A0A087YDE3_POEFO Loading...

Nibrin

AlphaFold DB , UniProt , Accession A0A087YDE3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 843 aa.

						>A0A087YDE3_POEFO|A0A087YDE3
MWILTPQQPGGETFYLLPGKEYVVGRKNCDILLASDQSISRSHAQLTVTDLTLTLKDTSKYGTFVNSQQLTAPVELSSGDNVAFGVFHSKFSVVFLEKPVVCSSCLDVAGKTSLSQALSALGGKLVSSWTPDCTHLAMPTVKVTIKTISALLCGRPIVKPEYFSELSRAVQQKSAPPKPESFVPEIDEPSLRKEDVKLATTSARKQLFTGKTFVFLTSKQLKRLGAAVSFGGGSSRLLEEGSLPRDLLESPHSCVVEVTTGSSQTLLPPSATEWANAVKNITHRKGLRVITESEIGLAAIYASCDKYCNPSCLIVDSDPVQKVKPRIPSASLSQSVTVDETVLPAASQNITAYAVNTETSQRMEVRHMTGPAAVGETPEQKQKAAQLPGAKATVQKSTSELIVEDTMSSSFSAADSTDSQRRKPDPKPKVPGFGNTNFRPPPSAPKTNGGSRTILHTQSSQKQKTSPQTSPQKQSTLTNFFQPVNKKRPLEEESSDIMSAPKRPAPESSASSKDTNSLGVSKKMPSLPLEGPSAVSETPLESASDLFSGRAERLEEEPRSRKRKEMEEEVIKMEELESIMSEDMDYLGDESPSGHGQKEEVTVRRGLAKQMQSSHTVESSAKKQRVYQEQTVGAGQRPGLGLDKERSQQNLGEQSDRHVVSNKTDNNISPNHNSSRPPKMPAATATEEKKVFEDDDASFIEDVELLQVDIPQPAEETRAAVRPVQIKEEVKESKVDEDLPKKLLMVEFRSLTVTAPSKPKPKQPQNNGHAKNFKCFRKKHLPGAEGFPHIIGGSDLLVHNRGTNSDLDEWLKGAAEGERQNKREEAIGDDLFRYNPTKLTKRR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	86.8	Confident	84.1	Confident	34 Å²	34	53 Å²	53	17%	0.167	35%	0.346	C	S	.	.				0	151.5	0	67.8	179.8	86.6	0	0	108.1	Y15 F95 L96 V170	M1-Y15 HydrophobicContact SD-CD1 4.02Å; M1-F95 WeakPolarHBondContact O-CD2 3.44Å; M1-L96 HydrophobicContact CE-CD2 4.19Å; M1-L96 HydrophobicContact CG-CB 3.92Å; M1-L96 HydrophobicContact CG-CD2 4.12Å; M1-L96 HydrophobicContact CG-CG 4.35Å; M1-L96 PolarHBondContact N-O 2.67Å; M1-L96 PolarHBondContact O-N 2.96Å; M1-L96 HydrophobicContact SD-CD2 4.06Å; M1-V170 HydrophobicContact SD-CG2 4.33Å
2	W	90.1	Very high	84.1	Confident	10 Å²	10	55.8 Å²	55.8	4%	0.038	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	149.5	178.9	-71.5	94.9	0	0	0	110.4	L16 L51 L53 L76 V93 V94 F95	W2-L16 HydrophobicContact CB-CB 4Å; W2-L16 HydrophobicContact CB-CD1 4.26Å; W2-L16 PolarHBondContact N-O 3.1Å; W2-L16 VanDerWaalsContact N-O 3.1Å; W2-L16 WeakPolarHBondContact O-CA 3.44Å; W2-L16 WeakPolarHBondContact O-CB 3.17Å; W2-L16 PolarHBondContact O-N 3.33Å; W2-L51 WeakPolarHBondContact CZ2-O 3.32Å; W2-L53 HydrophobicContact CB-CD2 4.16Å; W2-L53 HydrophobicContact CD2-CB 3.67Å; W2-L53 HydrophobicContact CD2-CD2 4.04Å; W2-L53 HydrophobicContact CD2-CG 4.42Å; W2-L53 HydrophobicContact CE3-CB 4.14Å; W2-L53 HydrophobicContact CE3-CD2 3.97Å; W2-L53 HydrophobicContact CG-CB 3.95Å; W2-L53 HydrophobicContact CG-CD1 4.49Å; W2-L53 HydrophobicContact CG-CD2 4.16Å; W2-L53 HydrophobicContact CG-CG 4.44Å; W2-L53 HydrophobicContact CH2-CB 4.45Å; W2-L53 HydrophobicContact CZ2-CB 4.03Å; W2-L53 HydrophobicContact CZ3-CB 4.5Å; W2-L76 WeakPolarHBondContact CH2-O 3.36Å; W2-V93 HydrophobicContact CE3-CG1 3.48Å; W2-V93 VanDerWaalsContact CE3-CG1 3.48Å; W2-V93 HydrophobicContact CZ3-CG1 3.51Å; W2-V94 CarbonylContact C-O 3.48Å; W2-F95 AromaticContact CD1-CD2 3.9Å; W2-F95 HydrophobicContact CD2-CB 4.2Å; W2-F95 AromaticContact CD2-CD2 3.61Å; W2-F95 HydrophobicContact CD2-CD2 3.61Å; W2-F95 HydrophobicContact CD2-CE2 4.46Å; W2-F95 HydrophobicContact CD2-CG 4.35Å; W2-F95 AromaticContact CE2-CD2 3.41Å; W2-F95 VanDerWaalsContact CE2-CD2 3.41Å; W2-F95 AromaticContact CE2-CE2 3.97Å; W2-F95 HydrophobicContact CE3-CB 3.85Å; W2-F95 HydrophobicContact CE3-CD2 4.16Å; W2-F95 HydrophobicContact CE3-CG 4.48Å; W2-F95 AromaticContact CG-CD2 3.94Å; W2-F95 HydrophobicContact CG-CD2 3.94Å; W2-F95 HydrophobicContact CH2-CB 3.98Å; W2-F95 HydrophobicContact CH2-CD2 4.39Å; W2-F95 HydrophobicContact CH2-CG 4.4Å; W2-F95 HydrophobicContact CZ2-CB 4.28Å; W2-F95 AromaticContact CZ2-CD2 3.84Å; W2-F95 HydrophobicContact CZ2-CD2 3.84Å; W2-F95 HydrophobicContact CZ2-CE2 4.45Å; W2-F95 HydrophobicContact CZ2-CG 4.23Å; W2-F95 HydrophobicContact CZ3-CB 3.75Å; W2-F95 AromaticContact NE1-CD2 3.58Å; W2-F95 AromaticContact NE1-CE2 3.7Å
3	I	90.9	Very high	84.4	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131	-176	-51.2	175.6	0	0	0	108.3	T13 F14 Y15 V94 L96 P176	I3-T13 HydrophobicContact CG2-CG2 3.41Å; I3-T13 VanDerWaalsContact CG2-CG2 3.41Å; I3-F14 WeakPolarHBondContact CA-O 3.49Å; I3-Y15 HydrophobicContact CD1-CD1 4Å; I3-Y15 HydrophobicContact CD1-CE1 3.53Å; I3-Y15 HydrophobicContact CG1-CD1 3.81Å; I3-Y15 HydrophobicContact CG1-CE1 3.85Å; I3-Y15 HydrophobicContact CG2-CD1 4.43Å; I3-Y15 HydrophobicContact CG2-CE1 4.23Å; I3-V94 HydrophobicContact CB-CB 4.36Å; I3-V94 PolarHBondContact N-O 2.77Å; I3-V94 PolarHBondContact O-N 3.1Å; I3-L96 HydrophobicContact CD1-CB 3.86Å; I3-L96 HydrophobicContact CD1-CD2 4.08Å; I3-L96 HydrophobicContact CG1-CB 4.5Å; I3-P176 HydrophobicContact CD1-CB 4.28Å; I3-P176 HydrophobicContact CD1-CG 4.02Å
4	L	91.3	Very high	84.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	104.9	168.7	-61.7	176.6	0	0	0	108.9	T13 F14 L16 I31 L46 F91 V93	L4-T13 WeakPolarHBondContact O-CA 3.33Å; L4-F14 HydrophobicContact CB-CB 4.32Å; L4-F14 PolarHBondContact N-O 2.94Å; L4-F14 PolarHBondContact O-N 3.38Å; L4-L16 HydrophobicContact CD1-CD1 4.1Å; L4-L16 HydrophobicContact CG-CD1 4.03Å; L4-I31 HydrophobicContact CD1-CD1 4.17Å; L4-L46 HydrophobicContact CD1-CD1 3.71Å; L4-F91 HydrophobicContact CB-CB 4.38Å; L4-F91 HydrophobicContact CB-CD1 4.1Å; L4-F91 HydrophobicContact CB-CG 4.49Å; L4-V93 HydrophobicContact CD2-CB 4.47Å; L4-V93 HydrophobicContact CD2-CG2 3.85Å
5	T	90.3	Very high	85.1	Confident	23 Å²	23	47.7 Å²	47.7	14%	0.141	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.6	178	-51.8	0	0	0	0	109.1	F91 S92 A175	T5-F91 CarbonylContact O-C 3.19Å; T5-F91 VanDerWaalsContact O-CA 3.24Å; T5-F91 WeakPolarHBondContact O-CA 3.43Å; T5-S92 PolarHBondContact N-O 2.93Å; T5-S92 PolarHBondContact O-N 3.09Å; T5-S92 PolarHBondContact O-OG 2.81Å; T5-A175 HydrophobicContact CG2-CB 3.93Å
6	P	89.9	Confident	85.4	Confident	23 Å²	23	44.8 Å²	44.8	15%	0.149	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137	179.9	27.2	-32.7	0	0	0	110.8	Q8 E12 T13 F91	P6-Q8 PolarHBondContact O-N 3.24Å; P6-E12 WeakPolarHBondContact CD-O 3.36Å; P6-T13 WeakPolarHBondContact CD-OG1 3.46Å; P6-F91 HydrophobicContact CB-CD1 4.01Å; P6-F91 HydrophobicContact CB-CE1 3.78Å
7	Q	86.6	Confident	85.4	Confident	121 Å²	121	48.2 Å²	48.2	57%	0.565	29%	0.292	S	S	*	.	S	Bend	trans	-74.2	-18.2	176	-164.3	179	40.5	0	0	112.1	K90	Q7-K90 HydrophobicContact CB-CB 4.08Å; Q7-K90 PolarHBondContact N-O 3.21Å
8	Q	81	Confident	85.4	Confident	99 Å²	99	48.3 Å²	48.3	46%	0.463	29%	0.293	S	S	.	.	S	Bend	trans	-96.3	140.9	179.4	-65.6	-151	-24	0	0	112.8	P6 G10 G11	P6-Q8 PolarHBondContact O-N 3.24Å; Q8-G10 PolarHBondContact O-N 2.96Å; Q8-G11 PolarHBondContact O-N 2.61Å
9	P	71.2	Confident	85.3	Confident	136 Å²	136	50.1 Å²	50.1	88%	0.883	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	127.7	176.2	27.4	-34.2	0	0	0	110.8
10	G	70.9	Confident	85.4	Confident	90 Å²	90	51.8 Å²	51.8	93%	0.928	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	3.9	177.8	0	0	0	0	0	116.2	Q8	Q8-G10 PolarHBondContact O-N 2.96Å
11	G	76.5	Confident	85.7	Confident	45 Å²	45	54 Å²	54	46%	0.464	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-77.7	158.1	169.6	0	0	0	0	0	113.9	Q8	Q8-G11 PolarHBondContact O-N 2.61Å
12	E	83.3	Confident	86	Confident	87 Å²	87	53.4 Å²	53.4	41%	0.407	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-79.1	143.9	169.4	-175	178.7	176.2	0	0	110.8	P6 F14 K173	P6-E12 WeakPolarHBondContact CD-O 3.36Å; E12-F14 HydrophobicContact CB-CE1 4.32Å; E12-F14 HydrophobicContact CB-CE2 4.19Å; E12-F14 HydrophobicContact CB-CZ 3.81Å; E12-F14 HydrophobicContact CG-CE1 3.93Å; E12-F14 HydrophobicContact CG-CZ 3.95Å; E12-F14 WeakPolarHBondContact O-CE2 3.37Å; E12-K173 HydrophobicContact CG-CB 4.35Å; E12-K173 HydrophobicContact CG-CD 4.26Å; E12-K173 WeakPolarHBondContact OE1-CD 3.36Å; E12-K173 WeakPolarHBondContact OE1-CE 3.14Å; E12-K173 IonicContact OE1-NZ 3.62Å; E12-K173 PolarHBondContact OE1-NZ 3.05Å
13	T	89.1	Confident	86.2	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.025	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-98.9	124.2	176	-61.2	0	0	0	0	110.3	I3 L4 P6 Y15 K173 A175	I3-T13 HydrophobicContact CG2-CG2 3.41Å; I3-T13 VanDerWaalsContact CG2-CG2 3.41Å; L4-T13 WeakPolarHBondContact O-CA 3.33Å; P6-T13 WeakPolarHBondContact CD-OG1 3.46Å; T13-Y15 HydrophobicContact CG2-CD2 4.4Å; T13-Y15 HydrophobicContact CG2-CE2 3.85Å; T13-K173 WeakPolarHBondContact CB-O 3.45Å; T13-K173 PolarHBondContact N-O 3.17Å; T13-K173 VanDerWaalsContact N-O 3.13Å; T13-K173 WeakPolarHBondContact O-CB 3.47Å; T13-A175 PolarHBondContact OG1-N 3.48Å
14	F	89.8	Confident	86.4	Confident	14 Å²	14	55.1 Å²	55.1	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.8	-173.6	-58.7	-81.3	0	0	0	111.6	I3 L4 E12 L16 I31 L33 F91	I3-F14 WeakPolarHBondContact CA-O 3.49Å; L4-F14 HydrophobicContact CB-CB 4.32Å; L4-F14 PolarHBondContact N-O 2.94Å; L4-F14 PolarHBondContact O-N 3.38Å; E12-F14 HydrophobicContact CB-CE1 4.32Å; E12-F14 HydrophobicContact CB-CE2 4.19Å; E12-F14 HydrophobicContact CB-CZ 3.81Å; E12-F14 HydrophobicContact CG-CE1 3.93Å; E12-F14 HydrophobicContact CG-CZ 3.95Å; E12-F14 WeakPolarHBondContact O-CE2 3.37Å; F14-L16 HydrophobicContact CB-CD2 4.39Å; F14-I31 HydrophobicContact CB-CD1 4.42Å; F14-I31 HydrophobicContact CB-CG1 4.33Å; F14-I31 HydrophobicContact CD1-CB 4.46Å; F14-I31 HydrophobicContact CD1-CG1 4Å; F14-I31 HydrophobicContact CD1-CG2 4.2Å; F14-I31 HydrophobicContact CD2-CG2 3.86Å; F14-I31 HydrophobicContact CE1-CG2 4.19Å; F14-I31 HydrophobicContact CE2-CG2 3.84Å; F14-I31 HydrophobicContact CG-CG1 4.08Å; F14-I31 HydrophobicContact CG-CG2 4.04Å; F14-I31 HydrophobicContact CZ-CG2 4.01Å; F14-L33 HydrophobicContact CE2-CD2 4.23Å; F14-L33 HydrophobicContact CZ-CD2 4.48Å; F14-F91 HydrophobicContact CD2-CE1 4.06Å; F14-F91 AromaticContact CE2-CE1 3.97Å; F14-F91 HydrophobicContact CE2-CE1 3.97Å; F14-F91 HydrophobicContact CE2-CZ 4.3Å
15	Y	89.3	Confident	86.4	Confident	28 Å²	28	55 Å²	55	11%	0.11	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.2	175.4	-70.7	-97.2	0	0	0	110.5	M1 I3 T13 Y22 V170 S174	M1-Y15 HydrophobicContact SD-CD1 4.02Å; I3-Y15 HydrophobicContact CD1-CD1 4Å; I3-Y15 HydrophobicContact CD1-CE1 3.53Å; I3-Y15 HydrophobicContact CG1-CD1 3.81Å; I3-Y15 HydrophobicContact CG1-CE1 3.85Å; I3-Y15 HydrophobicContact CG2-CD1 4.43Å; I3-Y15 HydrophobicContact CG2-CE1 4.23Å; T13-Y15 HydrophobicContact CG2-CD2 4.4Å; T13-Y15 HydrophobicContact CG2-CE2 3.85Å; Y15-Y22 PolarHBondContact O-OH 3.48Å; Y15-V170 HydrophobicContact CD1-CB 4.42Å; Y15-V170 HydrophobicContact CD1-CG1 4.45Å; Y15-V170 HydrophobicContact CD1-CG2 3.84Å; Y15-V170 HydrophobicContact CE1-CB 4.25Å; Y15-V170 HydrophobicContact CE1-CG2 3.47Å; Y15-V170 VanDerWaalsContact CE1-CG2 3.47Å; Y15-S174 VanDerWaalsContact CE2-O 3.29Å; Y15-S174 WeakPolarHBondContact CE2-O 3.27Å; Y15-S174 PolarHBondContact OH-O 2.9Å
16	L	89.5	Confident	86.5	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.3	-172.4	-49.8	-175.7	0	0	0	110.5	W2 L4 F14 Y22 I31 L46 V48 L53	W2-L16 HydrophobicContact CB-CB 4Å; W2-L16 HydrophobicContact CB-CD1 4.26Å; W2-L16 PolarHBondContact N-O 3.1Å; W2-L16 VanDerWaalsContact N-O 3.1Å; W2-L16 WeakPolarHBondContact O-CA 3.44Å; W2-L16 WeakPolarHBondContact O-CB 3.17Å; W2-L16 PolarHBondContact O-N 3.33Å; L4-L16 HydrophobicContact CD1-CD1 4.1Å; L4-L16 HydrophobicContact CG-CD1 4.03Å; F14-L16 HydrophobicContact CB-CD2 4.39Å; L16-Y22 WeakPolarHBondContact CA-OH 3.43Å; L16-Y22 HydrophobicContact CB-CE2 4.18Å; L16-Y22 HydrophobicContact CD2-CD1 3.76Å; L16-Y22 HydrophobicContact CD2-CD2 4.1Å; L16-Y22 HydrophobicContact CD2-CE1 3.78Å; L16-Y22 HydrophobicContact CD2-CE2 4.14Å; L16-Y22 HydrophobicContact CD2-CG 3.92Å; L16-I31 HydrophobicContact CD2-CD1 3.94Å; L16-L46 HydrophobicContact CD1-CD1 4.31Å; L16-V48 HydrophobicContact CB-CG1 4.49Å; L16-V48 HydrophobicContact CB-CG2 4.01Å; L16-V48 HydrophobicContact CD1-CG2 4.5Å; L16-L53 HydrophobicContact CD1-CD1 3.82Å; L16-L53 HydrophobicContact CD1-CD2 4.2Å
17	L	86.1	Confident	86.4	Confident	103 Å²	103	63.6 Å²	63.6	54%	0.539	37%	0.369	S	S	.	.			trans	-92.4	138.8	-178.5	-59.1	178.4	0	0	0	110.7	Y22 V48	L17-Y22 PolarHBondContact N-OH 2.83Å; L17-V48 WeakPolarHBondContact O-CB 3.31Å
18	P	85.6	Confident	86.4	Confident	49 Å²	49	65.8 Å²	65.8	32%	0.318	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	149.6	172.4	-26.1	35.9	0	0	0	113.3	K20	P18-K20 PolarHBondContact O-N 3.47Å
19	G	83.3	Confident	86.8	Confident	83 Å²	83	62.2 Å²	62.2	86%	0.856	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	1.4	178.4	0	0	0	0	0	114.7	V48	G19-V48 PolarHBondContact N-O 2.09Å
20	K	87.4	Confident	87.6	Confident	83 Å²	83	59.2 Å²	59.2	36%	0.361	35%	0.347	S	S	.	.			trans	-111.6	138.2	173.4	175.2	171.8	175.1	-175.3	0	111.3	P18 Y22 D30 V48	P18-K20 PolarHBondContact O-N 3.47Å; K20-Y22 HydrophobicContact CB-CD2 4.37Å; K20-Y22 HydrophobicContact CB-CE2 3.78Å; K20-Y22 HydrophobicContact CD-CD2 4.24Å; K20-Y22 HydrophobicContact CD-CE1 4.15Å; K20-Y22 HydrophobicContact CD-CE2 3.76Å; K20-Y22 HydrophobicContact CG-CD2 3.86Å; K20-Y22 HydrophobicContact CG-CE2 3.58Å; K20-D30 WeakPolarHBondContact CE-OD1 3.19Å; K20-D30 IonicContact NZ-OD1 3.65Å; K20-D30 PolarHBondContact NZ-OD1 3.25Å; K20-V48 WeakPolarHBondContact O-CG2 3.5Å; K20-V48 PolarHBondContact O-N 3.49Å
21	E	91.6	Very high	88.6	Confident	99 Å²	99	55 Å²	55	46%	0.463	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	141.7	161.8	-57	-158.4	143.5	0	0	111.4	Q45 L46 T47	E21-Q45 PolarHBondContact OE2-NE2 2.87Å; E21-L46 CarbonylContact C-O 3.55Å; E21-L46 WeakPolarHBondContact CA-O 2.95Å; E21-T47 HydrophobicContact CG-CG2 4.18Å; E21-T47 PolarHBondContact OE1-OG1 3.35Å
