	42.7	132.8	154	-58.9	0	0	0	0	120.1
824	T	25.9	Very low	32.8	Very low	136 Å²	136	123.7 Å²	123.7	83%	0.834	77%	0.767	S	S	*	*			cis	-139.8	162.7	39.5	44.4	0	0	0	0	114.9
825	S	24.1	Very low	31.6	Very low	101 Å²	101	118.7 Å²	118.7	71%	0.706	77%	0.765	S	S	*	*			trans	-62.3	174.4	159.6	-169.7	0	0	0	0	111.9
826	L	29.2	Very low	30.8	Very low	141 Å²	141	118.2 Å²	118.2	74%	0.738	76%	0.761	S	S	*	*			trans	-23.4	143.4	174.6	-73.9	74.9	0	0	0	115.8
827	D	22.6	Very low	30.5	Very low	153 Å²	153	122.1 Å²	122.1	82%	0.818	78%	0.778	S	S	*	*				-144.1	159.9	109.7	-128.1	-32.6	0	0	0	114.5
828	T	28.9	Very low	29.7	Very low	111 Å²	111	121 Å²	121	68%	0.681	77%	0.773	S	S	*	*			trans	-77.2	155.3	-162.7	51.1	0	0	0	0	115.6
829	G	34.9	Very low	30	Very low	73 Å²	73	121 Å²	121	75%	0.753	77%	0.773	S	S	*	*			trans	-90	160.2	164.4	0	0	0	0	0	112.9
830	L	28.8	Very low	29.6	Very low	154 Å²	154	120.6 Å²	120.6	81%	0.806	77%	0.773	S	S	*	*			trans	-125.7	139.4	168.9	-59.5	170.9	0	0	0	106.4
831	S	27.3	Very low	29.4	Very low	110 Å²	110	122.6 Å²	122.6	77%	0.769	78%	0.775	S	S	*	*	S	Bend	cis	-162.3	153.2	49.5	-62.3	0	0	0	0	109.9
832	S	24.1	Very low	29.3	Very low	117 Å²	117	122.2 Å²	122.2	82%	0.818	77%	0.773	S	S	*	*			cis	-152.6	161.2	-5.4	-100	0	0	0	0	111.5
833	S	26.8	Very low	29.4	Very low	105 Å²	105	120.3 Å²	120.3	73%	0.734	77%	0.773	S	S	*	*			trans	-113	169.9	-169.7	54.3	0	0	0	0	114.2
834	S	29.6	Very low	29.4	Very low	114 Å²	114	120.6 Å²	120.6	80%	0.797	78%	0.775	S	S	*	*			trans	-179.5	151.9	133.2	31.7	0	0	0	0	112.4
835	S	29.1	Very low	30.2	Very low	110 Å²	110	119.7 Å²	119.7	77%	0.769	77%	0.771	S	S	*	*			cis	-162.2	153.6	-22.8	-96	0	0	0	0	113.2
836	L	29.6	Very low	30.2	Very low	152 Å²	152	120 Å²	120	80%	0.796	77%	0.773	S	S	*	*			trans	-31.9	160.8	164.9	-70.1	169.1	0	0	0	119
837	P	35	Very low	31.2	Very low	129 Å²	129	118.9 Å²	118.9	84%	0.838	78%	0.775	S	S	*	*				-141.8	177	76.4	36.9	-17.1	0	0	0	118.4
838	S	25.5	Very low	31.3	Very low	100 Å²	100	117.6 Å²	117.6	70%	0.699	78%	0.778	S	S	*	*			trans	-107.2	-162.5	-172.9	-38.1	0	0	0	0	112.1
839	P	45.8	Very low	31.4	Very low	115 Å²	115	117.6 Å²	117.6	75%	0.747	78%	0.782	S	S	*	*			cis	-136.9	179.8	-12.2	40.8	-23.1	0	0	0	116.3
840	S	26.4	Very low	31	Very low	115 Å²	115	118.1 Å²	118.1	80%	0.804	78%	0.779	S	S	*	*			trans	132.9	143.4	144	-54.3	0	0	0	0	117.2
841	D	24.3	Very low	30.9	Very low	156 Å²	156	121.2 Å²	121.2	83%	0.834	78%	0.782	S	S	*	*			trans	-89.9	-174.9	177	-63.1	-73.7	0	0	0	113.4
842	P	46.3	Very low	31	Very low	111 Å²	111	120.6 Å²	120.6	72%	0.721	78%	0.778	S	S	*	*			cis	-129.6	179.1	-17.2	22.6	0.5	0	0	0	114.7
843	S	27	Very low	31.4	Very low	120 Å²	120	120.7 Å²	120.7	84%	0.839	78%	0.778	S	S	*	*			trans	126.2	146.1	141.9	-53.2	0	0	0	0	117.5
844	S	25.4	Very low	31.2	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	78%	0.781	S	S	*	*			trans	-100.5	172.2	173.8	57.7	0	0	0	0	111.8
845	P	43.4	Very low	32.5	Very low	116 Å²	116	119.9 Å²	119.9	75%	0.753	78%	0.781	S	S	*	*			cis	-133.3	-164.6	6.3	42.8	-24.3	0	0	0	115.3
846	S	24.1	Very low	32.4	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	78%	0.783	S	S	*	*			trans	-41.1	173.8	169.1	-47.5	0	0	0	0	118.1
847	P	50.4	Low	33.3	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	78%	0.781	S	S	*	*			cis	-136.1	167.4	-39.8	36.5	-21.2	0	0	0	113.7
848	S	25.2	Very low	33	Very low	126 Å²	126	119.1 Å²	119.1	88%	0.881	78%	0.779	S	S	*	*			trans	177.7	172.9	141.3	-88.2	0	0	0	0	114.8
849	S	29.7	Very low	33	Very low	110 Å²	110	120.2 Å²	120.2	77%	0.769	78%	0.777	S	S	*	*			trans	-82.2	164.8	-167.3	56	0	0	0	0	118.4
850	A	27.1	Very low	32.1	Very low	84 Å²	84	121.1 Å²	121.1	69%	0.694	78%	0.781	S	S	*	*			trans	100.6	122.8	136.9	0	0	0	0	0	122
851	Y	27.3	Very low	32	Very low	219 Å²	219	121.2 Å²	121.2	86%	0.859	78%	0.781	S	S	*	*			trans	65.4	103.5	142.5	-81.1	-105.9	0	0	0	123.6
852	S	29	Very low	33.2	Very low	98 Å²	98	119.2 Å²	119.2	69%	0.685	78%	0.777	S	S	*	*				68.8	120.6	115.6	-57	0	0	0	0	125.3
853	S	32.1	Very low	32.2	Very low	119 Å²	119	118.9 Å²	118.9	83%	0.832	78%	0.777	S	S	*	*				97.6	88.8	129.4	-61.2	0	0	0	0	124.9
854	G	23.3	Very low	32	Very low	77 Å²	77	118.6 Å²	118.6	79%	0.794	78%	0.775	S	S	*	*			trans	59.2	-170.3	133.9	0	0	0	0	0	122.1
855	P	56.3	Low	32.9	Very low	124 Å²	124	118.6 Å²	118.6	81%	0.805	77%	0.773	S	S	*	*			cis	-143.9	153.9	-25.8	39.4	-21.4	0	0	0	118.2
856	A	26.6	Very low	32.1	Very low	96 Å²	96	118 Å²	118	79%	0.793	77%	0.771	S	S	*	*			trans	62.5	-177.8	152.9	0	0	0	0	0	119.4
857	P	49.1	Very low	32.2	Very low	116 Å²	116	118 Å²	118	75%	0.753	77%	0.771	S	S	*	*			cis	-135.7	163.2	-12.7	15.3	11.7	0	0	0	119.2
858	M	29.5	Very low	30.9	Very low	164 Å²	164	119.9 Å²	119.9	81%	0.808	77%	0.774	S	S	*	*			trans	80.1	136.2	138.6	-70.6	-60.9	-121.7	0	0	128.1
859	D	24.5	Very low	30.9	Very low	122 Å²	122	118.7 Å²	118.7	65%	0.652	77%	0.765	S	S	*	*				103.1	113	129.8	-80.5	-30.9	0	0	0	128.1
860	T	26.8	Very low	30.7	Very low	134 Å²	134	118.1 Å²	118.1	82%	0.822	76%	0.761	S	S	*	*			trans	86	158.9	139.7	60.2	0	0	0	0	124.9
861	S	25.2	Very low	30.6	Very low	117 Å²	117	119.6 Å²	119.6	82%	0.818	77%	0.767	S	S	*	*			trans	-120.6	-158.9	-162.5	-39.7	0	0	0	0	111.6
862	P	48.7	Very low	30.4	Very low	115 Å²	115	113.6 Å²	113.6	75%	0.747	76%	0.757	S	S	*	*			cis	-146.8	-173	4.9	45.3	-24	0	0	0	119.6
863	S	26.2	Very low	30.2	Very low	103 Å²	103	116.8 Å²	116.8	72%	0.72	77%	0.765	S	S	*	*			trans	84	111	144.4	-64	0	0	0	0	125.6
864	S	22.7	Very low	29.8	Very low	115 Å²	115	115.4 Å²	115.4	80%	0.804	76%	0.756	S	S	*	*				53.7	164.2	117	-69.9	0	0	0	0	124.6
865	P	44.4	Very low	29.8	Very low	110 Å²	110	119.6 Å²	119.6	71%	0.714	76%	0.759	S	S	*	*			cis	-144.2	173.5	-18.8	36.8	-15.1	0	0	0	119.6
866	S	26.4	Very low	28.1	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	76%	0.755	S	S	*	*			trans	83.5	139	134.4	63.5	0	0	0	0	127.9
867	S	25.4	Very low	28.8	Very low	110 Å²	110	119.6 Å²	119.6	77%	0.769	75%	0.753	S	S	*	*			trans	83.8	150.5	144.2	79.7	0	0	0	0	121.5
868	L	24.4	Very low	27.6	Very low	157 Å²	157	119.5 Å²	119.5	82%	0.822	76%	0.755	S	S	*	*			cis	-169.2	163.2	-26.9	-114.4	171	0	0	0	112.7
869	S	25.3	Very low	27.5	Very low	100 Å²	100	117.3 Å²	117.3	70%	0.699	76%	0.756	S	S	*	*			trans	70	157.4	153	-72.7	0	0	0	0	122.4
870	S	23.9	Very low	28	Very low	98 Å²	98	117.8 Å²	117.8	69%	0.685	77%	0.766	S	S	*	*			cis	-174	145.9	-22.2	-89.8	0	0	0	0	113.5
871	S	25	Very low	27.8	Very low	115 Å²	115	116.3 Å²	116.3	80%	0.804	76%	0.761	S	S	*	*			trans	65.6	158.6	143.1	-66.7	0	0	0	0	122.3
872	S	24.3	Very low	27.7	Very low	94 Å²	94	120.2 Å²	120.2	66%	0.657	76%	0.763	S	S	*	*			cis	-177.6	146.6	-13.8	52.2	0	0	0	0	115.4
873	L	24.5	Very low	26.5	Very low	164 Å²	164	122 Å²	122	86%	0.859	77%	0.765	S	S	*	*			trans	63.3	166.3	147.7	-62.8	164.8	0	0	0	121.3
874	S	24	Very low	26.3	Very low	91 Å²	91	125.4 Å²	125.4	64%	0.636	77%	0.77	S	S	*	*			cis	-174.3	164.5	-45.6	62	0	0	0	0	112.4
875	I	22.5	Very low	26.3	Very low	165 Å²	165	124.5 Å²	124.5	85%	0.846	76%	0.763	S	S	*	*			trans	146.6	149.7	148.3	-75.3	163.9	0	0	0	116.2
876	S	21.1	Very low	25.2	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	77%	0.769	S	S	*	*			trans	-82.6	-161.2	-168.3	-35.5	0	0	0	0	115.9
877	P	41.4	Very low	25.5	Very low	115 Å²	115	127.3 Å²	127.3	75%	0.747	77%	0.774	S	S	*	*			cis	-142.6	-175.9	-2.9	38.3	-15.6	0	0	0	118.3
878	S	23.3	Very low	25.7	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	78%	0.775	S	S	*	*			trans	133	146.7	136.1	-62.6	0	0	0	0	119.9
879	S	27.9	Very low	25.6	Very low	119 Å²	119	128 Å²	128	83%	0.832	78%	0.776	S	S	*	*			trans	-146.6	160.7	165.7	-45.2	0	0	0	0	107.9
880	P	33.9	Very low	25.5	Very low	132 Å²	132	127.1 Å²	127.1	86%	0.857	77%	0.774	S	S	*	*				-153.2	-123.2	68.4	40.8	-15.8	0	0	0	115.5
881	S	23	Very low	25.5	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	78%	0.779	S	S	*	*			trans	-154.2	154	-149	59.9	0	0	0	0	120.1
882	F	24.3	Very low	25.4	Very low	198 Å²	198	129 Å²	129	87%	0.868	77%	0.774	S	S	*	*			trans	86.3	164	147.8	-118.7	-96.6	0	0	0	122.4
883	I	23	Very low	25.3	Very low	154 Å²	154	133.7 Å²	133.7	79%	0.79	78%	0.777	S	S	*	*			trans	93.6	143.8	178.2	-59.6	170.5	0	0	0	115.9
884	Q	22.3	Very low	25.2	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.813	77%	0.765	S	S	*	*			cis	-171.4	154.8	-39	-163.8	178.9	-18.6	0	0	111.1
885	S	21.6	Very low	25	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	77%	0.767	S	S	*	*			trans	75.5	121.5	151	-168.9	0	0	0	0	122.5
886	T	21.2	Very low	25.2	Very low	135 Å²	135	136 Å²	136	83%	0.828	76%	0.763	S	S	*	*				-171.3	161.1	114.3	14.2	0	0	0	0	113.3
887	V	33.3	Very low	25.7	Very low	136 Å²	136	136.5 Å²	136.5	82%	0.824	76%	0.764	S	S	*	*			trans	-146.2	140	168.7	-157.6	0	0	0	0	108.8
888	P	30.5	Very low	24.9	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	76%	0.763	S	S	*	*				-149.4	179.8	127	35.9	-18.8	0	0	0	113.3
889	L	21.1	Very low	25.5	Very low	160 Å²	160	136.9 Å²	136.9	84%	0.838	76%	0.756	S	S	*	*			cis	-176.5	126.6	-39.4	172.1	62.9	0	0	0	109
890	A	23.3	Very low	25.3	Very low	81 Å²	81	136.6 Å²	136.6	67%	0.669	75%	0.75	S	S	*	*			trans	54.9	147.5	164.3	0	0	0	0	0	118.2
891	S	24.6	Very low	24.9	Very low	114 Å²	114	137 Å²	137	80%	0.797	75%	0.75	S	S	*	*				-179.8	164.3	61.5	-74.9	0	0	0	0	110
892	M	21.7	Very low	24.9	Very low	139 Å²	139	135.7 Å²	135.7	69%	0.685	75%	0.752	S	S	*	*			cis	-177.5	145.1	-29.3	-152.1	179.2	-175.1	0	0	107.9
893	W	23	Very low	24.9	Very low	192 Å²	192	133.1 Å²	133.1	73%	0.727	75%	0.753	S	S	*	*			trans	68.2	158.3	168.8	-59.3	114.9	0	0	0	116.9
894	R	21.3	Very low	24.9	Very low	159 Å²	159	129.8 Å²	129.8	60%	0.6	76%	0.756	S	S	*	*			cis	-170.9	158.1	-7.6	152	-177.2	-65.5	-102.6	5	112.7
895	E	19.9	Very low	25	Very low	148 Å²	148	129.2 Å²	129.2	69%	0.692	76%	0.759	S	S	*	*			trans	65.2	119.8	159.1	-83.4	142.9	-150.4	0	0	124.5
896	E	28.6	Very low	25.9	Very low	162 Å²	162	129.9 Å²	129.9	76%	0.757	76%	0.761	S	S	*	*			trans	-68.7	150.9	131.5	-80.3	-82.5	150.8	0	0	110.1
897	P	29.8	Very low	26	Very low	115 Å²	115	126.5 Å²	126.5	75%	0.747	75%	0.753	S	S	*	*				-149.9	140.5	97.4	37.4	-20	0	0	0	117.6
898	N	25.3	Very low	25.6	Very low	136 Å²	136	128 Å²	128	73%	0.727	76%	0.756	S	S	*	*			trans	-60.8	148.7	153.7	-164.7	0.9	0	0	0	110.6
899	P	36.2	Very low	25.3	Very low	100 Å²	100	126.7 Å²	126.7	65%	0.649	76%	0.756	S	S	*	*				-157.9	160.7	100	41.3	-22	0	0	0	119.2
900	T	23.4	Very low	25.5	Very low	114 Å²	114	123.8 Å²	123.8	70%	0.699	76%	0.755	S	S	*	*			trans	66.5	120.6	138.8	50.5	0	0	0	0	124.6
901	V	24.7	Very low	25.6	Very low	141 Å²	141	125.7 Å²	125.7	86%	0.855	76%	0.763	S	S	*	*				68.6	125.1	125.3	179.7	0	0	0	0	120
902	G	24	Very low	25.5	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	77%	0.766	S	S	*	*			trans	-175.3	83.5	171.3	0	0	0	0	0	113.7
903	T	23.8	Very low	25.8	Very low	143 Å²	143	125.2 Å²	125.2	88%	0.877	77%	0.771	S	S	*	*			trans	-51.6	142.2	173.9	46.9	0	0	0	0	115.3
904	G	23.8	Very low	26.2	Very low	84 Å²	84	124 Å²	124	87%	0.866	78%	0.777	S	S	*	*			trans	174.1	111.7	166	0	0	0	0	0	116.8
905	N	24.3	Very low	26.8	Very low	162 Å²	162	121.5 Å²	121.5	87%	0.866	78%	0.781	S	S	*	*			trans	-117.2	168	160.5	-153.9	22.1	0	0	0	105.7
906	P	39.8	Very low	27	Very low	110 Å²	110	119.4 Å²	119.4	71%	0.714	78%	0.783	S	S	*	*			cis	-132.8	-176	-9.4	42.8	-27	0	0	0	114.3
907	G	22.8	Very low	27.1	Very low	64 Å²	64	121.2 Å²	121.2	66%	0.66	79%	0.791	S	S	*	*				91.7	119.7	125.9	0	0	0	0	0	121.9
908	N	26.3	Very low	26.9	Very low	168 Å²	168	121 Å²	121	90%	0.898	79%	0.793	S	S	*	*			trans	78.2	129.9	141.8	-70.5	-1.5	0	0	0	123.8
909	A	24.2	Very low	27	Very low	94 Å²	94	120.2 Å²	120.2	78%	0.777	80%	0.798	S	S	*	*			trans	83.1	91.5	135.7	0	0	0	0	0	121.7
910	A	24.8	Very low	26.6	Very low	99 Å²	99	119.9 Å²	119.9	82%	0.818	79%	0.793	S	S	*	*				53.6	107	122.6	0	0	0	0	0	121.4
911	S	24.7	Very low	27	Very low	120 Å²	120	117.9 Å²	117.9	84%	0.839	78%	0.781	S	S	*	*				-167.9	156.3	113.8	34.3	0	0	0	0	110.6
912	S	23.6	Very low	27.3	Very low	124 Å²	124	118.8 Å²	118.8	87%	0.867	78%	0.778	S	S	*	*			trans	-106	137.1	-171.5	-57.8	0	0	0	0	112.7
913	P	27.3	Very low	27.7	Very low	119 Å²	119	120.1 Å²	120.1	77%	0.773	77%	0.771	S	S	*	*			trans	-101.8	153.2	163.1	36.2	-30.3	0	0	0	113
914	I	31.1	Very low	28	Very low	166 Å²	166	116.3 Å²	116.3	85%	0.851	75%	0.746	S	S	*	*			trans	-97.6	134.5	165.5	-70.9	162.4	0	0	0	106.4
915	P	34.3	Very low	28.5	Very low	108 Å²	108	117 Å²	117	70%	0.701	73%	0.729	S	S	*	*				-157.3	159	105.7	41.5	-22.1	0	0	0	119.4
916	S	24.8	Very low	29.2	Very low	103 Å²	103	115.2 Å²	115.2	72%	0.72	72%	0.718	S	S	*	*			trans	30.8	107.7	145.8	64.5	0	0	0	0	122.4
917	Q	30.2	Very low	28.9	Very low	201 Å²	201	118.5 Å²	118.5	94%	0.939	72%	0.716	S	S	*	*			trans	18.8	125	136.6	-56.4	-173.8	29.1	0	0	120.8
918	S	26.1	Very low	29.4	Very low	111 Å²	111	120.2 Å²	120.2	78%	0.776	71%	0.709	S	S	*	*			trans	-133.6	167.5	143.3	57	0	0	0	0	109.1	V920	S918-V920 PolarHBondContact O-N 3.06Å
919	S	27.4	Very low	29.7	Very low	119 Å²	119	118.4 Å²	118.4	83%	0.832	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-69.3	124.1	-168.4	54.7	0	0	0	0	113.8
920	V	27.6	Very low	30.3	Very low	92 Å²	92	119.8 Å²	119.8	56%	0.558	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-93.1	135.2	-176.1	177.4	0	0	0	0	110.8	S918 D924 I928	S918-V920 PolarHBondContact O-N 3.06Å; V920-D924 HydrophobicContact CG1-CB 3.45Å; V920-D924 VanDerWaalsContact CG1-CB 3.45Å; V920-I928 HydrophobicContact CG1-CD1 4.25Å
921	T	31.8	Very low	30.8	Very low	72 Å²	72	120 Å²	120	44%	0.442	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-91	164.3	-175.6	70.4	0	0	0	0	112.8	T923 D924 L925	T921-T923 PolarHBondContact O-N 2.9Å; T921-T923 PolarHBondContact OG1-OG1 3.49Å; T921-D924 WeakPolarHBondContact CA-OD2 3.4Å; T921-D924 WeakPolarHBondContact CB-OD2 3.49Å; T921-D924 PolarHBondContact N-OD2 3.34Å; T921-D924 WeakPolarHBondContact O-CB 3.37Å; T921-D924 PolarHBondContact O-N 3.36Å; T921-D924 VanDerWaalsContact OG1-CG 3.28Å; T921-D924 PolarHBondContact OG1-OD2 3.28Å; T921-L925 PolarHBondContact O-N 2.96Å
922	M	30.3	Very low	31.2	Very low	161 Å²	161	122.9 Å²	122.9	79%	0.793	68%	0.684	S	S	*	*	H	α-helix	trans	-64.6	-24.9	-178.6	-163.5	173.4	-173.4	0	0	113	D924	M922-D924 VanDerWaalsContact C-N 3.34Å
923	T	32.8	Very low	31.4	Very low	103 Å²	103	124.7 Å²	124.7	63%	0.632	68%	0.677	S	S	*	*	H	α-helix	trans	-65.9	-34.4	169.2	23.2	0	0	0	0	112.8	T921 I926 W927	T921-T923 PolarHBondContact O-N 2.9Å; T921-T923 PolarHBondContact OG1-OG1 3.49Å; T923-I926 WeakPolarHBondContact O-CB 3.41Å; T923-I926 PolarHBondContact O-N 3.35Å; T923-W927 PolarHBondContact O-N 3.4Å
924	D	30.6	Very low	31.7	Very low	63 Å²	63	121.8 Å²	121.8	34%	0.337	67%	0.669	S	S	.	*	H	α-helix	trans	-75.3	-30.7	179.3	-53.1	-48.9	0	0	0	111.8	V920 T921 M922 I926 W927 I928	V920-D924 HydrophobicContact CG1-CB 3.45Å; V920-D924 VanDerWaalsContact CG1-CB 3.45Å; T921-D924 WeakPolarHBondContact CA-OD2 3.4Å; T921-D924 WeakPolarHBondContact CB-OD2 3.49Å; T921-D924 PolarHBondContact N-OD2 3.34Å; T921-D924 WeakPolarHBondContact O-CB 3.37Å; T921-D924 PolarHBondContact O-N 3.36Å; T921-D924 VanDerWaalsContact OG1-CG 3.28Å; T921-D924 PolarHBondContact OG1-OD2 3.28Å; M922-D924 VanDerWaalsContact C-N 3.34Å; D924-I926 PolarHBondContact O-N 3.28Å; D924-W927 CarbonylContact O-C 3.59Å; D924-W927 WeakPolarHBondContact O-CA 3.4Å; D924-W927 WeakPolarHBondContact O-CB 3.49Å; D924-W927 PolarHBondContact O-N 3.26Å; D924-I928 VanDerWaalsContact O-CG1 3.3Å; D924-I928 WeakPolarHBondContact O-CG1 3.37Å; D924-I928 PolarHBondContact O-N 3.19Å
925	L	33.7	Very low	31.8	Very low	98 Å²	98	120.6 Å²	120.6	51%	0.513	67%	0.672	S	S	.	*	H	α-helix	trans	-63.3	-29.7	171.5	-70.1	174.3	0	0	0	112.3	T921 N929	T921-L925 PolarHBondContact O-N 2.96Å; L925-N929 PolarHBondContact O-ND2 2.96Å
926	I	39.5	Very low	31.7	Very low	125 Å²	125	119.1 Å²	119.1	64%	0.641	66%	0.66	S	S	*	*	H	α-helix	trans	-74.2	-33.3	172.3	-61.6	170.7	0	0	0	110.7	T923 D924	T923-I926 WeakPolarHBondContact O-CB 3.41Å; T923-I926 PolarHBondContact O-N 3.35Å; D924-I926 PolarHBondContact O-N 3.28Å
927	W	33.8	Very low	32.1	Very low	179 Å²	179	119 Å²	119	68%	0.678	65%	0.652	S	S	*	*	H	α-helix	trans	-71.3	-47.4	176.3	-173.6	-106.8	0	0	0	112.9	T923 D924 N929 L930	T923-W927 PolarHBondContact O-N 3.4Å; D924-W927 CarbonylContact O-C 3.59Å; D924-W927 WeakPolarHBondContact O-CA 3.4Å; D924-W927 WeakPolarHBondContact O-CB 3.49Å; D924-W927 PolarHBondContact O-N 3.26Å; W927-N929 VanDerWaalsContact C-N 3.31Å; W927-N929 PolarHBondContact O-N 3.23Å; W927-L930 WeakPolarHBondContact O-CB 3.4Å; W927-L930 PolarHBondContact O-N 3.45Å