22	Y	93.4	Very high	89.2	Confident	22 Å²	22	57.2 Å²	57.2	9%	0.086	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.7	178.3	-68.7	-107.7	0	0	0	109.5	Y15 L16 L17 K20 D30 I31 L46 V48	Y15-Y22 PolarHBondContact O-OH 3.48Å; L16-Y22 WeakPolarHBondContact CA-OH 3.43Å; L16-Y22 HydrophobicContact CB-CE2 4.18Å; L16-Y22 HydrophobicContact CD2-CD1 3.76Å; L16-Y22 HydrophobicContact CD2-CD2 4.1Å; L16-Y22 HydrophobicContact CD2-CE1 3.78Å; L16-Y22 HydrophobicContact CD2-CE2 4.14Å; L16-Y22 HydrophobicContact CD2-CG 3.92Å; L17-Y22 PolarHBondContact N-OH 2.83Å; K20-Y22 HydrophobicContact CB-CD2 4.37Å; K20-Y22 HydrophobicContact CB-CE2 3.78Å; K20-Y22 HydrophobicContact CD-CD2 4.24Å; K20-Y22 HydrophobicContact CD-CE1 4.15Å; K20-Y22 HydrophobicContact CD-CE2 3.76Å; K20-Y22 HydrophobicContact CG-CD2 3.86Å; K20-Y22 HydrophobicContact CG-CE2 3.58Å; Y22-D30 HydrophobicContact CD1-CB 3.89Å; Y22-D30 HydrophobicContact CG-CB 4.48Å; Y22-I31 HydrophobicContact CD1-CD1 4.29Å; Y22-I31 HydrophobicContact CD1-CG1 4.43Å; Y22-L46 PolarHBondContact N-O 3.46Å; Y22-L46 PolarHBondContact O-N 3.29Å; Y22-V48 HydrophobicContact CD2-CG2 3.82Å; Y22-V48 HydrophobicContact CE2-CG2 3.93Å
23	V	94.2	Very high	89.5	Confident	46 Å²	46	53.8 Å²	53.8	28%	0.279	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.1	171.2	-168.9	0	0	0	0	109.6	C29 D30 I31 S42	V23-C29 HydrophobicContact CB-CB 4.38Å; V23-C29 HydrophobicContact CG1-CB 4.37Å; V23-C29 VanDerWaalsContact CG1-SG 3.6Å; V23-C29 WeakPolarHBondContact O-CB 3.03Å; V23-D30 PolarHBondContact N-OD2 2.83Å; V23-D30 PolarHBondContact O-N 3.48Å; V23-D30 VanDerWaalsContact O-N 3.1Å; V23-I31 PolarHBondContact O-N 2.82Å; V23-S42 VanDerWaalsContact CG1-OG 3.24Å; V23-S42 WeakPolarHBondContact CG1-OG 3.29Å
24	V	93.8	Very high	89.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.2	170.3	-175.7	0	0	0	0	108.7	I31 L33 H43 A44 L46 F84	V24-I31 HydrophobicContact CB-CB 4.47Å; V24-I31 HydrophobicContact CG1-CG2 4.18Å; V24-I31 HydrophobicContact CG2-CB 4.11Å; V24-I31 HydrophobicContact CG2-CD1 3.92Å; V24-I31 HydrophobicContact CG2-CG2 4.27Å; V24-L33 HydrophobicContact CG1-CD1 3.63Å; V24-L33 HydrophobicContact CG1-CG 4.31Å; V24-H43 PolarHBondContact O-N 3.02Å; V24-A44 HydrophobicContact CB-CB 4.25Å; V24-A44 PolarHBondContact N-O 2.85Å; V24-A44 PolarHBondContact O-N 3.16Å; V24-A44 VanDerWaalsContact O-N 3.16Å; V24-L46 HydrophobicContact CG2-CD1 3.6Å; V24-L46 HydrophobicContact CG2-CG 4.24Å; V24-F84 HydrophobicContact CB-CE1 4.34Å; V24-F84 HydrophobicContact CB-CZ 4.48Å; V24-F84 HydrophobicContact CG1-CD1 4.02Å; V24-F84 HydrophobicContact CG1-CD2 4.02Å; V24-F84 HydrophobicContact CG1-CE1 4.08Å; V24-F84 HydrophobicContact CG1-CE2 4.09Å; V24-F84 HydrophobicContact CG1-CG 3.99Å; V24-F84 HydrophobicContact CG1-CZ 4.11Å; V24-F84 HydrophobicContact CG2-CE1 4.12Å; V24-F84 HydrophobicContact CG2-CE2 4.48Å; V24-F84 HydrophobicContact CG2-CZ 3.92Å
25	G	92.6	Very high	88.9	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.8	175.9	176.6	0	0	0	0	0	115.5	I31 L32 L33 S40 R41	G25-I31 PolarHBondContact N-O 3.42Å; G25-L32 WeakPolarHBondContact O-CA 3.14Å; G25-L33 PolarHBondContact O-N 3.13Å; G25-S40 WeakPolarHBondContact CA-O 3.47Å; G25-R41 CarbonylContact C-O 3.48Å; G25-R41 WeakPolarHBondContact CA-O 3.45Å
26	R	91.3	Very high	88.7	Confident	89 Å²	89	58.7 Å²	58.7	34%	0.336	33%	0.332	S	S	.	.	S	Bend	trans	-82.3	-18.2	-171.6	-160.3	173.5	74.7	-161.3	13.1	114.1	L32 D36 Q37 I39 S40 R41	R26-L32 WeakPolarHBondContact O-CD1 3.24Å; R26-D36 WeakPolarHBondContact CD-O 3.35Å; R26-Q37 PolarHBondContact NH1-O 2.94Å; R26-I39 HydrophobicContact CB-CB 4.38Å; R26-I39 HydrophobicContact CB-CG2 4.02Å; R26-I39 WeakPolarHBondContact CD-O 3.41Å; R26-I39 PolarHBondContact NH1-O 3.23Å; R26-S40 PolarHBondContact N-O 3.43Å; R26-R41 PolarHBondContact N-O 3.4Å; R26-R41 VanDerWaalsContact N-O 3.16Å
27	K	88.4	Confident	88.6	Confident	137 Å²	137	66.2 Å²	66.2	60%	0.596	37%	0.367	S	S	*	.	S	Bend	trans	-151.7	143.8	176.8	-69.7	-162.5	174.5	-167	0	111.1	C29 R41	K27-C29 PolarHBondContact O-N 2.62Å; K27-C29 PolarHBondContact O-SG 2.7Å; K27-R41 PolarHBondContact N-O 3.35Å; K27-R41 VanDerWaalsContact O-O 3.08Å
28	N	85.8	Confident	88.7	Confident	166 Å²	166	61.5 Å²	61.5	89%	0.888	34%	0.343	S	S	*	.	S	Bend	trans	53.3	49.8	172.6	-55.9	12.7	0	0	0	113.1
29	C	88.9	Confident	88.9	Confident	24 Å²	24	59.2 Å²	59.2	16%	0.162	33%	0.328	C	S	.	.	S	Bend	trans	-134	156.2	-176.3	-73.4	0	0	0	0	109.7	V23 K27 I31 R41	V23-C29 HydrophobicContact CB-CB 4.38Å; V23-C29 HydrophobicContact CG1-CB 4.37Å; V23-C29 VanDerWaalsContact CG1-SG 3.6Å; V23-C29 WeakPolarHBondContact O-CB 3.03Å; K27-C29 PolarHBondContact O-N 2.62Å; K27-C29 PolarHBondContact O-SG 2.7Å; C29-I31 VanDerWaalsContact C-N 3.28Å; C29-I31 PolarHBondContact O-N 2.88Å; C29-R41 PolarHBondContact SG-O 3.19Å
30	D	89.4	Confident	89.3	Confident	74 Å²	74	56.3 Å²	56.3	40%	0.396	30%	0.295	S	S	.	.	S	Bend	trans	-62.6	-37.3	175.8	-59.1	-89.8	0	0	0	112.4	K20 Y22 V23	K20-D30 WeakPolarHBondContact CE-OD1 3.19Å; K20-D30 IonicContact NZ-OD1 3.65Å; K20-D30 PolarHBondContact NZ-OD1 3.25Å; Y22-D30 HydrophobicContact CD1-CB 3.89Å; Y22-D30 HydrophobicContact CG-CB 4.48Å; V23-D30 PolarHBondContact N-OD2 2.83Å; V23-D30 PolarHBondContact O-N 3.48Å; V23-D30 VanDerWaalsContact O-N 3.1Å
31	I	90.8	Very high	89.4	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	97.2	179.1	-62.3	166.2	0	0	0	106.6	L4 F14 L16 Y22 V23 V24 G25 C29 L33 L46	L4-I31 HydrophobicContact CD1-CD1 4.17Å; F14-I31 HydrophobicContact CB-CD1 4.42Å; F14-I31 HydrophobicContact CB-CG1 4.33Å; F14-I31 HydrophobicContact CD1-CB 4.46Å; F14-I31 HydrophobicContact CD1-CG1 4Å; F14-I31 HydrophobicContact CD1-CG2 4.2Å; F14-I31 HydrophobicContact CD2-CG2 3.86Å; F14-I31 HydrophobicContact CE1-CG2 4.19Å; F14-I31 HydrophobicContact CE2-CG2 3.84Å; F14-I31 HydrophobicContact CG-CG1 4.08Å; F14-I31 HydrophobicContact CG-CG2 4.04Å; F14-I31 HydrophobicContact CZ-CG2 4.01Å; L16-I31 HydrophobicContact CD2-CD1 3.94Å; Y22-I31 HydrophobicContact CD1-CD1 4.29Å; Y22-I31 HydrophobicContact CD1-CG1 4.43Å; V23-I31 PolarHBondContact O-N 2.82Å; V24-I31 HydrophobicContact CB-CB 4.47Å; V24-I31 HydrophobicContact CG1-CG2 4.18Å; V24-I31 HydrophobicContact CG2-CB 4.11Å; V24-I31 HydrophobicContact CG2-CD1 3.92Å; V24-I31 HydrophobicContact CG2-CG2 4.27Å; G25-I31 PolarHBondContact N-O 3.42Å; C29-I31 VanDerWaalsContact C-N 3.28Å; C29-I31 PolarHBondContact O-N 2.88Å; I31-L33 HydrophobicContact CG2-CD1 4.48Å; I31-L33 HydrophobicContact CG2-CD2 4.2Å; I31-L33 HydrophobicContact CG2-CG 4.2Å; I31-L33 PolarHBondContact O-N 2.93Å; I31-L46 HydrophobicContact CD1-CD1 3.9Å
32	L	90	Very high	89.3	Confident	91 Å²	91	59.8 Å²	59.8	48%	0.476	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	97.7	-168.8	-178.6	64.6	0	0	0	111.8	G25 R26 A34	G25-L32 WeakPolarHBondContact O-CA 3.14Å; R26-L32 WeakPolarHBondContact O-CD1 3.24Å; L32-A34 HydrophobicContact CD1-CB 4.49Å; L32-A34 HydrophobicContact CG-CB 4.25Å; L32-A34 PolarHBondContact O-N 3.41Å
33	L	89.3	Confident	89.2	Confident	15 Å²	15	58.7 Å²	58.7	8%	0.079	31%	0.305	C	S	.	.			trans	-98.3	66.7	-178.8	-55.8	-178.5	0	0	0	110.5	F14 V24 G25 I31 S35 I39 F84 F91	F14-L33 HydrophobicContact CE2-CD2 4.23Å; F14-L33 HydrophobicContact CZ-CD2 4.48Å; V24-L33 HydrophobicContact CG1-CD1 3.63Å; V24-L33 HydrophobicContact CG1-CG 4.31Å; G25-L33 PolarHBondContact O-N 3.13Å; I31-L33 HydrophobicContact CG2-CD1 4.48Å; I31-L33 HydrophobicContact CG2-CD2 4.2Å; I31-L33 HydrophobicContact CG2-CG 4.2Å; I31-L33 PolarHBondContact O-N 2.93Å; L33-S35 PolarHBondContact O-N 2.8Å; L33-I39 HydrophobicContact CB-CD1 3.51Å; L33-I39 HydrophobicContact CB-CG2 4.44Å; L33-I39 HydrophobicContact CD1-CD1 3.53Å; L33-I39 HydrophobicContact CG-CD1 4.15Å; L33-F84 HydrophobicContact CD1-CB 4.31Å; L33-F84 HydrophobicContact CD1-CD2 3.76Å; L33-F84 HydrophobicContact CD1-CE2 4.48Å; L33-F84 HydrophobicContact CD1-CG 4.29Å; L33-F91 HydrophobicContact CD1-CE2 3.84Å; L33-F91 HydrophobicContact CD1-CZ 4.2Å; L33-F91 HydrophobicContact CD2-CE2 4.16Å; L33-F91 HydrophobicContact CD2-CZ 3.67Å
34	A	83.7	Confident	89.2	Confident	66 Å²	66	56.5 Å²	56.5	55%	0.545	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-21.7	-169.6	0	0	0	0	0	115.2	L32	L32-A34 HydrophobicContact CD1-CB 4.49Å; L32-A34 HydrophobicContact CG-CB 4.25Å; L32-A34 PolarHBondContact O-N 3.41Å
35	S	83.3	Confident	89.2	Confident	83 Å²	83	58.7 Å²	58.7	58%	0.58	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-17.7	-177.3	57.6	0	0	0	0	114.1	L33 H88	L33-S35 PolarHBondContact O-N 2.8Å; S35-H88 WeakPolarHBondContact CB-NE2 3.38Å; S35-H88 PolarHBondContact O-CE1 2.89Å; S35-H88 PolarHBondContact OG-NE2 3.26Å
36	D	84.6	Confident	89.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.			trans	-100.3	117	-172.1	-167	-45.6	0	0	0	111.5	R26 S38 I39 F87 H88 S89	R26-D36 WeakPolarHBondContact CD-O 3.35Å; D36-S38 VanDerWaalsContact C-N 3.32Å; D36-S38 PolarHBondContact O-N 3.1Å; D36-S38 WeakPolarHBondContact OD1-CA 3.32Å; D36-S38 WeakPolarHBondContact OD1-CB 3.13Å; D36-S38 PolarHBondContact OD1-N 2.82Å; D36-S38 PolarHBondContact OD1-OG 2.84Å; D36-I39 HydrophobicContact CB-CB 4.27Å; D36-I39 HydrophobicContact CB-CD1 3.86Å; D36-I39 HydrophobicContact CB-CG1 3.88Å; D36-I39 PolarHBondContact O-N 3.1Å; D36-I39 PolarHBondContact OD1-N 3.14Å; D36-F87 WeakPolarHBondContact OD1-CD2 3.46Å; D36-H88 WeakPolarHBondContact CA-CE1 3.34Å; D36-H88 PolarHBondContact N-CE1 2.85Å; D36-H88 PolarHBondContact OD2-N 2.99Å; D36-H88 IonicContact OD2-ND1 3.92Å; D36-S89 VanDerWaalsContact CB-OG 3.24Å; D36-S89 WeakPolarHBondContact CB-OG 3.47Å; D36-S89 WeakPolarHBondContact OD2-CB 3.38Å; D36-S89 PolarHBondContact OD2-N 2.96Å; D36-S89 PolarHBondContact OD2-OG 2.68Å
37	Q	86.5	Confident	89.3	Confident	159 Å²	159	56.8 Å²	56.8	74%	0.743	30%	0.3	S	S	*	.	S	Bend	trans	-76.9	-16.8	-178.8	-63.5	-164	43	0	0	113.8	R26 I39	R26-Q37 PolarHBondContact NH1-O 2.94Å; Q37-I39 VanDerWaalsContact C-N 3.34Å
38	S	88.6	Confident	89.4	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.028	27%	0.273	C	S	.	.	S	Bend	trans	-79	-20.8	173.3	73.1	0	0	0	0	112.2	D36 S40 Y61 G85 V86	D36-S38 VanDerWaalsContact C-N 3.32Å; D36-S38 PolarHBondContact O-N 3.1Å; D36-S38 WeakPolarHBondContact OD1-CA 3.32Å; D36-S38 WeakPolarHBondContact OD1-CB 3.13Å; D36-S38 PolarHBondContact OD1-N 2.82Å; D36-S38 PolarHBondContact OD1-OG 2.84Å; S38-S40 PolarHBondContact O-N 2.87Å; S38-Y61 WeakPolarHBondContact O-CD2 3.42Å; S38-G85 WeakPolarHBondContact OG-CA 2.95Å; S38-V86 PolarHBondContact OG-N 2.93Å
39	I	91	Very high	89.5	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.251	C	S	.	.	S	Bend	trans	-71.2	134.8	177.1	-66.1	-174.8	0	0	0	110.9	R26 L33 D36 Q37 H43 F84 S89	R26-I39 HydrophobicContact CB-CB 4.38Å; R26-I39 HydrophobicContact CB-CG2 4.02Å; R26-I39 WeakPolarHBondContact CD-O 3.41Å; R26-I39 PolarHBondContact NH1-O 3.23Å; L33-I39 HydrophobicContact CB-CD1 3.51Å; L33-I39 HydrophobicContact CB-CG2 4.44Å; L33-I39 HydrophobicContact CD1-CD1 3.53Å; L33-I39 HydrophobicContact CG-CD1 4.15Å; D36-I39 HydrophobicContact CB-CB 4.27Å; D36-I39 HydrophobicContact CB-CD1 3.86Å; D36-I39 HydrophobicContact CB-CG1 3.88Å; D36-I39 PolarHBondContact O-N 3.1Å; D36-I39 PolarHBondContact OD1-N 3.14Å; Q37-I39 VanDerWaalsContact C-N 3.34Å; I39-H43 HydrophobicContact CG2-CB 3.77Å; I39-F84 HydrophobicContact CD1-CB 3.67Å; I39-F84 HydrophobicContact CG1-CB 4.19Å; I39-F84 WeakPolarHBondContact CG1-O 3.41Å; I39-S89 VanDerWaalsContact CD1-OG 3.29Å; I39-S89 WeakPolarHBondContact CD1-OG 3.01Å
40	S	89.9	Confident	88.9	Confident	23 Å²	23	49.7 Å²	49.7	16%	0.161	27%	0.27	C	S	.	.			trans	-84	165	-178	-64.1	0	0	0	0	110.2	G25 R26 S38 S42 H43 K60	G25-S40 WeakPolarHBondContact CA-O 3.47Å; R26-S40 PolarHBondContact N-O 3.43Å; S38-S40 PolarHBondContact O-N 2.87Å; S40-S42 CarbonylContact C-O 3.56Å; S40-S42 VanDerWaalsContact C-O 3.22Å; S40-S42 WeakPolarHBondContact CB-O 3.45Å; S40-H43 PolarHBondContact N-ND1 2.9Å; S40-K60 PolarHBondContact OG-N 3.06Å
41	R	89.8	Confident	88.6	Confident	200 Å²	200	52.4 Å²	52.4	76%	0.755	28%	0.284	S	S	*	.	S	Bend	trans	-58.7	-56.2	-171.9	-74.8	-177.6	-68	177.9	-0.9	111.6	G25 R26 K27 C29	G25-R41 CarbonylContact C-O 3.48Å; G25-R41 WeakPolarHBondContact CA-O 3.45Å; R26-R41 PolarHBondContact N-O 3.4Å; R26-R41 VanDerWaalsContact N-O 3.16Å; K27-R41 PolarHBondContact N-O 3.35Å; K27-R41 VanDerWaalsContact O-O 3.08Å; C29-R41 PolarHBondContact SG-O 3.19Å
42	S	90.5	Very high	88.5	Confident	54 Å²	54	54.5 Å²	54.5	38%	0.378	30%	0.297	S	S	.	.	S	Bend	trans	-97.5	145.3	143	171.3	0	0	0	0	106.5	V23 S40	V23-S42 VanDerWaalsContact CG1-OG 3.24Å; V23-S42 WeakPolarHBondContact CG1-OG 3.29Å; S40-S42 CarbonylContact C-O 3.56Å; S40-S42 VanDerWaalsContact C-O 3.22Å; S40-S42 WeakPolarHBondContact CB-O 3.45Å
43	H	91	Very high	88.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.274	C	S	.	.			trans	-132.8	-38.6	-174.6	179.3	99.8	0	0	0	111.7	V24 I39 S40 T58 S59 T63 F84 G85	V24-H43 PolarHBondContact O-N 3.02Å; I39-H43 HydrophobicContact CG2-CB 3.77Å; S40-H43 PolarHBondContact N-ND1 2.9Å; H43-T58 VanDerWaalsContact C-OG1 3.23Å; H43-T58 CarbonylContact O-C 3.6Å; H43-T58 PolarHBondContact O-N 2.81Å; H43-T58 PolarHBondContact O-OG1 2.81Å; H43-S59 WeakPolarHBondContact CE1-CB 3.47Å; H43-S59 WeakPolarHBondContact ND1-CB 3.35Å; H43-S59 WeakPolarHBondContact O-CB 3.39Å; H43-S59 PolarHBondContact O-N 2.79Å; H43-S59 VanDerWaalsContact O-N 3.1Å; H43-T63 PolarHBondContact CD2-OG1 3.31Å; H43-T63 PolarHBondContact NE2-OG1 3.43Å; H43-F84 AromaticContact CD2-CD1 3.73Å; H43-F84 WeakPolarHBondContact NE2-CA 3.38Å; H43-F84 AromaticContact NE2-CD1 4Å; H43-G85 PolarHBondContact CE1-N 3.13Å; H43-G85 PolarHBondContact NE2-N 2.65Å