928	I	33.5	Very low	32.3	Very low	100 Å²	100	116.2 Å²	116.2	51%	0.513	64%	0.641	S	S	.	*	H	α-helix	trans	-59.5	-40	-178.1	-70.8	163.6	0	0	0	111.5	V920 D924 L930	V920-I928 HydrophobicContact CG1-CD1 4.25Å; D924-I928 VanDerWaalsContact O-CG1 3.3Å; D924-I928 WeakPolarHBondContact O-CG1 3.37Å; D924-I928 PolarHBondContact O-N 3.19Å; I928-L930 PolarHBondContact O-N 3.33Å; I928-L930 VanDerWaalsContact O-N 3.14Å
929	N	31.7	Very low	32.7	Very low	129 Å²	129	113.7 Å²	113.7	69%	0.69	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-7.1	176.7	-82.3	-81.1	0	0	0	114.6	L925 W927	L925-N929 PolarHBondContact O-ND2 2.96Å; W927-N929 VanDerWaalsContact C-N 3.31Å; W927-N929 PolarHBondContact O-N 3.23Å
930	L	37.2	Very low	33.5	Very low	123 Å²	123	111 Å²	111	64%	0.644	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-10.3	-174.4	-153.5	69.4	0	0	0	114.2	W927 I928	W927-L930 WeakPolarHBondContact O-CB 3.4Å; W927-L930 PolarHBondContact O-N 3.45Å; I928-L930 PolarHBondContact O-N 3.33Å; I928-L930 VanDerWaalsContact O-N 3.14Å
931	V	35	Very low	34	Very low	105 Å²	105	110.3 Å²	110.3	64%	0.636	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-22.3	-172.8	-179.3	0	0	0	0	113.1	F933	V931-F933 VanDerWaalsContact C-N 3.32Å; V931-F933 PolarHBondContact O-N 3.47Å; V931-F933 VanDerWaalsContact O-N 3.16Å
932	Q	32.1	Very low	34.2	Very low	179 Å²	179	109.1 Å²	109.1	84%	0.836	60%	0.595	S	S	*	*			trans	-90.8	40.3	-172	-158.3	165.1	-5.7	0	0	114.9
933	F	29.6	Very low	34.7	Very low	163 Å²	163	107.6 Å²	107.6	72%	0.715	59%	0.586	S	S	*	*			trans	-130.4	98.5	165.6	-80.6	-79.4	0	0	0	111.1	V931 V936	V931-F933 VanDerWaalsContact C-N 3.32Å; V931-F933 PolarHBondContact O-N 3.47Å; V931-F933 VanDerWaalsContact O-N 3.16Å; F933-V936 HydrophobicContact CD1-CG2 4.16Å
934	G	33.4	Very low	34.9	Very low	58 Å²	58	107 Å²	107	60%	0.598	58%	0.576	S	S	*	*			trans	-67.4	-177.5	163.7	0	0	0	0	0	112.3	V936	G934-V936 PolarHBondContact O-N 3.46Å
935	P	31.6	Very low	35.4	Very low	141 Å²	141	109.3 Å²	109.3	92%	0.916	59%	0.587	S	S	*	*			trans	-63.2	106.3	-177.7	26.6	-34.3	0	0	0	111.3
936	V	32.2	Very low	35.6	Very low	76 Å²	76	110.1 Å²	110.1	46%	0.461	59%	0.591	S	S	.	*			trans	-70.9	131.1	-179.8	-178.7	0	0	0	0	110.1	F933 G934	F933-V936 HydrophobicContact CD1-CG2 4.16Å; G934-V936 PolarHBondContact O-N 3.46Å
937	D	35.2	Very low	35.5	Very low	100 Å²	100	110.7 Å²	110.7	54%	0.535	59%	0.591	S	S	.	*			trans	-72.5	154.3	176.8	-179.1	44.3	0	0	0	112.4	A939 T940 L941	D937-A939 PolarHBondContact O-N 3.4Å; D937-A939 VanDerWaalsContact OD2-CB 3.32Å; D937-A939 WeakPolarHBondContact OD2-CB 3.27Å; D937-A939 PolarHBondContact OD2-N 2.93Å; D937-T940 PolarHBondContact O-N 3.12Å; D937-L941 PolarHBondContact O-N 3.37Å; D937-L941 VanDerWaalsContact O-N 3.17Å
938	M	32.6	Very low	35.6	Very low	144 Å²	144	106.2 Å²	106.2	71%	0.709	59%	0.592	S	S	*	*	H	α-helix	trans	-61.9	-24.4	-179.6	-70	-69.6	-64.5	0	0	113.1	L941 A942	M938-L941 HydrophobicContact SD-CD2 4.2Å; M938-A942 PolarHBondContact O-N 2.85Å
939	A	35.3	Very low	35.7	Very low	58 Å²	58	104.7 Å²	104.7	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-66.7	-52.6	173.5	0	0	0	0	0	111.9	D937 L941 A942 E943	D937-A939 PolarHBondContact O-N 3.4Å; D937-A939 VanDerWaalsContact OD2-CB 3.32Å; D937-A939 WeakPolarHBondContact OD2-CB 3.27Å; D937-A939 PolarHBondContact OD2-N 2.93Å; A939-L941 VanDerWaalsContact C-N 3.27Å; A939-L941 PolarHBondContact O-N 2.8Å; A939-A942 WeakPolarHBondContact O-CA 3.29Å; A939-A942 WeakPolarHBondContact O-CB 3.5Å; A939-A942 PolarHBondContact O-N 2.66Å; A939-E943 PolarHBondContact O-N 2.93Å; A939-E943 VanDerWaalsContact O-N 3.16Å
940	T	43.2	Very low	36	Very low	61 Å²	61	103.3 Å²	103.3	37%	0.374	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-32.7	-179.3	-29.8	0	0	0	0	111.8	D937 A942 E943 Q944	D937-T940 PolarHBondContact O-N 3.12Å; T940-A942 VanDerWaalsContact C-N 3.29Å; T940-A942 PolarHBondContact O-N 3.28Å; T940-E943 PolarHBondContact O-N 3.28Å; T940-Q944 WeakPolarHBondContact O-CG 2.99Å; T940-Q944 PolarHBondContact O-N 3.07Å; T940-Q944 VanDerWaalsContact O-N 3.1Å
941	L	38.7	Very low	35.9	Very low	79 Å²	79	102.2 Å²	102.2	41%	0.414	58%	0.577	S	S	.	*	H	α-helix	trans	-64.1	-32.9	171.8	-177.8	62.1	0	0	0	112.4	D937 M938 A939 I945	D937-L941 PolarHBondContact O-N 3.37Å; D937-L941 VanDerWaalsContact O-N 3.17Å; M938-L941 HydrophobicContact SD-CD2 4.2Å; A939-L941 VanDerWaalsContact C-N 3.27Å; A939-L941 PolarHBondContact O-N 2.8Å; L941-I945 HydrophobicContact CD1-CD1 4.49Å; L941-I945 HydrophobicContact CG-CD1 4.24Å; L941-I945 WeakPolarHBondContact O-CD1 3.38Å; L941-I945 VanDerWaalsContact O-CG1 3.22Å; L941-I945 WeakPolarHBondContact O-CG1 3.41Å; L941-I945 PolarHBondContact O-N 3.26Å
942	A	35.9	Very low	36	Very low	47 Å²	47	107.7 Å²	107.7	39%	0.388	59%	0.587	S	S	.	*	H	α-helix	trans	-72.2	-38.6	175.8	0	0	0	0	0	112.1	M938 A939 T940 I945 I946	M938-A942 PolarHBondContact O-N 2.85Å; A939-A942 WeakPolarHBondContact O-CA 3.29Å; A939-A942 WeakPolarHBondContact O-CB 3.5Å; A939-A942 PolarHBondContact O-N 2.66Å; T940-A942 VanDerWaalsContact C-N 3.29Å; T940-A942 PolarHBondContact O-N 3.28Å; A942-I945 PolarHBondContact O-N 2.88Å; A942-I946 WeakPolarHBondContact O-CG1 3.49Å; A942-I946 PolarHBondContact O-N 3.25Å; A942-I946 VanDerWaalsContact O-N 3.09Å
943	E	40.4	Very low	36.3	Very low	129 Å²	129	106.1 Å²	106.1	60%	0.603	58%	0.582	S	S	*	*	H	α-helix	trans	-61.5	-47.6	174.5	-66.4	178.4	137.5	0	0	111.3	A939 T940 I945 I946 E947	A939-E943 PolarHBondContact O-N 2.93Å; A939-E943 VanDerWaalsContact O-N 3.16Å; T940-E943 PolarHBondContact O-N 3.28Å; E943-I945 PolarHBondContact O-N 2.68Å; E943-I946 WeakPolarHBondContact O-CB 3.36Å; E943-I946 PolarHBondContact O-N 3.32Å; E943-E947 PolarHBondContact O-N 3.43Å
944	Q	37.4	Very low	36.7	Very low	91 Å²	91	103.2 Å²	103.2	43%	0.425	57%	0.57	S	S	.	*	H	α-helix	trans	-62.4	-27.5	175.8	-69.9	179.6	-1.7	0	0	113.3	T940 A948	T940-Q944 WeakPolarHBondContact O-CG 2.99Å; T940-Q944 PolarHBondContact O-N 3.07Å; T940-Q944 VanDerWaalsContact O-N 3.1Å; Q944-A948 WeakPolarHBondContact O-CB 3.21Å; Q944-A948 PolarHBondContact O-N 2.94Å
945	I	41.1	Very low	36.7	Very low	110 Å²	110	108.2 Å²	108.2	56%	0.564	58%	0.577	S	S	*	*	H	α-helix	trans	-74.2	-32.2	173.5	-73.7	166.4	0	0	0	111.8	L941 A942 E943	L941-I945 HydrophobicContact CD1-CD1 4.49Å; L941-I945 HydrophobicContact CG-CD1 4.24Å; L941-I945 WeakPolarHBondContact O-CD1 3.38Å; L941-I945 VanDerWaalsContact O-CG1 3.22Å; L941-I945 WeakPolarHBondContact O-CG1 3.41Å; L941-I945 PolarHBondContact O-N 3.26Å; A942-I945 PolarHBondContact O-N 2.88Å; E943-I945 PolarHBondContact O-N 2.68Å
946	I	38.7	Very low	36.4	Very low	116 Å²	116	108.3 Å²	108.3	60%	0.595	57%	0.566	S	S	*	*	H	α-helix	trans	-73.7	-44.2	174.2	-67.1	164.2	0	0	0	110.2	A942 E943 A948 T949	A942-I946 WeakPolarHBondContact O-CG1 3.49Å; A942-I946 PolarHBondContact O-N 3.25Å; A942-I946 VanDerWaalsContact O-N 3.09Å; E943-I946 WeakPolarHBondContact O-CB 3.36Å; E943-I946 PolarHBondContact O-N 3.32Å; I946-A948 PolarHBondContact O-N 2.87Å; I946-T949 PolarHBondContact O-N 2.83Å; I946-T949 PolarHBondContact O-OG1 2.97Å
947	E	37.6	Very low	36.2	Very low	136 Å²	136	112.4 Å²	112.4	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-58.6	-45.3	176.2	-169.2	175	-157	0	0	111.4	E943 T949	E943-E947 PolarHBondContact O-N 3.43Å; E947-T949 PolarHBondContact O-N 2.88Å
948	A	35.5	Very low	35.8	Very low	85 Å²	85	115.7 Å²	115.7	70%	0.702	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	12.2	179	0	0	0	0	0	115.9	Q944 I946	Q944-A948 WeakPolarHBondContact O-CB 3.21Å; Q944-A948 PolarHBondContact O-N 2.94Å; I946-A948 PolarHBondContact O-N 2.87Å
949	T	34.8	Very low	35.7	Very low	68 Å²	68	114.4 Å²	114.4	42%	0.417	60%	0.597	S	S	.	*	S	Bend	trans	-80.8	137.6	168.3	56.7	0	0	0	0	110.9	I946 E947 E951	I946-T949 PolarHBondContact O-N 2.83Å; I946-T949 PolarHBondContact O-OG1 2.97Å; E947-T949 PolarHBondContact O-N 2.88Å; T949-E951 PolarHBondContact O-N 3.18Å
950	P	39.5	Very low	35.3	Very low	101 Å²	101	123.6 Å²	123.6	66%	0.656	62%	0.619	S	S	*	*			trans	-68.3	129.6	-170.8	26.8	-34.7	0	0	0	112.1	R952 I953	P950-R952 PolarHBondContact O-N 3.26Å; P950-I953 PolarHBondContact O-N 3.44Å
951	E	34.8	Very low	34.4	Very low	99 Å²	99	124.2 Å²	124.2	46%	0.463	64%	0.637	S	S	.	*	S	Bend	trans	-66.1	-3.7	-163.6	-59.7	-64.5	-172.1	0	0	117	T949 I953 K954	T949-E951 PolarHBondContact O-N 3.18Å; E951-I953 PolarHBondContact O-N 3.14Å; E951-K954 PolarHBondContact O-N 3.44Å; E951-K954 VanDerWaalsContact O-N 3.11Å; E951-K954 IonicContact OE1-NZ 3.91Å; E951-K954 PolarHBondContact OE1-NZ 3.1Å; E951-K954 WeakPolarHBondContact OE2-CD 3.04Å; E951-K954 WeakPolarHBondContact OE2-CE 2.99Å; E951-K954 VanDerWaalsContact OE2-CG 3.27Å; E951-K954 WeakPolarHBondContact OE2-CG 3.42Å; E951-K954 IonicContact OE2-NZ 3.27Å; E951-K954 PolarHBondContact OE2-NZ 3.47Å
952	R	35.7	Very low	33.8	Very low	221 Å²	221	125.5 Å²	125.5	83%	0.834	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	13.9	172.1	-149.1	-173.9	-60.1	-160.5	0.5	114	P950	P950-R952 PolarHBondContact O-N 3.26Å
953	I	38.8	Very low	33.2	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	-11.8	174.8	-61.6	177.8	0	0	0	111.1	P950 E951	P950-I953 PolarHBondContact O-N 3.44Å; E951-I953 PolarHBondContact O-N 3.14Å
954	K	37.8	Very low	32.4	Very low	103 Å²	103	129.8 Å²	129.8	45%	0.448	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.9	-10.5	176.4	-55.8	-167.9	-149.3	135.4	0	113.8	E951	E951-K954 PolarHBondContact O-N 3.44Å; E951-K954 VanDerWaalsContact O-N 3.11Å; E951-K954 IonicContact OE1-NZ 3.91Å; E951-K954 PolarHBondContact OE1-NZ 3.1Å; E951-K954 WeakPolarHBondContact OE2-CD 3.04Å; E951-K954 WeakPolarHBondContact OE2-CE 2.99Å; E951-K954 VanDerWaalsContact OE2-CG 3.27Å; E951-K954 WeakPolarHBondContact OE2-CG 3.42Å; E951-K954 IonicContact OE2-NZ 3.27Å; E951-K954 PolarHBondContact OE2-NZ 3.47Å
955	Q	33.3	Very low	32.4	Very low	162 Å²	162	130.6 Å²	130.6	76%	0.757	70%	0.695	S	S	*	*			trans	-135.2	88	179.2	-71.7	-173.4	-21.2	0	0	112.4
956	E	25.1	Very low	31.6	Very low	144 Å²	144	133.1 Å²	133.1	67%	0.673	71%	0.709	S	S	*	*			trans	-147.1	71.5	153.3	-75.5	-159.1	162.9	0	0	109.6	F958	E956-F958 HydrophobicContact CB-CD2 4.26Å; E956-F958 HydrophobicContact CB-CE2 4.31Å; E956-F958 HydrophobicContact CG-CE2 4.32Å; E956-F958 PolarHBondContact O-N 3.46Å
957	D	29.8	Very low	31	Very low	162 Å²	162	137 Å²	137	87%	0.866	72%	0.716	S	S	*	*			trans	-74.3	110.8	158.1	-79.8	-56.3	0	0	0	108.5	P959	D957-P959 WeakPolarHBondContact O-CD 3.27Å
958	F	25.9	Very low	30.4	Very low	168 Å²	168	136.4 Å²	136.4	74%	0.737	71%	0.713	S	S	*	*			trans	-102.3	110.1	174.5	-95	-72.8	0	0	0	111.5	E956	E956-F958 HydrophobicContact CB-CD2 4.26Å; E956-F958 HydrophobicContact CB-CE2 4.31Å; E956-F958 HydrophobicContact CG-CE2 4.32Å; E956-F958 PolarHBondContact O-N 3.46Å
959	P	30.7	Very low	29.9	Very low	118 Å²	118	142.6 Å²	142.6	77%	0.766	72%	0.718	S	S	*	*			trans	-70	160.6	167.7	30.1	-33.7	0	0	0	111.5	D957	D957-P959 WeakPolarHBondContact O-CD 3.27Å
960	R	25.6	Very low	29.5	Very low	251 Å²	251	149.2 Å²	149.2	95%	0.947	74%	0.736	S	S	*	*			trans	-83.6	120.3	-166.6	177.9	-169.4	-72	-168.7	-3.4	113.7
961	G	26.4	Very low	28.8	Very low	73 Å²	73	152.2 Å²	152.2	75%	0.753	75%	0.746	S	S	*	*			trans	96.9	125.3	130.1	0	0	0	0	0	119.6
962	A	24.3	Very low	28.5	Very low	106 Å²	106	153.8 Å²	153.8	88%	0.876	76%	0.758	S	S	*	*			trans	-158.9	144.7	141.4	0	0	0	0	0	109.2
963	E	24.1	Very low	28.6	Very low	174 Å²	174	148 Å²	148	81%	0.813	75%	0.749	S	S	*	*			trans	-72.7	145.3	-175.7	-75.1	-80.7	118.9	0	0	114
964	S	24.4	Very low	28.1	Very low	93 Å²	93	145.3 Å²	145.3	65%	0.65	75%	0.748	S	S	*	*				13.8	150.1	119	-52.6	0	0	0	0	118.7
965	P	37.1	Very low	27.8	Very low	107 Å²	107	147.3 Å²	147.3	70%	0.695	76%	0.762	S	S	*	*			cis	-156	157.8	43.6	40.7	-18.9	0	0	0	120.9
966	L	24.2	Very low	27.6	Very low	163 Å²	163	148.6 Å²	148.6	85%	0.853	77%	0.768	S	S	*	*			trans	65.7	153.3	148	-68.1	166.2	0	0	0	118.6
967	R	25.5	Very low	27.8	Very low	197 Å²	197	149.3 Å²	149.3	74%	0.743	78%	0.776	S	S	*	*			cis	-144.3	174.4	17.2	-129.8	-177.3	-168.9	-143.8	10	108.4
968	E	24.4	Very low	28	Very low	124 Å²	124	146.3 Å²	146.3	58%	0.579	76%	0.764	S	S	*	*			cis	-150.9	-67.4	1.9	-178.1	134.3	-132.1	0	0	113.9
969	R	24.8	Very low	28.4	Very low	215 Å²	215	148.7 Å²	148.7	81%	0.811	77%	0.768	S	S	*	*			trans	-146.7	142	-163.9	-80.4	171	177.4	-157.9	-2.1	110.7
970	R	27	Very low	28.6	Very low	207 Å²	207	150 Å²	150	78%	0.781	77%	0.768	S	S	*	*			cis	77.7	115.5	36.5	-177.1	-170.4	-86.5	-169.5	-3.7	113.8
971	D	24.1	Very low	29	Very low	165 Å²	165	141 Å²	141	88%	0.882	75%	0.748	S	S	*	*			trans	-141.5	168.9	134.1	-107.1	-43.3	0	0	0	111.5
972	N	28.6	Very low	29.5	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	74%	0.741	S	S	*	*			trans	-120.3	-170.5	-152	-132.6	4.1	0	0	0	111.5
973	P	39.6	Very low	29.9	Very low	100 Å²	100	146.6 Å²	146.6	65%	0.649	74%	0.736	S	S	*	*			cis	-135.3	-168.4	-21.8	37.4	-18.5	0	0	0	114.4
974	A	26.7	Very low	30.4	Very low	87 Å²	87	145.5 Å²	145.5	72%	0.719	74%	0.735	S	S	*	*			trans	77.2	135	139.9	0	0	0	0	0	119.8
975	I	32.7	Very low	30.8	Very low	146 Å²	146	148.9 Å²	148.9	75%	0.749	74%	0.741	S	S	*	*			cis	-148.2	131.2	-17.5	-35.8	172.6	0	0	0	109
976	Q	27.9	Very low	30.5	Very low	189 Å²	189	149.2 Å²	149.2	88%	0.883	74%	0.741	S	S	*	*			trans	-168.9	107.8	137.1	-117.1	-178.4	9.9	0	0	111.7
977	D	30	Very low	31	Very low	158 Å²	158	147.6 Å²	147.6	85%	0.845	74%	0.738	S	S	*	*			trans	-178.3	76.4	146	-105.2	-20.8	0	0	0	109.4
978	T	34.4	Very low	31.1	Very low	100 Å²	100	145.5 Å²	145.5	61%	0.613	74%	0.741	S	S	*	*			trans	-116.4	5.5	-172.2	-27	0	0	0	0	113.4
979	W	34.4	Very low	31.1	Very low	217 Å²	217	145.5 Å²	145.5	82%	0.822	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-50.9	-179.6	179.2	-12.4	0	0	0	111.6	A981 T982	W979-A981 PolarHBondContact O-N 3.11Å; W979-A981 VanDerWaalsContact O-N 3.11Å; W979-T982 PolarHBondContact O-N 3.4Å
980	L	34.5	Very low	31.3	Very low	145 Å²	145	144.7 Å²	144.7	76%	0.759	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-19.6	-166.9	-76.1	167	0	0	0	114.9
981	A	34.2	Very low	31.3	Very low	63 Å²	63	140.2 Å²	140.2	52%	0.521	76%	0.761	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.8	-46.2	175.1	0	0	0	0	0	112.4	W979 Y983 L984	W979-A981 PolarHBondContact O-N 3.11Å; W979-A981 VanDerWaalsContact O-N 3.11Å; A981-Y983 PolarHBondContact O-N 2.93Å; A981-L984 PolarHBondContact O-N 3.45Å
982	T	35.9	Very low	32.2	Very low	100 Å²	100	137.8 Å²	137.8	61%	0.613	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-3	-168.5	-37.2	0	0	0	0	114.4	W979	W979-T982 PolarHBondContact O-N 3.4Å
983	Y	34.2	Very low	32.8	Very low	196 Å²	196	137.1 Å²	137.1	77%	0.769	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-3	176.4	-159.3	-103.9	0	0	0	113.8	A981	A981-Y983 PolarHBondContact O-N 2.93Å
984	L	34.5	Very low	32.2	Very low	152 Å²	152	138 Å²	138	80%	0.796	77%	0.765	S	S	*	*	S	Bend	trans	-115	-1	178.7	-70.4	172.4	0	0	0	113.6	A981	A981-L984 PolarHBondContact O-N 3.45Å
985	E	31.7	Very low	32.2	Very low	163 Å²	163	137.7 Å²	137.7	76%	0.762	76%	0.763	S	S	*	*	S	Bend	trans	-102.4	8.1	-172.7	-157.8	168.1	-146.4	0	0	113.6
986	T	31.9	Very low	32.1	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	77%	0.773	S	S	*	*	S	Bend	trans	-119.5	12.9	-173.5	47.9	0	0	0	0	114.9
987	V	34.2	Very low	32.3	Very low	130 Å²	130	134.7 Å²	134.7	79%	0.788	77%	0.766	S	S	*	*	S	Bend	trans	-135	48.2	178	-158.3	0	0	0	0	112.3
988	D	26.8	Very low	32.5	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	77%	0.77	S	S	*	*			trans	-161.1	104.1	158	-124.9	-22.8	0	0	0	111.9
989	S	24.9	Very low	32.4	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	78%	0.78	S	S	*	*			trans	-179.1	45.6	165	-84.1	0	0	0	0	113.9
990	Q	28.5	Very low	32.5	Very low	197 Å²	197	141 Å²	141	92%	0.921	79%	0.786	S	S	*	*			trans	-139.8	126.7	158.3	-73.1	-163.9	-5.1	0	0	110.9
991	S	27.1	Very low	32.4	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	79%	0.791	S	S	*	*			trans	-158.6	173.8	179.1	67.2	0	0	0	0	107.5
992	P	42.7	Very low	32.8	Very low	115 Å²	115	149.8 Å²	149.8	75%	0.747	81%	0.807	S	S	*	*			cis	-121.9	-145.2	2.8	44.8	-28	0	0	0	109.3
993	P	42.5	Very low	33.1	Very low	118 Å²	118	150.2 Å²	150.2	77%	0.766	81%	0.812	S	S	*	*			cis	-116.8	-171.8	-19	42.3	-25.9	0	0	0	111.6
994	S	26.1	Very low	33.7	Very low	117 Å²	117	144.6 Å²	144.6	82%	0.818	80%	0.799	S	S	*	*			cis	-160.7	-170.7	22.8	-162.9	0	0	0	0	112.3
995	A	27.2	Very low	35	Very low	82 Å²	82	141 Å²	141	68%	0.678	79%	0.788	S	S	*	*			trans	86.3	81.8	160.7	0	0	0	0	0	120.1
996	L	30.5	Very low	36	Very low	181 Å²	181	138.4 Å²	138.4	95%	0.948	79%	0.787	S	S	*	*			trans	72.4	149	137.8	-61.8	171.6	0	0	0	120
997	A	32.7	Very low	37.3	Very low	91 Å²	91	136 Å²	136	75%	0.752	78%	0.779	S	S	*	*			trans	-117.9	149.3	-173.1	0	0	0	0	0	112.2
998	L	32.5	Very low	38.4	Very low	178 Å²	178	131.8 Å²	131.8	93%	0.932	76%	0.758	S	S	*	*			trans	-128.5	151.2	156.6	-79.5	178.4	0	0	0	110.5
999	Q	33.3	Very low	39.6	Very low	175 Å²	175	131.5 Å²	131.5	82%	0.818	75%	0.745	S	S	*	*			trans	-75.3	153.5	-165.3	-68.9	165	-32.7	0	0	113.2	L1001	Q999-L1001 PolarHBondContact O-N 2.94Å; Q999-L1001 VanDerWaalsContact O-N 3.08Å
1000	R	36.5	Very low	41.2	Very low	253 Å²	253	127.8 Å²	127.8	96%	0.955	72%	0.722	S	S	*	*			trans	-60	108.1	161.4	-77.1	178.2	169.5	168.4	-3.8	109.5
1001	L	33.4	Very low	42.6	Very low	163 Å²	163	125.5 Å²	125.5	85%	0.853	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-79.3	141.4	166.1	-76	169.9	0	0	0	110.7	Q999	Q999-L1001 PolarHBondContact O-N 2.94Å; Q999-L1001 VanDerWaalsContact O-N 3.08Å
1002	R	41	Very low	44	Very low	230 Å²	230	127.1 Å²	127.1	87%	0.868	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-75.8	141.3	174.4	-175.8	-177.7	-179.2	119.6	-2.8	109
1003	P	41.8	Very low	44.8	Very low	109 Å²	109	127.1 Å²	127.1	71%	0.708	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-59.4	141.5	175.5	24.2	-33.9	0	0	0	111.1
1004	P	48.7	Very low	45.5	Very low	78 Å²	78	127.1 Å²	127.1	51%	0.506	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-69.3	157.7	-176	28.3	-34.8	0	0	0	112.4	A1008	P1004-A1008 HydrophobicContact CB-CB 4.12Å
1005	S	60	Low	46.7	Very low	78 Å²	78	124.8 Å²	124.8	55%	0.545	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-73.6	163	-179.9	71.5	0	0	0	0	112.3	A1007 A1008 W1009	S1005-A1007 PolarHBondContact O-N 2.87Å; S1005-A1007 VanDerWaalsContact O-N 3.08Å; S1005-A1008 PolarHBondContact O-N 2.99Å; S1005-A1008 VanDerWaalsContact O-N 3.16Å; S1005-W1009 PolarHBondContact O-N 3.33Å
1006	S	53.7	Low	47.6	Very low	107 Å²	107	124.5 Å²	124.5	75%	0.748	67%	0.672	S	S	*	*	H	α-helix	trans	-59.8	-20	178.2	-166.7	0	0	0	0	114.2	A1010	S1006-A1010 PolarHBondContact O-N 3.14Å
1007	A	58.9	Low	48.5	Very low	65 Å²	65	120 Å²	120	54%	0.537	66%	0.661	S	S	.	*	H	α-helix	trans	-74.3	-43.3	176.4	0	0	0	0	0	111.9	S1005 W1009 A1010 E1011	S1005-A1007 PolarHBondContact O-N 2.87Å; S1005-A1007 VanDerWaalsContact O-N 3.08Å; A1007-W1009 VanDerWaalsContact C-N 3.28Å; A1007-W1009 PolarHBondContact O-N 3.42Å; A1007-A1010 WeakPolarHBondContact O-CA 3.44Å; A1007-A1010 WeakPolarHBondContact O-CB 3.49Å; A1007-A1010 PolarHBondContact O-N 2.99Å; A1007-E1011 PolarHBondContact O-N 2.88Å
1008	A	57.9	Low	49.5	Very low	41 Å²	41	121.9 Å²	121.9	34%	0.339	66%	0.658	S	S	.	*	H	α-helix	trans	-65.6	-32.4	176.6	0	0	0	0	0	112.2	P1004 S1005 A1010 E1011 F1012	P1004-A1008 HydrophobicContact CB-CB 4.12Å; S1005-A1008 PolarHBondContact O-N 2.99Å; S1005-A1008 VanDerWaalsContact O-N 3.16Å; A1008-A1010 VanDerWaalsContact C-N 3.35Å; A1008-E1011 PolarHBondContact O-N 2.72Å; A1008-F1012 WeakPolarHBondContact O-CB 3.35Å; A1008-F1012 PolarHBondContact O-N 3.12Å
1009	W	52.4	Low	50.6	Low	146 Å²	146	116 Å²	116	55%	0.553	64%	0.641	S	S	*	*	H	α-helix	trans	-63.9	-37.4	169.2	-81.1	104.2	0	0	0	112.7	S1005 A1007 L1013	S1005-W1009 PolarHBondContact O-N 3.33Å; A1007-W1009 VanDerWaalsContact C-N 3.28Å; A1007-W1009 PolarHBondContact O-N 3.42Å; W1009-L1013 VanDerWaalsContact O-CG 3.3Å; W1009-L1013 WeakPolarHBondContact O-CG 3.17Å; W1009-L1013 PolarHBondContact O-N 2.88Å; W1009-L1013 VanDerWaalsContact O-N 3.09Å
1010	A	57.2	Low	51.5	Low	47 Å²	47	115.9 Å²	115.9	39%	0.388	64%	0.638	S	S	.	*	H	α-helix	trans	-69.8	-39.3	176.4	0	0	0	0	0	112.2	S1006 A1007 A1008 L1013 N1014	S1006-A1010 PolarHBondContact O-N 3.14Å; A1007-A1010 WeakPolarHBondContact O-CA 3.44Å; A1007-A1010 WeakPolarHBondContact O-CB 3.49Å; A1007-A1010 PolarHBondContact O-N 2.99Å; A1008-A1010 VanDerWaalsContact C-N 3.35Å; A1010-L1013 PolarHBondContact O-N 3.05Å; A1010-N1014 VanDerWaalsContact O-CB 3.31Å; A1010-N1014 WeakPolarHBondContact O-CB 3.42Å; A1010-N1014 VanDerWaalsContact O-CG 3.32Å; A1010-N1014 PolarHBondContact O-N 2.94Å
1011	E	59.3	Low	52.1	Low	149 Å²	149	108.3 Å²	108.3	70%	0.696	61%	0.614	S	S	*	*	H	α-helix	trans	-63.3	-44	172.9	-71.3	-174.1	129.8	0	0	112.1	A1007 A1008 L1013 N1014 A1015	A1007-E1011 PolarHBondContact O-N 2.88Å; A1008-E1011 PolarHBondContact O-N 2.72Å; E1011-L1013 PolarHBondContact O-N 3.28Å; E1011-N1014 PolarHBondContact O-N 3.4Å; E1011-A1015 PolarHBondContact O-N 3.19Å
1012	F	56.4	Low	52.9	Low	147 Å²	147	107.9 Å²	107.9	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-61.8	-41.2	177.7	-175.5	-98.4	0	0	0	112.6	A1008	A1008-F1012 WeakPolarHBondContact O-CB 3.35Å; A1008-F1012 PolarHBondContact O-N 3.12Å
1013	L	58.3	Low	53.3	Low	115 Å²	115	105.5 Å²	105.5	60%	0.602	60%	0.599	S	S	*	*	H	α-helix	trans	-71	-39.1	176.3	-68.7	169.5	0	0	0	112.1	W1009 A1010 E1011 A1015 S1016	W1009-L1013 VanDerWaalsContact O-CG 3.3Å; W1009-L1013 WeakPolarHBondContact O-CG 3.17Å; W1009-L1013 PolarHBondContact O-N 2.88Å; W1009-L1013 VanDerWaalsContact O-N 3.09Å; A1010-L1013 PolarHBondContact O-N 3.05Å; E1011-L1013 PolarHBondContact O-N 3.28Å; L1013-A1015 VanDerWaalsContact C-N 3.32Å; L1013-A1015 PolarHBondContact O-N 3.11Å; L1013-S1016 VanDerWaalsContact O-CB 3.31Å; L1013-S1016 WeakPolarHBondContact O-CB 3.46Å; L1013-S1016 PolarHBondContact O-N 3.24Å
1014	N	57.2	Low	53.7	Low	118 Å²	118	105.3 Å²	105.3	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-68.6	-28.1	176.3	-77.7	-14.1	0	0	0	113.1	A1010 E1011 S1016 A1017	A1010-N1014 VanDerWaalsContact O-CB 3.31Å; A1010-N1014 WeakPolarHBondContact O-CB 3.42Å; A1010-N1014 VanDerWaalsContact O-CG 3.32Å; A1010-N1014 PolarHBondContact O-N 2.94Å; E1011-N1014 PolarHBondContact O-N 3.4Å; N1014-S1016 PolarHBondContact O-N 3.47Å; N1014-A1017 WeakPolarHBondContact O-CB 3.33Å; N1014-A1017 PolarHBondContact O-N 3.07Å
1015	A	51.6	Low	53.6	Low	67 Å²	67	107.7 Å²	107.7	55%	0.554	60%	0.595	S	S	*	*	H	α-helix	trans	-59.7	-27.8	173.7	0	0	0	0	0	112.6	E1011 L1013 A1017	E1011-A1015 PolarHBondContact O-N 3.19Å; L1013-A1015 VanDerWaalsContact C-N 3.32Å; L1013-A1015 PolarHBondContact O-N 3.11Å; A1015-A1017 VanDerWaalsContact C-N 3.28Å; A1015-A1017 PolarHBondContact O-N 3.21Å
1016	S	46.5	Very low	52.9	Low	76 Å²	76	107.7 Å²	107.7	53%	0.531	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-17.9	176.4	-166.3	0	0	0	0	113.7	L1013 N1014 N1018	L1013-S1016 VanDerWaalsContact O-CB 3.31Å; L1013-S1016 WeakPolarHBondContact O-CB 3.46Å; L1013-S1016 PolarHBondContact O-N 3.24Å; N1014-S1016 PolarHBondContact O-N 3.47Å; S1016-N1018 VanDerWaalsContact C-N 3.28Å; S1016-N1018 PolarHBondContact O-N 2.9Å
1017	A	49.2	Very low	52.8	Low	86 Å²	86	109.2 Å²	109.2	71%	0.711	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-15.5	-176.6	0	0	0	0	0	114.3	N1014 A1015	N1014-A1017 WeakPolarHBondContact O-CB 3.33Å; N1014-A1017 PolarHBondContact O-N 3.07Å; A1015-A1017 VanDerWaalsContact C-N 3.28Å; A1015-A1017 PolarHBondContact O-N 3.21Å
1018	N	54.4	Low	52.4	Low	131 Å²	131	112.1 Å²	112.1	70%	0.701	60%	0.604	S	S	*	*	S	Bend	trans	-89.7	109.7	172.6	-80.9	-41	0	0	0	110	S1016 K1020	S1016-N1018 VanDerWaalsContact C-N 3.28Å; S1016-N1018 PolarHBondContact O-N 2.9Å; N1018-K1020 PolarHBondContact O-N 3.48Å
1019	G	55.6	Low	52.5	Low	55 Å²	55	115.8 Å²	115.8	57%	0.567	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	49.2	-172.8	0	0	0	0	0	117.7
1020	K	51.8	Low	52.8	Low	173 Å²	173	113 Å²	113	75%	0.752	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-32.6	162.8	-77.5	-172.7	172.4	-177.1	0	112.3	N1018 E1022 R1023	N1018-K1020 PolarHBondContact O-N 3.48Å; K1020-E1022 VanDerWaalsContact C-N 3.34Å; K1020-E1022 PolarHBondContact O-N 3.46Å; K1020-R1023 PolarHBondContact O-N 3.48Å
1021	M	48.5	Very low	53.6	Low	93 Å²	93	114.5 Å²	114.5	46%	0.458	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.5	-20.9	-167.8	-140.5	171.4	-164.5	0	0	114.8	R1023 D1024 F1025	M1021-R1023 PolarHBondContact O-N 3.31Å; M1021-D1024 PolarHBondContact O-N 3.48Å; M1021-D1024 VanDerWaalsContact O-N 3.12Å; M1021-F1025 HydrophobicContact CB-CD2 4.45Å; M1021-F1025 HydrophobicContact CE-CE2 4.36Å; M1021-F1025 HydrophobicContact CG-CD2 3.97Å; M1021-F1025 HydrophobicContact CG-CE2 3.94Å; M1021-F1025 PolarHBondContact O-N 2.95Å; M1021-F1025 HydrophobicContact SD-CE2 3.94Å
1022	E	51	Low	54.2	Low	155 Å²	155	113.3 Å²	113.3	72%	0.724	62%	0.62	S	S	*	*	H	α-helix	trans	-60.3	-31.2	178.5	-69.2	-173.9	125	0	0	113.2	K1020 A1026	K1020-E1022 VanDerWaalsContact C-N 3.34Å; K1020-E1022 PolarHBondContact O-N 3.46Å; E1022-A1026 VanDerWaalsContact O-CB 3.32Å; E1022-A1026 WeakPolarHBondContact O-CB 3.21Å; E1022-A1026 PolarHBondContact O-N 2.98Å
1023	R	48.8	Very low	55.3	Low	180 Å²	180	108 Å²	108	68%	0.679	61%	0.607	S	S	*	*	H	α-helix	trans	-71.2	-33.7	177	-69.7	-175.8	-175.4	75.4	2.5	112.4	K1020 M1021 L1027	K1020-R1023 PolarHBondContact O-N 3.48Å; M1021-R1023 PolarHBondContact O-N 3.31Å; R1023-L1027 PolarHBondContact O-N 3.13Å
1024	D	50.3	Low	56.2	Low	104 Å²	104	106.9 Å²	106.9	56%	0.556	60%	0.599	S	S	*	*	H	α-helix	trans	-78	-38.2	179.3	-55.5	-31.9	0	0	0	110.3	M1021 L1027 L1028	M1021-D1024 PolarHBondContact O-N 3.48Å; M1021-D1024 VanDerWaalsContact O-N 3.12Å; D1024-L1027 WeakPolarHBondContact O-CB 3.34Å; D1024-L1027 PolarHBondContact O-N 3.48Å; D1024-L1027 VanDerWaalsContact O-N 3.11Å; D1024-L1028 PolarHBondContact O-N 3.31Å
1025	F	46.5	Very low	57.1	Low	129 Å²	129	106.8 Å²	106.8	57%	0.566	60%	0.595	S	S	*	*	H	α-helix	trans	-65.6	-34.4	171.1	-88.7	-76.7	0	0	0	113.2	M1021 L1027 L1028	M1021-F1025 HydrophobicContact CB-CD2 4.45Å; M1021-F1025 HydrophobicContact CE-CE2 4.36Å; M1021-F1025 HydrophobicContact CG-CD2 3.97Å; M1021-F1025 HydrophobicContact CG-CE2 3.94Å; M1021-F1025 PolarHBondContact O-N 2.95Å; M1021-F1025 HydrophobicContact SD-CE2 3.94Å; F1025-L1027 PolarHBondContact O-N 3.41Å; F1025-L1028 HydrophobicContact CD1-CD1 3.84Å; F1025-L1028 HydrophobicContact CE1-CD1 4.06Å; F1025-L1028 PolarHBondContact O-N 2.93Å
1026	A	46.5	Very low	58.4	Low	78 Å²	78	111.5 Å²	111.5	65%	0.645	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-18.2	172.1	0	0	0	0	0	113.4	E1022	E1022-A1026 VanDerWaalsContact O-CB 3.32Å; E1022-A1026 WeakPolarHBondContact O-CB 3.21Å; E1022-A1026 PolarHBondContact O-N 2.98Å
1027	L	51.1	Low	60.3	Low	139 Å²	139	114.8 Å²	114.8	73%	0.728	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-10.1	172.8	-113.2	74.7	0	0	0	113.6	R1023 D1024 F1025 T1029	R1023-L1027 PolarHBondContact O-N 3.13Å; D1024-L1027 WeakPolarHBondContact O-CB 3.34Å; D1024-L1027 PolarHBondContact O-N 3.48Å; D1024-L1027 VanDerWaalsContact O-N 3.11Å; F1025-L1027 PolarHBondContact O-N 3.41Å; L1027-T1029 PolarHBondContact O-N 2.94Å
1028	L	50.8	Low	61.9	Low	126 Å²	126	115.6 Å²	115.6	66%	0.66	60%	0.597	S	S	*	*			trans	-79.4	52.3	175.5	-70.1	173.6	0	0	0	112.2	D1024 F1025 L1030	D1024-L1028 PolarHBondContact O-N 3.31Å; F1025-L1028 HydrophobicContact CD1-CD1 3.84Å; F1025-L1028 HydrophobicContact CE1-CD1 4.06Å; F1025-L1028 PolarHBondContact O-N 2.93Å; L1028-L1030 PolarHBondContact O-N 2.84Å
1029	T	58.3	Low	63.4	Low	117 Å²	117	117.5 Å²	117.5	72%	0.718	60%	0.595	S	S	*	*			trans	-64.5	115	155.1	49.4	0	0	0	0	107.9	L1027 T1031	L1027-T1029 PolarHBondContact O-N 2.94Å; T1029-T1031 PolarHBondContact O-N 3.41Å
1030	L	60.4	Low	64.8	Low	88 Å²	88	118.2 Å²	118.2	46%	0.461	58%	0.584	S	S	.	*			trans	-46.1	131.2	173.8	-71.3	166.3	0	0	0	110.2	L1028 E1034 Q1035 L1038	L1028-L1030 PolarHBondContact O-N 2.84Å; L1030-E1034 HydrophobicContact CD2-CB 4.08Å; L1030-Q1035 HydrophobicContact CB-CB 4.34Å; L1030-L1038 HydrophobicContact CD1-CD1 3.81Å; L1030-L1038 HydrophobicContact CD2-CD1 4.21Å
1031	T	72.9	Confident	66.6	Low	79 Å²	79	112.2 Å²	112.2	49%	0.485	57%	0.566	S	S	.	*			trans	-65.7	155.8	176.2	62.8	0	0	0	0	110.9	T1029 G1033 E1034 Q1035	T1029-T1031 PolarHBondContact O-N 3.41Å; T1031-G1033 PolarHBondContact O-N 3.15Å; T1031-E1034 VanDerWaalsContact CB-OE2 3.3Å; T1031-E1034 WeakPolarHBondContact CB-OE2 3.41Å; T1031-E1034 WeakPolarHBondContact CG2-OE2 3.44Å; T1031-E1034 PolarHBondContact N-OE2 2.92Å; T1031-E1034 PolarHBondContact O-N 3.08Å; T1031-E1034 WeakPolarHBondContact OG1-CG 3.4Å; T1031-E1034 PolarHBondContact OG1-N 3Å; T1031-E1034 PolarHBondContact OG1-OE2 3.33Å; T1031-Q1035 PolarHBondContact O-N 3.04Å
1032	D	71.2	Confident	68.4	Low	123 Å²	123	109.7 Å²	109.7	66%	0.658	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-13.1	175	-81.2	-40.9	0	0	0	114.2	R1036	D1032-R1036 VanDerWaalsContact O-CB 3.24Å; D1032-R1036 WeakPolarHBondContact O-CB 3.43Å; D1032-R1036 PolarHBondContact O-NE 2.87Å; D1032-R1036 VanDerWaalsContact O-NE 3.16Å; D1032-R1036 PolarHBondContact O-NH2 2.86Å
1033	G	80.3	Confident	70.2	Confident	35 Å²	35	108.7 Å²	108.7	36%	0.361	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-60.7	167.8	0	0	0	0	0	111.7	T1031 Q1035 R1036 E1037	T1031-G1033 PolarHBondContact O-N 3.15Å; G1033-Q1035 VanDerWaalsContact C-N 3.33Å; G1033-Q1035 PolarHBondContact O-N 2.8Å; G1033-R1036 CarbonylContact O-C 3.59Å; G1033-R1036 WeakPolarHBondContact O-CA 3.29Å; G1033-R1036 VanDerWaalsContact O-CB 3.31Å; G1033-R1036 WeakPolarHBondContact O-CB 3.28Å; G1033-R1036 PolarHBondContact O-N 2.96Å; G1033-E1037 PolarHBondContact O-N 2.59Å
1034	E	77.5	Confident	72.2	Confident	93 Å²	93	104.9 Å²	104.9	44%	0.435	54%	0.542	S	S	.	.	H	α-helix	trans	-58.5	-42.2	-178.7	-65.4	159.9	118.6	0	0	112.3	L1030 T1031 R1036 E1037 L1038	L1030-E1034 HydrophobicContact CD2-CB 4.08Å; T1031-E1034 VanDerWaalsContact CB-OE2 3.3Å; T1031-E1034 WeakPolarHBondContact CB-OE2 3.41Å; T1031-E1034 WeakPolarHBondContact CG2-OE2 3.44Å; T1031-E1034 PolarHBondContact N-OE2 2.92Å; T1031-E1034 PolarHBondContact O-N 3.08Å; T1031-E1034 WeakPolarHBondContact OG1-CG 3.4Å; T1031-E1034 PolarHBondContact OG1-N 3Å; T1031-E1034 PolarHBondContact OG1-OE2 3.33Å; E1034-R1036 PolarHBondContact O-N 2.65Å; E1034-E1037 PolarHBondContact O-N 3.44Å; E1034-L1038 WeakPolarHBondContact O-CB 3.27Å; E1034-L1038 VanDerWaalsContact O-CG 3.31Å; E1034-L1038 WeakPolarHBondContact O-CG 3.42Å; E1034-L1038 PolarHBondContact O-N 2.85Å
1035	Q	75.2	Confident	74	Confident	115 Å²	115	105.7 Å²	105.7	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-63	-31.5	176	-172.9	171	-78.5	0	0	112.2	L1030 T1031 G1033 Y1039	L1030-Q1035 HydrophobicContact CB-CB 4.34Å; T1031-Q1035 PolarHBondContact O-N 3.04Å; G1033-Q1035 VanDerWaalsContact C-N 3.33Å; G1033-Q1035 PolarHBondContact O-N 2.8Å; Q1035-Y1039 WeakPolarHBondContact O-CB 3.45Å; Q1035-Y1039 PolarHBondContact O-N 2.92Å
1036	R	80	Confident	75.9	Confident	167 Å²	167	104.2 Å²	104.2	63%	0.63	54%	0.54	S	S	*	.	H	α-helix	trans	-78.3	-36.7	178	-171.4	-176.5	-47.7	-176.7	3.6	112.1	D1032 G1033 E1034 Y1039 E1040	D1032-R1036 VanDerWaalsContact O-CB 3.24Å; D1032-R1036 WeakPolarHBondContact O-CB 3.43Å; D1032-R1036 PolarHBondContact O-NE 2.87Å; D1032-R1036 VanDerWaalsContact O-NE 3.16Å; D1032-R1036 PolarHBondContact O-NH2 2.86Å; G1033-R1036 CarbonylContact O-C 3.59Å; G1033-R1036 WeakPolarHBondContact O-CA 3.29Å; G1033-R1036 VanDerWaalsContact O-CB 3.31Å; G1033-R1036 WeakPolarHBondContact O-CB 3.28Å; G1033-R1036 PolarHBondContact O-N 2.96Å; E1034-R1036 PolarHBondContact O-N 2.65Å; R1036-Y1039 PolarHBondContact O-N 2.88Å; R1036-E1040 WeakPolarHBondContact O-CB 3.47Å; R1036-E1040 PolarHBondContact O-N 3.28Å
1037	E	86.1	Confident	77.9	Confident	145 Å²	145	103.9 Å²	103.9	68%	0.678	53%	0.527	S	S	*	.	H	α-helix	trans	-65	-43.9	171.6	-70.2	-176.5	-176.2	0	0	111.4	G1033 E1034 Y1039 E1040 A1041	G1033-E1037 PolarHBondContact O-N 2.59Å; E1034-E1037 PolarHBondContact O-N 3.44Å; E1037-Y1039 VanDerWaalsContact C-N 3.35Å; E1037-Y1039 PolarHBondContact O-N 3.43Å; E1037-E1040 PolarHBondContact O-N 2.69Å; E1037-A1041 VanDerWaalsContact O-CB 3.32Å; E1037-A1041 WeakPolarHBondContact O-CB 3.42Å; E1037-A1041 PolarHBondContact O-N 2.99Å