44	A	93.4	Very high	88.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	160.4	171.5	0	0	0	0	0	111.5	V24 L55 K56 F84	V24-A44 HydrophobicContact CB-CB 4.25Å; V24-A44 PolarHBondContact N-O 2.85Å; V24-A44 PolarHBondContact O-N 3.16Å; V24-A44 VanDerWaalsContact O-N 3.16Å; A44-L55 HydrophobicContact CB-CD1 3.73Å; A44-K56 CarbonylContact C-O 3.22Å; A44-K56 VanDerWaalsContact CA-O 3.32Å; A44-K56 WeakPolarHBondContact CA-O 3.43Å; A44-K56 WeakPolarHBondContact CB-O 3.44Å; A44-F84 HydrophobicContact CB-CD1 4.17Å; A44-F84 HydrophobicContact CB-CE1 3.89Å
45	Q	93.9	Very high	89.2	Confident	46 Å²	46	48 Å²	48	22%	0.215	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.4	172.7	-174.2	178.1	14.7	0	0	108	E21 K56	E21-Q45 PolarHBondContact OE2-NE2 2.87Å; Q45-K56 HydrophobicContact CB-CB 4.43Å; Q45-K56 PolarHBondContact N-O 3.21Å; Q45-K56 PolarHBondContact O-N 3.23Å; Q45-K56 VanDerWaalsContact OE1-NZ 3.12Å
46	L	94.2	Very high	89.7	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.3	174.8	-74.4	163.7	0	0	0	108.5	L4 L16 E21 Y22 V24 I31 L53 T54 L55 L76	L4-L46 HydrophobicContact CD1-CD1 3.71Å; L16-L46 HydrophobicContact CD1-CD1 4.31Å; E21-L46 CarbonylContact C-O 3.55Å; E21-L46 WeakPolarHBondContact CA-O 2.95Å; Y22-L46 PolarHBondContact N-O 3.46Å; Y22-L46 PolarHBondContact O-N 3.29Å; V24-L46 HydrophobicContact CG2-CD1 3.6Å; V24-L46 HydrophobicContact CG2-CG 4.24Å; I31-L46 HydrophobicContact CD1-CD1 3.9Å; L46-L53 HydrophobicContact CB-CD1 4.43Å; L46-L53 HydrophobicContact CD2-CD1 4.1Å; L46-L53 HydrophobicContact CD2-CD2 4.45Å; L46-L53 HydrophobicContact CD2-CG 4.22Å; L46-T54 WeakPolarHBondContact CA-O 3.24Å; L46-L55 HydrophobicContact CD2-CB 3.87Å; L46-L55 HydrophobicContact CD2-CD1 3.72Å; L46-L55 HydrophobicContact CD2-CG 4.3Å; L46-L55 HydrophobicContact CG-CD1 4.17Å; L46-L76 HydrophobicContact CD2-CD1 4.23Å
47	T	92	Very high	90.1	Very high	47 Å²	47	50.4 Å²	50.4	29%	0.288	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.6	176.1	-58.7	0	0	0	0	108.4	E21 T54	E21-T47 HydrophobicContact CG-CG2 4.18Å; E21-T47 PolarHBondContact OE1-OG1 3.35Å; T47-T54 PolarHBondContact N-O 2.92Å; T47-T54 PolarHBondContact O-N 2.91Å
48	V	91.5	Very high	90.3	Very high	4 Å²	4	46 Å²	46	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	110.4	-171.9	-163.7	0	0	0	0	109.9	L16 L17 G19 K20 Y22 L53	L16-V48 HydrophobicContact CB-CG1 4.49Å; L16-V48 HydrophobicContact CB-CG2 4.01Å; L16-V48 HydrophobicContact CD1-CG2 4.5Å; L17-V48 WeakPolarHBondContact O-CB 3.31Å; G19-V48 PolarHBondContact N-O 2.09Å; K20-V48 WeakPolarHBondContact O-CG2 3.5Å; K20-V48 PolarHBondContact O-N 3.49Å; Y22-V48 HydrophobicContact CD2-CG2 3.82Å; Y22-V48 HydrophobicContact CE2-CG2 3.93Å; V48-L53 HydrophobicContact CB-CD1 4.42Å; V48-L53 HydrophobicContact CG1-CD1 4.4Å; V48-L53 HydrophobicContact CG2-CD1 3.79Å
49	T	86.4	Confident	90.3	Very high	70 Å²	70	47 Å²	47	43%	0.429	25%	0.248	S	C	.	.			trans	-91.8	174	168.6	-26.4	0	0	0	0	109.9	L51 T52	T49-L51 PolarHBondContact O-N 2.96Å; T49-T52 WeakPolarHBondContact CB-OG1 3.47Å; T49-T52 PolarHBondContact N-O 2.75Å; T49-T52 PolarHBondContact OG1-OG1 2.87Å
50	D	77.7	Confident	90.2	Very high	105 Å²	105	54.8 Å²	54.8	56%	0.561	28%	0.282	S	S	*	.	S	Bend	trans	-56.9	-32.9	-179.2	-82.7	-55.4	0	0	0	114.4
51	L	82.5	Confident	90.1	Very high	131 Å²	131	59 Å²	59	69%	0.686	30%	0.295	S	S	*	.	S	Bend	trans	-126.2	-11.2	-177.7	-62.2	172.1	0	0	0	114.5	W2 T49 F95	W2-L51 WeakPolarHBondContact CZ2-O 3.32Å; T49-L51 PolarHBondContact O-N 2.96Å; L51-F95 HydrophobicContact CD2-CZ 4.05Å
52	T	87.5	Confident	90.1	Very high	44 Å²	44	49.6 Å²	49.6	27%	0.27	26%	0.26	S	S	.	.			trans	-124.4	150.5	-176.2	59.2	0	0	0	0	112.1	T49	T49-T52 WeakPolarHBondContact CB-OG1 3.47Å; T49-T52 PolarHBondContact N-O 2.75Å; T49-T52 PolarHBondContact OG1-OG1 2.87Å
53	L	92.7	Very high	90.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	103.1	176	178.4	67.5	0	0	0	108.9	W2 L16 L46 V48 L76 V93	W2-L53 HydrophobicContact CB-CD2 4.16Å; W2-L53 HydrophobicContact CD2-CB 3.67Å; W2-L53 HydrophobicContact CD2-CD2 4.04Å; W2-L53 HydrophobicContact CD2-CG 4.42Å; W2-L53 HydrophobicContact CE3-CB 4.14Å; W2-L53 HydrophobicContact CE3-CD2 3.97Å; W2-L53 HydrophobicContact CG-CB 3.95Å; W2-L53 HydrophobicContact CG-CD1 4.49Å; W2-L53 HydrophobicContact CG-CD2 4.16Å; W2-L53 HydrophobicContact CG-CG 4.44Å; W2-L53 HydrophobicContact CH2-CB 4.45Å; W2-L53 HydrophobicContact CZ2-CB 4.03Å; W2-L53 HydrophobicContact CZ3-CB 4.5Å; L16-L53 HydrophobicContact CD1-CD1 3.82Å; L16-L53 HydrophobicContact CD1-CD2 4.2Å; L46-L53 HydrophobicContact CB-CD1 4.43Å; L46-L53 HydrophobicContact CD2-CD1 4.1Å; L46-L53 HydrophobicContact CD2-CD2 4.45Å; L46-L53 HydrophobicContact CD2-CG 4.22Å; V48-L53 HydrophobicContact CB-CD1 4.42Å; V48-L53 HydrophobicContact CG1-CD1 4.4Å; V48-L53 HydrophobicContact CG2-CD1 3.79Å; L53-L76 HydrophobicContact CB-CB 4.36Å; L53-L76 HydrophobicContact CD2-CB 4.24Å; L53-L76 HydrophobicContact CD2-CD1 3.75Å; L53-L76 HydrophobicContact CG-CB 4.42Å; L53-L76 HydrophobicContact CG-CD1 4.07Å; L53-L76 PolarHBondContact O-N 3.29Å; L53-V93 HydrophobicContact CD2-CG1 3.87Å
54	T	92.8	Very high	90.3	Very high	35 Å²	35	49.2 Å²	49.2	22%	0.215	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	124.6	179.7	-45.1	0	0	0	0	110	L46 T47 P73	L46-T54 WeakPolarHBondContact CA-O 3.24Å; T47-T54 PolarHBondContact N-O 2.92Å; T47-T54 PolarHBondContact O-N 2.91Å; T54-P73 HydrophobicContact CG2-CB 4.16Å
55	L	93.9	Very high	90.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.4	176	170.8	60.1	0	0	0	110.4	A44 L46 T63 V65 L70 P73 V74 L76 V82 F84	A44-L55 HydrophobicContact CB-CD1 3.73Å; L46-L55 HydrophobicContact CD2-CB 3.87Å; L46-L55 HydrophobicContact CD2-CD1 3.72Å; L46-L55 HydrophobicContact CD2-CG 4.3Å; L46-L55 HydrophobicContact CG-CD1 4.17Å; L55-T63 HydrophobicContact CD1-CG2 4.35Å; L55-T63 HydrophobicContact CD2-CG2 3.89Å; L55-T63 HydrophobicContact CG-CG2 4.47Å; L55-V65 HydrophobicContact CD2-CG2 3.79Å; L55-L70 HydrophobicContact CD2-CD1 3.68Å; L55-L70 HydrophobicContact CG-CD1 3.69Å; L55-P73 VanDerWaalsContact O-CA 3.31Å; L55-P73 WeakPolarHBondContact O-CA 3.45Å; L55-V74 PolarHBondContact N-O 2.75Å; L55-V74 PolarHBondContact O-N 2.92Å; L55-L76 HydrophobicContact CB-CD1 3.71Å; L55-L76 HydrophobicContact CB-CG 4.02Å; L55-L76 HydrophobicContact CD2-CD1 3.98Å; L55-L76 HydrophobicContact CD2-CD2 4.25Å; L55-L76 HydrophobicContact CD2-CG 4.48Å; L55-L76 HydrophobicContact CG-CD1 4.47Å; L55-V82 HydrophobicContact CD2-CG1 3.67Å; L55-V82 HydrophobicContact CD2-CG2 4.07Å; L55-F84 HydrophobicContact CD1-CE1 4.06Å
56	K	93.4	Very high	89.9	Confident	96 Å²	96	51.7 Å²	51.7	42%	0.417	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120	178.7	173.1	-179.1	168.5	-159.8	0	110.2	A44 Q45 P73	A44-K56 CarbonylContact C-O 3.22Å; A44-K56 VanDerWaalsContact CA-O 3.32Å; A44-K56 WeakPolarHBondContact CA-O 3.43Å; A44-K56 WeakPolarHBondContact CB-O 3.44Å; Q45-K56 HydrophobicContact CB-CB 4.43Å; Q45-K56 PolarHBondContact N-O 3.21Å; Q45-K56 PolarHBondContact O-N 3.23Å; Q45-K56 VanDerWaalsContact OE1-NZ 3.12Å; K56-P73 HydrophobicContact CB-CB 4.29Å; K56-P73 HydrophobicContact CB-CG 4.38Å; K56-P73 HydrophobicContact CD-CG 4.46Å; K56-P73 HydrophobicContact CG-CG 4.22Å
57	D	93.5	Very high	89.5	Confident	39 Å²	39	57.3 Å²	57.3	21%	0.209	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	139.5	175.8	-166.5	8.8	0	0	0	111.2	S59 G62 T63 L70	D57-S59 WeakPolarHBondContact OD1-CB 3.24Å; D57-S59 PolarHBondContact OD1-N 2.86Å; D57-S59 PolarHBondContact OD1-OG 2.81Å; D57-S59 PolarHBondContact OD2-OG 3.16Å; D57-G62 WeakPolarHBondContact OD2-CA 3.41Å; D57-T63 VanDerWaalsContact CG-N 3.33Å; D57-T63 PolarHBondContact OD1-OG1 2.87Å; D57-T63 PolarHBondContact OD2-N 2.82Å; D57-L70 HydrophobicContact CB-CB 4.24Å
58	T	89.8	Confident	89.4	Confident	66 Å²	66	62.4 Å²	62.4	41%	0.405	33%	0.326	S	S	.	.			trans	-134.5	13.5	172.5	60.7	0	0	0	0	111.8	H43	H43-T58 VanDerWaalsContact C-OG1 3.23Å; H43-T58 CarbonylContact O-C 3.6Å; H43-T58 PolarHBondContact O-N 2.81Å; H43-T58 PolarHBondContact O-OG1 2.81Å
59	S	89.2	Confident	89.3	Confident	26 Å²	26	67.2 Å²	67.2	18%	0.182	35%	0.349	C	S	.	.			trans	-87.7	168.9	-167.9	75	0	0	0	0	115.1	H43 D57 G62	H43-S59 WeakPolarHBondContact CE1-CB 3.47Å; H43-S59 WeakPolarHBondContact ND1-CB 3.35Å; H43-S59 WeakPolarHBondContact O-CB 3.39Å; H43-S59 PolarHBondContact O-N 2.79Å; H43-S59 VanDerWaalsContact O-N 3.1Å; D57-S59 WeakPolarHBondContact OD1-CB 3.24Å; D57-S59 PolarHBondContact OD1-N 2.86Å; D57-S59 PolarHBondContact OD1-OG 2.81Å; D57-S59 PolarHBondContact OD2-OG 3.16Å; S59-G62 WeakPolarHBondContact OG-CA 3.47Å; S59-G62 PolarHBondContact OG-N 3.16Å
60	K	87.8	Confident	89.5	Confident	164 Å²	164	64.7 Å²	64.7	71%	0.713	33%	0.332	S	S	*	.	S	Bend	trans	-80.8	-27.8	168.6	-171.8	-173.4	173.7	-158.9	0	113.5	S40	S40-K60 PolarHBondContact OG-N 3.06Å
61	Y	88.3	Confident	89.9	Confident	111 Å²	111	66.6 Å²	66.6	44%	0.435	35%	0.348	S	S	.	.	S	Bend	trans	-114.8	1.7	-164.9	-69.9	-75.3	0	0	0	114.4	S38 V86	S38-Y61 WeakPolarHBondContact O-CD2 3.42Å; Y61-V86 HydrophobicContact CD1-CG2 4.34Å; Y61-V86 HydrophobicContact CG-CG2 4.35Å
62	G	90.1	Very high	90.2	Very high	2 Å²	2	63 Å²	63	2%	0.021	34%	0.338	C	S	.	.			trans	89.6	140.2	-175	0	0	0	0	0	112.9	D57 S59 G85	D57-G62 WeakPolarHBondContact OD2-CA 3.41Å; S59-G62 WeakPolarHBondContact OG-CA 3.47Å; S59-G62 PolarHBondContact OG-N 3.16Å; G62-G85 WeakPolarHBondContact O-CA 3.16Å; G62-G85 PolarHBondContact O-N 3.43Å; G62-G85 VanDerWaalsContact O-N 3.1Å
63	T	92.9	Very high	90.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.8	154.4	-56.1	0	0	0	0	108.3	H43 L55 D57 L70 V82 F84	H43-T63 PolarHBondContact CD2-OG1 3.31Å; H43-T63 PolarHBondContact NE2-OG1 3.43Å; L55-T63 HydrophobicContact CD1-CG2 4.35Å; L55-T63 HydrophobicContact CD2-CG2 3.89Å; L55-T63 HydrophobicContact CG-CG2 4.47Å; D57-T63 VanDerWaalsContact CG-N 3.33Å; D57-T63 PolarHBondContact OD1-OG1 2.87Å; D57-T63 PolarHBondContact OD2-N 2.82Å; T63-L70 HydrophobicContact CG2-CD1 4.08Å; T63-L70 PolarHBondContact O-N 2.83Å; T63-V82 HydrophobicContact CG2-CG1 4.03Å; T63-F84 HydrophobicContact CG2-CD1 3.61Å; T63-F84 HydrophobicContact CG2-CE1 3.8Å
64	F	92.1	Very high	90.4	Very high	47 Å²	47	67.6 Å²	67.6	21%	0.206	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143	-177.6	-54.3	-103.2	0	0	0	110.8	Q68 Q69 V82 A83 G85	F64-Q68 CarbonylContact C-O 3.47Å; F64-Q68 WeakPolarHBondContact CA-O 3.46Å; F64-Q69 HydrophobicContact CD1-CB 3.68Å; F64-Q69 HydrophobicContact CD1-CG 4.12Å; F64-Q69 HydrophobicContact CE1-CB 3.61Å; F64-Q69 HydrophobicContact CE1-CG 3.82Å; F64-Q69 HydrophobicContact CZ-CB 4.45Å; F64-Q69 HydrophobicContact CZ-CG 4.18Å; F64-V82 CarbonylContact O-C 3.59Å; F64-V82 WeakPolarHBondContact O-CA 3.44Å; F64-A83 HydrophobicContact CB-CB 4.32Å; F64-A83 PolarHBondContact N-O 3.37Å; F64-A83 PolarHBondContact O-N 3.46Å; F64-G85 WeakPolarHBondContact CE2-O 3.35Å
65	V	91.9	Very high	90.3	Very high	14 Å²	14	71.8 Å²	71.8	9%	0.085	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.9	174.1	-176.4	0	0	0	0	108.1	L55 S67 Q68 L70 L76 D80 N81 V82	L55-V65 HydrophobicContact CD2-CG2 3.79Å; V65-S67 PolarHBondContact O-N 3.43Å; V65-S67 VanDerWaalsContact O-N 3.13Å; V65-Q68 PolarHBondContact N-O 2.83Å; V65-Q68 PolarHBondContact O-N 2.76Å; V65-L70 HydrophobicContact CB-CD2 4.49Å; V65-L70 HydrophobicContact CG2-CD1 3.89Å; V65-L70 HydrophobicContact CG2-CD2 3.83Å; V65-L70 HydrophobicContact CG2-CG 3.94Å; V65-L76 HydrophobicContact CB-CD2 4.42Å; V65-L76 HydrophobicContact CG1-CD2 3.62Å; V65-L76 HydrophobicContact CG2-CD2 3.85Å; V65-D80 HydrophobicContact CG1-CB 4.36Å; V65-N81 CarbonylContact C-O 3.47Å; V65-N81 WeakPolarHBondContact CA-O 3.47Å; V65-V82 HydrophobicContact CG2-CG2 4.37Å
66	N	88.3	Confident	90.2	Very high	84 Å²	84	72.1 Å²	72.1	45%	0.449	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	41.9	-176	-62.1	-30.7	0	0	0	112.7	Q68 D80 N81	N66-Q68 PolarHBondContact O-N 3.45Å; N66-D80 PolarHBondContact ND2-OD1 3.47Å; N66-N81 PolarHBondContact N-O 3.1Å; N66-N81 PolarHBondContact OD1-N 2.93Å
67	S	86	Confident	90.1	Very high	119 Å²	119	71 Å²	71	83%	0.832	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	0.6	-175	-62.9	0	0	0	0	117.2	V65	V65-S67 PolarHBondContact O-N 3.43Å; V65-S67 VanDerWaalsContact O-N 3.13Å
68	Q	88.4	Confident	89.9	Confident	153 Å²	153	72.6 Å²	72.6	72%	0.715	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.6	170.7	-170.2	173.3	17.1	0	0	110.9	F64 V65 N66	F64-Q68 CarbonylContact C-O 3.47Å; F64-Q68 WeakPolarHBondContact CA-O 3.46Å; V65-Q68 PolarHBondContact N-O 2.83Å; V65-Q68 PolarHBondContact O-N 2.76Å; N66-Q68 PolarHBondContact O-N 3.45Å
69	Q	90.1	Very high	89.9	Confident	106 Å²	106	71.8 Å²	71.8	50%	0.495	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137.6	176.8	-168	177.5	-12.6	0	0	111.2	F64	F64-Q69 HydrophobicContact CD1-CB 3.68Å; F64-Q69 HydrophobicContact CD1-CG 4.12Å; F64-Q69 HydrophobicContact CE1-CB 3.61Å; F64-Q69 HydrophobicContact CE1-CG 3.82Å; F64-Q69 HydrophobicContact CZ-CB 4.45Å; F64-Q69 HydrophobicContact CZ-CG 4.18Å