1038	L	83.5	Confident	79.4	Confident	103 Å²	103	99.9 Å²	99.9	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-41.7	173.1	-71.9	168.8	0	0	0	112	L1030 E1034 A1042	L1030-L1038 HydrophobicContact CD1-CD1 3.81Å; L1030-L1038 HydrophobicContact CD2-CD1 4.21Å; E1034-L1038 WeakPolarHBondContact O-CB 3.27Å; E1034-L1038 VanDerWaalsContact O-CG 3.31Å; E1034-L1038 WeakPolarHBondContact O-CG 3.42Å; E1034-L1038 PolarHBondContact O-N 2.85Å; L1038-A1042 VanDerWaalsContact O-CB 3.31Å; L1038-A1042 WeakPolarHBondContact O-CB 3.36Å; L1038-A1042 PolarHBondContact O-N 3.03Å
1039	Y	84.9	Confident	80.9	Confident	170 Å²	170	99.7 Å²	99.7	67%	0.667	51%	0.509	S	S	*	.	H	α-helix	trans	-65.1	-41.8	175.2	-175.5	-98.3	0	0	0	112.4	Q1035 R1036 E1037 A1042 R1043	Q1035-Y1039 WeakPolarHBondContact O-CB 3.45Å; Q1035-Y1039 PolarHBondContact O-N 2.92Å; R1036-Y1039 PolarHBondContact O-N 2.88Å; E1037-Y1039 VanDerWaalsContact C-N 3.35Å; E1037-Y1039 PolarHBondContact O-N 3.43Å; Y1039-A1042 PolarHBondContact O-N 3.42Å; Y1039-R1043 WeakPolarHBondContact O-CB 3.43Å; Y1039-R1043 PolarHBondContact O-N 3.47Å
1040	E	86.1	Confident	82.1	Confident	71 Å²	71	102.3 Å²	102.3	33%	0.332	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-40.9	178.5	-176.2	56.7	-159	0	0	111.9	R1036 E1037 A1042 R1043 I1044	R1036-E1040 WeakPolarHBondContact O-CB 3.47Å; R1036-E1040 PolarHBondContact O-N 3.28Å; E1037-E1040 PolarHBondContact O-N 2.69Å; E1040-A1042 PolarHBondContact O-N 3.16Å; E1040-R1043 WeakPolarHBondContact O-CB 3.22Å; E1040-R1043 PolarHBondContact O-N 3.05Å; E1040-R1043 VanDerWaalsContact O-N 3.14Å; E1040-R1043 IonicContact OE1-CZ 2.85Å; E1040-R1043 IonicContact OE1-NE 2.85Å; E1040-R1043 PolarHBondContact OE1-NE 2.86Å; E1040-R1043 IonicContact OE1-NH2 2.86Å; E1040-R1043 PolarHBondContact OE1-NH2 3.24Å; E1040-R1043 IonicContact OE2-CZ 3.95Å; E1040-R1043 IonicContact OE2-NE 3.7Å; E1040-R1043 PolarHBondContact OE2-NE 3.23Å; E1040-R1043 IonicContact OE2-NH2 3.78Å; E1040-R1043 PolarHBondContact OE2-NH2 3.22Å; E1040-I1044 HydrophobicContact CG-CD1 4.17Å; E1040-I1044 VanDerWaalsContact O-CG1 3.31Å; E1040-I1044 WeakPolarHBondContact O-CG1 3.46Å; E1040-I1044 PolarHBondContact O-N 3.14Å
1041	A	88	Confident	82.8	Confident	46 Å²	46	106.1 Å²	106.1	38%	0.38	51%	0.513	S	S	.	.	H	α-helix	trans	-58.7	-46.3	171.3	0	0	0	0	0	111.3	E1037 R1043 I1044 I1045	E1037-A1041 VanDerWaalsContact O-CB 3.32Å; E1037-A1041 WeakPolarHBondContact O-CB 3.42Å; E1037-A1041 PolarHBondContact O-N 2.99Å; A1041-R1043 VanDerWaalsContact C-N 3.33Å; A1041-R1043 PolarHBondContact O-N 3.02Å; A1041-I1044 PolarHBondContact O-N 2.73Å; A1041-I1045 VanDerWaalsContact O-CG1 3.29Å; A1041-I1045 WeakPolarHBondContact O-CG1 3.41Å; A1041-I1045 PolarHBondContact O-N 2.85Å
1042	A	86.3	Confident	83.2	Confident	40 Å²	40	108.9 Å²	108.9	33%	0.331	52%	0.516	S	S	.	.	H	α-helix	trans	-60.6	-40.4	173.7	0	0	0	0	0	112	L1038 Y1039 E1040 I1045 Q1046	L1038-A1042 VanDerWaalsContact O-CB 3.31Å; L1038-A1042 WeakPolarHBondContact O-CB 3.36Å; L1038-A1042 PolarHBondContact O-N 3.03Å; Y1039-A1042 PolarHBondContact O-N 3.42Å; E1040-A1042 PolarHBondContact O-N 3.16Å; A1042-I1045 PolarHBondContact O-N 3.48Å; A1042-Q1046 WeakPolarHBondContact O-CB 3.33Å; A1042-Q1046 VanDerWaalsContact O-CG 3.26Å; A1042-Q1046 WeakPolarHBondContact O-CG 3.42Å; A1042-Q1046 PolarHBondContact O-N 2.8Å
1043	R	90.1	Very high	83.5	Confident	134 Å²	134	110.2 Å²	110.2	51%	0.506	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-42.8	176.7	-165	-179	74.4	112.8	0.8	111.9	Y1039 E1040 A1041 N1047	Y1039-R1043 WeakPolarHBondContact O-CB 3.43Å; Y1039-R1043 PolarHBondContact O-N 3.47Å; E1040-R1043 WeakPolarHBondContact O-CB 3.22Å; E1040-R1043 PolarHBondContact O-N 3.05Å; E1040-R1043 VanDerWaalsContact O-N 3.14Å; E1040-R1043 IonicContact OE1-CZ 2.85Å; E1040-R1043 IonicContact OE1-NE 2.85Å; E1040-R1043 PolarHBondContact OE1-NE 2.86Å; E1040-R1043 IonicContact OE1-NH2 2.86Å; E1040-R1043 PolarHBondContact OE1-NH2 3.24Å; E1040-R1043 IonicContact OE2-CZ 3.95Å; E1040-R1043 IonicContact OE2-NE 3.7Å; E1040-R1043 PolarHBondContact OE2-NE 3.23Å; E1040-R1043 IonicContact OE2-NH2 3.78Å; E1040-R1043 PolarHBondContact OE2-NH2 3.22Å; A1041-R1043 VanDerWaalsContact C-N 3.33Å; A1041-R1043 PolarHBondContact O-N 3.02Å; R1043-N1047 VanDerWaalsContact O-CB 3.27Å; R1043-N1047 WeakPolarHBondContact O-CB 3.5Å; R1043-N1047 PolarHBondContact O-N 2.72Å
1044	I	91.3	Very high	83.2	Confident	101 Å²	101	110.5 Å²	110.5	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-50.3	175.8	-69.6	164.3	0	0	0	110.4	E1040 A1041 Q1046 N1047 A1048	E1040-I1044 HydrophobicContact CG-CD1 4.17Å; E1040-I1044 VanDerWaalsContact O-CG1 3.31Å; E1040-I1044 WeakPolarHBondContact O-CG1 3.46Å; E1040-I1044 PolarHBondContact O-N 3.14Å; A1041-I1044 PolarHBondContact O-N 2.73Å; I1044-Q1046 PolarHBondContact O-N 3.27Å; I1044-N1047 PolarHBondContact O-N 3.26Å; I1044-A1048 WeakPolarHBondContact O-CB 3.49Å; I1044-A1048 PolarHBondContact O-N 3.15Å
1045	I	87.9	Confident	83.1	Confident	120 Å²	120	113.1 Å²	113.1	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-60.9	-46.2	179.2	-67.3	165.5	0	0	0	110.8	A1041 A1042 N1047 A1048 F1049	A1041-I1045 VanDerWaalsContact O-CG1 3.29Å; A1041-I1045 WeakPolarHBondContact O-CG1 3.41Å; A1041-I1045 PolarHBondContact O-N 2.85Å; A1042-I1045 PolarHBondContact O-N 3.48Å; I1045-N1047 PolarHBondContact O-N 3.41Å; I1045-A1048 PolarHBondContact O-N 3.31Å; I1045-F1049 WeakPolarHBondContact O-CB 3.41Å; I1045-F1049 PolarHBondContact O-N 3.06Å
1046	Q	85.8	Confident	83.1	Confident	98 Å²	98	116 Å²	116	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-40.3	176.6	-75	-175.5	34.1	0	0	112.5	A1042 I1044 F1049 R1050	A1042-Q1046 WeakPolarHBondContact O-CB 3.33Å; A1042-Q1046 VanDerWaalsContact O-CG 3.26Å; A1042-Q1046 WeakPolarHBondContact O-CG 3.42Å; A1042-Q1046 PolarHBondContact O-N 2.8Å; I1044-Q1046 PolarHBondContact O-N 3.27Å; Q1046-F1049 PolarHBondContact O-N 3.43Å; Q1046-R1050 WeakPolarHBondContact O-CB 3.26Å; Q1046-R1050 WeakPolarHBondContact O-CG 3.4Å; Q1046-R1050 PolarHBondContact O-N 3.05Å; Q1046-R1050 VanDerWaalsContact OE1-NH2 3.09Å
1047	N	87.9	Confident	83	Confident	71 Å²	71	112.8 Å²	112.8	38%	0.38	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-42.3	178.5	-165.7	-7.1	0	0	0	111	R1043 I1044 I1045 R1050 R1051	R1043-N1047 VanDerWaalsContact O-CB 3.27Å; R1043-N1047 WeakPolarHBondContact O-CB 3.5Å; R1043-N1047 PolarHBondContact O-N 2.72Å; I1044-N1047 PolarHBondContact O-N 3.26Å; I1045-N1047 PolarHBondContact O-N 3.41Å; N1047-R1050 PolarHBondContact O-N 3.48Å; N1047-R1051 WeakPolarHBondContact O-CB 3.47Å; N1047-R1051 VanDerWaalsContact O-CG 3.27Å; N1047-R1051 WeakPolarHBondContact O-CG 3.08Å; N1047-R1051 PolarHBondContact O-N 3.29Å; N1047-R1051 PolarHBondContact OD1-NE 3.47Å; N1047-R1051 VanDerWaalsContact OD1-NE 3.13Å
1048	A	83.6	Confident	82.5	Confident	55 Å²	55	111.8 Å²	111.8	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-45	172.5	0	0	0	0	0	112	I1044 I1045 R1051 Y1052	I1044-A1048 WeakPolarHBondContact O-CB 3.49Å; I1044-A1048 PolarHBondContact O-N 3.15Å; I1045-A1048 PolarHBondContact O-N 3.31Å; A1048-R1051 PolarHBondContact O-N 3.23Å; A1048-Y1052 WeakPolarHBondContact O-CB 3.34Å; A1048-Y1052 PolarHBondContact O-N 3.48Å
1049	F	82.6	Confident	82.3	Confident	123 Å²	123	111.7 Å²	111.7	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-66.2	-42.3	177.7	-175.5	-104.6	0	0	0	112.8	I1045 Q1046 R1051 Y1052 K1053	I1045-F1049 WeakPolarHBondContact O-CB 3.41Å; I1045-F1049 PolarHBondContact O-N 3.06Å; Q1046-F1049 PolarHBondContact O-N 3.43Å; F1049-R1051 VanDerWaalsContact C-N 3.34Å; F1049-R1051 PolarHBondContact O-N 2.9Å; F1049-Y1052 HydrophobicContact CD2-CD1 4.44Å; F1049-Y1052 HydrophobicContact CE2-CD1 4.48Å; F1049-Y1052 PolarHBondContact O-N 2.85Å; F1049-K1053 WeakPolarHBondContact O-CB 3.23Å; F1049-K1053 PolarHBondContact O-N 3.04Å
1050	R	83	Confident	82.1	Confident	171 Å²	171	109.5 Å²	109.5	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-60.1	-42.6	173.9	-71.9	172.8	-161.3	-148.3	9.9	111.1	Q1046 N1047 G1054	Q1046-R1050 WeakPolarHBondContact O-CB 3.26Å; Q1046-R1050 WeakPolarHBondContact O-CG 3.4Å; Q1046-R1050 PolarHBondContact O-N 3.05Å; Q1046-R1050 VanDerWaalsContact OE1-NH2 3.09Å; N1047-R1050 PolarHBondContact O-N 3.48Å; R1050-G1054 PolarHBondContact O-N 2.91Å
1051	R	75.1	Confident	81.8	Confident	168 Å²	168	111.7 Å²	111.7	63%	0.634	52%	0.522	S	S	*	.	H	α-helix	trans	-65.1	-38.8	174.1	-70.8	172.7	-177.5	-151.4	-5.4	112.7	N1047 A1048 F1049 R1055	N1047-R1051 WeakPolarHBondContact O-CB 3.47Å; N1047-R1051 VanDerWaalsContact O-CG 3.27Å; N1047-R1051 WeakPolarHBondContact O-CG 3.08Å; N1047-R1051 PolarHBondContact O-N 3.29Å; N1047-R1051 PolarHBondContact OD1-NE 3.47Å; N1047-R1051 VanDerWaalsContact OD1-NE 3.13Å; A1048-R1051 PolarHBondContact O-N 3.23Å; F1049-R1051 VanDerWaalsContact C-N 3.34Å; F1049-R1051 PolarHBondContact O-N 2.9Å; R1051-R1055 PolarHBondContact O-N 3.35Å
1052	Y	80.6	Confident	81.3	Confident	138 Å²	138	114 Å²	114	54%	0.541	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-50.3	174	172	-101	0	0	0	112	A1048 F1049 G1054 R1055 R1056	A1048-Y1052 WeakPolarHBondContact O-CB 3.34Å; A1048-Y1052 PolarHBondContact O-N 3.48Å; F1049-Y1052 HydrophobicContact CD2-CD1 4.44Å; F1049-Y1052 HydrophobicContact CE2-CD1 4.48Å; F1049-Y1052 PolarHBondContact O-N 2.85Å; Y1052-G1054 VanDerWaalsContact C-N 3.28Å; Y1052-G1054 PolarHBondContact O-N 3.44Å; Y1052-R1055 PolarHBondContact O-N 2.86Å; Y1052-R1055 VanDerWaalsContact O-N 3.13Å; Y1052-R1056 PolarHBondContact O-N 3.27Å
1053	K	77.4	Confident	80.7	Confident	150 Å²	150	118.1 Å²	118.1	65%	0.652	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-37.4	177.3	-168.7	172.9	-177.7	176.7	0	112.1	F1049	F1049-K1053 WeakPolarHBondContact O-CB 3.23Å; F1049-K1053 PolarHBondContact O-N 3.04Å
1054	G	74.3	Confident	79.9	Confident	42 Å²	42	114.2 Å²	114.2	43%	0.433	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-36.5	174.4	0	0	0	0	0	114.4	R1050 Y1052 L1057 K1058	R1050-G1054 PolarHBondContact O-N 2.91Å; Y1052-G1054 VanDerWaalsContact C-N 3.28Å; Y1052-G1054 PolarHBondContact O-N 3.44Å; G1054-L1057 PolarHBondContact O-N 2.88Å; G1054-K1058 PolarHBondContact O-N 2.88Å
1055	R	76.2	Confident	79	Confident	147 Å²	147	111.1 Å²	111.1	56%	0.555	53%	0.528	S	S	*	.	H	α-helix	trans	-61.2	-48.2	177.8	-87.3	-174.3	-71.4	-151.9	1.4	112.5	R1051 Y1052 L1057 K1058 E1059	R1051-R1055 PolarHBondContact O-N 3.35Å; Y1052-R1055 PolarHBondContact O-N 2.86Å; Y1052-R1055 VanDerWaalsContact O-N 3.13Å; R1055-L1057 VanDerWaalsContact C-N 3.28Å; R1055-L1057 PolarHBondContact O-N 2.88Å; R1055-K1058 WeakPolarHBondContact O-CA 3.5Å; R1055-K1058 PolarHBondContact O-N 3.04Å; R1055-E1059 WeakPolarHBondContact O-CG 3.42Å; R1055-E1059 PolarHBondContact O-N 2.94Å
1056	R	74.8	Confident	78.4	Confident	175 Å²	175	108 Å²	108	66%	0.66	52%	0.52	S	S	*	.	H	α-helix	trans	-57.2	-37.8	179.4	-175.2	172.7	173	172	-2.9	113.3	Y1052 E1059 Q1060	Y1052-R1056 PolarHBondContact O-N 3.27Å; R1056-E1059 WeakPolarHBondContact CA-OE2 3.44Å; R1056-Q1060 WeakPolarHBondContact O-CB 3.21Å; R1056-Q1060 PolarHBondContact O-N 2.87Å; R1056-Q1060 VanDerWaalsContact O-N 3.12Å
1057	L	77.3	Confident	78.2	Confident	100 Å²	100	107.7 Å²	107.7	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-69.1	-39.8	175.2	-179.1	61.4	0	0	0	111.9	G1054 R1055 Q1060 Q1061	G1054-L1057 PolarHBondContact O-N 2.88Å; R1055-L1057 VanDerWaalsContact C-N 3.28Å; R1055-L1057 PolarHBondContact O-N 2.88Å; L1057-Q1060 PolarHBondContact O-N 3.19Å; L1057-Q1061 WeakPolarHBondContact O-CG 3.39Å; L1057-Q1061 PolarHBondContact O-N 2.92Å
1058	K	75.4	Confident	77.7	Confident	125 Å²	125	110 Å²	110	54%	0.543	54%	0.536	S	S	.	.	H	α-helix	trans	-68.2	-42.6	176.9	-176.9	163.3	-177.4	172.2	0	112.1	G1054 R1055 Q1060 Q1061 D1062	G1054-K1058 PolarHBondContact O-N 2.88Å; R1055-K1058 WeakPolarHBondContact O-CA 3.5Å; R1055-K1058 PolarHBondContact O-N 3.04Å; K1058-Q1060 VanDerWaalsContact C-N 3.25Å; K1058-Q1060 PolarHBondContact O-N 3.43Å; K1058-Q1061 CarbonylContact O-C 3.39Å; K1058-Q1061 WeakPolarHBondContact O-CB 3.38Å; K1058-Q1061 PolarHBondContact O-N 3.09Å; K1058-D1062 PolarHBondContact O-N 3.18Å
1059	E	80.1	Confident	77.1	Confident	101 Å²	101	111.9 Å²	111.9	47%	0.472	54%	0.535	S	S	.	.	H	α-helix	trans	-56.8	-40.2	172.9	-71.1	153.1	-162.6	0	0	111.3	R1055 R1056 D1062 M1063	R1055-E1059 WeakPolarHBondContact O-CG 3.42Å; R1055-E1059 PolarHBondContact O-N 2.94Å; R1056-E1059 WeakPolarHBondContact CA-OE2 3.44Å; E1059-D1062 PolarHBondContact O-N 2.88Å; E1059-M1063 WeakPolarHBondContact O-CB 3.04Å; E1059-M1063 WeakPolarHBondContact O-CG 3.36Å; E1059-M1063 PolarHBondContact O-N 3.35Å
1060	Q	79.9	Confident	76.8	Confident	123 Å²	123	115.7 Å²	115.7	58%	0.575	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-39.4	174.1	-168.9	176.6	5.6	0	0	112.9	R1056 L1057 K1058 A1064	R1056-Q1060 WeakPolarHBondContact O-CB 3.21Å; R1056-Q1060 PolarHBondContact O-N 2.87Å; R1056-Q1060 VanDerWaalsContact O-N 3.12Å; L1057-Q1060 PolarHBondContact O-N 3.19Å; K1058-Q1060 VanDerWaalsContact C-N 3.25Å; K1058-Q1060 PolarHBondContact O-N 3.43Å; Q1060-A1064 WeakPolarHBondContact O-CB 3.39Å; Q1060-A1064 PolarHBondContact O-N 2.91Å
1061	Q	80.4	Confident	76.4	Confident	118 Å²	118	111.3 Å²	111.3	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-66.6	-43	174	-70.7	173.5	-4.4	0	0	112.1	L1057 K1058 A1064 A1065	L1057-Q1061 WeakPolarHBondContact O-CG 3.39Å; L1057-Q1061 PolarHBondContact O-N 2.92Å; K1058-Q1061 CarbonylContact O-C 3.39Å; K1058-Q1061 WeakPolarHBondContact O-CB 3.38Å; K1058-Q1061 PolarHBondContact O-N 3.09Å; Q1061-A1064 PolarHBondContact O-N 2.9Å; Q1061-A1065 WeakPolarHBondContact O-CB 3.46Å; Q1061-A1065 PolarHBondContact O-N 3.45Å
1062	D	77.4	Confident	76.5	Confident	94 Å²	94	110 Å²	110	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-37.8	178.7	-72.6	-33.8	0	0	0	111.4	K1058 E1059 A1065 A1066	K1058-D1062 PolarHBondContact O-N 3.18Å; E1059-D1062 PolarHBondContact O-N 2.88Å; D1062-A1065 PolarHBondContact O-N 2.86Å; D1062-A1066 WeakPolarHBondContact O-CB 3.42Å; D1062-A1066 PolarHBondContact O-N 2.68Å
1063	M	74.3	Confident	76.4	Confident	127 Å²	127	111 Å²	111	63%	0.626	54%	0.539	S	S	*	.	H	α-helix	trans	-62.1	-45.8	169.7	-76.8	-169.9	-69.8	0	0	112.4	E1059 A1065 A1066 V1067	E1059-M1063 WeakPolarHBondContact O-CB 3.04Å; E1059-M1063 WeakPolarHBondContact O-CG 3.36Å; E1059-M1063 PolarHBondContact O-N 3.35Å; M1063-A1065 VanDerWaalsContact C-N 3.35Å; M1063-A1065 PolarHBondContact O-N 2.79Å; M1063-A1066 WeakPolarHBondContact O-CB 3.25Å; M1063-A1066 PolarHBondContact O-N 3.01Å; M1063-V1067 WeakPolarHBondContact O-CG2 3.46Å; M1063-V1067 PolarHBondContact O-N 3.07Å
1064	A	71.9	Confident	76.5	Confident	51 Å²	51	109 Å²	109	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-42.8	176.7	0	0	0	0	0	111.6	Q1060 Q1061 A1066 V1067 I1068	Q1060-A1064 WeakPolarHBondContact O-CB 3.39Å; Q1060-A1064 PolarHBondContact O-N 2.91Å; Q1061-A1064 PolarHBondContact O-N 2.9Å; A1064-A1066 PolarHBondContact O-N 2.97Å; A1064-V1067 PolarHBondContact O-N 3.36Å; A1064-I1068 WeakPolarHBondContact O-CG1 3.42Å; A1064-I1068 PolarHBondContact O-N 3.08Å
1065	A	73.2	Confident	76.9	Confident	36 Å²	36	113.8 Å²	113.8	30%	0.298	54%	0.537	S	S	.	.	H	α-helix	trans	-61.3	-41.4	174.3	0	0	0	0	0	112	Q1061 D1062 M1063 V1067 I1068 Q1069	Q1061-A1065 WeakPolarHBondContact O-CB 3.46Å; Q1061-A1065 PolarHBondContact O-N 3.45Å; D1062-A1065 PolarHBondContact O-N 2.86Å; M1063-A1065 VanDerWaalsContact C-N 3.35Å; M1063-A1065 PolarHBondContact O-N 2.79Å; A1065-V1067 PolarHBondContact O-N 2.83Å; A1065-I1068 PolarHBondContact O-N 2.94Å; A1065-Q1069 WeakPolarHBondContact O-CB 3.42Å; A1065-Q1069 VanDerWaalsContact O-CG 3.26Å; A1065-Q1069 WeakPolarHBondContact O-CG 3.46Å; A1065-Q1069 PolarHBondContact O-N 3.39Å
1066	A	75.3	Confident	77.1	Confident	55 Å²	55	113.4 Å²	113.4	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-40.8	176.1	0	0	0	0	0	112.4	D1062 M1063 A1064 Q1069 R1070	D1062-A1066 WeakPolarHBondContact O-CB 3.42Å; D1062-A1066 PolarHBondContact O-N 2.68Å; M1063-A1066 WeakPolarHBondContact O-CB 3.25Å; M1063-A1066 PolarHBondContact O-N 3.01Å; A1064-A1066 PolarHBondContact O-N 2.97Å; A1066-Q1069 PolarHBondContact O-N 3.27Å; A1066-R1070 WeakPolarHBondContact O-CB 3.35Å; A1066-R1070 PolarHBondContact O-N 2.99Å
1067	V	80.9	Confident	76.9	Confident	92 Å²	92	111.8 Å²	111.8	56%	0.558	54%	0.539	S	S	*	.	H	α-helix	trans	-63.5	-47.1	174.8	173.5	0	0	0	0	111.4	M1063 A1064 A1065 Q1069 R1070 C1071	M1063-V1067 WeakPolarHBondContact O-CG2 3.46Å; M1063-V1067 PolarHBondContact O-N 3.07Å; A1064-V1067 PolarHBondContact O-N 3.36Å; A1065-V1067 PolarHBondContact O-N 2.83Å; V1067-Q1069 PolarHBondContact O-N 3.47Å; V1067-R1070 PolarHBondContact O-N 3.31Å; V1067-C1071 PolarHBondContact O-N 3.2Å; V1067-C1071 PolarHBondContact O-SG 3.1Å
1068	I	78.9	Confident	77.2	Confident	120 Å²	120	111.7 Å²	111.7	62%	0.615	53%	0.532	S	S	*	.	H	α-helix	trans	-60.4	-45.9	177.7	-67.2	164.9	0	0	0	110.5	A1064 A1065 R1070 C1071 Y1072	A1064-I1068 WeakPolarHBondContact O-CG1 3.42Å; A1064-I1068 PolarHBondContact O-N 3.08Å; A1065-I1068 PolarHBondContact O-N 2.94Å; I1068-R1070 PolarHBondContact O-N 2.62Å; I1068-C1071 PolarHBondContact O-N 2.96Å; I1068-Y1072 PolarHBondContact O-N 3.37Å
1069	Q	70.3	Confident	77.4	Confident	93 Å²	93	107.3 Å²	107.3	44%	0.435	52%	0.52	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.3	-73.2	-176.8	42.9	0	0	112.4	A1065 A1066 V1067 Y1072 R1073	A1065-Q1069 WeakPolarHBondContact O-CB 3.42Å; A1065-Q1069 VanDerWaalsContact O-CG 3.26Å; A1065-Q1069 WeakPolarHBondContact O-CG 3.46Å; A1065-Q1069 PolarHBondContact O-N 3.39Å; A1066-Q1069 PolarHBondContact O-N 3.27Å; V1067-Q1069 PolarHBondContact O-N 3.47Å; Q1069-Y1072 PolarHBondContact O-N 3.45Å; Q1069-R1073 WeakPolarHBondContact O-CB 3.34Å; Q1069-R1073 WeakPolarHBondContact O-CG 3.48Å; Q1069-R1073 PolarHBondContact O-N 3.17Å
1070	R	76.9	Confident	77.3	Confident	203 Å²	203	107.7 Å²	107.7	77%	0.766	52%	0.524	S	S	*	.	H	α-helix	trans	-60.3	-45.3	176.2	-174.4	178.8	-177.8	-178.1	1.2	111.1	A1066 V1067 I1068 R1073 K1074	A1066-R1070 WeakPolarHBondContact O-CB 3.35Å; A1066-R1070 PolarHBondContact O-N 2.99Å; V1067-R1070 PolarHBondContact O-N 3.31Å; I1068-R1070 PolarHBondContact O-N 2.62Å; R1070-R1073 PolarHBondContact O-N 3.33Å; R1070-K1074 PolarHBondContact O-N 3.16Å; R1070-K1074 VanDerWaalsContact O-N 3.13Å
1071	C	73.9	Confident	77.4	Confident	79 Å²	79	109.1 Å²	109.1	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-46.6	177.3	-64.9	0	0	0	0	112	V1067 I1068 R1073 K1074 Y1075	V1067-C1071 PolarHBondContact O-N 3.2Å; V1067-C1071 PolarHBondContact O-SG 3.1Å; I1068-C1071 PolarHBondContact O-N 2.96Å; C1071-R1073 PolarHBondContact O-N 3.01Å; C1071-K1074 PolarHBondContact O-N 3.09Å; C1071-Y1075 PolarHBondContact O-N 3.12Å
1072	Y	77.3	Confident	77.6	Confident	141 Å²	141	108.1 Å²	108.1	55%	0.553	52%	0.519	S	S	*	.	H	α-helix	trans	-64.8	-39.2	179	-179.1	-116.8	0	0	0	113	I1068 Q1069 Y1075 K1076	I1068-Y1072 PolarHBondContact O-N 3.37Å; Q1069-Y1072 PolarHBondContact O-N 3.45Å; Y1072-Y1075 HydrophobicContact CD2-CD1 4.28Å; Y1072-Y1075 HydrophobicContact CE2-CD1 4.36Å; Y1072-Y1075 PolarHBondContact O-N 3.06Å; Y1072-K1076 WeakPolarHBondContact O-CB 3.49Å; Y1072-K1076 PolarHBondContact O-N 3.37Å
1073	R	78.9	Confident	78.1	Confident	159 Å²	159	111.4 Å²	111.4	60%	0.6	53%	0.529	S	S	*	.	H	α-helix	trans	-60.8	-45.3	174.5	-69.9	169.2	-162.9	-160.7	9.6	111.3	Q1069 R1070 C1071 K1076 Q1077	Q1069-R1073 WeakPolarHBondContact O-CB 3.34Å; Q1069-R1073 WeakPolarHBondContact O-CG 3.48Å; Q1069-R1073 PolarHBondContact O-N 3.17Å; R1070-R1073 PolarHBondContact O-N 3.33Å; C1071-R1073 PolarHBondContact O-N 3.01Å; R1073-K1076 PolarHBondContact O-N 3.44Å; R1073-Q1077 PolarHBondContact O-N 2.84Å
1074	K	78.4	Confident	78.7	Confident	107 Å²	107	111.3 Å²	111.3	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174.8	-173	177.3	-179.2	-179.4	0	111.7	N628 R1070 C1071 K1076 Q1077 Y1078	N628-K1074 PolarHBondContact OD1-NZ 2.79Å; R1070-K1074 PolarHBondContact O-N 3.16Å; R1070-K1074 VanDerWaalsContact O-N 3.13Å; C1071-K1074 PolarHBondContact O-N 3.09Å; K1074-K1076 PolarHBondContact O-N 2.97Å; K1074-Q1077 PolarHBondContact O-N 3.24Å; K1074-Y1078 PolarHBondContact O-N 2.82Å
1075	Y	84.1	Confident	79.6	Confident	143 Å²	143	111.1 Å²	111.1	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-59.5	-46.1	176.8	170.4	-107.5	0	0	0	112.7	C1071 Y1072 Q1077 Y1078 A1079	C1071-Y1075 PolarHBondContact O-N 3.12Å; Y1072-Y1075 HydrophobicContact CD2-CD1 4.28Å; Y1072-Y1075 HydrophobicContact CE2-CD1 4.36Å; Y1072-Y1075 PolarHBondContact O-N 3.06Å; Y1075-Q1077 VanDerWaalsContact C-N 3.3Å; Y1075-Q1077 PolarHBondContact O-N 3.05Å; Y1075-Y1078 PolarHBondContact O-N 2.82Å; Y1075-A1079 WeakPolarHBondContact O-CB 3.49Å; Y1075-A1079 PolarHBondContact O-N 3.33Å
1076	K	79.6	Confident	80	Confident	139 Å²	139	115.6 Å²	115.6	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-36.8	-179.9	-173	173.4	179.8	178.1	0	112.4	Y1072 R1073 K1074 L1080	Y1072-K1076 WeakPolarHBondContact O-CB 3.49Å; Y1072-K1076 PolarHBondContact O-N 3.37Å; R1073-K1076 PolarHBondContact O-N 3.44Å; K1074-K1076 PolarHBondContact O-N 2.97Å; K1076-L1080 PolarHBondContact O-N 2.7Å
1077	Q	71.1	Confident	80.6	Confident	141 Å²	141	115.3 Å²	115.3	66%	0.659	54%	0.535	S	S	*	.	H	α-helix	trans	-67.5	-46.8	173.3	-72.2	174.7	-32.8	0	0	111.9	R1073 K1074 Y1075 A1079 L1080 Y1081	R1073-Q1077 PolarHBondContact O-N 2.84Å; K1074-Q1077 PolarHBondContact O-N 3.24Å; Y1075-Q1077 VanDerWaalsContact C-N 3.3Å; Y1075-Q1077 PolarHBondContact O-N 3.05Å; Q1077-A1079 PolarHBondContact O-N 2.78Å; Q1077-L1080 PolarHBondContact O-N 3.38Å; Q1077-Y1081 PolarHBondContact O-N 3.07Å
1078	Y	82.9	Confident	80.8	Confident	98 Å²	98	112.9 Å²	112.9	38%	0.384	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-43.7	177.4	174.8	-100.3	0	0	0	112.5	M632 K1074 Y1075 L1080 Y1081 K1082	M632-Y1078 HydrophobicContact CE-CE2 4.12Å; K1074-Y1078 PolarHBondContact O-N 2.82Å; Y1075-Y1078 PolarHBondContact O-N 2.82Å; Y1078-L1080 VanDerWaalsContact C-N 3.33Å; Y1078-L1080 PolarHBondContact O-N 2.74Å; Y1078-Y1081 PolarHBondContact O-N 2.82Å; Y1078-K1082 HydrophobicContact CE1-CD 4.1Å; Y1078-K1082 PolarHBondContact O-N 3.04Å
1079	A	79.1	Confident	81.6	Confident	34 Å²	34	111.6 Å²	111.6	28%	0.281	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-37.3	177.7	0	0	0	0	0	112.8	Y1075 Q1077 K1083	Y1075-A1079 WeakPolarHBondContact O-CB 3.49Å; Y1075-A1079 PolarHBondContact O-N 3.33Å; Q1077-A1079 PolarHBondContact O-N 2.78Å; A1079-K1083 PolarHBondContact O-N 2.82Å
1080	L	78.3	Confident	82.7	Confident	108 Å²	108	112.1 Å²	112.1	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-67.4	-43.5	173.1	180	60.5	0	0	0	111.4	K1076 Q1077 Y1078 K1083 M1084	K1076-L1080 PolarHBondContact O-N 2.7Å; Q1077-L1080 PolarHBondContact O-N 3.38Å; Y1078-L1080 VanDerWaalsContact C-N 3.33Å; Y1078-L1080 PolarHBondContact O-N 2.74Å; L1080-K1083 PolarHBondContact O-N 3.22Å; L1080-M1084 HydrophobicContact CD1-CG 4.47Å; L1080-M1084 HydrophobicContact CD1-SD 4.45Å; L1080-M1084 HydrophobicContact CG-SD 4.21Å; L1080-M1084 WeakPolarHBondContact O-CG 3.4Å; L1080-M1084 PolarHBondContact O-N 3.12Å
1081	Y	83.1	Confident	83.5	Confident	153 Å²	153	107.9 Å²	107.9	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-62	-44.3	176.8	177.3	-96.3	0	0	0	112.8	Q1077 Y1078 K1083 M1084 T1085	Q1077-Y1081 PolarHBondContact O-N 3.07Å; Y1078-Y1081 PolarHBondContact O-N 2.82Å; Y1081-K1083 VanDerWaalsContact C-N 3.32Å; Y1081-K1083 PolarHBondContact O-N 2.83Å; Y1081-M1084 PolarHBondContact O-N 3.03Å; Y1081-T1085 WeakPolarHBondContact O-CB 3.48Å; Y1081-T1085 PolarHBondContact O-N 3.18Å; Y1081-T1085 PolarHBondContact O-OG1 3.25Å
1082	K	84.3	Confident	84.2	Confident	97 Å²	97	108.9 Å²	108.9	42%	0.422	51%	0.511	S	S	.	.	H	α-helix	trans	-59.2	-42.4	176.3	-162.7	166.3	-175	169.3	0	110.5	E639 Y1078 Q1086	E639-K1082 IonicContact OE1-NZ 2.75Å; E639-K1082 PolarHBondContact OE1-NZ 3.42Å; E639-K1082 IonicContact OE2-NZ 3.17Å; E639-K1082 PolarHBondContact OE2-NZ 3Å; Y1078-K1082 HydrophobicContact CE1-CD 4.1Å; Y1078-K1082 PolarHBondContact O-N 3.04Å; K1082-Q1086 WeakPolarHBondContact O-CB 3.44Å; K1082-Q1086 PolarHBondContact O-N 3.36Å
1083	K	86.7	Confident	84.9	Confident	164 Å²	164	105.7 Å²	105.7	71%	0.713	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-45.1	173.5	-73.9	-174.9	176	-172.1	0	113.4	A1079 L1080 Y1081 Q1086 A1087	A1079-K1083 PolarHBondContact O-N 2.82Å; L1080-K1083 PolarHBondContact O-N 3.22Å; Y1081-K1083 VanDerWaalsContact C-N 3.32Å; Y1081-K1083 PolarHBondContact O-N 2.83Å; K1083-Q1086 PolarHBondContact O-N 2.87Å; K1083-A1087 PolarHBondContact O-N 3.11Å; K1083-A1087 VanDerWaalsContact O-N 3.09Å
1084	M	87.3	Confident	85.6	Confident	125 Å²	125	105.3 Å²	105.3	62%	0.616	51%	0.512	S	S	*	.	H	α-helix	trans	-63.4	-40.9	178.2	-74.6	178.9	60.4	0	0	112.3	L1080 Y1081 A1087 A1088	L1080-M1084 HydrophobicContact CD1-CG 4.47Å; L1080-M1084 HydrophobicContact CD1-SD 4.45Å; L1080-M1084 HydrophobicContact CG-SD 4.21Å; L1080-M1084 WeakPolarHBondContact O-CG 3.4Å; L1080-M1084 PolarHBondContact O-N 3.12Å; Y1081-M1084 PolarHBondContact O-N 3.03Å; M1084-A1087 PolarHBondContact O-N 3.04Å; M1084-A1088 PolarHBondContact O-N 3.36Å
1085	T	91.1	Very high	86.5	Confident	47 Å²	47	106.5 Å²	106.5	29%	0.288	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-44.1	178.5	-58.1	0	0	0	0	111.2	Y1081 A1087 A1088 I1089	Y1081-T1085 WeakPolarHBondContact O-CB 3.48Å; Y1081-T1085 PolarHBondContact O-N 3.18Å; Y1081-T1085 PolarHBondContact O-OG1 3.25Å; T1085-A1087 VanDerWaalsContact C-N 3.35Å; T1085-A1087 PolarHBondContact O-N 2.82Å; T1085-A1088 WeakPolarHBondContact O-CB 3.32Å; T1085-A1088 PolarHBondContact O-N 3.26Å; T1085-A1088 VanDerWaalsContact O-N 3.16Å; T1085-I1089 HydrophobicContact CG2-CD1 4Å; T1085-I1089 WeakPolarHBondContact O-CG1 3Å; T1085-I1089 PolarHBondContact O-N 3.26Å
1086	Q	81.6	Confident	87	Confident	129 Å²	129	107.9 Å²	107.9	60%	0.603	52%	0.522	S	S	*	.	H	α-helix	trans	-60.8	-42.5	175.8	-168.9	66.6	1	0	0	112.2	K1082 K1083 A1088 I1089 L1090	K1082-Q1086 WeakPolarHBondContact O-CB 3.44Å; K1082-Q1086 PolarHBondContact O-N 3.36Å; K1083-Q1086 PolarHBondContact O-N 2.87Å; Q1086-A1088 PolarHBondContact O-N 2.87Å; Q1086-I1089 PolarHBondContact O-N 3.26Å; Q1086-L1090 WeakPolarHBondContact O-CB 3.36Å; Q1086-L1090 PolarHBondContact O-N 3.4Å
1087	A	87.8	Confident	87.6	Confident	50 Å²	50	104.9 Å²	104.9	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-40.4	174.7	0	0	0	0	0	112.2	K1083 M1084 T1085 L1090 I1091	K1083-A1087 PolarHBondContact O-N 3.11Å; K1083-A1087 VanDerWaalsContact O-N 3.09Å; M1084-A1087 PolarHBondContact O-N 3.04Å; T1085-A1087 VanDerWaalsContact C-N 3.35Å; T1085-A1087 PolarHBondContact O-N 2.82Å; A1087-L1090 PolarHBondContact O-N 3.13Å; A1087-I1091 WeakPolarHBondContact O-CB 3.32Å; A1087-I1091 WeakPolarHBondContact O-CD1 3.21Å; A1087-I1091 VanDerWaalsContact O-CG1 3.24Å; A1087-I1091 WeakPolarHBondContact O-CG1 3.31Å; A1087-I1091 PolarHBondContact O-N 3.24Å
1088	A	85.6	Confident	88.7	Confident	41 Å²	41	104 Å²	104	34%	0.339	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-44.3	176.2	0	0	0	0	0	112.2	M1084 T1085 Q1086 I1091 Q1092	M1084-A1088 PolarHBondContact O-N 3.36Å; T1085-A1088 WeakPolarHBondContact O-CB 3.32Å; T1085-A1088 PolarHBondContact O-N 3.26Å; T1085-A1088 VanDerWaalsContact O-N 3.16Å; Q1086-A1088 PolarHBondContact O-N 2.87Å; A1088-I1091 PolarHBondContact O-N 3.3Å; A1088-Q1092 WeakPolarHBondContact O-CB 3.46Å; A1088-Q1092 VanDerWaalsContact O-CG 3.24Å; A1088-Q1092 WeakPolarHBondContact O-CG 3.38Å; A1088-Q1092 PolarHBondContact O-N 3.13Å
1089	I	94.7	Very high	89.2	Confident	92 Å²	92	105.9 Å²	105.9	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-46.5	176.7	-68.5	166.1	0	0	0	110.8	T1085 Q1086 I1091 Q1092 S1093	T1085-I1089 HydrophobicContact CG2-CD1 4Å; T1085-I1089 WeakPolarHBondContact O-CG1 3Å; T1085-I1089 PolarHBondContact O-N 3.26Å; Q1086-I1089 PolarHBondContact O-N 3.26Å; I1089-I1091 PolarHBondContact O-N 3.21Å; I1089-Q1092 PolarHBondContact O-N 2.86Å; I1089-S1093 WeakPolarHBondContact O-CB 3.38Å; I1089-S1093 PolarHBondContact O-N 2.98Å
1090	L	93.2	Very high	89.9	Confident	104 Å²	104	107.3 Å²	107.3	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-45.2	179.4	-172	154	0	0	0	111.8	Q1086 A1087 S1093 K1094	Q1086-L1090 WeakPolarHBondContact O-CB 3.36Å; Q1086-L1090 PolarHBondContact O-N 3.4Å; A1087-L1090 PolarHBondContact O-N 3.13Å; L1090-S1093 PolarHBondContact O-N 3.06Å; L1090-K1094 HydrophobicContact CD2-CG 4.26Å; L1090-K1094 WeakPolarHBondContact O-CG 3.26Å; L1090-K1094 PolarHBondContact O-N 3.33Å
1091	I	94.4	Very high	90.5	Very high	115 Å²	115	107.4 Å²	107.4	59%	0.59	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-46	176.5	-69.1	166.1	0	0	0	111	A1087 A1088 I1089 S1093 F1095	A1087-I1091 WeakPolarHBondContact O-CB 3.32Å; A1087-I1091 WeakPolarHBondContact O-CD1 3.21Å; A1087-I1091 VanDerWaalsContact O-CG1 3.24Å; A1087-I1091 WeakPolarHBondContact O-CG1 3.31Å; A1087-I1091 PolarHBondContact O-N 3.24Å; A1088-I1091 PolarHBondContact O-N 3.3Å; I1089-I1091 PolarHBondContact O-N 3.21Å; I1091-S1093 PolarHBondContact O-N 3.2Å; I1091-F1095 VanDerWaalsContact O-CB 3.26Å; I1091-F1095 WeakPolarHBondContact O-CB 3.29Å; I1091-F1095 PolarHBondContact O-N 3.48Å
1092	Q	89.4	Confident	91	Very high	100 Å²	100	104.8 Å²	104.8	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-42.5	178	-73.5	176.2	17.5	0	0	112	A1088 I1089 R1096	A1088-Q1092 WeakPolarHBondContact O-CB 3.46Å; A1088-Q1092 VanDerWaalsContact O-CG 3.24Å; A1088-Q1092 WeakPolarHBondContact O-CG 3.38Å; A1088-Q1092 PolarHBondContact O-N 3.13Å; I1089-Q1092 PolarHBondContact O-N 2.86Å; Q1092-R1096 WeakPolarHBondContact O-CB 3.2Å; Q1092-R1096 VanDerWaalsContact O-CG 3.23Å; Q1092-R1096 WeakPolarHBondContact O-CG 3.32Å; Q1092-R1096 PolarHBondContact O-N 3.44Å
1093	S	91.9	Very high	91.4	Very high	73 Å²	73	107 Å²	107	51%	0.51	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-53.5	177.6	179.8	0	0	0	0	111.7	I1089 L1090 I1091 F1095 R1096 S1097	I1089-S1093 WeakPolarHBondContact O-CB 3.38Å; I1089-S1093 PolarHBondContact O-N 2.98Å; L1090-S1093 PolarHBondContact O-N 3.06Å; I1091-S1093 PolarHBondContact O-N 3.2Å; S1093-F1095 VanDerWaalsContact C-N 3.32Å; S1093-F1095 PolarHBondContact O-N 2.99Å; S1093-R1096 PolarHBondContact O-N 3.29Å; S1093-S1097 WeakPolarHBondContact O-CB 3.41Å; S1093-S1097 PolarHBondContact O-N 3.16Å
1094	K	94	Very high	91.7	Very high	152 Å²	152	102.1 Å²	102.1	66%	0.661	49%	0.492	S	S	*	.	H	α-helix	trans	-61.1	-39.1	178.1	-70.4	-70.5	-174.6	177.8	0	112	L1090 Y1098	L1090-K1094 HydrophobicContact CD2-CG 4.26Å; L1090-K1094 WeakPolarHBondContact O-CG 3.26Å; L1090-K1094 PolarHBondContact O-N 3.33Å; K1094-Y1098 WeakPolarHBondContact O-CB 3.38Å; K1094-Y1098 PolarHBondContact O-N 3.02Å
1095	F	95.8	Very high	91.9	Very high	131 Å²	131	99.7 Å²	99.7	58%	0.575	48%	0.479	S	S	*	.	H	α-helix	trans	-65.8	-46	176.7	-178.5	-96.9	0	0	0	112.9	I1091 S1093 S1097 Y1098 Y1099	I1091-F1095 VanDerWaalsContact O-CB 3.26Å; I1091-F1095 WeakPolarHBondContact O-CB 3.29Å; I1091-F1095 PolarHBondContact O-N 3.48Å; S1093-F1095 VanDerWaalsContact C-N 3.32Å; S1093-F1095 PolarHBondContact O-N 2.99Å; F1095-S1097 VanDerWaalsContact C-N 3.33Å; F1095-S1097 PolarHBondContact O-N 3.08Å; F1095-Y1098 PolarHBondContact O-N 2.7Å; F1095-Y1099 WeakPolarHBondContact O-CB 3.49Å; F1095-Y1099 PolarHBondContact O-N 3.23Å
1096	R	95.1	Very high	92	Very high	173 Å²	173	103.6 Å²	103.6	65%	0.653	49%	0.494	S	S	*	.	H	α-helix	trans	-58.5	-45.4	176	-74.4	170.2	-177	175.8	4	111.2	Q1092 S1093 Y1099 E1100	Q1092-R1096 WeakPolarHBondContact O-CB 3.2Å; Q1092-R1096 VanDerWaalsContact O-CG 3.23Å; Q1092-R1096 WeakPolarHBondContact O-CG 3.32Å; Q1092-R1096 PolarHBondContact O-N 3.44Å; S1093-R1096 PolarHBondContact O-N 3.29Å; R1096-Y1099 PolarHBondContact O-N 3.39Å; R1096-E1100 PolarHBondContact O-N 3.35Å
1097	S	91.5	Very high	92.4	Very high	76 Å²	76	99.8 Å²	99.8	53%	0.531	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-50.4	177.2	-174.7	0	0	0	0	112.3	S1093 F1095 Y1099 E1100 Q1101	S1093-S1097 WeakPolarHBondContact O-CB 3.41Å; S1093-S1097 PolarHBondContact O-N 3.16Å; F1095-S1097 VanDerWaalsContact C-N 3.33Å; F1095-S1097 PolarHBondContact O-N 3.08Å; S1097-Y1099 VanDerWaalsContact C-N 3.31Å; S1097-Y1099 PolarHBondContact O-N 2.93Å; S1097-E1100 PolarHBondContact O-N 3.4Å; S1097-Q1101 VanDerWaalsContact O-CB 3.3Å; S1097-Q1101 WeakPolarHBondContact O-CB 3.49Å; S1097-Q1101 PolarHBondContact O-N 3.45Å