70	L	90	Very high	90	Very high	16 Å²	16	71.8 Å²	71.8	8%	0.084	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-75.2	132.7	174.2	-67	178.4	0	0	0	112	L55 D57 T63 V65 V74	L55-L70 HydrophobicContact CD2-CD1 3.68Å; L55-L70 HydrophobicContact CG-CD1 3.69Å; D57-L70 HydrophobicContact CB-CB 4.24Å; T63-L70 HydrophobicContact CG2-CD1 4.08Å; T63-L70 PolarHBondContact O-N 2.83Å; V65-L70 HydrophobicContact CB-CD2 4.49Å; V65-L70 HydrophobicContact CG2-CD1 3.89Å; V65-L70 HydrophobicContact CG2-CD2 3.83Å; V65-L70 HydrophobicContact CG2-CG 3.94Å; L70-V74 HydrophobicContact CD2-CB 3.76Å; L70-V74 HydrophobicContact CD2-CG1 4.49Å; L70-V74 HydrophobicContact CD2-CG2 3.5Å; L70-V74 VanDerWaalsContact CD2-CG2 3.5Å
71	T	86.3	Confident	90.3	Very high	146 Å²	146	67.2 Å²	67.2	90%	0.896	39%	0.39	S	S	*	.	S	Bend	trans	-117.9	-13.7	169.3	44	0	0	0	0	113
72	A	89.3	Confident	90.5	Very high	56 Å²	56	62 Å²	62	46%	0.463	37%	0.37	S	S	.	.	S	Bend	trans	-141	166.4	175.8	0	0	0	0	0	109.4
73	P	90.6	Very high	90.6	Very high	82 Å²	82	62.8 Å²	62.8	53%	0.532	38%	0.376	S	S	.	.			trans	-60.6	138.8	169.7	-19.2	32.4	0	0	0	111.1	T54 L55 K56	T54-P73 HydrophobicContact CG2-CB 4.16Å; L55-P73 VanDerWaalsContact O-CA 3.31Å; L55-P73 WeakPolarHBondContact O-CA 3.45Å; K56-P73 HydrophobicContact CB-CB 4.29Å; K56-P73 HydrophobicContact CB-CG 4.38Å; K56-P73 HydrophobicContact CD-CG 4.46Å; K56-P73 HydrophobicContact CG-CG 4.22Å
74	V	93.1	Very high	90.5	Very high	58 Å²	58	62.9 Å²	62.9	35%	0.352	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.5	-178.6	166.8	0	0	0	0	109.9	L55 L70	L55-V74 PolarHBondContact N-O 2.75Å; L55-V74 PolarHBondContact O-N 2.92Å; L70-V74 HydrophobicContact CD2-CB 3.76Å; L70-V74 HydrophobicContact CD2-CG1 4.49Å; L70-V74 HydrophobicContact CD2-CG2 3.5Å; L70-V74 VanDerWaalsContact CD2-CG2 3.5Å
75	E	92.3	Very high	90.4	Very high	123 Å²	123	60.9 Å²	60.9	58%	0.575	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.6	170.6	-60.6	-167.5	159.9	0	0	110.1
76	L	91	Very high	90.1	Very high	7 Å²	7	64.5 Å²	64.5	4%	0.037	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	141.9	-178.7	-64.6	171.8	0	0	0	111.2	W2 L46 L53 L55 V65 D80 V82 V93	W2-L76 WeakPolarHBondContact CH2-O 3.36Å; L46-L76 HydrophobicContact CD2-CD1 4.23Å; L53-L76 HydrophobicContact CB-CB 4.36Å; L53-L76 HydrophobicContact CD2-CB 4.24Å; L53-L76 HydrophobicContact CD2-CD1 3.75Å; L53-L76 HydrophobicContact CG-CB 4.42Å; L53-L76 HydrophobicContact CG-CD1 4.07Å; L53-L76 PolarHBondContact O-N 3.29Å; L55-L76 HydrophobicContact CB-CD1 3.71Å; L55-L76 HydrophobicContact CB-CG 4.02Å; L55-L76 HydrophobicContact CD2-CD1 3.98Å; L55-L76 HydrophobicContact CD2-CD2 4.25Å; L55-L76 HydrophobicContact CD2-CG 4.48Å; L55-L76 HydrophobicContact CG-CD1 4.47Å; V65-L76 HydrophobicContact CB-CD2 4.42Å; V65-L76 HydrophobicContact CG1-CD2 3.62Å; V65-L76 HydrophobicContact CG2-CD2 3.85Å; L76-D80 HydrophobicContact CD2-CB 4.35Å; L76-V82 HydrophobicContact CD1-CG2 3.85Å; L76-V82 HydrophobicContact CD2-CG2 3.83Å; L76-V93 HydrophobicContact CB-CG1 4.38Å; L76-V93 HydrophobicContact CD1-CG2 4.05Å
77	S	91.1	Very high	89.9	Confident	73 Å²	73	66.6 Å²	66.6	51%	0.51	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-101.5	159.3	174.3	-68.5	0	0	0	0	112.1	G79 D80	S77-G79 PolarHBondContact O-N 2.81Å; S77-D80 PolarHBondContact N-OD2 2.91Å; S77-D80 WeakPolarHBondContact O-CB 3.35Å; S77-D80 PolarHBondContact O-N 2.91Å
78	S	90.4	Very high	89.6	Confident	72 Å²	72	64.3 Å²	64.3	50%	0.503	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	120.2	172.4	-163.5	0	0	0	0	109.8	F95	S78-F95 PolarHBondContact OG-N 3.39Å
79	G	88.3	Confident	89.6	Confident	49 Å²	49	57.5 Å²	57.5	51%	0.505	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.1	-13.2	-173.7	0	0	0	0	0	114.7	S77 N81 V93	S77-G79 PolarHBondContact O-N 2.81Å; G79-N81 PolarHBondContact O-ND2 2.86Å; G79-V93 PolarHBondContact N-O 2.88Å
80	D	92.6	Very high	89.7	Confident	26 Å²	26	57 Å²	57	14%	0.139	34%	0.338	C	S	.	.			trans	-65.7	148.9	-179.4	-77.5	-21.2	0	0	0	113	V65 N66 L76 S77 S92 V93	V65-D80 HydrophobicContact CG1-CB 4.36Å; N66-D80 PolarHBondContact ND2-OD1 3.47Å; L76-D80 HydrophobicContact CD2-CB 4.35Å; S77-D80 PolarHBondContact N-OD2 2.91Å; S77-D80 WeakPolarHBondContact O-CB 3.35Å; S77-D80 PolarHBondContact O-N 2.91Å; D80-S92 CarbonylContact O-C 3.58Å; D80-S92 WeakPolarHBondContact O-CA 3.49Å; D80-V93 HydrophobicContact CB-CB 4.3Å; D80-V93 HydrophobicContact CB-CG2 4.15Å; D80-V93 WeakPolarHBondContact O-CG2 3.4Å; D80-V93 PolarHBondContact O-N 2.9Å
81	N	92.9	Very high	89.8	Confident	68 Å²	68	56.9 Å²	56.9	36%	0.364	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	108.9	179.4	-65.7	-94.5	0	0	0	109.8	V65 N66 G79 F91	V65-N81 CarbonylContact C-O 3.47Å; V65-N81 WeakPolarHBondContact CA-O 3.47Å; N66-N81 PolarHBondContact N-O 3.1Å; N66-N81 PolarHBondContact OD1-N 2.93Å; G79-N81 PolarHBondContact O-ND2 2.86Å; N81-F91 CarbonylContact C-O 3.59Å; N81-F91 WeakPolarHBondContact CA-O 3.48Å
82	V	93.3	Very high	90.1	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.6	179.6	-178.3	0	0	0	0	109.7	L55 T63 F64 V65 L76 F84 K90 F91 V93	L55-V82 HydrophobicContact CD2-CG1 3.67Å; L55-V82 HydrophobicContact CD2-CG2 4.07Å; T63-V82 HydrophobicContact CG2-CG1 4.03Å; F64-V82 CarbonylContact O-C 3.59Å; F64-V82 WeakPolarHBondContact O-CA 3.44Å; V65-V82 HydrophobicContact CG2-CG2 4.37Å; L76-V82 HydrophobicContact CD1-CG2 3.85Å; L76-V82 HydrophobicContact CD2-CG2 3.83Å; V82-F84 HydrophobicContact CG1-CD1 4.2Å; V82-F84 HydrophobicContact CG1-CD2 4.43Å; V82-F84 HydrophobicContact CG1-CE1 3.66Å; V82-F84 HydrophobicContact CG1-CE2 3.92Å; V82-F84 HydrophobicContact CG1-CZ 3.5Å; V82-K90 WeakPolarHBondContact O-CA 3.44Å; V82-F91 PolarHBondContact N-O 3.02Å; V82-F91 PolarHBondContact O-N 2.98Å; V82-V93 HydrophobicContact CG2-CG2 3.61Å
83	A	92.4	Very high	90.2	Very high	19 Å²	19	48.9 Å²	48.9	16%	0.157	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123	171.9	0	0	0	0	0	110.2	F64 K90	F64-A83 HydrophobicContact CB-CB 4.32Å; F64-A83 PolarHBondContact N-O 3.37Å; F64-A83 PolarHBondContact O-N 3.46Å; A83-K90 HydrophobicContact CB-CG 3.95Å
84	F	91.2	Very high	90.2	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	110.6	177.5	-61	-67.4	0	0	0	109.4	V24 L33 I39 H43 A44 L55 T63 V82 S89 F91	V24-F84 HydrophobicContact CB-CE1 4.34Å; V24-F84 HydrophobicContact CB-CZ 4.48Å; V24-F84 HydrophobicContact CG1-CD1 4.02Å; V24-F84 HydrophobicContact CG1-CD2 4.02Å; V24-F84 HydrophobicContact CG1-CE1 4.08Å; V24-F84 HydrophobicContact CG1-CE2 4.09Å; V24-F84 HydrophobicContact CG1-CG 3.99Å; V24-F84 HydrophobicContact CG1-CZ 4.11Å; V24-F84 HydrophobicContact CG2-CE1 4.12Å; V24-F84 HydrophobicContact CG2-CE2 4.48Å; V24-F84 HydrophobicContact CG2-CZ 3.92Å; L33-F84 HydrophobicContact CD1-CB 4.31Å; L33-F84 HydrophobicContact CD1-CD2 3.76Å; L33-F84 HydrophobicContact CD1-CE2 4.48Å; L33-F84 HydrophobicContact CD1-CG 4.29Å; I39-F84 HydrophobicContact CD1-CB 3.67Å; I39-F84 HydrophobicContact CG1-CB 4.19Å; I39-F84 WeakPolarHBondContact CG1-O 3.41Å; H43-F84 AromaticContact CD2-CD1 3.73Å; H43-F84 WeakPolarHBondContact NE2-CA 3.38Å; H43-F84 AromaticContact NE2-CD1 4Å; A44-F84 HydrophobicContact CB-CD1 4.17Å; A44-F84 HydrophobicContact CB-CE1 3.89Å; L55-F84 HydrophobicContact CD1-CE1 4.06Å; T63-F84 HydrophobicContact CG2-CD1 3.61Å; T63-F84 HydrophobicContact CG2-CE1 3.8Å; V82-F84 HydrophobicContact CG1-CD1 4.2Å; V82-F84 HydrophobicContact CG1-CD2 4.43Å; V82-F84 HydrophobicContact CG1-CE1 3.66Å; V82-F84 HydrophobicContact CG1-CE2 3.92Å; V82-F84 HydrophobicContact CG1-CZ 3.5Å; F84-S89 PolarHBondContact N-O 3.41Å; F84-F91 AromaticContact CD2-CD2 3.77Å; F84-F91 HydrophobicContact CD2-CD2 3.77Å; F84-F91 AromaticContact CD2-CE2 3.93Å; F84-F91 HydrophobicContact CD2-CE2 3.93Å; F84-F91 AromaticContact CE2-CD2 3.81Å; F84-F91 HydrophobicContact CE2-CD2 3.81Å; F84-F91 HydrophobicContact CE2-CE2 4.23Å
85	G	88.9	Confident	90	Very high	4 Å²	4	46.8 Å²	46.8	4%	0.041	27%	0.265	C	S	.	.	S	Bend	trans	74.7	-153.7	-173.8	0	0	0	0	0	112.9	S38 H43 G62 F64	S38-G85 WeakPolarHBondContact OG-CA 2.95Å; H43-G85 PolarHBondContact CE1-N 3.13Å; H43-G85 PolarHBondContact NE2-N 2.65Å; G62-G85 WeakPolarHBondContact O-CA 3.16Å; G62-G85 PolarHBondContact O-N 3.43Å; G62-G85 VanDerWaalsContact O-N 3.1Å; F64-G85 WeakPolarHBondContact CE2-O 3.35Å
86	V	85.7	Confident	89.7	Confident	91 Å²	91	42.1 Å²	42.1	55%	0.552	24%	0.244	S	C	*	.	S	Bend	trans	-116	-6.9	-162.4	-142.9	0	0	0	0	114	S38 Y61	S38-V86 PolarHBondContact OG-N 2.93Å; Y61-V86 HydrophobicContact CD1-CG2 4.34Å; Y61-V86 HydrophobicContact CG-CG2 4.35Å
87	F	83.9	Confident	89.5	Confident	128 Å²	128	46.8 Å²	46.8	56%	0.561	27%	0.266	S	S	*	.	S	Bend	trans	-100.1	-110.1	-177.7	-63.7	-61.3	0	0	0	112.5	D36	D36-F87 WeakPolarHBondContact OD1-CD2 3.46Å
88	H	80.6	Confident	89.3	Confident	71 Å²	71	49.9 Å²	49.9	33%	0.329	27%	0.27	S	S	.	.	S	Bend	trans	-114.3	-5.7	-159.4	60	-93.1	0	0	0	114.3	S35 D36 K90	S35-H88 WeakPolarHBondContact CB-NE2 3.38Å; S35-H88 PolarHBondContact O-CE1 2.89Å; S35-H88 PolarHBondContact OG-NE2 3.26Å; D36-H88 WeakPolarHBondContact CA-CE1 3.34Å; D36-H88 PolarHBondContact N-CE1 2.85Å; D36-H88 PolarHBondContact OD2-N 2.99Å; D36-H88 IonicContact OD2-ND1 3.92Å; H88-K90 PolarHBondContact O-N 2.84Å
89	S	88.8	Confident	89.4	Confident	9 Å²	9	46.7 Å²	46.7	6%	0.063	25%	0.248	C	C	.	.			trans	-78.2	63.8	-176	-57.4	0	0	0	0	113.4	D36 I39 F84	D36-S89 VanDerWaalsContact CB-OG 3.24Å; D36-S89 WeakPolarHBondContact CB-OG 3.47Å; D36-S89 WeakPolarHBondContact OD2-CB 3.38Å; D36-S89 PolarHBondContact OD2-N 2.96Å; D36-S89 PolarHBondContact OD2-OG 2.68Å; I39-S89 VanDerWaalsContact CD1-OG 3.29Å; I39-S89 WeakPolarHBondContact CD1-OG 3.01Å; F84-S89 PolarHBondContact N-O 3.41Å
90	K	91.2	Very high	89.6	Confident	97 Å²	97	45.2 Å²	45.2	42%	0.422	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.6	179.5	-57.9	-173.7	-179.7	-177.7	0	111.1	Q7 V82 A83 H88	Q7-K90 HydrophobicContact CB-CB 4.08Å; Q7-K90 PolarHBondContact N-O 3.21Å; V82-K90 WeakPolarHBondContact O-CA 3.44Å; A83-K90 HydrophobicContact CB-CG 3.95Å; H88-K90 PolarHBondContact O-N 2.84Å
91	F	92.1	Very high	89.7	Confident	12 Å²	12	44 Å²	44	5%	0.053	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.5	-176.4	-64.9	-94.6	0	0	0	110.6	L4 T5 P6 F14 L33 N81 V82 F84	L4-F91 HydrophobicContact CB-CB 4.38Å; L4-F91 HydrophobicContact CB-CD1 4.1Å; L4-F91 HydrophobicContact CB-CG 4.49Å; T5-F91 CarbonylContact O-C 3.19Å; T5-F91 VanDerWaalsContact O-CA 3.24Å; T5-F91 WeakPolarHBondContact O-CA 3.43Å; P6-F91 HydrophobicContact CB-CD1 4.01Å; P6-F91 HydrophobicContact CB-CE1 3.78Å; F14-F91 HydrophobicContact CD2-CE1 4.06Å; F14-F91 AromaticContact CE2-CE1 3.97Å; F14-F91 HydrophobicContact CE2-CE1 3.97Å; F14-F91 HydrophobicContact CE2-CZ 4.3Å; L33-F91 HydrophobicContact CD1-CE2 3.84Å; L33-F91 HydrophobicContact CD1-CZ 4.2Å; L33-F91 HydrophobicContact CD2-CE2 4.16Å; L33-F91 HydrophobicContact CD2-CZ 3.67Å; N81-F91 CarbonylContact C-O 3.59Å; N81-F91 WeakPolarHBondContact CA-O 3.48Å; V82-F91 PolarHBondContact N-O 3.02Å; V82-F91 PolarHBondContact O-N 2.98Å; F84-F91 AromaticContact CD2-CD2 3.77Å; F84-F91 HydrophobicContact CD2-CD2 3.77Å; F84-F91 AromaticContact CD2-CE2 3.93Å; F84-F91 HydrophobicContact CD2-CE2 3.93Å; F84-F91 AromaticContact CE2-CD2 3.81Å; F84-F91 HydrophobicContact CE2-CD2 3.81Å; F84-F91 HydrophobicContact CE2-CE2 4.23Å
92	S	92.3	Very high	89.8	Confident	35 Å²	35	40.8 Å²	40.8	25%	0.245	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.5	163.3	55.7	0	0	0	0	110.4	T5 D80	T5-S92 PolarHBondContact N-O 2.93Å; T5-S92 PolarHBondContact O-N 3.09Å; T5-S92 PolarHBondContact O-OG 2.81Å; D80-S92 CarbonylContact O-C 3.58Å; D80-S92 WeakPolarHBondContact O-CA 3.49Å
93	V	92.2	Very high	89.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	129	176	-174.7	0	0	0	0	108.2	W2 L4 L53 L76 G79 D80 V82	W2-V93 HydrophobicContact CE3-CG1 3.48Å; W2-V93 VanDerWaalsContact CE3-CG1 3.48Å; W2-V93 HydrophobicContact CZ3-CG1 3.51Å; L4-V93 HydrophobicContact CD2-CB 4.47Å; L4-V93 HydrophobicContact CD2-CG2 3.85Å; L53-V93 HydrophobicContact CD2-CG1 3.87Å; L76-V93 HydrophobicContact CB-CG1 4.38Å; L76-V93 HydrophobicContact CD1-CG2 4.05Å; G79-V93 PolarHBondContact N-O 2.88Å; D80-V93 HydrophobicContact CB-CB 4.3Å; D80-V93 HydrophobicContact CB-CG2 4.15Å; D80-V93 WeakPolarHBondContact O-CG2 3.4Å; D80-V93 PolarHBondContact O-N 2.9Å; V82-V93 HydrophobicContact CG2-CG2 3.61Å
94	V	90.3	Very high	89.8	Confident	49 Å²	49	40.5 Å²	40.5	30%	0.297	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	125.6	174.8	-178.1	0	0	0	0	109.3	W2 I3	W2-V94 CarbonylContact C-O 3.48Å; I3-V94 HydrophobicContact CB-CB 4.36Å; I3-V94 PolarHBondContact N-O 2.77Å; I3-V94 PolarHBondContact O-N 3.1Å
95	F	89.4	Confident	89.6	Confident	47 Å²	47	43.4 Å²	43.4	21%	0.206	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.1	166.5	-172.2	-119.9	0	0	0	109.7	M1 W2 L51 S78 E97	M1-F95 WeakPolarHBondContact O-CD2 3.44Å; W2-F95 AromaticContact CD1-CD2 3.9Å; W2-F95 HydrophobicContact CD2-CB 4.2Å; W2-F95 AromaticContact CD2-CD2 3.61Å; W2-F95 HydrophobicContact CD2-CD2 3.61Å; W2-F95 HydrophobicContact CD2-CE2 4.46Å; W2-F95 HydrophobicContact CD2-CG 4.35Å; W2-F95 AromaticContact CE2-CD2 3.41Å; W2-F95 VanDerWaalsContact CE2-CD2 3.41Å; W2-F95 AromaticContact CE2-CE2 3.97Å; W2-F95 HydrophobicContact CE3-CB 3.85Å; W2-F95 HydrophobicContact CE3-CD2 4.16Å; W2-F95 HydrophobicContact CE3-CG 4.48Å; W2-F95 AromaticContact CG-CD2 3.94Å; W2-F95 HydrophobicContact CG-CD2 3.94Å; W2-F95 HydrophobicContact CH2-CB 3.98Å; W2-F95 HydrophobicContact CH2-CD2 4.39Å; W2-F95 HydrophobicContact CH2-CG 4.4Å; W2-F95 HydrophobicContact CZ2-CB 4.28Å; W2-F95 AromaticContact CZ2-CD2 3.84Å; W2-F95 HydrophobicContact CZ2-CD2 3.84Å; W2-F95 HydrophobicContact CZ2-CE2 4.45Å; W2-F95 HydrophobicContact CZ2-CG 4.23Å; W2-F95 HydrophobicContact CZ3-CB 3.75Å; W2-F95 AromaticContact NE1-CD2 3.58Å; W2-F95 AromaticContact NE1-CE2 3.7Å; L51-F95 HydrophobicContact CD2-CZ 4.05Å; S78-F95 PolarHBondContact OG-N 3.39Å; F95-E97 HydrophobicContact CD1-CG 3.97Å; F95-E97 HydrophobicContact CE1-CG 3.78Å
96	L	86.3	Confident	89.7	Confident	25 Å²	25	44.1 Å²	44.1	13%	0.131	23%	0.225	C	C	.	.			trans	-99.3	105.7	170.6	178.7	63.6	0	0	0	108.7	M1 I3 L166	M1-L96 HydrophobicContact CE-CD2 4.19Å; M1-L96 HydrophobicContact CG-CB 3.92Å; M1-L96 HydrophobicContact CG-CD2 4.12Å; M1-L96 HydrophobicContact CG-CG 4.35Å; M1-L96 PolarHBondContact N-O 2.67Å; M1-L96 PolarHBondContact O-N 2.96Å; M1-L96 HydrophobicContact SD-CD2 4.06Å; I3-L96 HydrophobicContact CD1-CB 3.86Å; I3-L96 HydrophobicContact CD1-CD2 4.08Å; I3-L96 HydrophobicContact CG1-CB 4.5Å; L96-L166 HydrophobicContact CD1-CD2 4.31Å; L96-L166 HydrophobicContact CD2-CD1 3.94Å; L96-L166 HydrophobicContact CD2-CD2 4.28Å; L96-L166 HydrophobicContact CD2-CG 4.41Å
97	E	85.5	Confident	89.9	Confident	104 Å²	104	44.2 Å²	44.2	49%	0.486	22%	0.222	S	C	.	.			trans	-57.6	155	171.7	-69.3	-177.6	171.5	0	0	111.4	F95 P99	F95-E97 HydrophobicContact CD1-CG 3.97Å; F95-E97 HydrophobicContact CE1-CG 3.78Å; E97-P99 VanDerWaalsContact O-CD 3.32Å; E97-P99 WeakPolarHBondContact O-CD 3.44Å
98	K	88	Confident	90.3	Very high	139 Å²	139	43.5 Å²	43.5	60%	0.604	23%	0.228	S	C	*	.			trans	-67	116	173.6	-68	176.8	-175.8	171	0	108.1	V100	K98-V100 PolarHBondContact O-N 3.19Å; K98-V100 VanDerWaalsContact O-N 3.11Å
99	P	90.8	Very high	90.8	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.032	24%	0.238	C	C	.	.			trans	-71.2	113.9	-168.1	24.6	-31	0	0	0	111.3	E97 V101 L118 L121 G123 K124 F163	E97-P99 VanDerWaalsContact O-CD 3.32Å; E97-P99 WeakPolarHBondContact O-CD 3.44Å; P99-V101 HydrophobicContact CB-CG2 4.12Å; P99-L118 HydrophobicContact CB-CD2 3.86Å; P99-L118 HydrophobicContact CG-CD2 3.72Å; P99-L121 HydrophobicContact CG-CB 4.07Å; P99-L121 HydrophobicContact CG-CD1 4.34Å; P99-G123 CarbonylContact O-C 3.54Å; P99-G123 WeakPolarHBondContact O-CA 3.4Å; P99-K124 PolarHBondContact O-N 2.92Å; P99-F163 HydrophobicContact CB-CE1 4.09Å
100	V	94.4	Very high	91	Very high	18 Å²	18	43.7 Å²	43.7	11%	0.109	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.8	167.1	-176.2	0	0	0	0	108	K98 K124 V126 D132 C133 T134 H135	K98-V100 PolarHBondContact O-N 3.19Å; K98-V100 VanDerWaalsContact O-N 3.11Å; V100-K124 HydrophobicContact CB-CG 4.29Å; V100-K124 HydrophobicContact CG1-CD 4.25Å; V100-K124 HydrophobicContact CG1-CG 3.91Å; V100-K124 HydrophobicContact CG2-CD 4.35Å; V100-K124 HydrophobicContact CG2-CG 4.09Å; V100-V126 HydrophobicContact CG1-CG2 3.8Å; V100-D132 VanDerWaalsContact CB-O 3.31Å; V100-D132 WeakPolarHBondContact CB-O 3.31Å; V100-C133 HydrophobicContact CG1-CB 4.47Å; V100-T134 HydrophobicContact CB-CG2 4.24Å; V100-T134 HydrophobicContact CG2-CG2 4.48Å; V100-T134 PolarHBondContact N-OG1 2.77Å; V100-T134 VanDerWaalsContact N-OG1 3.08Å; V100-T134 PolarHBondContact O-N 3.27Å; V100-T134 PolarHBondContact O-OG1 3.15Å; V100-H135 PolarHBondContact O-N 3.08Å
101	V	94.1	Very high	91	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.2	-168.5	-174.6	0	0	0	0	111.1	P99 L114 L118 K124 L125 V126 H135 A137 F163	P99-V101 HydrophobicContact CB-CG2 4.12Å; V101-L114 HydrophobicContact CG1-CD2 4.41Å; V101-L118 HydrophobicContact CB-CD1 3.79Å; V101-L118 HydrophobicContact CB-CD2 4.39Å; V101-L118 HydrophobicContact CG1-CD1 4.45Å; V101-L118 HydrophobicContact CG2-CD1 3.9Å; V101-L118 HydrophobicContact CG2-CD2 3.56Å; V101-L118 HydrophobicContact CG2-CG 4.39Å; V101-K124 PolarHBondContact N-O 3.41Å; V101-L125 CarbonylContact O-C 3.3Å; V101-L125 WeakPolarHBondContact O-CA 3.39Å; V101-V126 PolarHBondContact O-N 3.27Å; V101-H135 WeakPolarHBondContact CA-O 3.45Å; V101-H135 HydrophobicContact CG2-CB 4.28Å; V101-A137 HydrophobicContact CG1-CB 3.69Å; V101-F163 HydrophobicContact CB-CZ 4.47Å; V101-F163 HydrophobicContact CG1-CE2 3.95Å; V101-F163 HydrophobicContact CG1-CZ 4.04Å; V101-F163 HydrophobicContact CG2-CD1 4.44Å; V101-F163 HydrophobicContact CG2-CE1 3.68Å; V101-F163 HydrophobicContact CG2-CE2 4.18Å; V101-F163 HydrophobicContact CG2-CZ 3.53Å
102	C	94.4	Very high	91.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	146.2	164.7	-64.1	0	0	0	0	110.4	S128 W129 C133 H135 L136 A137	C102-S128 PolarHBondContact SG-O 3.14Å; C102-W129 HydrophobicContact CB-CE3 3.75Å; C102-W129 HydrophobicContact CB-CZ3 4.15Å; C102-C133 PolarHBondContact SG-SG 3.06Å; C102-H135 PolarHBondContact N-O 2.97Å; C102-L136 HydrophobicContact CB-CD1 3.9Å; C102-A137 PolarHBondContact O-N 2.66Å
103	S	93.3	Very high	91.2	Very high	7 Å²	7	48.1 Å²	48.1	5%	0.049	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	139.9	166.4	57.9	0	0	0	0	111.6	K146	S103-K146 WeakPolarHBondContact O-CD 3.46Å; S103-K146 PolarHBondContact O-NZ 2.68Å
104	S	92.4	Very high	91.3	Very high	8 Å²	8	48.3 Å²	48.3	6%	0.056	28%	0.275	C	S	.	.			trans	-134.5	143.6	170	-172.4	0	0	0	0	109	L106 A137 M138 T144	S104-L106 PolarHBondContact O-N 3.12Å; S104-A137 PolarHBondContact N-O 2.87Å; S104-M138 WeakPolarHBondContact O-CA 3.49Å; S104-M138 VanDerWaalsContact O-CB 3.31Å; S104-M138 WeakPolarHBondContact O-CB 3.46Å; S104-T144 PolarHBondContact OG-OG1 3.15Å; S104-T144 VanDerWaalsContact OG-OG1 3.11Å
105	C	88.1	Confident	91.5	Very high	63 Å²	63	48.2 Å²	48.2	43%	0.426	28%	0.277	S	S	.	.	S	Bend	trans	52.5	38.5	177.5	-50.9	0	0	0	0	113.4	P139	C105-P139 VanDerWaalsContact O-CD 3.32Å; C105-P139 WeakPolarHBondContact O-CD 3.43Å
106	L	89.3	Confident	91.7	Very high	19 Å²	19	53 Å²	53	10%	0.099	30%	0.3	C	S	.	.			trans	-125.1	135.4	-175.4	-167.2	64.5	0	0	0	110.5	S104 K111 L114 P139 P160	S104-L106 PolarHBondContact O-N 3.12Å; L106-K111 HydrophobicContact CB-CG 4.31Å; L106-K111 HydrophobicContact CD2-CG 4.11Å; L106-K111 HydrophobicContact CG-CG 4.19Å; L106-K111 WeakPolarHBondContact O-CE 3.42Å; L106-K111 PolarHBondContact O-NZ 3.03Å; L106-L114 HydrophobicContact CD2-CB 4.45Å; L106-L114 HydrophobicContact CD2-CD2 3.86Å; L106-P139 HydrophobicContact CD1-CG 3.85Å; L106-P160 HydrophobicContact CD1-CG 3.84Å; L106-P160 HydrophobicContact CD2-CG 4.29Å
107	D	90.9	Very high	92	Very high	93 Å²	93	52.2 Å²	52.2	50%	0.497	30%	0.297	S	S	.	.			trans	-76.8	178.3	-177.9	79.9	-61.9	0	0	0	112.3	A109 G110 K111	D107-A109 WeakPolarHBondContact OD2-CA 3.38Å; D107-A109 VanDerWaalsContact OD2-CB 3.23Å; D107-A109 WeakPolarHBondContact OD2-CB 3.45Å; D107-A109 PolarHBondContact OD2-N 2.68Å; D107-G110 VanDerWaalsContact OD1-CA 3.3Å; D107-G110 WeakPolarHBondContact OD1-CA 3.34Å; D107-G110 PolarHBondContact OD1-N 3.11Å; D107-G110 PolarHBondContact OD2-N 3.29Å; D107-K111 VanDerWaalsContact O-CB 3.27Å; D107-K111 WeakPolarHBondContact O-CB 3.33Å; D107-K111 WeakPolarHBondContact O-CD 3.43Å; D107-K111 WeakPolarHBondContact O-CG 3.34Å; D107-K111 PolarHBondContact O-N 2.88Å
108	V	91.5	Very high	92.4	Very high	113 Å²	113	47.3 Å²	47.3	69%	0.685	27%	0.274	S	S	*	.	H	α-helix	trans	-67.9	-37.7	-178.2	-176.7	0	0	0	0	112.3	T112	V108-T112 WeakPolarHBondContact O-CB 3.29Å; V108-T112 PolarHBondContact O-N 3.03Å; V108-T112 PolarHBondContact O-OG1 3.41Å
109	A	91.8	Very high	92.6	Very high	66 Å²	66	44.6 Å²	44.6	55%	0.545	27%	0.272	S	S	.	.	H	α-helix	trans	-71.7	-44.1	177.4	0	0	0	0	0	111.1	D107 T112 S113	D107-A109 WeakPolarHBondContact OD2-CA 3.38Å; D107-A109 VanDerWaalsContact OD2-CB 3.23Å; D107-A109 WeakPolarHBondContact OD2-CB 3.45Å; D107-A109 PolarHBondContact OD2-N 2.68Å; A109-T112 PolarHBondContact O-N 2.7Å; A109-S113 WeakPolarHBondContact O-CB 3.43Å; A109-S113 PolarHBondContact O-N 3.2Å
110	G	92.1	Very high	92.5	Very high	18 Å²	18	47.5 Å²	47.5	19%	0.186	30%	0.297	C	S	.	.	H	α-helix	trans	-58.4	-46.7	172.9	0	0	0	0	0	112.8	D107 T112 S113 L114	D107-G110 VanDerWaalsContact OD1-CA 3.3Å; D107-G110 WeakPolarHBondContact OD1-CA 3.34Å; D107-G110 PolarHBondContact OD1-N 3.11Å; D107-G110 PolarHBondContact OD2-N 3.29Å; G110-T112 VanDerWaalsContact C-N 3.31Å; G110-T112 PolarHBondContact O-N 2.92Å; G110-S113 PolarHBondContact O-N 3.36Å; G110-L114 VanDerWaalsContact O-CB 3.28Å; G110-L114 WeakPolarHBondContact O-CB 3.37Å; G110-L114 PolarHBondContact O-N 3.26Å
111	K	92.8	Very high	92.2	Very high	90 Å²	90	47 Å²	47	39%	0.391	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-41.3	173.6	-77.9	164.1	175.1	151.5	0	112.1	L106 D107 S115	L106-K111 HydrophobicContact CB-CG 4.31Å; L106-K111 HydrophobicContact CD2-CG 4.11Å; L106-K111 HydrophobicContact CG-CG 4.19Å; L106-K111 WeakPolarHBondContact O-CE 3.42Å; L106-K111 PolarHBondContact O-NZ 3.03Å; D107-K111 VanDerWaalsContact O-CB 3.27Å; D107-K111 WeakPolarHBondContact O-CB 3.33Å; D107-K111 WeakPolarHBondContact O-CD 3.43Å; D107-K111 WeakPolarHBondContact O-CG 3.34Å; D107-K111 PolarHBondContact O-N 2.88Å; K111-S115 WeakPolarHBondContact O-CB 3.4Å; K111-S115 PolarHBondContact O-N 3.14Å
112	T	93.3	Very high	91.8	Very high	86 Å²	86	49.4 Å²	49.4	53%	0.528	32%	0.318	S	S	.	.	H	α-helix	trans	-67.4	-46.4	179.1	-56.8	0	0	0	0	111.6	V108 A109 G110 S115 Q116	V108-T112 WeakPolarHBondContact O-CB 3.29Å; V108-T112 PolarHBondContact O-N 3.03Å; V108-T112 PolarHBondContact O-OG1 3.41Å; A109-T112 PolarHBondContact O-N 2.7Å; G110-T112 VanDerWaalsContact C-N 3.31Å; G110-T112 PolarHBondContact O-N 2.92Å; T112-S115 PolarHBondContact O-N 3.07Å; T112-Q116 PolarHBondContact O-N 3.08Å
113	S	94.3	Very high	91.6	Very high	61 Å²	61	50.3 Å²	50.3	43%	0.427	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-46.7	176.1	-175	0	0	0	0	111.8	A109 G110 S115 Q116 A117	A109-S113 WeakPolarHBondContact O-CB 3.43Å; A109-S113 PolarHBondContact O-N 3.2Å; G110-S113 PolarHBondContact O-N 3.36Å; S113-S115 PolarHBondContact O-N 3.2Å; S113-Q116 PolarHBondContact O-N 3.39Å; S113-A117 PolarHBondContact O-N 3.22Å
114	L	94.3	Very high	91.6	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-44.6	175.4	177.9	60.3	0	0	0	111.9	V101 L106 G110 Q116 A117 L118 L125 A137 F163	V101-L114 HydrophobicContact CG1-CD2 4.41Å; L106-L114 HydrophobicContact CD2-CB 4.45Å; L106-L114 HydrophobicContact CD2-CD2 3.86Å; G110-L114 VanDerWaalsContact O-CB 3.28Å; G110-L114 WeakPolarHBondContact O-CB 3.37Å; G110-L114 PolarHBondContact O-N 3.26Å; L114-Q116 PolarHBondContact O-N 3.31Å; L114-A117 PolarHBondContact O-N 3.31Å; L114-L118 HydrophobicContact CD1-CD1 3.88Å; L114-L118 HydrophobicContact CD1-CG 4.1Å; L114-L118 HydrophobicContact CG-CD1 3.86Å; L114-L118 HydrophobicContact CG-CG 4.49Å; L114-L118 WeakPolarHBondContact O-CB 2.92Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.2Å; L114-L118 PolarHBondContact O-N 2.81Å; L114-L125 HydrophobicContact CD2-CD1 3.74Å; L114-L125 HydrophobicContact CG-CD1 4.23Å; L114-A137 HydrophobicContact CD2-CB 3.64Å; L114-F163 HydrophobicContact CD1-CB 3.91Å; L114-F163 HydrophobicContact CD1-CD2 3.39Å; L114-F163 HydrophobicContact CD1-CE2 4.17Å; L114-F163 HydrophobicContact CD1-CG 3.82Å
115	S	94.5	Very high	91.7	Very high	48 Å²	48	57 Å²	57	34%	0.336	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-42.6	176.3	-169.3	0	0	0	0	112.2	K111 T112 S113 L118 S119	K111-S115 WeakPolarHBondContact O-CB 3.4Å; K111-S115 PolarHBondContact O-N 3.14Å; T112-S115 PolarHBondContact O-N 3.07Å; S113-S115 PolarHBondContact O-N 3.2Å; S115-L118 PolarHBondContact O-N 3.32Å; S115-S119 WeakPolarHBondContact O-CB 3.48Å; S115-S119 PolarHBondContact O-N 2.55Å; S115-S119 PolarHBondContact O-OG 3.21Å
116	Q	93.9	Very high	92	Very high	147 Å²	147	55.3 Å²	55.3	69%	0.687	35%	0.345	S	S	*	.	H	α-helix	trans	-63.9	-44.6	175.2	-176.8	179.2	-12.2	0	0	112.1	T112 S113 L114 S119 A120	T112-Q116 PolarHBondContact O-N 3.08Å; S113-Q116 PolarHBondContact O-N 3.39Å; L114-Q116 PolarHBondContact O-N 3.31Å; Q116-S119 PolarHBondContact O-N 3.43Å; Q116-A120 PolarHBondContact O-N 3.17Å; Q116-A120 VanDerWaalsContact O-N 3.15Å
117	A	93.3	Very high	92	Very high	9 Å²	9	58.9 Å²	58.9	7%	0.074	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-42.7	177.5	0	0	0	0	0	112.1	S113 L114 A120 L121 F163	S113-A117 PolarHBondContact O-N 3.22Å; L114-A117 PolarHBondContact O-N 3.31Å; A117-A120 PolarHBondContact O-N 3.09Å; A117-L121 WeakPolarHBondContact O-CG 3.47Å; A117-L121 PolarHBondContact O-N 3.42Å; A117-F163 HydrophobicContact CB-CB 4.18Å
118	L	93.5	Very high	92	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-66.9	-38.7	176	-69.2	169.2	0	0	0	112.4	P99 V101 L114 S115 A120 L121 G122 G123 L125 F163	P99-L118 HydrophobicContact CB-CD2 3.86Å; P99-L118 HydrophobicContact CG-CD2 3.72Å; V101-L118 HydrophobicContact CB-CD1 3.79Å; V101-L118 HydrophobicContact CB-CD2 4.39Å; V101-L118 HydrophobicContact CG1-CD1 4.45Å; V101-L118 HydrophobicContact CG2-CD1 3.9Å; V101-L118 HydrophobicContact CG2-CD2 3.56Å; V101-L118 HydrophobicContact CG2-CG 4.39Å; L114-L118 HydrophobicContact CD1-CD1 3.88Å; L114-L118 HydrophobicContact CD1-CG 4.1Å; L114-L118 HydrophobicContact CG-CD1 3.86Å; L114-L118 HydrophobicContact CG-CG 4.49Å; L114-L118 WeakPolarHBondContact O-CB 2.92Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.2Å; L114-L118 PolarHBondContact O-N 2.81Å; S115-L118 PolarHBondContact O-N 3.32Å; L118-A120 VanDerWaalsContact C-N 3.3Å; L118-A120 PolarHBondContact O-N 3.26Å; L118-L121 CarbonylContact O-C 3.58Å; L118-L121 WeakPolarHBondContact O-CA 3.31Å; L118-L121 PolarHBondContact O-N 3.31Å; L118-G122 PolarHBondContact O-N 2.85Å; L118-G122 VanDerWaalsContact O-N 3.09Å; L118-G123 PolarHBondContact O-N 3.3Å; L118-L125 HydrophobicContact CD1-CB 4.06Å; L118-L125 HydrophobicContact CD1-CD1 4.33Å; L118-F163 HydrophobicContact CD2-CB 4.43Å; L118-F163 HydrophobicContact CD2-CD1 3.54Å; L118-F163 HydrophobicContact CD2-CE1 3.98Å; L118-F163 HydrophobicContact CD2-CG 3.99Å