1098	Y	94.9	Very high	92.6	Very high	121 Å²	121	104.3 Å²	104.3	48%	0.475	49%	0.488	S	S	.	.	H	α-helix	trans	-56.9	-42.1	176.3	170.9	-95.5	0	0	0	112.4	K1094 F1095 Q1101 K1102	K1094-Y1098 WeakPolarHBondContact O-CB 3.38Å; K1094-Y1098 PolarHBondContact O-N 3.02Å; F1095-Y1098 PolarHBondContact O-N 2.7Å; Y1098-Q1101 PolarHBondContact O-N 3.36Å; Y1098-K1102 HydrophobicContact CE1-CD 3.94Å; Y1098-K1102 VanDerWaalsContact O-CB 3.32Å; Y1098-K1102 WeakPolarHBondContact O-CB 3.4Å; Y1098-K1102 PolarHBondContact O-N 2.89Å; Y1098-K1102 PolarHBondContact OH-NZ 2.86Å
1099	Y	93.9	Very high	92.9	Very high	139 Å²	139	110.8 Å²	110.8	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-49.3	-178.2	-172.4	-89.3	0	0	0	112.3	F1095 R1096 S1097 Q1101 K1102 R1103	F1095-Y1099 WeakPolarHBondContact O-CB 3.49Å; F1095-Y1099 PolarHBondContact O-N 3.23Å; R1096-Y1099 PolarHBondContact O-N 3.39Å; S1097-Y1099 VanDerWaalsContact C-N 3.31Å; S1097-Y1099 PolarHBondContact O-N 2.93Å; Y1099-Q1101 VanDerWaalsContact C-N 3.34Å; Y1099-Q1101 PolarHBondContact O-N 2.99Å; Y1099-K1102 PolarHBondContact O-N 3.48Å; Y1099-R1103 WeakPolarHBondContact O-CB 3.49Å; Y1099-R1103 PolarHBondContact O-N 2.71Å
1100	E	93	Very high	92.7	Very high	63 Å²	63	108.6 Å²	108.6	29%	0.294	50%	0.499	S	S	.	.	H	α-helix	trans	-66.6	-34.7	175.3	-84.8	-63.9	116.4	0	0	112	R1096 S1097 R1103 F1104 R1168	R1096-E1100 PolarHBondContact O-N 3.35Å; S1097-E1100 PolarHBondContact O-N 3.4Å; E1100-R1103 PolarHBondContact O-N 3.36Å; E1100-R1103 WeakPolarHBondContact OE1-CD 3.37Å; E1100-R1103 IonicContact OE1-CZ 3.75Å; E1100-R1103 IonicContact OE1-NE 2.72Å; E1100-R1103 IonicContact OE1-NH1 3.17Å; E1100-R1103 PolarHBondContact OE1-NH1 3.04Å; E1100-R1103 IonicContact OE2-NH1 3.46Å; E1100-F1104 VanDerWaalsContact O-CB 3.28Å; E1100-F1104 WeakPolarHBondContact O-CB 3.46Å; E1100-F1104 PolarHBondContact O-N 3.06Å; E1100-R1168 IonicContact OE2-NH2 3.22Å; E1100-R1168 PolarHBondContact OE2-NH2 3.5Å; E1100-R1168 VanDerWaalsContact OE2-NH2 3.1Å
1101	Q	90.4	Very high	92.5	Very high	111 Å²	111	104 Å²	104	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-45.1	173.8	-170.8	-178.4	12.8	0	0	111.5	S1097 Y1098 Y1099 F1104 Q1105	S1097-Q1101 VanDerWaalsContact O-CB 3.3Å; S1097-Q1101 WeakPolarHBondContact O-CB 3.49Å; S1097-Q1101 PolarHBondContact O-N 3.45Å; Y1098-Q1101 PolarHBondContact O-N 3.36Å; Y1099-Q1101 VanDerWaalsContact C-N 3.34Å; Y1099-Q1101 PolarHBondContact O-N 2.99Å; Q1101-F1104 PolarHBondContact O-N 3.29Å; Q1101-Q1105 WeakPolarHBondContact O-CB 3.38Å; Q1101-Q1105 WeakPolarHBondContact O-CG 3.2Å; Q1101-Q1105 PolarHBondContact O-N 2.85Å
1102	K	94.4	Very high	92.4	Very high	98 Å²	98	102.1 Å²	102.1	43%	0.426	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-43.7	176.5	-170.9	173.3	-167.4	163.9	0	111.8	Y1098 Y1099 Q1105 Q1106	Y1098-K1102 HydrophobicContact CE1-CD 3.94Å; Y1098-K1102 VanDerWaalsContact O-CB 3.32Å; Y1098-K1102 WeakPolarHBondContact O-CB 3.4Å; Y1098-K1102 PolarHBondContact O-N 2.89Å; Y1098-K1102 PolarHBondContact OH-NZ 2.86Å; Y1099-K1102 PolarHBondContact O-N 3.48Å; K1102-Q1105 PolarHBondContact O-N 2.82Å; K1102-Q1106 PolarHBondContact O-N 3.17Å
1103	R	92.4	Very high	92.6	Very high	143 Å²	143	102.5 Å²	102.5	54%	0.54	48%	0.475	S	S	.	.	H	α-helix	trans	-61.1	-44.3	174.7	-171.6	-170.9	-173.8	-173.9	2.7	111.9	Y1099 E1100 Q1106 S1107	Y1099-R1103 WeakPolarHBondContact O-CB 3.49Å; Y1099-R1103 PolarHBondContact O-N 2.71Å; E1100-R1103 PolarHBondContact O-N 3.36Å; E1100-R1103 WeakPolarHBondContact OE1-CD 3.37Å; E1100-R1103 IonicContact OE1-CZ 3.75Å; E1100-R1103 IonicContact OE1-NE 2.72Å; E1100-R1103 IonicContact OE1-NH1 3.17Å; E1100-R1103 PolarHBondContact OE1-NH1 3.04Å; E1100-R1103 IonicContact OE2-NH1 3.46Å; R1103-Q1106 PolarHBondContact O-N 3.08Å; R1103-S1107 WeakPolarHBondContact O-CB 3.14Å; R1103-S1107 PolarHBondContact O-N 2.75Å
1104	F	92.6	Very high	92.5	Very high	62 Å²	62	102.8 Å²	102.8	27%	0.272	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.3	177.7	-101.2	0	0	0	111.8	E1100 Q1101 Q1106 S1107 R1108 I1169	E1100-F1104 VanDerWaalsContact O-CB 3.28Å; E1100-F1104 WeakPolarHBondContact O-CB 3.46Å; E1100-F1104 PolarHBondContact O-N 3.06Å; Q1101-F1104 PolarHBondContact O-N 3.29Å; F1104-Q1106 PolarHBondContact O-N 3.46Å; F1104-S1107 PolarHBondContact O-N 3.04Å; F1104-R1108 WeakPolarHBondContact O-CB 3.12Å; F1104-R1108 PolarHBondContact O-N 2.83Å; F1104-I1169 HydrophobicContact CZ-CD1 4.47Å; F1104-I1169 HydrophobicContact CZ-CG1 4.18Å
1105	Q	93.1	Very high	92.3	Very high	74 Å²	74	98.4 Å²	98.4	35%	0.346	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-43.1	175.5	-76.3	-174.3	12.4	0	0	112.5	Q1101 K1102 R1108 R1109	Q1101-Q1105 WeakPolarHBondContact O-CB 3.38Å; Q1101-Q1105 WeakPolarHBondContact O-CG 3.2Å; Q1101-Q1105 PolarHBondContact O-N 2.85Å; K1102-Q1105 PolarHBondContact O-N 2.82Å; Q1105-R1108 PolarHBondContact O-N 2.76Å; Q1105-R1109 WeakPolarHBondContact O-CG 3.47Å; Q1105-R1109 PolarHBondContact O-N 2.87Å
1106	Q	91.7	Very high	92.2	Very high	129 Å²	129	98 Å²	98	60%	0.603	45%	0.451	S	S	*	.	H	α-helix	trans	-60	-47.9	173.4	-75.8	180	-26.9	0	0	111.4	K1102 R1103 F1104 R1108 R1109 A1110	K1102-Q1106 PolarHBondContact O-N 3.17Å; R1103-Q1106 PolarHBondContact O-N 3.08Å; F1104-Q1106 PolarHBondContact O-N 3.46Å; Q1106-R1108 VanDerWaalsContact C-N 3.27Å; Q1106-R1108 PolarHBondContact O-N 2.9Å; Q1106-R1109 PolarHBondContact O-N 2.89Å; Q1106-A1110 PolarHBondContact O-N 3.19Å
1107	S	90.5	Very high	91.9	Very high	49 Å²	49	98.5 Å²	98.5	34%	0.343	46%	0.455	S	S	.	.	H	α-helix	trans	-60.6	-35.8	176.4	-169.7	0	0	0	0	112.5	R1103 F1104 A1111	R1103-S1107 WeakPolarHBondContact O-CB 3.14Å; R1103-S1107 PolarHBondContact O-N 2.75Å; F1104-S1107 PolarHBondContact O-N 3.04Å; S1107-A1111 WeakPolarHBondContact O-CB 3.28Å; S1107-A1111 PolarHBondContact O-N 3.3Å
1108	R	91.8	Very high	91.9	Very high	145 Å²	145	99.6 Å²	99.6	55%	0.547	45%	0.448	S	S	.	.	H	α-helix	trans	-70.3	-44.9	175.8	-171.6	179.5	73.7	167.8	3.6	111.9	F1104 Q1105 Q1106 A1111 V1112	F1104-R1108 WeakPolarHBondContact O-CB 3.12Å; F1104-R1108 PolarHBondContact O-N 2.83Å; Q1105-R1108 PolarHBondContact O-N 2.76Å; Q1106-R1108 VanDerWaalsContact C-N 3.27Å; Q1106-R1108 PolarHBondContact O-N 2.9Å; R1108-A1111 WeakPolarHBondContact O-CB 3.19Å; R1108-A1111 PolarHBondContact O-N 3.06Å; R1108-V1112 WeakPolarHBondContact O-CG2 3.39Å; R1108-V1112 PolarHBondContact O-N 2.95Å
1109	R	91.9	Very high	91.7	Very high	177 Å²	177	102.5 Å²	102.5	67%	0.668	46%	0.458	S	S	*	.	H	α-helix	trans	-59.8	-46.7	175.8	-75.5	-179.7	176.9	-177.7	-0.5	110.8	Q1105 Q1106 A1111 V1112 L1113	Q1105-R1109 WeakPolarHBondContact O-CG 3.47Å; Q1105-R1109 PolarHBondContact O-N 2.87Å; Q1106-R1109 PolarHBondContact O-N 2.89Å; R1109-A1111 VanDerWaalsContact C-N 3.35Å; R1109-A1111 PolarHBondContact O-N 3.17Å; R1109-V1112 PolarHBondContact O-N 3.26Å; R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.92Å
1110	A	90.6	Very high	91.5	Very high	45 Å²	45	99.2 Å²	99.2	37%	0.372	46%	0.455	S	S	.	.	H	α-helix	trans	-60.7	-41.2	174.4	0	0	0	0	0	112.5	Q1106 V1112 I1114	Q1106-A1110 PolarHBondContact O-N 3.19Å; A1110-V1112 PolarHBondContact O-N 3.31Å; A1110-I1114 WeakPolarHBondContact O-CB 3.36Å; A1110-I1114 WeakPolarHBondContact O-CD1 3.39Å; A1110-I1114 WeakPolarHBondContact O-CG1 3.06Å; A1110-I1114 PolarHBondContact O-N 2.89Å
1111	A	89.1	Confident	91.3	Very high	8 Å²	8	99.5 Å²	99.5	7%	0.066	45%	0.454	C	S	.	.	H	α-helix	trans	-58.9	-47.4	175.4	0	0	0	0	0	112.3	S1107 R1108 R1109 I1114 Q1115 F1161 L1162	S1107-A1111 WeakPolarHBondContact O-CB 3.28Å; S1107-A1111 PolarHBondContact O-N 3.3Å; R1108-A1111 WeakPolarHBondContact O-CB 3.19Å; R1108-A1111 PolarHBondContact O-N 3.06Å; R1109-A1111 VanDerWaalsContact C-N 3.35Å; R1109-A1111 PolarHBondContact O-N 3.17Å; A1111-I1114 PolarHBondContact O-N 3.42Å; A1111-Q1115 WeakPolarHBondContact O-CB 3.4Å; A1111-Q1115 VanDerWaalsContact O-CG 3.27Å; A1111-Q1115 WeakPolarHBondContact O-CG 3.46Å; A1111-Q1115 PolarHBondContact O-N 3.37Å; A1111-Q1115 PolarHBondContact O-OE1 3.44Å; A1111-F1161 HydrophobicContact CB-CE1 3.68Å; A1111-F1161 HydrophobicContact CB-CZ 4.41Å; A1111-L1162 HydrophobicContact CB-CD2 4.33Å
1112	V	93.4	Very high	91.2	Very high	76 Å²	76	100.5 Å²	100.5	46%	0.461	46%	0.457	S	S	.	.	H	α-helix	trans	-65	-46.6	-179.1	172.4	0	0	0	0	111.3	R1108 R1109 A1110 I1114 Q1115 Q1116	R1108-V1112 WeakPolarHBondContact O-CG2 3.39Å; R1108-V1112 PolarHBondContact O-N 2.95Å; R1109-V1112 PolarHBondContact O-N 3.26Å; A1110-V1112 PolarHBondContact O-N 3.31Å; V1112-I1114 VanDerWaalsContact C-N 3.34Å; V1112-I1114 PolarHBondContact O-N 3.44Å; V1112-Q1115 WeakPolarHBondContact O-CB 3.38Å; V1112-Q1115 PolarHBondContact O-N 3.45Å; V1112-Q1115 VanDerWaalsContact O-N 3.15Å; V1112-Q1116 WeakPolarHBondContact O-CB 3.45Å; V1112-Q1116 PolarHBondContact O-N 2.87Å
1113	L	92.6	Very high	90.8	Very high	108 Å²	108	99.7 Å²	99.7	57%	0.565	45%	0.454	S	S	*	.	H	α-helix	trans	-59.2	-44.1	177.1	-71.2	170.1	0	0	0	111.8	R1109 Q1115 Q1116 Y1117	R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.92Å; L1113-Q1115 VanDerWaalsContact C-N 3.35Å; L1113-Q1115 PolarHBondContact O-N 2.99Å; L1113-Q1116 PolarHBondContact O-N 3.21Å; L1113-Y1117 WeakPolarHBondContact O-CB 3.45Å; L1113-Y1117 PolarHBondContact O-N 2.91Å
1114	I	90.8	Very high	90.3	Very high	79 Å²	79	99.5 Å²	99.5	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-65.7	-37.3	177.1	-67.5	166.5	0	0	0	111.4	A1110 A1111 V1112 Y1118 I1158	A1110-I1114 WeakPolarHBondContact O-CB 3.36Å; A1110-I1114 WeakPolarHBondContact O-CD1 3.39Å; A1110-I1114 WeakPolarHBondContact O-CG1 3.06Å; A1110-I1114 PolarHBondContact O-N 2.89Å; A1111-I1114 PolarHBondContact O-N 3.42Å; V1112-I1114 VanDerWaalsContact C-N 3.34Å; V1112-I1114 PolarHBondContact O-N 3.44Å; I1114-Y1118 VanDerWaalsContact O-CB 3.28Å; I1114-Y1118 WeakPolarHBondContact O-CB 3.43Å; I1114-Y1118 PolarHBondContact O-N 3.49Å; I1114-I1158 HydrophobicContact CG2-CD1 3.47Å; I1114-I1158 VanDerWaalsContact CG2-CD1 3.47Å; I1114-I1158 HydrophobicContact CG2-CG1 3.67Å; I1114-I1158 HydrophobicContact CG2-CG2 4.2Å
1115	Q	88.7	Confident	89.7	Confident	60 Å²	60	98.6 Å²	98.6	28%	0.28	45%	0.451	S	S	.	.	H	α-helix	trans	-66.2	-42.2	173.8	-75.4	175	-71	0	0	112.4	A1111 V1112 L1113 R1119 L1162	A1111-Q1115 WeakPolarHBondContact O-CB 3.4Å; A1111-Q1115 VanDerWaalsContact O-CG 3.27Å; A1111-Q1115 WeakPolarHBondContact O-CG 3.46Å; A1111-Q1115 PolarHBondContact O-N 3.37Å; A1111-Q1115 PolarHBondContact O-OE1 3.44Å; V1112-Q1115 WeakPolarHBondContact O-CB 3.38Å; V1112-Q1115 PolarHBondContact O-N 3.45Å; V1112-Q1115 VanDerWaalsContact O-N 3.15Å; L1113-Q1115 VanDerWaalsContact C-N 3.35Å; L1113-Q1115 PolarHBondContact O-N 2.99Å; Q1115-R1119 WeakPolarHBondContact O-CB 3.2Å; Q1115-R1119 VanDerWaalsContact O-CG 3.27Å; Q1115-R1119 WeakPolarHBondContact O-CG 3.36Å; Q1115-R1119 PolarHBondContact O-N 3.35Å; Q1115-L1162 HydrophobicContact CG-CD1 3.77Å; Q1115-L1162 HydrophobicContact CG-CD2 4.07Å
1116	Q	92.9	Very high	89	Confident	122 Å²	122	102.8 Å²	102.8	57%	0.57	46%	0.464	S	S	*	.	H	α-helix	trans	-63.6	-50.1	178.6	-177.3	179	0.5	0	0	110.7	V1112 L1113 Y1118 R1119 S1120	V1112-Q1116 WeakPolarHBondContact O-CB 3.45Å; V1112-Q1116 PolarHBondContact O-N 2.87Å; L1113-Q1116 PolarHBondContact O-N 3.21Å; Q1116-Y1118 VanDerWaalsContact C-N 3.33Å; Q1116-Y1118 PolarHBondContact O-N 3.49Å; Q1116-R1119 WeakPolarHBondContact O-CB 3.34Å; Q1116-R1119 PolarHBondContact O-N 3.09Å; Q1116-R1119 VanDerWaalsContact O-N 3.13Å; Q1116-S1120 PolarHBondContact O-N 2.88Å; Q1116-S1120 PolarHBondContact O-OG 3.02Å
1117	Y	90.8	Very high	88.3	Confident	184 Å²	184	102.4 Å²	102.4	72%	0.722	47%	0.465	S	S	*	.	H	α-helix	trans	-65.4	-34.1	179.3	-148.4	-81	0	0	0	112.6	L1113 S1120 Y1121	L1113-Y1117 WeakPolarHBondContact O-CB 3.45Å; L1113-Y1117 PolarHBondContact O-N 2.91Å; Y1117-S1120 PolarHBondContact O-OG 3.45Å; Y1117-Y1121 VanDerWaalsContact O-CB 3.26Å; Y1117-Y1121 WeakPolarHBondContact O-CB 3.37Å; Y1117-Y1121 PolarHBondContact O-N 3Å
1118	Y	89.8	Confident	87.3	Confident	99 Å²	99	106.5 Å²	106.5	39%	0.388	48%	0.477	S	S	.	.	H	α-helix	trans	-69.7	-36.4	172.4	178.7	-102.4	0	0	0	112.5	I1114 Q1116 K1122 A1155	I1114-Y1118 VanDerWaalsContact O-CB 3.28Å; I1114-Y1118 WeakPolarHBondContact O-CB 3.43Å; I1114-Y1118 PolarHBondContact O-N 3.49Å; Q1116-Y1118 VanDerWaalsContact C-N 3.33Å; Q1116-Y1118 PolarHBondContact O-N 3.49Å; Y1118-K1122 VanDerWaalsContact O-CB 3.3Å; Y1118-K1122 WeakPolarHBondContact O-CB 3.49Å; Y1118-K1122 PolarHBondContact O-N 3.25Å; Y1118-A1155 HydrophobicContact CE2-CB 4.05Å
1119	R	91.4	Very high	85.9	Confident	182 Å²	182	106.5 Å²	106.5	69%	0.687	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-48.8	175.4	-77.5	170.2	174.4	-174.9	-3.7	111.5	Q1115 Q1116 K1122 E1123	Q1115-R1119 WeakPolarHBondContact O-CB 3.2Å; Q1115-R1119 VanDerWaalsContact O-CG 3.27Å; Q1115-R1119 WeakPolarHBondContact O-CG 3.36Å; Q1115-R1119 PolarHBondContact O-N 3.35Å; Q1116-R1119 WeakPolarHBondContact O-CB 3.34Å; Q1116-R1119 PolarHBondContact O-N 3.09Å; Q1116-R1119 VanDerWaalsContact O-N 3.13Å; R1119-K1122 PolarHBondContact O-N 2.91Å; R1119-E1123 PolarHBondContact O-N 3.02Å
1120	S	89.8	Confident	84	Confident	69 Å²	69	100.8 Å²	100.8	48%	0.483	47%	0.474	S	S	.	.	H	α-helix	trans	-64	-42.2	177.8	57.9	0	0	0	0	111.9	Q1116 Y1117 K1122 E1123 Y1124	Q1116-S1120 PolarHBondContact O-N 2.88Å; Q1116-S1120 PolarHBondContact O-OG 3.02Å; Y1117-S1120 PolarHBondContact O-OG 3.45Å; S1120-K1122 VanDerWaalsContact C-N 3.34Å; S1120-K1122 PolarHBondContact O-N 3.46Å; S1120-E1123 PolarHBondContact O-N 3.08Å; S1120-Y1124 WeakPolarHBondContact O-CB 3.15Å; S1120-Y1124 PolarHBondContact O-N 3.03Å
1121	Y	89.3	Confident	82.2	Confident	70 Å²	70	104.8 Å²	104.8	28%	0.275	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-41	173.8	178.8	-111.3	0	0	0	112.5	Y1117 Y1124 E1125 Q1151	Y1117-Y1121 VanDerWaalsContact O-CB 3.26Å; Y1117-Y1121 WeakPolarHBondContact O-CB 3.37Å; Y1117-Y1121 PolarHBondContact O-N 3Å; Y1121-Y1124 HydrophobicContact CE2-CD1 4.45Å; Y1121-Y1124 PolarHBondContact O-N 3.45Å; Y1121-E1125 HydrophobicContact CD2-CG 4.44Å; Y1121-E1125 HydrophobicContact CE1-CG 3.85Å; Y1121-E1125 HydrophobicContact CE2-CG 3.71Å; Y1121-E1125 PolarHBondContact O-N 2.92Å; Y1121-E1125 VanDerWaalsContact OH-CG 3.25Å; Y1121-E1125 WeakPolarHBondContact OH-CG 3.31Å; Y1121-E1125 PolarHBondContact OH-OE1 2.83Å; Y1121-Q1151 VanDerWaalsContact CZ-NE2 3.32Å; Y1121-Q1151 PolarHBondContact OH-NE2 2.91Å
1122	K	87.9	Confident	80.3	Confident	132 Å²	132	116 Å²	116	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-66.5	-37.6	178.3	-168.7	179.8	179.9	-170.9	0	112.3	Y1118 R1119 S1120 E1125 R1126	Y1118-K1122 VanDerWaalsContact O-CB 3.3Å; Y1118-K1122 WeakPolarHBondContact O-CB 3.49Å; Y1118-K1122 PolarHBondContact O-N 3.25Å; R1119-K1122 PolarHBondContact O-N 2.91Å; S1120-K1122 VanDerWaalsContact C-N 3.34Å; S1120-K1122 PolarHBondContact O-N 3.46Å; K1122-E1125 PolarHBondContact O-N 2.84Å; K1122-R1126 PolarHBondContact O-N 3.43Å
1123	E	85.7	Confident	78.2	Confident	80 Å²	80	116.3 Å²	116.3	37%	0.374	56%	0.555	S	S	.	*	H	α-helix	trans	-73.1	-35.8	176.5	-162.2	58.5	-155.3	0	0	112	R1119 S1120 R1126 L1127	R1119-E1123 PolarHBondContact O-N 3.02Å; S1120-E1123 PolarHBondContact O-N 3.08Å; E1123-R1126 WeakPolarHBondContact O-CB 3.3Å; E1123-R1126 PolarHBondContact O-N 3.34Å; E1123-R1126 VanDerWaalsContact O-N 3.1Å; E1123-R1126 IonicContact OE1-CZ 3.14Å; E1123-R1126 IonicContact OE1-NE 3.72Å; E1123-R1126 PolarHBondContact OE1-NE 3.35Å; E1123-R1126 IonicContact OE1-NH2 2.68Å; E1123-R1126 PolarHBondContact OE1-NH2 3.49Å; E1123-R1126 IonicContact OE2-NE 3Å; E1123-R1126 PolarHBondContact OE2-NE 2.67Å; E1123-L1127 WeakPolarHBondContact O-CG 3.45Å; E1123-L1127 PolarHBondContact O-N 3.31Å