119	S	91.7	Very high	92	Very high	81 Å²	81	53.6 Å²	53.6	57%	0.566	34%	0.342	S	S	*	.	H	α-helix	trans	-60.1	-41	176.3	-60.9	0	0	0	0	111.6	S115 Q116 L121 G122	S115-S119 WeakPolarHBondContact O-CB 3.48Å; S115-S119 PolarHBondContact O-N 2.55Å; S115-S119 PolarHBondContact O-OG 3.21Å; Q116-S119 PolarHBondContact O-N 3.43Å; S119-L121 PolarHBondContact O-N 3.19Å; S119-G122 PolarHBondContact O-N 2.72Å
120	A	88.7	Confident	92	Very high	67 Å²	67	52.4 Å²	52.4	55%	0.554	33%	0.328	S	S	*	.	H	α-helix	trans	-66.1	-21.6	174.7	0	0	0	0	0	113.8	Q116 A117 L118	Q116-A120 PolarHBondContact O-N 3.17Å; Q116-A120 VanDerWaalsContact O-N 3.15Å; A117-A120 PolarHBondContact O-N 3.09Å; L118-A120 VanDerWaalsContact C-N 3.3Å; L118-A120 PolarHBondContact O-N 3.26Å
121	L	87.8	Confident	91.8	Very high	8 Å²	8	55.9 Å²	55.9	4%	0.042	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-2.5	176.5	-66.9	170.1	0	0	0	113.5	P99 A117 L118 S119 G123 L166 V170	P99-L121 HydrophobicContact CG-CB 4.07Å; P99-L121 HydrophobicContact CG-CD1 4.34Å; A117-L121 WeakPolarHBondContact O-CG 3.47Å; A117-L121 PolarHBondContact O-N 3.42Å; L118-L121 CarbonylContact O-C 3.58Å; L118-L121 WeakPolarHBondContact O-CA 3.31Å; L118-L121 PolarHBondContact O-N 3.31Å; S119-L121 PolarHBondContact O-N 3.19Å; L121-G123 VanDerWaalsContact C-N 3.28Å; L121-G123 PolarHBondContact O-N 2.9Å; L121-L166 HydrophobicContact CD1-CB 4.12Å; L121-L166 HydrophobicContact CD1-CD2 3.78Å; L121-L166 HydrophobicContact CD1-CG 3.84Å; L121-L166 HydrophobicContact CD2-CG 4.01Å; L121-V170 HydrophobicContact CD2-CB 4.5Å; L121-V170 HydrophobicContact CD2-CG2 3.75Å
122	G	87	Confident	91.7	Very high	49 Å²	49	54.9 Å²	54.9	51%	0.505	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	23.5	-172.5	0	0	0	0	0	114.1	L118 S119	L118-G122 PolarHBondContact O-N 2.85Å; L118-G122 VanDerWaalsContact O-N 3.09Å; S119-G122 PolarHBondContact O-N 2.72Å
123	G	90.3	Very high	91.6	Very high	19 Å²	19	50.8 Å²	50.8	20%	0.196	32%	0.321	C	S	.	.			trans	-93.6	-177.9	175.2	0	0	0	0	0	113.9	P99 L118 L121	P99-G123 CarbonylContact O-C 3.54Å; P99-G123 WeakPolarHBondContact O-CA 3.4Å; L118-G123 PolarHBondContact O-N 3.3Å; L121-G123 VanDerWaalsContact C-N 3.28Å; L121-G123 PolarHBondContact O-N 2.9Å
124	K	92.8	Very high	91.6	Very high	101 Å²	101	48.4 Å²	48.4	44%	0.439	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.6	177.1	71.5	-178.7	-174.9	179.2	0	112.1	P99 V100 V101 V126 D132	P99-K124 PolarHBondContact O-N 2.92Å; V100-K124 HydrophobicContact CB-CG 4.29Å; V100-K124 HydrophobicContact CG1-CD 4.25Å; V100-K124 HydrophobicContact CG1-CG 3.91Å; V100-K124 HydrophobicContact CG2-CD 4.35Å; V100-K124 HydrophobicContact CG2-CG 4.09Å; V101-K124 PolarHBondContact N-O 3.41Å; K124-V126 HydrophobicContact CD-CG2 4.31Å; K124-V126 HydrophobicContact CG-CG2 4.11Å; K124-D132 VanDerWaalsContact CE-OD2 3.28Å; K124-D132 WeakPolarHBondContact CE-OD2 3.38Å; K124-D132 IonicContact NZ-OD2 2.67Å; K124-D132 PolarHBondContact NZ-OD2 3.47Å
125	L	94.2	Very high	91.5	Very high	54 Å²	54	49.5 Å²	49.5	28%	0.283	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.2	169.7	-177.4	62	0	0	0	109.2	V101 L114 L118	V101-L125 CarbonylContact O-C 3.3Å; V101-L125 WeakPolarHBondContact O-CA 3.39Å; L114-L125 HydrophobicContact CD2-CD1 3.74Å; L114-L125 HydrophobicContact CG-CD1 4.23Å; L118-L125 HydrophobicContact CD1-CB 4.06Å; L118-L125 HydrophobicContact CD1-CD1 4.33Å
126	V	93.6	Very high	91.5	Very high	29 Å²	29	47.2 Å²	47.2	18%	0.176	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	142.1	-178.2	-164.8	0	0	0	0	110.2	V100 V101 K124 S128	V100-V126 HydrophobicContact CG1-CG2 3.8Å; V101-V126 PolarHBondContact O-N 3.27Å; K124-V126 HydrophobicContact CD-CG2 4.31Å; K124-V126 HydrophobicContact CG-CG2 4.11Å; V126-S128 VanDerWaalsContact CG1-O 3.31Å; V126-S128 WeakPolarHBondContact CG1-O 3.49Å
127	S	89.9	Confident	91.6	Very high	94 Å²	94	40.2 Å²	40.2	66%	0.657	26%	0.26	S	S	*	.	S	Bend	trans	-78.4	-51.9	179.2	48.6	0	0	0	0	112.4	K146	S127-K146 WeakPolarHBondContact O-CE 3.35Å; S127-K146 PolarHBondContact O-NZ 2.82Å
128	S	90.1	Very high	91.6	Very high	68 Å²	68	39.8 Å²	39.8	48%	0.476	26%	0.257	S	S	.	.	S	Bend	trans	-85.7	166.1	173.2	54.4	0	0	0	0	111.8	C102 V126	C102-S128 PolarHBondContact SG-O 3.14Å; V126-S128 VanDerWaalsContact CG1-O 3.31Å; V126-S128 WeakPolarHBondContact CG1-O 3.49Å
129	W	92.8	Very high	91.5	Very high	27 Å²	27	42.1 Å²	42.1	10%	0.102	27%	0.272	C	S	.	.			trans	-97.2	130.7	175	-178.3	-82.2	0	0	0	111.2	C102 C133 L136 A150 C153 R155 F230	C102-W129 HydrophobicContact CB-CE3 3.75Å; C102-W129 HydrophobicContact CB-CZ3 4.15Å; W129-C133 HydrophobicContact CD2-CB 4.06Å; W129-C133 HydrophobicContact CE3-CB 4.01Å; W129-C133 HydrophobicContact CH2-CB 3.7Å; W129-C133 HydrophobicContact CZ2-CB 3.78Å; W129-C133 HydrophobicContact CZ3-CB 3.82Å; W129-L136 HydrophobicContact CE3-CD1 4.36Å; W129-L136 HydrophobicContact CZ3-CB 3.91Å; W129-L136 HydrophobicContact CZ3-CD1 4.26Å; W129-A150 HydrophobicContact CE3-CB 4.37Å; W129-A150 HydrophobicContact CH2-CB 3.58Å; W129-A150 HydrophobicContact CZ2-CB 3.97Å; W129-A150 HydrophobicContact CZ3-CB 3.8Å; W129-C153 HydrophobicContact CZ2-CB 4.11Å; W129-C153 PolarHBondContact NE1-SG 3.34Å; W129-C153 VanDerWaalsContact NE1-SG 3.4Å; W129-R155 HydrophobicContact CH2-CB 3.91Å; W129-R155 HydrophobicContact CH2-CG 4.07Å; W129-R155 HydrophobicContact CZ2-CB 4.13Å; W129-R155 HydrophobicContact CZ2-CG 3.89Å; W129-F230 AromaticContact CD1-CE2 3.53Å
130	T	91.1	Very high	91.3	Very high	41 Å²	41	40.2 Å²	40.2	25%	0.252	26%	0.257	S	S	.	.			trans	-133.8	161.3	-178.1	51.8	0	0	0	0	111.4	D132 C133	T130-D132 WeakPolarHBondContact CB-OD1 3.11Å; T130-D132 PolarHBondContact O-N 2.73Å; T130-D132 PolarHBondContact OG1-OD1 2.85Å; T130-C133 PolarHBondContact N-SG 2.92Å; T130-C133 VanDerWaalsContact N-SG 3.4Å; T130-C133 WeakPolarHBondContact O-CB 3.47Å; T130-C133 PolarHBondContact O-N 2.76Å; T130-C133 PolarHBondContact O-SG 3.28Å; T130-C133 PolarHBondContact OG1-SG 3.49Å
131	P	87.8	Confident	91.3	Very high	90 Å²	90	37.4 Å²	37.4	58%	0.584	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.4	-175.7	-25.2	35.4	0	0	0	115.2	C133 R155 F230	P131-C133 PolarHBondContact O-N 2.74Å; P131-R155 PolarHBondContact O-NH2 2.98Å; P131-F230 HydrophobicContact CG-CE1 3.99Å
132	D	90.1	Very high	91.4	Very high	70 Å²	70	40.4 Å²	40.4	37%	0.374	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.3	175.5	68.1	-48.6	0	0	0	113.2	V100 K124 T130 T134	V100-D132 VanDerWaalsContact CB-O 3.31Å; V100-D132 WeakPolarHBondContact CB-O 3.31Å; K124-D132 VanDerWaalsContact CE-OD2 3.28Å; K124-D132 WeakPolarHBondContact CE-OD2 3.38Å; K124-D132 IonicContact NZ-OD2 2.67Å; K124-D132 PolarHBondContact NZ-OD2 3.47Å; T130-D132 WeakPolarHBondContact CB-OD1 3.11Å; T130-D132 PolarHBondContact O-N 2.73Å; T130-D132 PolarHBondContact OG1-OD1 2.85Å; D132-T134 PolarHBondContact O-N 3.16Å
133	C	93	Very high	91.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.234	C	C	.	.			trans	-61.4	123.9	171.9	-65.2	0	0	0	0	111	V100 C102 W129 T130 P131 R155	V100-C133 HydrophobicContact CG1-CB 4.47Å; C102-C133 PolarHBondContact SG-SG 3.06Å; W129-C133 HydrophobicContact CD2-CB 4.06Å; W129-C133 HydrophobicContact CE3-CB 4.01Å; W129-C133 HydrophobicContact CH2-CB 3.7Å; W129-C133 HydrophobicContact CZ2-CB 3.78Å; W129-C133 HydrophobicContact CZ3-CB 3.82Å; T130-C133 PolarHBondContact N-SG 2.92Å; T130-C133 VanDerWaalsContact N-SG 3.4Å; T130-C133 WeakPolarHBondContact O-CB 3.47Å; T130-C133 PolarHBondContact O-N 2.76Å; T130-C133 PolarHBondContact O-SG 3.28Å; T130-C133 PolarHBondContact OG1-SG 3.49Å; P131-C133 PolarHBondContact O-N 2.74Å; C133-R155 WeakPolarHBondContact O-CD 3.28Å; C133-R155 WeakPolarHBondContact O-CG 3.3Å; C133-R155 PolarHBondContact O-NE 3.44Å; C133-R155 PolarHBondContact O-NH2 2.9Å
134	T	92.6	Very high	91.4	Very high	11 Å²	11	40.9 Å²	40.9	7%	0.067	24%	0.235	C	C	.	.			trans	-90	-33.3	-178.8	63	0	0	0	0	112.3	V100 D132 P156	V100-T134 HydrophobicContact CB-CG2 4.24Å; V100-T134 HydrophobicContact CG2-CG2 4.48Å; V100-T134 PolarHBondContact N-OG1 2.77Å; V100-T134 VanDerWaalsContact N-OG1 3.08Å; V100-T134 PolarHBondContact O-N 3.27Å; V100-T134 PolarHBondContact O-OG1 3.15Å; D132-T134 PolarHBondContact O-N 3.16Å; T134-P156 WeakPolarHBondContact O-CD 3.31Å
135	H	93.4	Very high	91.3	Very high	25 Å²	25	39.2 Å²	39.2	12%	0.116	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	153	-174.7	-62.1	75.5	0	0	0	111.5	V100 V101 C102 P156 V158 Y162 F163	V100-H135 PolarHBondContact O-N 3.08Å; V101-H135 WeakPolarHBondContact CA-O 3.45Å; V101-H135 HydrophobicContact CG2-CB 4.28Å; C102-H135 PolarHBondContact N-O 2.97Å; H135-P156 VanDerWaalsContact CD2-CG 3.46Å; H135-P156 WeakPolarHBondContact CD2-CG 3.49Å; H135-V158 HydrophobicContact CB-CG2 4.5Å; H135-Y162 AromaticContact NE2-CE1 3.96Å; H135-F163 HydrophobicContact CB-CZ 3.78Å; H135-F163 AromaticContact CG-CZ 3.86Å
136	L	94.8	Very high	91.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.6	162.9	-177.5	64.4	0	0	0	110	C102 W129 M138 K146 A150 P156 I157 V158	C102-L136 HydrophobicContact CB-CD1 3.9Å; W129-L136 HydrophobicContact CE3-CD1 4.36Å; W129-L136 HydrophobicContact CZ3-CB 3.91Å; W129-L136 HydrophobicContact CZ3-CD1 4.26Å; L136-M138 HydrophobicContact CD2-SD 3.78Å; L136-M138 HydrophobicContact CG-SD 4.35Å; L136-K146 HydrophobicContact CD1-CB 3.9Å; L136-K146 HydrophobicContact CD2-CB 4.47Å; L136-A150 HydrophobicContact CB-CB 3.88Å; L136-A150 HydrophobicContact CD2-CB 3.93Å; L136-A150 HydrophobicContact CG-CB 4.5Å; L136-P156 PolarHBondContact N-O 3.42Å; L136-I157 HydrophobicContact CB-CG1 4.24Å; L136-I157 HydrophobicContact CB-CG2 4.42Å; L136-I157 HydrophobicContact CD2-CD1 4.25Å; L136-I157 HydrophobicContact CD2-CG1 4.18Å; L136-I157 HydrophobicContact CD2-CG2 4.23Å; L136-I157 HydrophobicContact CG-CG2 4.44Å; L136-I157 WeakPolarHBondContact O-CA 3.32Å; L136-V158 PolarHBondContact O-N 3.24Å
137	A	94.4	Very high	91.2	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.3	172.8	0	0	0	0	0	110.9	V101 C102 S104 L114 V158 F163	V101-A137 HydrophobicContact CG1-CB 3.69Å; C102-A137 PolarHBondContact O-N 2.66Å; S104-A137 PolarHBondContact N-O 2.87Å; L114-A137 HydrophobicContact CD2-CB 3.64Å; A137-V158 WeakPolarHBondContact CA-O 3.41Å; A137-F163 HydrophobicContact CB-CE2 4.21Å
138	M	93.4	Very high	91.3	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.			trans	-152.3	140.6	173.1	67.7	-162.6	-44	0	0	111.9	S104 L136 T140 V141 T147 I157 V158 P184	S104-M138 WeakPolarHBondContact O-CA 3.49Å; S104-M138 VanDerWaalsContact O-CB 3.31Å; S104-M138 WeakPolarHBondContact O-CB 3.46Å; L136-M138 HydrophobicContact CD2-SD 3.78Å; L136-M138 HydrophobicContact CG-SD 4.35Å; M138-T140 WeakPolarHBondContact CE-O 3.4Å; M138-T140 WeakPolarHBondContact CG-O 3.29Å; M138-V141 HydrophobicContact SD-CB 4.37Å; M138-V141 HydrophobicContact SD-CG1 4.12Å; M138-V141 HydrophobicContact SD-CG2 4.27Å; M138-T147 WeakPolarHBondContact CE-OG1 3.35Å; M138-I157 HydrophobicContact CG-CG2 3.72Å; M138-I157 HydrophobicContact SD-CG2 3.52Å; M138-I157 VanDerWaalsContact SD-CG2 3.52Å; M138-V158 PolarHBondContact N-O 3.43Å; M138-P184 HydrophobicContact CG-CG 3.99Å; M138-P184 WeakPolarHBondContact O-CG 3.27Å
139	P	91.1	Very high	91.5	Very high	50 Å²	50	30.9 Å²	30.9	33%	0.325	17%	0.17	S	C	.	.	S	Bend	trans	-69.1	-37.6	-176.9	-21.1	33.9	0	0	0	114.3	C105 L106 P160	C105-P139 VanDerWaalsContact O-CD 3.32Å; C105-P139 WeakPolarHBondContact O-CD 3.43Å; L106-P139 HydrophobicContact CD1-CG 3.85Å; P139-P160 HydrophobicContact CG-CG 4.35Å
140	T	89	Confident	91.5	Very high	42 Å²	42	29.6 Å²	29.6	26%	0.258	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	153.8	171.8	60	0	0	0	0	108.9	M138 E185 D187	M138-T140 WeakPolarHBondContact CE-O 3.4Å; M138-T140 WeakPolarHBondContact CG-O 3.29Å; T140-E185 CarbonylContact C-O 3.5Å; T140-E185 WeakPolarHBondContact CA-O 3.46Å; T140-E185 WeakPolarHBondContact CB-O 3.48Å; T140-D187 HydrophobicContact CG2-CB 4.08Å; T140-D187 PolarHBondContact OG1-OD2 3.37Å
141	V	88.4	Confident	91.5	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.8	-179.1	-168	0	0	0	0	110.6	M138 T147 I157 P184 E185 D187 L198	M138-V141 HydrophobicContact SD-CB 4.37Å; M138-V141 HydrophobicContact SD-CG1 4.12Å; M138-V141 HydrophobicContact SD-CG2 4.27Å; V141-T147 HydrophobicContact CG1-CG2 3.76Å; V141-I157 HydrophobicContact CG2-CG2 4.4Å; V141-P184 HydrophobicContact CG2-CB 3.7Å; V141-P184 HydrophobicContact CG2-CG 3.99Å; V141-E185 PolarHBondContact N-O 2.74Å; V141-D187 PolarHBondContact O-N 3.14Å; V141-L198 HydrophobicContact CB-CD1 3.96Å; V141-L198 HydrophobicContact CG1-CD1 3.79Å; V141-L198 HydrophobicContact CG2-CD1 3.7Å
142	K	88.7	Confident	91.7	Very high	71 Å²	71	23.5 Å²	23.5	31%	0.309	13%	0.126	S	C	.	.			trans	-125	156.9	170.7	-56.4	-172.8	178	-75.7	0	109.6	T144 T147 D187	K142-T144 VanDerWaalsContact C-N 3.27Å; K142-T144 HydrophobicContact CB-CG2 4.4Å; K142-T144 PolarHBondContact O-N 2.8Å; K142-T147 WeakPolarHBondContact O-CB 3.28Å; K142-T147 PolarHBondContact O-OG1 3.08Å; K142-D187 VanDerWaalsContact CE-OD2 3.31Å; K142-D187 WeakPolarHBondContact CE-OD2 3.35Å; K142-D187 VanDerWaalsContact NZ-CG 3.29Å; K142-D187 PolarHBondContact NZ-O 3.15Å; K142-D187 IonicContact NZ-OD1 2.73Å; K142-D187 IonicContact NZ-OD2 2.92Å; K142-D187 PolarHBondContact NZ-OD2 3.42Å
143	V	87	Confident	91.7	Very high	44 Å²	44	21 Å²	21	27%	0.267	11%	0.114	S	C	.	.			trans	-81.5	70.1	-174.6	-174.8	0	0	0	0	111.6	I148 E188 L191 I300	V143-I148 HydrophobicContact CG1-CD1 4.15Å; V143-I148 HydrophobicContact CG1-CG1 4.33Å; V143-E188 HydrophobicContact CG2-CG 3.77Å; V143-E188 WeakPolarHBondContact CG2-OE2 3.25Å; V143-E188 PolarHBondContact N-OE2 3.24Å; V143-L191 HydrophobicContact CG2-CD1 4.14Å; V143-I300 HydrophobicContact CB-CD1 4.27Å; V143-I300 HydrophobicContact CG1-CD1 3.8Å; V143-I300 HydrophobicContact CG2-CD1 3.42Å; V143-I300 VanDerWaalsContact CG2-CD1 3.42Å
144	T	90.7	Very high	91.5	Very high	35 Å²	35	21.9 Å²	21.9	22%	0.215	12%	0.123	C	C	.	.			trans	-92.2	159.7	173.7	83.4	0	0	0	0	111.2	S104 K142 K146 T147 I148	S104-T144 PolarHBondContact OG-OG1 3.15Å; S104-T144 VanDerWaalsContact OG-OG1 3.11Å; K142-T144 VanDerWaalsContact C-N 3.27Å; K142-T144 HydrophobicContact CB-CG2 4.4Å; K142-T144 PolarHBondContact O-N 2.8Å; T144-K146 PolarHBondContact O-N 3.28Å; T144-K146 VanDerWaalsContact O-N 3.16Å; T144-K146 PolarHBondContact OG1-N 2.79Å; T144-T147 WeakPolarHBondContact O-CA 3.38Å; T144-T147 VanDerWaalsContact O-CB 3.26Å; T144-T147 WeakPolarHBondContact O-CB 3.48Å; T144-T147 PolarHBondContact O-N 2.93Å; T144-T147 PolarHBondContact OG1-N 3.34Å; T144-T147 PolarHBondContact OG1-OG1 3.32Å; T144-I148 WeakPolarHBondContact O-CG1 3.48Å; T144-I148 PolarHBondContact O-N 3.1Å
145	I	91.4	Very high	91.5	Very high	66 Å²	66	24.8 Å²	24.8	34%	0.338	13%	0.133	S	C	.	.	H	α-helix	trans	-56.7	-31.5	175.1	-61.2	143	0	0	0	111.6	S149 R223 L224	I145-S149 VanDerWaalsContact O-CB 3.31Å; I145-S149 WeakPolarHBondContact O-CB 3.41Å; I145-S149 PolarHBondContact O-N 3.01Å; I145-S149 PolarHBondContact O-OG 2.76Å; I145-R223 HydrophobicContact CD1-CG 3.42Å; I145-R223 VanDerWaalsContact CD1-CG 3.42Å; I145-R223 HydrophobicContact CG1-CG 4.35Å; I145-R223 WeakPolarHBondContact CG2-O 3.44Å; I145-L224 HydrophobicContact CG1-CD2 4.15Å
146	K	93.1	Very high	91.4	Very high	56 Å²	56	25 Å²	25	24%	0.243	14%	0.136	C	C	.	.	H	α-helix	trans	-68.4	-43.8	174.7	-65.2	174.1	173.4	177.4	0	111.5	S103 S127 L136 T144 S149 A150	S103-K146 WeakPolarHBondContact O-CD 3.46Å; S103-K146 PolarHBondContact O-NZ 2.68Å; S127-K146 WeakPolarHBondContact O-CE 3.35Å; S127-K146 PolarHBondContact O-NZ 2.82Å; L136-K146 HydrophobicContact CD1-CB 3.9Å; L136-K146 HydrophobicContact CD2-CB 4.47Å; T144-K146 PolarHBondContact O-N 3.28Å; T144-K146 VanDerWaalsContact O-N 3.16Å; T144-K146 PolarHBondContact OG1-N 2.79Å; K146-S149 PolarHBondContact O-N 3.17Å; K146-A150 WeakPolarHBondContact O-CB 3.29Å; K146-A150 PolarHBondContact O-N 3.14Å
147	T	92.1	Very high	91.3	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-56.8	-49.9	171.6	-49.8	0	0	0	0	111.1	M138 V141 K142 T144 S149 A150 L151 I157	M138-T147 WeakPolarHBondContact CE-OG1 3.35Å; V141-T147 HydrophobicContact CG1-CG2 3.76Å; K142-T147 WeakPolarHBondContact O-CB 3.28Å; K142-T147 PolarHBondContact O-OG1 3.08Å; T144-T147 WeakPolarHBondContact O-CA 3.38Å; T144-T147 VanDerWaalsContact O-CB 3.26Å; T144-T147 WeakPolarHBondContact O-CB 3.48Å; T144-T147 PolarHBondContact O-N 2.93Å; T144-T147 PolarHBondContact OG1-N 3.34Å; T144-T147 PolarHBondContact OG1-OG1 3.32Å; T147-S149 PolarHBondContact O-N 2.94Å; T147-A150 PolarHBondContact O-N 3.33Å; T147-L151 HydrophobicContact CG2-CD1 4.17Å; T147-L151 WeakPolarHBondContact O-CB 3.34Å; T147-L151 VanDerWaalsContact O-CG 3.28Å; T147-L151 WeakPolarHBondContact O-CG 3.24Å; T147-L151 PolarHBondContact O-N 3.2Å; T147-I157 HydrophobicContact CG2-CD1 3.93Å
148	I	92.4	Very high	91.3	Very high	9 Å²	9	25.5 Å²	25.5	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-48.2	179.1	-62	168.9	0	0	0	110.5	V143 T144 A150 L151 L152 A227 G296 A299	V143-I148 HydrophobicContact CG1-CD1 4.15Å; V143-I148 HydrophobicContact CG1-CG1 4.33Å; T144-I148 WeakPolarHBondContact O-CG1 3.48Å; T144-I148 PolarHBondContact O-N 3.1Å; I148-A150 PolarHBondContact O-N 3.42Å; I148-L151 PolarHBondContact O-N 3.3Å; I148-L152 HydrophobicContact CG2-CD1 3.77Å; I148-L152 HydrophobicContact CG2-CG 4.46Å; I148-L152 WeakPolarHBondContact O-CB 3.45Å; I148-L152 VanDerWaalsContact O-CG 3.28Å; I148-L152 WeakPolarHBondContact O-CG 3.39Å; I148-L152 PolarHBondContact O-N 3Å; I148-A227 HydrophobicContact CG2-CB 4.2Å; I148-G296 VanDerWaalsContact CD1-CA 3.4Å; I148-A299 HydrophobicContact CG2-CB 3.92Å
149	S	93.2	Very high	91.3	Very high	4 Å²	4	28 Å²	28	3%	0.028	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-40.9	-179.7	-56.2	0	0	0	0	112.4	I145 K146 T147 L152 C153	I145-S149 VanDerWaalsContact O-CB 3.31Å; I145-S149 WeakPolarHBondContact O-CB 3.41Å; I145-S149 PolarHBondContact O-N 3.01Å; I145-S149 PolarHBondContact O-OG 2.76Å; K146-S149 PolarHBondContact O-N 3.17Å; T147-S149 PolarHBondContact O-N 2.94Å; S149-L152 PolarHBondContact O-N 2.88Å; S149-C153 VanDerWaalsContact O-CB 3.32Å; S149-C153 WeakPolarHBondContact O-CB 3.45Å; S149-C153 PolarHBondContact O-N 3.06Å; S149-C153 PolarHBondContact O-SG 3.42Å
150	A	93	Very high	91.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-44.9	175.7	0	0	0	0	0	112.3	W129 L136 K146 T147 I148 G154 R155 I157	W129-A150 HydrophobicContact CE3-CB 4.37Å; W129-A150 HydrophobicContact CH2-CB 3.58Å; W129-A150 HydrophobicContact CZ2-CB 3.97Å; W129-A150 HydrophobicContact CZ3-CB 3.8Å; L136-A150 HydrophobicContact CB-CB 3.88Å; L136-A150 HydrophobicContact CD2-CB 3.93Å; L136-A150 HydrophobicContact CG-CB 4.5Å; K146-A150 WeakPolarHBondContact O-CB 3.29Å; K146-A150 PolarHBondContact O-N 3.14Å; T147-A150 PolarHBondContact O-N 3.33Å; I148-A150 PolarHBondContact O-N 3.42Å; A150-G154 PolarHBondContact O-N 3.14Å; A150-G154 VanDerWaalsContact O-N 3.09Å; A150-R155 PolarHBondContact O-N 3.31Å; A150-I157 HydrophobicContact CB-CG1 4.3Å
151	L	91.6	Very high	91.6	Very high	3 Å²	3	29 Å²	29	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-44.9	176.4	-70.5	172.7	0	0	0	111.8	T147 I148 G154 I157 L198 R204 I300	T147-L151 HydrophobicContact CG2-CD1 4.17Å; T147-L151 WeakPolarHBondContact O-CB 3.34Å; T147-L151 VanDerWaalsContact O-CG 3.28Å; T147-L151 WeakPolarHBondContact O-CG 3.24Å; T147-L151 PolarHBondContact O-N 3.2Å; I148-L151 PolarHBondContact O-N 3.3Å; L151-G154 WeakPolarHBondContact O-CA 3.21Å; L151-G154 PolarHBondContact O-N 3.4Å; L151-I157 HydrophobicContact CD2-CD1 3.99Å; L151-I157 HydrophobicContact CG-CD1 4.09Å; L151-L198 HydrophobicContact CD1-CD2 4.31Å; L151-L198 HydrophobicContact CD2-CD2 4.32Å; L151-R204 VanDerWaalsContact O-CB 3.31Å; L151-R204 WeakPolarHBondContact O-CB 3.32Å; L151-R204 WeakPolarHBondContact O-CD 3.45Å; L151-I300 HydrophobicContact CD1-CG1 3.91Å
152	L	92.3	Very high	91.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.2	-42.1	179	-66.8	172.6	0	0	0	112.2	I148 S149 G154 R204 K205 L207 F208 A227 F230 A299	I148-L152 HydrophobicContact CG2-CD1 3.77Å; I148-L152 HydrophobicContact CG2-CG 4.46Å; I148-L152 WeakPolarHBondContact O-CB 3.45Å; I148-L152 VanDerWaalsContact O-CG 3.28Å; I148-L152 WeakPolarHBondContact O-CG 3.39Å; I148-L152 PolarHBondContact O-N 3Å; S149-L152 PolarHBondContact O-N 2.88Å; L152-G154 PolarHBondContact O-N 3.39Å; L152-G154 VanDerWaalsContact O-N 3.1Å; L152-R204 HydrophobicContact CD2-CB 4.44Å; L152-R204 WeakPolarHBondContact CD2-O 3.4Å; L152-K205 WeakPolarHBondContact O-CA 3.45Å; L152-K205 WeakPolarHBondContact O-CG 3.5Å; L152-K205 PolarHBondContact O-N 2.89Å; L152-L207 HydrophobicContact CD2-CB 4.37Å; L152-L207 HydrophobicContact CD2-CD2 3.93Å; L152-F208 HydrophobicContact CD1-CD2 4.44Å; L152-F208 HydrophobicContact CD1-CE2 3.7Å; L152-F208 HydrophobicContact CD2-CE2 4.03Å; L152-F208 HydrophobicContact CD2-CZ 4.48Å; L152-A227 HydrophobicContact CD1-CB 4.45Å; L152-A227 WeakPolarHBondContact CD1-O 3.24Å; L152-F230 HydrophobicContact CB-CB 4.06Å; L152-A299 HydrophobicContact CD1-CB 4.24Å; L152-A299 HydrophobicContact CD2-CB 3.79Å; L152-A299 HydrophobicContact CG-CB 3.88Å
153	C	90.5	Very high	92.1	Very high	17 Å²	17	25.8 Å²	25.8	12%	0.115	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-7.4	169.2	-67.7	0	0	0	0	113.8	W129 S149 R155 K205 F230	W129-C153 HydrophobicContact CZ2-CB 4.11Å; W129-C153 PolarHBondContact NE1-SG 3.34Å; W129-C153 VanDerWaalsContact NE1-SG 3.4Å; S149-C153 VanDerWaalsContact O-CB 3.32Å; S149-C153 WeakPolarHBondContact O-CB 3.45Å; S149-C153 PolarHBondContact O-N 3.06Å; S149-C153 PolarHBondContact O-SG 3.42Å; C153-R155 VanDerWaalsContact C-N 3.29Å; C153-R155 HydrophobicContact CB-CG 3.87Å; C153-R155 PolarHBondContact O-N 3.27Å; C153-K205 WeakPolarHBondContact O-CE 3.19Å; C153-F230 VanDerWaalsContact SG-CG 3.57Å
154	G	89.5	Confident	92.4	Very high	18 Å²	18	26.1 Å²	26.1	19%	0.186	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	30.1	-177.4	0	0	0	0	0	113.7	A150 L151 L152 T200	A150-G154 PolarHBondContact O-N 3.14Å; A150-G154 VanDerWaalsContact O-N 3.09Å; L151-G154 WeakPolarHBondContact O-CA 3.21Å; L151-G154 PolarHBondContact O-N 3.4Å; L152-G154 PolarHBondContact O-N 3.39Å; L152-G154 VanDerWaalsContact O-N 3.1Å; G154-T200 WeakPolarHBondContact O-CG2 3.21Å
155	R	91.6	Very high	92.5	Very high	73 Å²	73	27.4 Å²	27.4	28%	0.275	14%	0.141	S	C	.	.			trans	-94.2	147.6	-179.7	-62.8	-61.3	-161.2	172	5.3	111.3	W129 P131 C133 A150 C153 T200	W129-R155 HydrophobicContact CH2-CB 3.91Å; W129-R155 HydrophobicContact CH2-CG 4.07Å; W129-R155 HydrophobicContact CZ2-CB 4.13Å; W129-R155 HydrophobicContact CZ2-CG 3.89Å; P131-R155 PolarHBondContact O-NH2 2.98Å; C133-R155 WeakPolarHBondContact O-CD 3.28Å; C133-R155 WeakPolarHBondContact O-CG 3.3Å; C133-R155 PolarHBondContact O-NE 3.44Å; C133-R155 PolarHBondContact O-NH2 2.9Å; A150-R155 PolarHBondContact O-N 3.31Å; C153-R155 VanDerWaalsContact C-N 3.29Å; C153-R155 HydrophobicContact CB-CG 3.87Å; C153-R155 PolarHBondContact O-N 3.27Å; R155-T200 VanDerWaalsContact C-CG2 3.47Å
156	P	91.9	Very high	92.5	Very high	30 Å²	30	24.3 Å²	24.3	20%	0.195	13%	0.125	C	C	.	.			trans	-66.2	144.2	177.7	27.7	-36.8	0	0	0	112.7	T134 H135 L136 P179 T200	T134-P156 WeakPolarHBondContact O-CD 3.31Å; H135-P156 VanDerWaalsContact CD2-CG 3.46Å; H135-P156 WeakPolarHBondContact CD2-CG 3.49Å; L136-P156 PolarHBondContact N-O 3.42Å; P156-P179 HydrophobicContact CB-CB 4.24Å; P156-T200 HydrophobicContact CB-CG2 4.11Å
157	I	92.8	Very high	92.4	Very high	9 Å²	9	22.2 Å²	22.2	5%	0.046	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.7	169.1	-53.4	-179.4	0	0	0	107.1	L136 M138 V141 T147 A150 L151 P184	L136-I157 HydrophobicContact CB-CG1 4.24Å; L136-I157 HydrophobicContact CB-CG2 4.42Å; L136-I157 HydrophobicContact CD2-CD1 4.25Å; L136-I157 HydrophobicContact CD2-CG1 4.18Å; L136-I157 HydrophobicContact CD2-CG2 4.23Å; L136-I157 HydrophobicContact CG-CG2 4.44Å; L136-I157 WeakPolarHBondContact O-CA 3.32Å; M138-I157 HydrophobicContact CG-CG2 3.72Å; M138-I157 HydrophobicContact SD-CG2 3.52Å; M138-I157 VanDerWaalsContact SD-CG2 3.52Å; V141-I157 HydrophobicContact CG2-CG2 4.4Å; T147-I157 HydrophobicContact CG2-CD1 3.93Å; A150-I157 HydrophobicContact CB-CG1 4.3Å; L151-I157 HydrophobicContact CD2-CD1 3.99Å; L151-I157 HydrophobicContact CG-CD1 4.09Å; I157-P184 HydrophobicContact CG2-CG 3.97Å; I157-P184 WeakPolarHBondContact O-CD 3.44Å
158	V	93.7	Very high	92.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.7	-174.8	-64.6	0	0	0	0	112	H135 L136 A137 M138 Y162 F163 P179 F182	H135-V158 HydrophobicContact CB-CG2 4.5Å; L136-V158 PolarHBondContact O-N 3.24Å; A137-V158 WeakPolarHBondContact CA-O 3.41Å; M138-V158 PolarHBondContact N-O 3.43Å; V158-Y162 HydrophobicContact CB-CD1 4.45Å; V158-Y162 HydrophobicContact CB-CG 4.3Å; V158-Y162 HydrophobicContact CG1-CD1 4.5Å; V158-Y162 HydrophobicContact CG1-CG 4.42Å; V158-Y162 HydrophobicContact CG2-CD1 4.01Å; V158-Y162 HydrophobicContact CG2-CG 4.3Å; V158-F163 HydrophobicContact CG2-CE2 3.57Å; V158-F163 HydrophobicContact CG2-CZ 3.88Å; V158-P179 HydrophobicContact CG1-CB 3.96Å; V158-F182 CarbonylContact C-O 3.48Å; V158-F182 VanDerWaalsContact CA-O 3.32Å; V158-F182 WeakPolarHBondContact CA-O 3.45Å; V158-F182 HydrophobicContact CB-CB 4.41Å
159	K	93.8	Very high	92.2	Very high	54 Å²	54	27.6 Å²	27.6	24%	0.235	14%	0.138	C	C	.	.			trans	-68.6	144.3	168.9	-62.6	-173	176.6	-173.7	0	109.6	E161 Y162 F182 P184 E185	K159-E161 VanDerWaalsContact CB-OE2 3.27Å; K159-E161 WeakPolarHBondContact CB-OE2 3.32Å; K159-E161 PolarHBondContact O-N 2.88Å; K159-E161 VanDerWaalsContact O-N 3.07Å; K159-Y162 VanDerWaalsContact O-CB 3.29Å; K159-Y162 WeakPolarHBondContact O-CB 3.25Å; K159-Y162 PolarHBondContact O-N 3.1Å; K159-Y162 VanDerWaalsContact O-N 3.08Å; K159-F182 PolarHBondContact N-O 3.5Å; K159-P184 HydrophobicContact CG-CB 3.81Å; K159-P184 HydrophobicContact CG-CG 3.91Å; K159-E185 IonicContact NZ-OE1 3.86Å; K159-E185 PolarHBondContact NZ-OE1 2.89Å
160	P	92.7	Very high	91.9	Very high	11 Å²	11	29.2 Å²	29.2	7%	0.071	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.7	-174.8	-25.9	34.7	0	0	0	114.7	L106 P139 Y162 F163	L106-P160 HydrophobicContact CD1-CG 3.84Å; L106-P160 HydrophobicContact CD2-CG 4.29Å; P139-P160 HydrophobicContact CG-CG 4.35Å; P160-Y162 PolarHBondContact O-N 2.97Å; P160-Y162 VanDerWaalsContact O-N 3.15Å; P160-F163 PolarHBondContact O-N 3.29Å; P160-F163 VanDerWaalsContact O-N 3.15Å
161	E	93.1	Very high	91.6	Very high	101 Å²	101	36.1 Å²	36.1	47%	0.472	18%	0.18	S	C	.	.	H	α-helix	trans	-59.3	-25.1	-180	-63.2	66.6	-142.5	0	0	112.4	K159 F163 S164 E165	K159-E161 VanDerWaalsContact CB-OE2 3.27Å; K159-E161 WeakPolarHBondContact CB-OE2 3.32Å; K159-E161 PolarHBondContact O-N 2.88Å; K159-E161 VanDerWaalsContact O-N 3.07Å; E161-F163 PolarHBondContact O-N 3.39Å; E161-S164 WeakPolarHBondContact O-CB 3.49Å; E161-S164 PolarHBondContact O-N 2.86Å; E161-S164 VanDerWaalsContact O-N 3.14Å; E161-E165 WeakPolarHBondContact O-CG 3.2Å; E161-E165 PolarHBondContact O-N 3.49Å