1124	Y	82.8	Confident	76	Confident	139 Å²	139	114.6 Å²	114.6	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-59.7	-44.2	170.1	175.8	-93.8	0	0	0	112.2	S1120 Y1121 R1126 L1127 K1128	S1120-Y1124 WeakPolarHBondContact O-CB 3.15Å; S1120-Y1124 PolarHBondContact O-N 3.03Å; Y1121-Y1124 HydrophobicContact CE2-CD1 4.45Å; Y1121-Y1124 PolarHBondContact O-N 3.45Å; Y1124-R1126 VanDerWaalsContact C-N 3.31Å; Y1124-R1126 PolarHBondContact O-N 3.07Å; Y1124-L1127 PolarHBondContact O-N 2.73Å; Y1124-K1128 HydrophobicContact CE1-CD 4.15Å; Y1124-K1128 VanDerWaalsContact O-CB 3.28Å; Y1124-K1128 WeakPolarHBondContact O-CB 3.42Å; Y1124-K1128 PolarHBondContact O-N 2.84Å
1125	E	79.5	Confident	73.6	Confident	43 Å²	43	115.9 Å²	115.9	20%	0.201	59%	0.586	C	S	.	*	H	α-helix	trans	-63.7	-35.2	172	-76.3	-66.5	149.1	0	0	112.3	Y1121 K1122 K1128 Q1129	Y1121-E1125 HydrophobicContact CD2-CG 4.44Å; Y1121-E1125 HydrophobicContact CE1-CG 3.85Å; Y1121-E1125 HydrophobicContact CE2-CG 3.71Å; Y1121-E1125 PolarHBondContact O-N 2.92Å; Y1121-E1125 VanDerWaalsContact OH-CG 3.25Å; Y1121-E1125 WeakPolarHBondContact OH-CG 3.31Å; Y1121-E1125 PolarHBondContact OH-OE1 2.83Å; K1122-E1125 PolarHBondContact O-N 2.84Å; E1125-K1128 PolarHBondContact O-N 3.42Å; E1125-K1128 IonicContact OE1-NZ 3.41Å; E1125-Q1129 WeakPolarHBondContact O-CB 3.45Å; E1125-Q1129 WeakPolarHBondContact O-CG 3.46Å; E1125-Q1129 PolarHBondContact O-N 2.67Å; E1125-Q1129 PolarHBondContact OE2-NE2 3.05Å
1126	R	78.5	Confident	71.3	Confident	163 Å²	163	117.3 Å²	117.3	62%	0.615	61%	0.608	S	S	*	*	H	α-helix	trans	-67.2	-43	176.1	-159.2	177	76.8	97.9	4	112	K1122 E1123 Y1124 K1128 Q1129 A1130	K1122-R1126 PolarHBondContact O-N 3.43Å; E1123-R1126 WeakPolarHBondContact O-CB 3.3Å; E1123-R1126 PolarHBondContact O-N 3.34Å; E1123-R1126 VanDerWaalsContact O-N 3.1Å; E1123-R1126 IonicContact OE1-CZ 3.14Å; E1123-R1126 IonicContact OE1-NE 3.72Å; E1123-R1126 PolarHBondContact OE1-NE 3.35Å; E1123-R1126 IonicContact OE1-NH2 2.68Å; E1123-R1126 PolarHBondContact OE1-NH2 3.49Å; E1123-R1126 IonicContact OE2-NE 3Å; E1123-R1126 PolarHBondContact OE2-NE 2.67Å; Y1124-R1126 VanDerWaalsContact C-N 3.31Å; Y1124-R1126 PolarHBondContact O-N 3.07Å; R1126-K1128 VanDerWaalsContact C-N 3.29Å; R1126-K1128 PolarHBondContact O-N 2.65Å; R1126-Q1129 CarbonylContact O-C 3.54Å; R1126-Q1129 PolarHBondContact O-N 3.14Å; R1126-A1130 PolarHBondContact O-N 3.36Å
1127	L	76.8	Confident	69.2	Low	121 Å²	121	119.5 Å²	119.5	63%	0.634	62%	0.623	S	S	*	*	H	α-helix	trans	-62.8	-35.2	173.2	-72.2	164.8	0	0	0	112	E1123 Y1124 Q1129 A1130	E1123-L1127 WeakPolarHBondContact O-CG 3.45Å; E1123-L1127 PolarHBondContact O-N 3.31Å; Y1124-L1127 PolarHBondContact O-N 2.73Å; L1127-Q1129 VanDerWaalsContact C-N 3.34Å; L1127-A1130 WeakPolarHBondContact O-CB 3.41Å
1128	K	69.6	Low	67.2	Low	135 Å²	135	117.8 Å²	117.8	59%	0.587	63%	0.626	S	S	*	*	H	α-helix	trans	-76	-19.6	176	-171.9	177.3	175.2	-173.4	0	113.9	Y1124 E1125 R1126	Y1124-K1128 HydrophobicContact CE1-CD 4.15Å; Y1124-K1128 VanDerWaalsContact O-CB 3.28Å; Y1124-K1128 WeakPolarHBondContact O-CB 3.42Å; Y1124-K1128 PolarHBondContact O-N 2.84Å; E1125-K1128 PolarHBondContact O-N 3.42Å; E1125-K1128 IonicContact OE1-NZ 3.41Å; R1126-K1128 VanDerWaalsContact C-N 3.29Å; R1126-K1128 PolarHBondContact O-N 2.65Å
1129	Q	62.8	Low	65.4	Low	144 Å²	144	117.9 Å²	117.9	67%	0.673	64%	0.638	S	S	*	*	H	α-helix	trans	-97.9	-3.7	175.5	-70.1	168.4	34.8	0	0	112.8	E1125 R1126 L1127	E1125-Q1129 WeakPolarHBondContact O-CB 3.45Å; E1125-Q1129 WeakPolarHBondContact O-CG 3.46Å; E1125-Q1129 PolarHBondContact O-N 2.67Å; E1125-Q1129 PolarHBondContact OE2-NE2 3.05Å; R1126-Q1129 CarbonylContact O-C 3.54Å; R1126-Q1129 PolarHBondContact O-N 3.14Å; L1127-Q1129 VanDerWaalsContact C-N 3.34Å
1130	A	50.6	Low	63	Low	58 Å²	58	118.6 Å²	118.6	48%	0.479	65%	0.647	S	S	.	*	S	Bend	trans	-62.2	136.7	165.5	0	0	0	0	0	109.5	R1126 L1127 R1132	R1126-A1130 PolarHBondContact O-N 3.36Å; L1127-A1130 WeakPolarHBondContact O-CB 3.41Å; A1130-R1132 PolarHBondContact O-N 3.14Å; A1130-R1132 VanDerWaalsContact O-N 3.12Å
1131	P	54.1	Low	61	Low	129 Å²	129	120.5 Å²	120.5	84%	0.838	66%	0.66	S	S	*	*			trans	-70	113	-168.1	26.4	-34.4	0	0	0	111.9	G1133	P1131-G1133 PolarHBondContact O-N 3.15Å
1132	R	49	Very low	59.1	Low	244 Å²	244	124 Å²	124	92%	0.921	68%	0.683	S	S	*	*			trans	-68.3	112.7	153.1	-74.1	-175	174.2	-168.5	-4.2	107.7	A1130	A1130-R1132 PolarHBondContact O-N 3.14Å; A1130-R1132 VanDerWaalsContact O-N 3.12Å
1133	G	48.3	Very low	57.1	Low	81 Å²	81	128.2 Å²	128.2	84%	0.835	70%	0.696	S	S	*	*			trans	-66.9	135.6	165.9	0	0	0	0	0	110.2	P1131	P1131-G1133 PolarHBondContact O-N 3.15Å
1134	G	47.3	Very low	55.3	Low	72 Å²	72	126.6 Å²	126.6	74%	0.742	70%	0.701	S	S	*	*			trans	108.6	118.4	168.5	0	0	0	0	0	116.9
1135	A	40.6	Very low	53.8	Low	106 Å²	106	122.1 Å²	122.1	88%	0.876	69%	0.69	S	S	*	*			trans	76.5	132.7	149.1	0	0	0	0	0	122.8
1136	A	40.8	Very low	52.5	Low	90 Å²	90	127.6 Å²	127.6	74%	0.744	71%	0.713	S	S	*	*			trans	72.4	87.5	141.3	0	0	0	0	0	122
1137	L	48.4	Very low	51.3	Low	169 Å²	169	125.2 Å²	125.2	89%	0.885	71%	0.712	S	S	*	*				49	131.3	118.1	-69.1	168.3	0	0	0	123
1138	N	47.6	Very low	50.4	Low	147 Å²	147	123 Å²	123	79%	0.786	70%	0.704	S	S	*	*			trans	80.5	163.5	145.2	-112.7	-9.6	0	0	0	119.5
1139	P	52.4	Low	49.9	Very low	101 Å²	101	122.8 Å²	122.8	66%	0.656	70%	0.703	S	S	*	*				-124.6	133.2	-110.2	38	-22.4	0	0	0	115.4
1140	K	41.9	Very low	49.7	Very low	198 Å²	198	123.8 Å²	123.8	86%	0.861	71%	0.705	S	S	*	*			trans	-137.8	43.7	175.7	-69.7	-179.4	179.6	162.2	0	113.8	N1142	K1140-N1142 VanDerWaalsContact C-N 3.35Å; K1140-N1142 PolarHBondContact O-N 3.12Å; K1140-N1142 VanDerWaalsContact O-N 3.15Å
1141	S	48.2	Very low	50.2	Low	109 Å²	109	124.2 Å²	124.2	76%	0.762	70%	0.697	S	S	*	*	H	α-helix	trans	-51.2	-40.2	-169.7	-167.4	0	0	0	0	115.6	R1143	S1141-R1143 PolarHBondContact O-N 3.28Å
1142	N	47.9	Very low	50.7	Low	142 Å²	142	121.5 Å²	121.5	76%	0.759	68%	0.675	S	S	*	*	H	α-helix	trans	-85.6	-5.6	-166.4	-88.7	-18.7	0	0	0	117.8	K1140	K1140-N1142 VanDerWaalsContact C-N 3.35Å; K1140-N1142 PolarHBondContact O-N 3.12Å; K1140-N1142 VanDerWaalsContact O-N 3.15Å
1143	R	46.9	Very low	51.5	Low	221 Å²	221	114 Å²	114	83%	0.834	65%	0.651	S	S	*	*	H	α-helix	trans	-89.5	-29	176.1	-75.9	-170.9	177.3	-177.5	0.7	114.2	S1141	S1141-R1143 PolarHBondContact O-N 3.28Å
1144	G	46.9	Very low	52.1	Low	47 Å²	47	112.3 Å²	112.3	49%	0.485	63%	0.629	S	S	.	*	H	α-helix	trans	-68.5	-36	179.4	0	0	0	0	0	114.1	F1146 T1148	G1144-F1146 VanDerWaalsContact C-N 3.3Å; G1144-F1146 PolarHBondContact O-N 3.41Å; G1144-T1148 PolarHBondContact O-N 3.22Å; G1144-T1148 PolarHBondContact O-OG1 3.33Å
1145	S	52.7	Low	52.9	Low	44 Å²	44	109.3 Å²	109.3	31%	0.308	60%	0.597	S	S	.	*	H	α-helix	trans	-63.6	-31.9	-177.3	-160	0	0	0	0	113.3	T1148 K1149	S1145-T1148 WeakPolarHBondContact CA-OG1 3.27Å; S1145-T1148 PolarHBondContact O-OG1 3.06Å; S1145-T1148 VanDerWaalsContact O-OG1 3.08Å; S1145-K1149 VanDerWaalsContact O-CB 3.26Å; S1145-K1149 WeakPolarHBondContact O-CB 3.45Å; S1145-K1149 VanDerWaalsContact O-CD 3.31Å; S1145-K1149 WeakPolarHBondContact O-CD 3.38Å; S1145-K1149 WeakPolarHBondContact O-CG 3.49Å; S1145-K1149 PolarHBondContact O-N 3.23Å; S1145-K1149 VanDerWaalsContact O-N 3.08Å; S1145-K1149 WeakPolarHBondContact OG-CE 3.44Å; S1145-K1149 PolarHBondContact OG-NZ 2.87Å
1146	F	50.8	Low	54.4	Low	159 Å²	159	109.3 Å²	109.3	70%	0.697	57%	0.574	S	S	*	*	H	α-helix	trans	-78.5	-37.6	-177.7	-108.5	-88.8	0	0	0	113.6	G1144 K1150	G1144-F1146 VanDerWaalsContact C-N 3.3Å; G1144-F1146 PolarHBondContact O-N 3.41Å; F1146-K1150 WeakPolarHBondContact O-CB 3.46Å; F1146-K1150 PolarHBondContact O-N 3.24Å
1147	L	54.2	Low	55.9	Low	113 Å²	113	111.2 Å²	111.2	59%	0.592	57%	0.565	S	S	*	*	H	α-helix	trans	-65.2	-50.8	173.5	-99.7	72.7	0	0	0	110.6	K1149 K1150 Q1151	L1147-K1149 PolarHBondContact O-N 3.45Å; L1147-K1150 PolarHBondContact O-N 2.95Å; L1147-K1150 VanDerWaalsContact O-N 3.09Å; L1147-Q1151 WeakPolarHBondContact O-CB 3.49Å; L1147-Q1151 VanDerWaalsContact O-CG 3.3Å; L1147-Q1151 WeakPolarHBondContact O-CG 3.15Å; L1147-Q1151 PolarHBondContact O-N 2.97Å
1148	T	57.7	Low	57.2	Low	75 Å²	75	104.9 Å²	104.9	46%	0.46	53%	0.532	S	S	.	.	H	α-helix	trans	-58.2	-47.8	179.4	47	0	0	0	0	111.8	G1144 S1145 K1150 Q1151 D1152	G1144-T1148 PolarHBondContact O-N 3.22Å; G1144-T1148 PolarHBondContact O-OG1 3.33Å; S1145-T1148 WeakPolarHBondContact CA-OG1 3.27Å; S1145-T1148 PolarHBondContact O-OG1 3.06Å; S1145-T1148 VanDerWaalsContact O-OG1 3.08Å; T1148-K1150 VanDerWaalsContact C-N 3.28Å; T1148-K1150 PolarHBondContact O-N 3.48Å; T1148-Q1151 PolarHBondContact O-N 3.31Å; T1148-D1152 WeakPolarHBondContact O-CB 3.31Å; T1148-D1152 PolarHBondContact O-N 2.87Å
1149	K	57.9	Low	58	Low	130 Å²	130	103 Å²	103	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-58.7	-35.3	175.1	-76	167.1	178.8	157.7	0	113.3	S1145 L1147 Q1153	S1145-K1149 VanDerWaalsContact O-CB 3.26Å; S1145-K1149 WeakPolarHBondContact O-CB 3.45Å; S1145-K1149 VanDerWaalsContact O-CD 3.31Å; S1145-K1149 WeakPolarHBondContact O-CD 3.38Å; S1145-K1149 WeakPolarHBondContact O-CG 3.49Å; S1145-K1149 PolarHBondContact O-N 3.23Å; S1145-K1149 VanDerWaalsContact O-N 3.08Å; S1145-K1149 WeakPolarHBondContact OG-CE 3.44Å; S1145-K1149 PolarHBondContact OG-NZ 2.87Å; L1147-K1149 PolarHBondContact O-N 3.45Å; K1149-Q1153 WeakPolarHBondContact O-CB 3.35Å; K1149-Q1153 PolarHBondContact O-N 3.44Å
1150	K	59.8	Low	59	Low	164 Å²	164	106.4 Å²	106.4	71%	0.713	52%	0.52	S	S	*	.	H	α-helix	trans	-75.9	-41.4	178.7	-163.2	173.9	-175.6	179.7	0	111.9	F1146 L1147 T1148 Q1153 A1154	F1146-K1150 WeakPolarHBondContact O-CB 3.46Å; F1146-K1150 PolarHBondContact O-N 3.24Å; L1147-K1150 PolarHBondContact O-N 2.95Å; L1147-K1150 VanDerWaalsContact O-N 3.09Å; T1148-K1150 VanDerWaalsContact C-N 3.28Å; T1148-K1150 PolarHBondContact O-N 3.48Å; K1150-Q1153 PolarHBondContact O-N 2.82Å; K1150-A1154 PolarHBondContact O-N 2.81Å
1151	Q	60.6	Low	60.7	Low	67 Å²	67	100.3 Å²	100.3	31%	0.313	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-42.2	173.9	-70.7	166.4	-17.6	0	0	111.9	Y1121 L1147 T1148 A1154 A1155	Y1121-Q1151 VanDerWaalsContact CZ-NE2 3.32Å; Y1121-Q1151 PolarHBondContact OH-NE2 2.91Å; L1147-Q1151 WeakPolarHBondContact O-CB 3.49Å; L1147-Q1151 VanDerWaalsContact O-CG 3.3Å; L1147-Q1151 WeakPolarHBondContact O-CG 3.15Å; L1147-Q1151 PolarHBondContact O-N 2.97Å; T1148-Q1151 PolarHBondContact O-N 3.31Å; Q1151-A1154 CarbonylContact O-C 3.59Å; Q1151-A1154 WeakPolarHBondContact O-CA 3.31Å; Q1151-A1154 WeakPolarHBondContact O-CB 3.41Å; Q1151-A1154 PolarHBondContact O-N 3.5Å; Q1151-A1154 VanDerWaalsContact O-N 3.08Å; Q1151-A1155 PolarHBondContact O-N 2.76Å
1152	D	63.7	Low	61.9	Low	73 Å²	73	96.2 Å²	96.2	39%	0.39	46%	0.463	S	S	.	.	H	α-helix	trans	-70.4	-32.8	178.2	-175.8	26.7	0	0	0	111.6	T1148 A1155 R1156	T1148-D1152 WeakPolarHBondContact O-CB 3.31Å; T1148-D1152 PolarHBondContact O-N 2.87Å; D1152-A1155 PolarHBondContact O-N 3.13Å; D1152-R1156 WeakPolarHBondContact O-CB 3.5Å; D1152-R1156 WeakPolarHBondContact O-CG 3.1Å; D1152-R1156 PolarHBondContact O-N 3.23Å; D1152-R1156 IonicContact OD1-CZ 3.08Å; D1152-R1156 IonicContact OD1-NH1 2.7Å; D1152-R1156 PolarHBondContact OD1-NH1 3.04Å; D1152-R1156 IonicContact OD1-NH2 3.6Å; D1152-R1156 IonicContact OD2-CZ 3.76Å; D1152-R1156 IonicContact OD2-NH1 3.91Å; D1152-R1156 PolarHBondContact OD2-NH1 2.88Å; D1152-R1156 IonicContact OD2-NH2 2.68Å; D1152-R1156 PolarHBondContact OD2-NH2 3.4Å
1153	Q	66.4	Low	63.2	Low	87 Å²	87	98.2 Å²	98.2	41%	0.407	46%	0.46	S	S	.	.	H	α-helix	trans	-63.8	-38.6	165.7	-162.8	-165.8	76.8	0	0	112.3	K1149 K1150 K1157	K1149-Q1153 WeakPolarHBondContact O-CB 3.35Å; K1149-Q1153 PolarHBondContact O-N 3.44Å; K1150-Q1153 PolarHBondContact O-N 2.82Å; Q1153-K1157 WeakPolarHBondContact O-CG 3.38Å; Q1153-K1157 PolarHBondContact O-N 3.45Å; Q1153-K1157 VanDerWaalsContact OE1-NZ 3.1Å
1154	A	60.9	Low	64.4	Low	44 Å²	44	95.8 Å²	95.8	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-66.8	-46	174.5	0	0	0	0	0	111.6	K1150 Q1151 R1156 K1157 I1158	K1150-A1154 PolarHBondContact O-N 2.81Å; Q1151-A1154 CarbonylContact O-C 3.59Å; Q1151-A1154 WeakPolarHBondContact O-CA 3.31Å; Q1151-A1154 WeakPolarHBondContact O-CB 3.41Å; Q1151-A1154 PolarHBondContact O-N 3.5Å; Q1151-A1154 VanDerWaalsContact O-N 3.08Å; A1154-R1156 VanDerWaalsContact C-N 3.33Å; A1154-R1156 PolarHBondContact O-N 3.03Å; A1154-K1157 WeakPolarHBondContact O-CA 3.38Å; A1154-K1157 WeakPolarHBondContact O-CB 3.23Å; A1154-K1157 PolarHBondContact O-N 3.19Å; A1154-I1158 VanDerWaalsContact O-CG1 3.28Å; A1154-I1158 WeakPolarHBondContact O-CG1 3.33Å; A1154-I1158 PolarHBondContact O-N 3.44Å
1155	A	63.9	Low	65.6	Low	9 Å²	9	94.9 Å²	94.9	7%	0.074	44%	0.437	C	S	.	.	H	α-helix	trans	-57.6	-42.9	175	0	0	0	0	0	111.7	Y1118 Q1151 D1152 I1158 M1159	Y1118-A1155 HydrophobicContact CE2-CB 4.05Å; Q1151-A1155 PolarHBondContact O-N 2.76Å; D1152-A1155 PolarHBondContact O-N 3.13Å; A1155-I1158 PolarHBondContact O-N 2.81Å; A1155-M1159 WeakPolarHBondContact O-CB 3.48Å; A1155-M1159 WeakPolarHBondContact O-CG 3.42Å; A1155-M1159 PolarHBondContact O-N 3.05Å
1156	R	72.2	Confident	66.6	Low	107 Å²	107	101 Å²	101	40%	0.404	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-40.5	171.8	-80.6	-174.6	-78.2	-89.5	-4.8	113.2	D1152 A1154 R1160	D1152-R1156 WeakPolarHBondContact O-CB 3.5Å; D1152-R1156 WeakPolarHBondContact O-CG 3.1Å; D1152-R1156 PolarHBondContact O-N 3.23Å; D1152-R1156 IonicContact OD1-CZ 3.08Å; D1152-R1156 IonicContact OD1-NH1 2.7Å; D1152-R1156 PolarHBondContact OD1-NH1 3.04Å; D1152-R1156 IonicContact OD1-NH2 3.6Å; D1152-R1156 IonicContact OD2-CZ 3.76Å; D1152-R1156 IonicContact OD2-NH1 3.91Å; D1152-R1156 PolarHBondContact OD2-NH1 2.88Å; D1152-R1156 IonicContact OD2-NH2 2.68Å; D1152-R1156 PolarHBondContact OD2-NH2 3.4Å; A1154-R1156 VanDerWaalsContact C-N 3.33Å; A1154-R1156 PolarHBondContact O-N 3.03Å; R1156-R1160 WeakPolarHBondContact O-CB 3.43Å; R1156-R1160 VanDerWaalsContact O-CG 3.25Å; R1156-R1160 WeakPolarHBondContact O-CG 3.33Å; R1156-R1160 PolarHBondContact O-N 3.46Å
1157	K	73.6	Confident	67.8	Low	129 Å²	129	98.8 Å²	98.8	56%	0.561	45%	0.445	S	S	*	.	H	α-helix	trans	-62.6	-44.9	174.1	-75.3	171.1	178.7	170.2	0	111.2	Q1153 A1154 R1160 F1161	Q1153-K1157 WeakPolarHBondContact O-CG 3.38Å; Q1153-K1157 PolarHBondContact O-N 3.45Å; Q1153-K1157 VanDerWaalsContact OE1-NZ 3.1Å; A1154-K1157 WeakPolarHBondContact O-CA 3.38Å; A1154-K1157 WeakPolarHBondContact O-CB 3.23Å; A1154-K1157 PolarHBondContact O-N 3.19Å; K1157-R1160 PolarHBondContact O-N 2.72Å; K1157-F1161 WeakPolarHBondContact O-CB 3.31Å; K1157-F1161 PolarHBondContact O-N 3.22Å
1158	I	75.1	Confident	68.6	Low	37 Å²	37	99.4 Å²	99.4	19%	0.19	44%	0.439	C	S	.	.	H	α-helix	trans	-62.2	-48.4	176.8	-64.9	162.7	0	0	0	110.5	I1114 A1154 A1155 R1160 F1161 L1162	I1114-I1158 HydrophobicContact CG2-CD1 3.47Å; I1114-I1158 VanDerWaalsContact CG2-CD1 3.47Å; I1114-I1158 HydrophobicContact CG2-CG1 3.67Å; I1114-I1158 HydrophobicContact CG2-CG2 4.2Å; A1154-I1158 VanDerWaalsContact O-CG1 3.28Å; A1154-I1158 WeakPolarHBondContact O-CG1 3.33Å; A1154-I1158 PolarHBondContact O-N 3.44Å; A1155-I1158 PolarHBondContact O-N 2.81Å; I1158-R1160 PolarHBondContact O-N 2.85Å; I1158-F1161 WeakPolarHBondContact O-CB 3.31Å; I1158-F1161 PolarHBondContact O-N 3.14Å; I1158-F1161 VanDerWaalsContact O-N 3.12Å; I1158-L1162 HydrophobicContact CG2-CD1 3.76Å; I1158-L1162 HydrophobicContact CG2-CG 4.25Å; I1158-L1162 VanDerWaalsContact O-CG 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.45Å; I1158-L1162 PolarHBondContact O-N 3.47Å
1159	M	64.9	Low	69.4	Low	107 Å²	107	99.4 Å²	99.4	53%	0.527	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-38.8	177.3	-73.7	-155.9	-75	0	0	113	A1155 F1161 L1162 R1163	A1155-M1159 WeakPolarHBondContact O-CB 3.48Å; A1155-M1159 WeakPolarHBondContact O-CG 3.42Å; A1155-M1159 PolarHBondContact O-N 3.05Å; M1159-F1161 VanDerWaalsContact C-N 3.29Å; M1159-F1161 PolarHBondContact O-N 3.35Å; M1159-L1162 PolarHBondContact O-N 3.4Å; M1159-R1163 WeakPolarHBondContact O-CB 3.26Å; M1159-R1163 WeakPolarHBondContact O-CG 3.34Å; M1159-R1163 PolarHBondContact O-N 2.95Å
1160	R	73.2	Confident	70.1	Confident	172 Å²	172	100 Å²	100	65%	0.649	44%	0.438	S	S	*	.	H	α-helix	trans	-67.1	-28.4	173.5	-73.1	173.9	-178.8	-174.1	-0.1	112.9	R1156 K1157 I1158 R1164	R1156-R1160 WeakPolarHBondContact O-CB 3.43Å; R1156-R1160 VanDerWaalsContact O-CG 3.25Å; R1156-R1160 WeakPolarHBondContact O-CG 3.33Å; R1156-R1160 PolarHBondContact O-N 3.46Å; K1157-R1160 PolarHBondContact O-N 2.72Å; I1158-R1160 PolarHBondContact O-N 2.85Å; R1160-R1164 PolarHBondContact O-N 3.29Å; R1160-R1164 PolarHBondContact O-NE 2.88Å
1161	F	77.7	Confident	70.6	Confident	70 Å²	70	96.8 Å²	96.8	31%	0.307	43%	0.426	S	S	.	.	H	α-helix	trans	-73.9	-48.9	171	175.2	-118.4	0	0	0	111	A1111 K1157 I1158 M1159 R1163 R1164 C1165	A1111-F1161 HydrophobicContact CB-CE1 3.68Å; A1111-F1161 HydrophobicContact CB-CZ 4.41Å; K1157-F1161 WeakPolarHBondContact O-CB 3.31Å; K1157-F1161 PolarHBondContact O-N 3.22Å; I1158-F1161 WeakPolarHBondContact O-CB 3.31Å; I1158-F1161 PolarHBondContact O-N 3.14Å; I1158-F1161 VanDerWaalsContact O-N 3.12Å; M1159-F1161 VanDerWaalsContact C-N 3.29Å; M1159-F1161 PolarHBondContact O-N 3.35Å; F1161-R1163 VanDerWaalsContact C-N 3.31Å; F1161-R1163 PolarHBondContact O-N 2.92Å; F1161-R1164 CarbonylContact O-C 3.58Å; F1161-R1164 WeakPolarHBondContact O-CA 3.21Å; F1161-R1164 PolarHBondContact O-N 3.48Å; F1161-C1165 PolarHBondContact O-N 3.43Å; F1161-C1165 PolarHBondContact O-SG 3.4Å; F1161-C1165 VanDerWaalsContact O-SG 3.37Å
1162	L	72.6	Confident	70.9	Confident	24 Å²	24	97.4 Å²	97.4	13%	0.126	43%	0.431	C	S	.	.	H	α-helix	trans	-65.1	-27.8	178.1	-65.4	172.1	0	0	0	114	A1111 Q1115 I1158 M1159 R1166	A1111-L1162 HydrophobicContact CB-CD2 4.33Å; Q1115-L1162 HydrophobicContact CG-CD1 3.77Å; Q1115-L1162 HydrophobicContact CG-CD2 4.07Å; I1158-L1162 HydrophobicContact CG2-CD1 3.76Å; I1158-L1162 HydrophobicContact CG2-CG 4.25Å; I1158-L1162 VanDerWaalsContact O-CG 3.32Å; I1158-L1162 WeakPolarHBondContact O-CG 3.45Å; I1158-L1162 PolarHBondContact O-N 3.47Å; M1159-L1162 PolarHBondContact O-N 3.4Å; L1162-R1166 WeakPolarHBondContact O-CB 3.27Å; L1162-R1166 PolarHBondContact O-N 2.68Å; L1162-R1166 PolarHBondContact O-NE 3.09Å
1163	R	74.8	Confident	71.3	Confident	183 Å²	183	101.1 Å²	101.1	69%	0.691	44%	0.444	S	S	*	.	H	α-helix	trans	-68	-44.6	168.3	-75.7	-176.2	-175.6	-159.8	1.8	111	M1159 F1161 R1166 H1167	M1159-R1163 WeakPolarHBondContact O-CB 3.26Å; M1159-R1163 WeakPolarHBondContact O-CG 3.34Å; M1159-R1163 PolarHBondContact O-N 2.95Å; F1161-R1163 VanDerWaalsContact C-N 3.31Å; F1161-R1163 PolarHBondContact O-N 2.92Å; R1163-R1166 PolarHBondContact O-N 2.84Å; R1163-H1167 PolarHBondContact O-N 2.9Å
1164	R	73	Confident	71.3	Confident	170 Å²	170	102.2 Å²	102.2	64%	0.642	45%	0.449	S	S	*	.	H	α-helix	trans	-65.5	-37.4	173.9	-79.8	-178.8	-72.1	174.6	-1.2	113.3	R1160 F1161 H1167 R1168	R1160-R1164 PolarHBondContact O-N 3.29Å; R1160-R1164 PolarHBondContact O-NE 2.88Å; F1161-R1164 CarbonylContact O-C 3.58Å; F1161-R1164 WeakPolarHBondContact O-CA 3.21Å; F1161-R1164 PolarHBondContact O-N 3.48Å; R1164-H1167 PolarHBondContact O-N 3.28Å; R1164-R1168 WeakPolarHBondContact O-CB 3.49Å; R1164-R1168 PolarHBondContact O-N 3.32Å
1165	C	72.1	Confident	71.1	Confident	29 Å²	29	102.7 Å²	102.7	20%	0.196	45%	0.449	C	S	.	.	H	α-helix	trans	-64.5	-40.2	172.8	-65.2	0	0	0	0	111.7	F1161 R1168 I1169	F1161-C1165 PolarHBondContact O-N 3.43Å; F1161-C1165 PolarHBondContact O-SG 3.4Å; F1161-C1165 VanDerWaalsContact O-SG 3.37Å; C1165-R1168 PolarHBondContact O-N 3.26Å; C1165-I1169 WeakPolarHBondContact O-CB 3.38Å; C1165-I1169 WeakPolarHBondContact O-CD1 3.29Å; C1165-I1169 VanDerWaalsContact O-CG1 3.22Å; C1165-I1169 WeakPolarHBondContact O-CG1 3.4Å; C1165-I1169 PolarHBondContact O-N 3.24Å
1166	R	72.8	Confident	71.1	Confident	173 Å²	173	110.4 Å²	110.4	65%	0.653	48%	0.476	S	S	*	.	H	α-helix	trans	-67.1	-37.4	173.2	-82.6	-176	-81.7	-166.9	-4	112.9	L1162 R1163 I1169 K1170	L1162-R1166 WeakPolarHBondContact O-CB 3.27Å; L1162-R1166 PolarHBondContact O-N 2.68Å; L1162-R1166 PolarHBondContact O-NE 3.09Å; R1163-R1166 PolarHBondContact O-N 2.84Å; R1166-I1169 PolarHBondContact O-N 2.7Å; R1166-K1170 PolarHBondContact O-N 3.34Å
1167	H	76.9	Confident	70.5	Confident	112 Å²	112	108.2 Å²	108.2	52%	0.519	47%	0.471	S	S	.	.	H	α-helix	trans	-60	-53.1	171.4	-162.6	-83.5	0	0	0	110.9	R1163 R1164 I1169 K1170 E1171	R1163-H1167 PolarHBondContact O-N 2.9Å; R1164-H1167 PolarHBondContact O-N 3.28Å; H1167-I1169 VanDerWaalsContact C-N 3.27Å; H1167-I1169 PolarHBondContact O-N 2.75Å; H1167-K1170 CarbonylContact O-C 3.51Å; H1167-K1170 WeakPolarHBondContact O-CA 3.32Å; H1167-K1170 WeakPolarHBondContact O-CB 3.39Å; H1167-K1170 PolarHBondContact O-N 2.73Å; H1167-E1171 IonicContact CE1-OE1 3.72Å; H1167-E1171 PolarHBondContact CE1-OE1 3.35Å; H1167-E1171 IonicContact CE1-OE2 3.34Å; H1167-E1171 IonicContact CG-OE2 3.47Å; H1167-E1171 IonicContact ND1-OE1 3.77Å; H1167-E1171 PolarHBondContact ND1-OE1 3.19Å; H1167-E1171 IonicContact ND1-OE2 2.63Å; H1167-E1171 PolarHBondContact ND1-OE2 3.35Å; H1167-E1171 WeakPolarHBondContact O-CG 3.35Å; H1167-E1171 PolarHBondContact O-N 2.96Å
1168	R	70.6	Confident	69.7	Low	125 Å²	125	105 Å²	105	47%	0.472	46%	0.459	S	S	.	.	H	α-helix	trans	-63.8	-27.4	178.9	-164.7	166.8	175.7	-177.8	-6.7	113.8	E1100 R1164 C1165 E1171 L1172	E1100-R1168 IonicContact OE2-NH2 3.22Å; E1100-R1168 PolarHBondContact OE2-NH2 3.5Å; E1100-R1168 VanDerWaalsContact OE2-NH2 3.1Å; R1164-R1168 WeakPolarHBondContact O-CB 3.49Å; R1164-R1168 PolarHBondContact O-N 3.32Å; C1165-R1168 PolarHBondContact O-N 3.26Å; R1168-E1171 WeakPolarHBondContact CA-OE2 3.14Å; R1168-E1171 PolarHBondContact N-OE2 3.11Å; R1168-L1172 HydrophobicContact CG-CD1 4.42Å; R1168-L1172 VanDerWaalsContact O-CB 3.29Å; R1168-L1172 WeakPolarHBondContact O-CB 3.31Å; R1168-L1172 WeakPolarHBondContact O-CD1 3.32Å; R1168-L1172 WeakPolarHBondContact O-CG 3.45Å; R1168-L1172 PolarHBondContact O-N 3.25Å
1169	I	74.3	Confident	68.8	Low	76 Å²	76	109 Å²	109	39%	0.39	48%	0.477	S	S	.	.	H	α-helix	trans	-74.9	-36	170	-71.3	166	0	0	0	111.5	F1104 C1165 R1166 H1167 K1173	F1104-I1169 HydrophobicContact CZ-CD1 4.47Å; F1104-I1169 HydrophobicContact CZ-CG1 4.18Å; C1165-I1169 WeakPolarHBondContact O-CB 3.38Å; C1165-I1169 WeakPolarHBondContact O-CD1 3.29Å; C1165-I1169 VanDerWaalsContact O-CG1 3.22Å; C1165-I1169 WeakPolarHBondContact O-CG1 3.4Å; C1165-I1169 PolarHBondContact O-N 3.24Å; R1166-I1169 PolarHBondContact O-N 2.7Å; H1167-I1169 VanDerWaalsContact C-N 3.27Å; H1167-I1169 PolarHBondContact O-N 2.75Å; I1169-K1173 WeakPolarHBondContact O-CB 3.31Å; I1169-K1173 WeakPolarHBondContact O-CG 3.24Å; I1169-K1173 PolarHBondContact O-N 2.98Å
1170	K	73.3	Confident	68.4	Low	143 Å²	143	112 Å²	112	62%	0.622	48%	0.482	S	S	*	.	H	α-helix	trans	-66.1	-45.1	172.2	-166.1	-177	179.1	-171.2	0	110.6	R1166 H1167 K1173 Q1174	R1166-K1170 PolarHBondContact O-N 3.34Å; H1167-K1170 CarbonylContact O-C 3.51Å; H1167-K1170 WeakPolarHBondContact O-CA 3.32Å; H1167-K1170 WeakPolarHBondContact O-CB 3.39Å; H1167-K1170 PolarHBondContact O-N 2.73Å; K1170-K1173 PolarHBondContact O-N 2.99Å; K1170-Q1174 VanDerWaalsContact O-CB 3.22Å; K1170-Q1174 WeakPolarHBondContact O-CB 3.41Å; K1170-Q1174 PolarHBondContact O-N 3.12Å
1171	E	69.4	Low	67.5	Low	95 Å²	95	111.7 Å²	111.7	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-59.7	-44.5	173.1	-69.6	166	124.3	0	0	111.8	H1167 R1168 Q1174 S1175	H1167-E1171 IonicContact CE1-OE1 3.72Å; H1167-E1171 PolarHBondContact CE1-OE1 3.35Å; H1167-E1171 IonicContact CE1-OE2 3.34Å; H1167-E1171 IonicContact CG-OE2 3.47Å; H1167-E1171 IonicContact ND1-OE1 3.77Å; H1167-E1171 PolarHBondContact ND1-OE1 3.19Å; H1167-E1171 IonicContact ND1-OE2 2.63Å; H1167-E1171 PolarHBondContact ND1-OE2 3.35Å; H1167-E1171 WeakPolarHBondContact O-CG 3.35Å; H1167-E1171 PolarHBondContact O-N 2.96Å; R1168-E1171 WeakPolarHBondContact CA-OE2 3.14Å; R1168-E1171 PolarHBondContact N-OE2 3.11Å; E1171-Q1174 PolarHBondContact O-N 2.93Å; E1171-S1175 VanDerWaalsContact O-CB 3.22Å; E1171-S1175 WeakPolarHBondContact O-CB 3.4Å; E1171-S1175 PolarHBondContact O-N 3.34Å
1172	L	66.7	Low	65.8	Low	80 Å²	80	111.5 Å²	111.5	42%	0.419	50%	0.5	S	S	.	.	H	α-helix	trans	-68.2	-34	176.1	-76.5	167.7	0	0	0	113	R1168 R1176	R1168-L1172 HydrophobicContact CG-CD1 4.42Å; R1168-L1172 VanDerWaalsContact O-CB 3.29Å; R1168-L1172 WeakPolarHBondContact O-CB 3.31Å; R1168-L1172 WeakPolarHBondContact O-CD1 3.32Å; R1168-L1172 WeakPolarHBondContact O-CG 3.45Å; R1168-L1172 PolarHBondContact O-N 3.25Å; L1172-R1176 WeakPolarHBondContact O-CB 3.38Å; L1172-R1176 WeakPolarHBondContact O-CG 3.31Å; L1172-R1176 PolarHBondContact O-N 2.86Å; L1172-R1176 VanDerWaalsContact O-N 3.11Å
1173	K	73	Confident	64.4	Low	152 Å²	152	115.8 Å²	115.8	66%	0.661	52%	0.522	S	S	*	.	H	α-helix	trans	-67.1	-44.7	170.5	-82.8	-165.8	170.1	-162.1	0	111.1	I1169 K1170 R1176 E1177	I1169-K1173 WeakPolarHBondContact O-CB 3.31Å; I1169-K1173 WeakPolarHBondContact O-CG 3.24Å; I1169-K1173 PolarHBondContact O-N 2.98Å; K1170-K1173 PolarHBondContact O-N 2.99Å; K1173-R1176 CarbonylContact O-C 3.57Å; K1173-R1176 PolarHBondContact O-N 3.02Å; K1173-E1177 VanDerWaalsContact O-CB 3.29Å; K1173-E1177 WeakPolarHBondContact O-CB 3.4Å; K1173-E1177 PolarHBondContact O-N 3.33Å
1174	Q	65.8	Low	62.6	Low	110 Å²	110	110.8 Å²	110.8	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-69	-38	-179	-167.7	165.9	-4.7	0	0	111.4	K1170 E1171 E1177 L1178	K1170-Q1174 VanDerWaalsContact O-CB 3.22Å; K1170-Q1174 WeakPolarHBondContact O-CB 3.41Å; K1170-Q1174 PolarHBondContact O-N 3.12Å; E1171-Q1174 PolarHBondContact O-N 2.93Å; Q1174-E1177 CarbonylContact O-C 3.56Å; Q1174-E1177 WeakPolarHBondContact O-CB 3.32Å; Q1174-E1177 PolarHBondContact O-N 3.06Å; Q1174-L1178 HydrophobicContact CG-CD1 4.38Å; Q1174-L1178 WeakPolarHBondContact O-CB 3.46Å; Q1174-L1178 WeakPolarHBondContact O-CD1 3.3Å; Q1174-L1178 WeakPolarHBondContact O-CG 3.36Å; Q1174-L1178 PolarHBondContact O-N 2.9Å
1175	S	56.6	Low	61.1	Low	53 Å²	53	112.9 Å²	112.9	37%	0.371	54%	0.544	S	S	.	.	H	α-helix	trans	-62.3	-42	170.7	-172.1	0	0	0	0	111.8	E1171 E1177 L1178 E1179	E1171-S1175 VanDerWaalsContact O-CB 3.22Å; E1171-S1175 WeakPolarHBondContact O-CB 3.4Å; E1171-S1175 PolarHBondContact O-N 3.34Å; S1175-E1177 VanDerWaalsContact C-N 3.32Å; S1175-L1178 PolarHBondContact O-N 3.31Å; S1175-E1179 WeakPolarHBondContact O-CG 3.39Å; S1175-E1179 PolarHBondContact O-N 2.63Å
1176	R	64	Low	60.5	Low	171 Å²	171	117.1 Å²	117.1	65%	0.645	56%	0.561	S	S	*	*	H	α-helix	trans	-70.1	-28.8	173.6	-77.5	176.7	170	-153.3	-5.8	113.4	L1172 K1173 E1179 R1180	L1172-R1176 WeakPolarHBondContact O-CB 3.38Å; L1172-R1176 WeakPolarHBondContact O-CG 3.31Å; L1172-R1176 PolarHBondContact O-N 2.86Å; L1172-R1176 VanDerWaalsContact O-N 3.11Å; K1173-R1176 CarbonylContact O-C 3.57Å; K1173-R1176 PolarHBondContact O-N 3.02Å; R1176-E1179 WeakPolarHBondContact CA-OE2 3.37Å; R1176-E1179 WeakPolarHBondContact CG-OE2 3.35Å; R1176-R1180 WeakPolarHBondContact O-CB 3.4Å; R1176-R1180 PolarHBondContact O-N 2.81Å
1177	E	61.1	Low	59.9	Low	61 Å²	61	114.2 Å²	114.2	29%	0.285	56%	0.556	S	S	.	*	H	α-helix	trans	-72.7	-35.1	173.6	-164.6	63.1	-154.7	0	0	110.8	K1173 Q1174 S1175 R1180 R1181	K1173-E1177 VanDerWaalsContact O-CB 3.29Å; K1173-E1177 WeakPolarHBondContact O-CB 3.4Å; K1173-E1177 PolarHBondContact O-N 3.33Å; Q1174-E1177 CarbonylContact O-C 3.56Å; Q1174-E1177 WeakPolarHBondContact O-CB 3.32Å; Q1174-E1177 PolarHBondContact O-N 3.06Å; S1175-E1177 VanDerWaalsContact C-N 3.32Å; E1177-R1180 VanDerWaalsContact CD-NH1 3.3Å; E1177-R1180 IonicContact OE1-NH1 2.7Å; E1177-R1180 PolarHBondContact OE1-NH1 2.7Å; E1177-R1180 IonicContact OE2-CZ 2.68Å; E1177-R1180 VanDerWaalsContact OE2-CZ 3.25Å; E1177-R1180 IonicContact OE2-NH1 3.75Å; E1177-R1180 PolarHBondContact OE2-NH1 3.1Å; E1177-R1180 IonicContact OE2-NH2 3.01Å; E1177-R1180 PolarHBondContact OE2-NH2 3.31Å; E1177-R1181 WeakPolarHBondContact O-CB 3.31Å; E1177-R1181 WeakPolarHBondContact O-CD 3.43Å; E1177-R1181 WeakPolarHBondContact O-CG 3.24Å; E1177-R1181 PolarHBondContact O-N 2.87Å; E1177-R1181 IonicContact OE1-CZ 2.79Å; E1177-R1181 IonicContact OE1-NE 3.83Å; E1177-R1181 PolarHBondContact OE1-NE 2.93Å; E1177-R1181 IonicContact OE1-NH2 3.32Å; E1177-R1181 PolarHBondContact OE1-NH2 3.33Å
1178	L	55.1	Low	59	Low	61 Å²	61	114.3 Å²	114.3	32%	0.319	56%	0.559	S	S	.	*	H	α-helix	trans	-72.9	-41.8	172.7	-67.9	162.6	0	0	0	111.3	Q1174 S1175 R1180 R1181 G1182 L1183 T1184	Q1174-L1178 HydrophobicContact CG-CD1 4.38Å; Q1174-L1178 WeakPolarHBondContact O-CB 3.46Å; Q1174-L1178 WeakPolarHBondContact O-CD1 3.3Å; Q1174-L1178 WeakPolarHBondContact O-CG 3.36Å; Q1174-L1178 PolarHBondContact O-N 2.9Å; S1175-L1178 PolarHBondContact O-N 3.31Å; L1178-R1180 VanDerWaalsContact C-N 3.33Å; L1178-R1180 PolarHBondContact O-N 2.96Å; L1178-R1181 CarbonylContact O-C 3.6Å; L1178-R1181 PolarHBondContact O-N 3Å; L1178-G1182 PolarHBondContact O-N 2.96Å; L1178-L1183 HydrophobicContact CB-CB 4.21Å; L1178-L1183 HydrophobicContact CD2-CB 3.51Å; L1178-L1183 HydrophobicContact CD2-CD1 4.06Å; L1178-L1183 HydrophobicContact CD2-CG 4.44Å; L1178-L1183 HydrophobicContact CG-CB 4.47Å; L1178-L1183 PolarHBondContact O-N 3.16Å; L1178-T1184 HydrophobicContact CB-CG2 3.83Å
1179	E	56	Low	58.3	Low	121 Å²	121	113.6 Å²	113.6	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-54.6	-49.4	169.2	-77.4	175.9	119.8	0	0	110.2	S1175 R1176 R1181 G1182 T1184	S1175-E1179 WeakPolarHBondContact O-CG 3.39Å; S1175-E1179 PolarHBondContact O-N 2.63Å; R1176-E1179 WeakPolarHBondContact CA-OE2 3.37Å; R1176-E1179 WeakPolarHBondContact CG-OE2 3.35Å; E1179-R1181 PolarHBondContact O-N 3.33Å; E1179-R1181 VanDerWaalsContact O-N 3.13Å; E1179-G1182 PolarHBondContact O-N 3.25Å; E1179-T1184 HydrophobicContact CG-CG2 4.19Å
1180	R	56.5	Low	57.3	Low	170 Å²	170	116 Å²	116	64%	0.642	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-2.8	178.5	-140.3	-169.9	-42.6	102.5	12.5	114.4	R1176 E1177 L1178	R1176-R1180 WeakPolarHBondContact O-CB 3.4Å; R1176-R1180 PolarHBondContact O-N 2.81Å; E1177-R1180 VanDerWaalsContact CD-NH1 3.3Å; E1177-R1180 IonicContact OE1-NH1 2.7Å; E1177-R1180 PolarHBondContact OE1-NH1 2.7Å; E1177-R1180 IonicContact OE2-CZ 2.68Å; E1177-R1180 VanDerWaalsContact OE2-CZ 3.25Å; E1177-R1180 IonicContact OE2-NH1 3.75Å; E1177-R1180 PolarHBondContact OE2-NH1 3.1Å; E1177-R1180 IonicContact OE2-NH2 3.01Å; E1177-R1180 PolarHBondContact OE2-NH2 3.31Å; L1178-R1180 VanDerWaalsContact C-N 3.33Å; L1178-R1180 PolarHBondContact O-N 2.96Å
1181	R	54.5	Low	56.2	Low	166 Å²	166	114.2 Å²	114.2	63%	0.626	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.4	7.7	175.6	-67.8	172	-169.2	-134.1	3.3	112.7	E1177 L1178 E1179 L1183	E1177-R1181 WeakPolarHBondContact O-CB 3.31Å; E1177-R1181 WeakPolarHBondContact O-CD 3.43Å; E1177-R1181 WeakPolarHBondContact O-CG 3.24Å; E1177-R1181 PolarHBondContact O-N 2.87Å; E1177-R1181 IonicContact OE1-CZ 2.79Å; E1177-R1181 IonicContact OE1-NE 3.83Å; E1177-R1181 PolarHBondContact OE1-NE 2.93Å; E1177-R1181 IonicContact OE1-NH2 3.32Å; E1177-R1181 PolarHBondContact OE1-NH2 3.33Å; L1178-R1181 CarbonylContact O-C 3.6Å; L1178-R1181 PolarHBondContact O-N 3Å; E1179-R1181 PolarHBondContact O-N 3.33Å; E1179-R1181 VanDerWaalsContact O-N 3.13Å; R1181-L1183 HydrophobicContact CB-CD1 4.03Å; R1181-L1183 HydrophobicContact CB-CG 4.44Å; R1181-L1183 PolarHBondContact O-N 3.1Å
1182	G	42.3	Very low	55.3	Low	67 Å²	67	115.6 Å²	115.6	69%	0.691	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.5	17.1	-179.3	0	0	0	0	0	115.7	L1178 E1179	L1178-G1182 PolarHBondContact O-N 2.96Å; E1179-G1182 PolarHBondContact O-N 3.25Å
1183	L	44.3	Very low	54.4	Low	114 Å²	114	118.3 Å²	118.3	60%	0.597	59%	0.593	S	S	*	*			trans	-101.6	32.6	-170	-76.8	166.1	0	0	0	113.8	L1178 R1181	L1178-L1183 HydrophobicContact CB-CB 4.21Å; L1178-L1183 HydrophobicContact CD2-CB 3.51Å; L1178-L1183 HydrophobicContact CD2-CD1 4.06Å; L1178-L1183 HydrophobicContact CD2-CG 4.44Å; L1178-L1183 HydrophobicContact CG-CB 4.47Å; L1178-L1183 PolarHBondContact O-N 3.16Å; R1181-L1183 HydrophobicContact CB-CD1 4.03Å; R1181-L1183 HydrophobicContact CB-CG 4.44Å; R1181-L1183 PolarHBondContact O-N 3.1Å
1184	T	36.9	Very low	52.8	Low	78 Å²	78	115.5 Å²	115.5	48%	0.479	59%	0.587	S	S	.	*			trans	-115.7	107.9	175.8	53.8	0	0	0	0	110.8	L1178 E1179	L1178-T1184 HydrophobicContact CB-CG2 3.83Å; E1179-T1184 HydrophobicContact CG-CG2 4.19Å
1185	T	40.9	Very low	51.6	Low	214 Å²	214	116 Å²	116	100%	1.313	59%	0.594	S	S	*	*			trans	-75.3	0	178.7	57.7	0	0	0	0	113.8

Retrieved 1,185 of 1,185 residues in 3188.4 ms (Link to these results)

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