162	Y	94.3	Very high	91.4	Very high	10 Å²	10	42 Å²	42	4%	0.039	21%	0.208	C	C	.	.	H	α-helix	trans	-51	-42.4	173.7	174.6	-106.1	0	0	0	112.5	H135 V158 K159 P160 E165 L166 P177 P179 F182	H135-Y162 AromaticContact NE2-CE1 3.96Å; V158-Y162 HydrophobicContact CB-CD1 4.45Å; V158-Y162 HydrophobicContact CB-CG 4.3Å; V158-Y162 HydrophobicContact CG1-CD1 4.5Å; V158-Y162 HydrophobicContact CG1-CG 4.42Å; V158-Y162 HydrophobicContact CG2-CD1 4.01Å; V158-Y162 HydrophobicContact CG2-CG 4.3Å; K159-Y162 VanDerWaalsContact O-CB 3.29Å; K159-Y162 WeakPolarHBondContact O-CB 3.25Å; K159-Y162 PolarHBondContact O-N 3.1Å; K159-Y162 VanDerWaalsContact O-N 3.08Å; P160-Y162 PolarHBondContact O-N 2.97Å; P160-Y162 VanDerWaalsContact O-N 3.15Å; Y162-E165 PolarHBondContact O-N 3.43Å; Y162-L166 HydrophobicContact CE1-CD2 4.08Å; Y162-L166 VanDerWaalsContact O-CB 3.25Å; Y162-L166 WeakPolarHBondContact O-CB 3.28Å; Y162-L166 PolarHBondContact O-N 3.06Å; Y162-P177 HydrophobicContact CD2-CB 4.14Å; Y162-P177 HydrophobicContact CD2-CG 4.14Å; Y162-P177 HydrophobicContact CE2-CB 3.92Å; Y162-P177 HydrophobicContact CE2-CG 3.82Å; Y162-P177 WeakPolarHBondContact CE2-O 3.5Å; Y162-P177 PolarHBondContact OH-O 3.37Å; Y162-P179 HydrophobicContact CE2-CG 4.21Å; Y162-F182 HydrophobicContact CD2-CB 4.16Å; Y162-F182 AromaticContact CD2-CD2 3.68Å; Y162-F182 HydrophobicContact CD2-CD2 3.68Å; Y162-F182 HydrophobicContact CD2-CE2 4.24Å; Y162-F182 AromaticContact CD2-CG 3.93Å; Y162-F182 HydrophobicContact CD2-CG 3.93Å; Y162-F182 HydrophobicContact CG-CB 4.4Å; Y162-F182 HydrophobicContact CG-CG 4.4Å
163	F	93.9	Very high	91	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-77.5	-31.6	-177.8	-61.5	-75.1	0	0	0	112.4	P99 V101 L114 A117 L118 H135 A137 V158 P160 E161 S167	P99-F163 HydrophobicContact CB-CE1 4.09Å; V101-F163 HydrophobicContact CB-CZ 4.47Å; V101-F163 HydrophobicContact CG1-CE2 3.95Å; V101-F163 HydrophobicContact CG1-CZ 4.04Å; V101-F163 HydrophobicContact CG2-CD1 4.44Å; V101-F163 HydrophobicContact CG2-CE1 3.68Å; V101-F163 HydrophobicContact CG2-CE2 4.18Å; V101-F163 HydrophobicContact CG2-CZ 3.53Å; L114-F163 HydrophobicContact CD1-CB 3.91Å; L114-F163 HydrophobicContact CD1-CD2 3.39Å; L114-F163 HydrophobicContact CD1-CE2 4.17Å; L114-F163 HydrophobicContact CD1-CG 3.82Å; A117-F163 HydrophobicContact CB-CB 4.18Å; L118-F163 HydrophobicContact CD2-CB 4.43Å; L118-F163 HydrophobicContact CD2-CD1 3.54Å; L118-F163 HydrophobicContact CD2-CE1 3.98Å; L118-F163 HydrophobicContact CD2-CG 3.99Å; H135-F163 HydrophobicContact CB-CZ 3.78Å; H135-F163 AromaticContact CG-CZ 3.86Å; A137-F163 HydrophobicContact CB-CE2 4.21Å; V158-F163 HydrophobicContact CG2-CE2 3.57Å; V158-F163 HydrophobicContact CG2-CZ 3.88Å; P160-F163 PolarHBondContact O-N 3.29Å; P160-F163 VanDerWaalsContact O-N 3.15Å; E161-F163 PolarHBondContact O-N 3.39Å; F163-S167 VanDerWaalsContact O-CB 3.31Å; F163-S167 WeakPolarHBondContact O-CB 3.27Å; F163-S167 PolarHBondContact O-N 2.8Å
164	S	92.3	Very high	90.8	Very high	52 Å²	52	48.4 Å²	48.4	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-43.3	170.6	-59.1	0	0	0	0	111.2	E161 R168	E161-S164 WeakPolarHBondContact O-CB 3.49Å; E161-S164 PolarHBondContact O-N 2.86Å; E161-S164 VanDerWaalsContact O-N 3.14Å; S164-R168 WeakPolarHBondContact O-CB 3.33Å; S164-R168 PolarHBondContact O-N 3.28Å
165	E	92.6	Very high	90.6	Very high	61 Å²	61	50.2 Å²	50.2	29%	0.285	25%	0.252	S	S	.	.	H	α-helix	trans	-67.1	-39.6	174.8	-73	-62.8	162.8	0	0	112.5	E161 Y162 R168 A169 P177 F182	E161-E165 WeakPolarHBondContact O-CG 3.2Å; E161-E165 PolarHBondContact O-N 3.49Å; Y162-E165 PolarHBondContact O-N 3.43Å; E165-R168 CarbonylContact O-C 3.39Å; E165-R168 PolarHBondContact O-N 2.8Å; E165-R168 IonicContact OE1-CZ 2.72Å; E165-R168 IonicContact OE1-NE 2.64Å; E165-R168 IonicContact OE1-NH1 3.33Å; E165-R168 IonicContact OE1-NH2 2.65Å; E165-R168 PolarHBondContact OE1-NH2 3.11Å; E165-R168 IonicContact OE2-CZ 2.64Å; E165-R168 IonicContact OE2-NE 3.73Å; E165-R168 PolarHBondContact OE2-NE 3.36Å; E165-R168 IonicContact OE2-NH2 2.65Å; E165-R168 PolarHBondContact OE2-NH2 3.09Å; E165-A169 WeakPolarHBondContact O-CB 3.46Å; E165-A169 PolarHBondContact O-N 2.99Å; E165-P177 HydrophobicContact CB-CG 4.19Å; E165-F182 HydrophobicContact CB-CE1 4.47Å; E165-F182 HydrophobicContact CB-CZ 4.14Å; E165-F182 HydrophobicContact CG-CE1 4.01Å; E165-F182 HydrophobicContact CG-CZ 3.91Å
166	L	91.4	Very high	90.3	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-43.1	176.1	-177.8	59.4	0	0	0	111.4	L96 L121 Y162 R168 A169 V170 P176 P177	L96-L166 HydrophobicContact CD1-CD2 4.31Å; L96-L166 HydrophobicContact CD2-CD1 3.94Å; L96-L166 HydrophobicContact CD2-CD2 4.28Å; L96-L166 HydrophobicContact CD2-CG 4.41Å; L121-L166 HydrophobicContact CD1-CB 4.12Å; L121-L166 HydrophobicContact CD1-CD2 3.78Å; L121-L166 HydrophobicContact CD1-CG 3.84Å; L121-L166 HydrophobicContact CD2-CG 4.01Å; Y162-L166 HydrophobicContact CE1-CD2 4.08Å; Y162-L166 VanDerWaalsContact O-CB 3.25Å; Y162-L166 WeakPolarHBondContact O-CB 3.28Å; Y162-L166 PolarHBondContact O-N 3.06Å; L166-R168 VanDerWaalsContact C-N 3.33Å; L166-R168 PolarHBondContact O-N 2.88Å; L166-A169 PolarHBondContact O-N 3.28Å; L166-V170 WeakPolarHBondContact O-CG2 3.35Å; L166-V170 PolarHBondContact O-N 2.81Å; L166-P176 HydrophobicContact CD1-CB 3.96Å; L166-P177 HydrophobicContact CB-CG 3.85Å; L166-P177 HydrophobicContact CD1-CG 4.18Å
167	S	91.1	Very high	90.1	Very high	11 Å²	11	48 Å²	48	8%	0.077	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-40.1	172.7	-176.1	0	0	0	0	111.9	F163 Q171	F163-S167 VanDerWaalsContact O-CB 3.31Å; F163-S167 WeakPolarHBondContact O-CB 3.27Å; F163-S167 PolarHBondContact O-N 2.8Å; S167-Q171 VanDerWaalsContact O-CG 3.28Å; S167-Q171 WeakPolarHBondContact O-CG 3.49Å; S167-Q171 PolarHBondContact O-N 3.42Å; S167-Q171 VanDerWaalsContact O-N 3.16Å; S167-Q171 PolarHBondContact O-NE2 2.72Å; S167-Q171 VanDerWaalsContact O-NE2 3.15Å; S167-Q171 PolarHBondContact OG-NE2 3.08Å; S167-Q171 VanDerWaalsContact OG-NE2 3.15Å
168	R	91.5	Very high	89.8	Confident	119 Å²	119	54.6 Å²	54.6	45%	0.449	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-40.7	173.9	-174.2	167.9	74.5	166.7	6.7	112.2	S164 E165 L166 Q171 Q172	S164-R168 WeakPolarHBondContact O-CB 3.33Å; S164-R168 PolarHBondContact O-N 3.28Å; E165-R168 CarbonylContact O-C 3.39Å; E165-R168 PolarHBondContact O-N 2.8Å; E165-R168 IonicContact OE1-CZ 2.72Å; E165-R168 IonicContact OE1-NE 2.64Å; E165-R168 IonicContact OE1-NH1 3.33Å; E165-R168 IonicContact OE1-NH2 2.65Å; E165-R168 PolarHBondContact OE1-NH2 3.11Å; E165-R168 IonicContact OE2-CZ 2.64Å; E165-R168 IonicContact OE2-NE 3.73Å; E165-R168 PolarHBondContact OE2-NE 3.36Å; E165-R168 IonicContact OE2-NH2 2.65Å; E165-R168 PolarHBondContact OE2-NH2 3.09Å; L166-R168 VanDerWaalsContact C-N 3.33Å; L166-R168 PolarHBondContact O-N 2.88Å; R168-Q171 PolarHBondContact O-N 3.25Å; R168-Q172 HydrophobicContact CG-CG 4.24Å; R168-Q172 WeakPolarHBondContact O-CB 3.32Å; R168-Q172 WeakPolarHBondContact O-CG 3.47Å; R168-Q172 PolarHBondContact O-N 2.92Å
169	A	89.4	Confident	89.4	Confident	4 Å²	4	55.8 Å²	55.8	3%	0.033	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-40.7	179.6	0	0	0	0	0	112.5	E165 L166 Q172 K173 S174	E165-A169 WeakPolarHBondContact O-CB 3.46Å; E165-A169 PolarHBondContact O-N 2.99Å; L166-A169 PolarHBondContact O-N 3.28Å; A169-Q172 PolarHBondContact O-N 3.46Å; A169-K173 WeakPolarHBondContact O-CA 3.31Å; A169-K173 PolarHBondContact O-N 3.5Å; A169-S174 WeakPolarHBondContact CA-OG 3.4Å; A169-S174 PolarHBondContact O-N 3.25Å; A169-S174 VanDerWaalsContact O-N 3.11Å
170	V	87	Confident	89.1	Confident	39 Å²	39	59.3 Å²	59.3	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-59.5	-45.8	171.5	172.5	0	0	0	0	111.1	M1 Y15 L121 L166	M1-V170 HydrophobicContact SD-CG2 4.33Å; Y15-V170 HydrophobicContact CD1-CB 4.42Å; Y15-V170 HydrophobicContact CD1-CG1 4.45Å; Y15-V170 HydrophobicContact CD1-CG2 3.84Å; Y15-V170 HydrophobicContact CE1-CB 4.25Å; Y15-V170 HydrophobicContact CE1-CG2 3.47Å; Y15-V170 VanDerWaalsContact CE1-CG2 3.47Å; L121-V170 HydrophobicContact CD2-CB 4.5Å; L121-V170 HydrophobicContact CD2-CG2 3.75Å; L166-V170 WeakPolarHBondContact O-CG2 3.35Å; L166-V170 PolarHBondContact O-N 2.81Å
171	Q	86.7	Confident	88.8	Confident	145 Å²	145	62.9 Å²	62.9	68%	0.678	33%	0.326	S	S	*	.	H	α-helix	trans	-66.9	-35.8	178.8	-69.9	168.8	53.6	0	0	113.1	S167 R168	S167-Q171 VanDerWaalsContact O-CG 3.28Å; S167-Q171 WeakPolarHBondContact O-CG 3.49Å; S167-Q171 PolarHBondContact O-N 3.42Å; S167-Q171 VanDerWaalsContact O-N 3.16Å; S167-Q171 PolarHBondContact O-NE2 2.72Å; S167-Q171 VanDerWaalsContact O-NE2 3.15Å; S167-Q171 PolarHBondContact OG-NE2 3.08Å; S167-Q171 VanDerWaalsContact OG-NE2 3.15Å; R168-Q171 PolarHBondContact O-N 3.25Å
172	Q	87.8	Confident	88.7	Confident	127 Å²	127	60.2 Å²	60.2	59%	0.593	31%	0.313	S	S	*	.	H	α-helix	trans	-91.1	-3.7	-177.5	-68.5	-178.8	-8.9	0	0	114.1	R168 A169 S174	R168-Q172 HydrophobicContact CG-CG 4.24Å; R168-Q172 WeakPolarHBondContact O-CB 3.32Å; R168-Q172 WeakPolarHBondContact O-CG 3.47Å; R168-Q172 PolarHBondContact O-N 2.92Å; A169-Q172 PolarHBondContact O-N 3.46Å; Q172-S174 PolarHBondContact O-N 3.37Å
173	K	84.4	Confident	88.4	Confident	104 Å²	104	63.2 Å²	63.2	45%	0.452	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	34	-172.4	-56.1	-173.3	-171.8	-177.6	0	114.1	E12 T13 A169	E12-K173 HydrophobicContact CG-CB 4.35Å; E12-K173 HydrophobicContact CG-CD 4.26Å; E12-K173 WeakPolarHBondContact OE1-CD 3.36Å; E12-K173 WeakPolarHBondContact OE1-CE 3.14Å; E12-K173 IonicContact OE1-NZ 3.62Å; E12-K173 PolarHBondContact OE1-NZ 3.05Å; T13-K173 WeakPolarHBondContact CB-O 3.45Å; T13-K173 PolarHBondContact N-O 3.17Å; T13-K173 VanDerWaalsContact N-O 3.13Å; T13-K173 WeakPolarHBondContact O-CB 3.47Å; A169-K173 WeakPolarHBondContact O-CA 3.31Å; A169-K173 PolarHBondContact O-N 3.5Å
174	S	86.3	Confident	88.1	Confident	47 Å²	47	63.5 Å²	63.5	33%	0.329	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-93.2	167.8	174.7	57.2	0	0	0	0	111	Y15 A169 Q172	Y15-S174 VanDerWaalsContact CE2-O 3.29Å; Y15-S174 WeakPolarHBondContact CE2-O 3.27Å; Y15-S174 PolarHBondContact OH-O 2.9Å; A169-S174 WeakPolarHBondContact CA-OG 3.4Å; A169-S174 PolarHBondContact O-N 3.25Å; A169-S174 VanDerWaalsContact O-N 3.11Å; Q172-S174 PolarHBondContact O-N 3.37Å
175	A	84.3	Confident	87.7	Confident	55 Å²	55	67.2 Å²	67.2	46%	0.455	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-59.7	138.3	176.6	0	0	0	0	0	110.7	T5 T13	T5-A175 HydrophobicContact CG2-CB 3.93Å; T13-A175 PolarHBondContact OG1-N 3.48Å
176	P	85.3	Confident	87.3	Confident	32 Å²	32	65.7 Å²	65.7	21%	0.208	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.6	142.6	-178.9	26.8	-35	0	0	0	111.2	I3 L166	I3-P176 HydrophobicContact CD1-CB 4.28Å; I3-P176 HydrophobicContact CD1-CG 4.02Å; L166-P176 HydrophobicContact CD1-CB 3.96Å
177	P	88.5	Confident	86.7	Confident	24 Å²	24	69.1 Å²	69.1	16%	0.156	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-60.8	147.5	173.1	25.7	-35	0	0	0	111.4	Y162 E165 L166 F182	Y162-P177 HydrophobicContact CD2-CB 4.14Å; Y162-P177 HydrophobicContact CD2-CG 4.14Å; Y162-P177 HydrophobicContact CE2-CB 3.92Å; Y162-P177 HydrophobicContact CE2-CG 3.82Å; Y162-P177 WeakPolarHBondContact CE2-O 3.5Å; Y162-P177 PolarHBondContact OH-O 3.37Å; E165-P177 HydrophobicContact CB-CG 4.19Å; L166-P177 HydrophobicContact CB-CG 3.85Å; L166-P177 HydrophobicContact CD1-CG 4.18Å; P177-F182 HydrophobicContact CB-CD2 4.41Å; P177-F182 HydrophobicContact CB-CE2 3.67Å; P177-F182 HydrophobicContact CB-CZ 4.29Å
178	K	85.5	Confident	86	Confident	148 Å²	148	70.3 Å²	70.3	64%	0.643	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-87.9	129.6	176.5	-72.3	-169.7	177.4	-173.2	0	110.4	E180 S181 F182	K178-E180 WeakPolarHBondContact CB-OE2 3.43Å; K178-E180 PolarHBondContact O-N 3.26Å; K178-E180 VanDerWaalsContact O-N 3.12Å; K178-S181 PolarHBondContact O-N 3.19Å; K178-S181 VanDerWaalsContact O-N 3.14Å; K178-S181 PolarHBondContact O-OG 3Å; K178-F182 WeakPolarHBondContact O-CD2 3.16Å
179	P	85.9	Confident	85.1	Confident	26 Å²	26	71 Å²	71	17%	0.169	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-52.8	-34.4	176.4	-26.8	34.9	0	0	0	113.1	P156 V158 Y162 S181 F182	P156-P179 HydrophobicContact CB-CB 4.24Å; V158-P179 HydrophobicContact CG1-CB 3.96Å; Y162-P179 HydrophobicContact CE2-CG 4.21Å; P179-S181 VanDerWaalsContact C-N 3.26Å; P179-S181 PolarHBondContact O-N 3.09Å; P179-F182 PolarHBondContact O-N 3.01Å
180	E	86.2	Confident	84.1	Confident	127 Å²	127	74.1 Å²	74.1	59%	0.593	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-66.7	-23.2	-176.1	-57	71.1	-148.2	0	0	113.3	K178 F182	K178-E180 WeakPolarHBondContact CB-OE2 3.43Å; K178-E180 PolarHBondContact O-N 3.26Å; K178-E180 VanDerWaalsContact O-N 3.12Å; E180-F182 VanDerWaalsContact C-N 3.32Å
181	S	87.4	Confident	83.5	Confident	86 Å²	86	73 Å²	73	60%	0.601	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-86.9	-0.4	174.6	64.7	0	0	0	0	113.7	K178 P179	K178-S181 PolarHBondContact O-N 3.19Å; K178-S181 VanDerWaalsContact O-N 3.14Å; K178-S181 PolarHBondContact O-OG 3Å; P179-S181 VanDerWaalsContact C-N 3.26Å; P179-S181 PolarHBondContact O-N 3.09Å
182	F	90.1	Very high	82.6	Confident	46 Å²	46	74.1 Å²	74.1	20%	0.202	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-122	21.5	-180	-68.8	-97.2	0	0	0	112.5	V158 K159 Y162 E165 P177 K178 P179 E180	V158-F182 CarbonylContact C-O 3.48Å; V158-F182 VanDerWaalsContact CA-O 3.32Å; V158-F182 WeakPolarHBondContact CA-O 3.45Å; V158-F182 HydrophobicContact CB-CB 4.41Å; K159-F182 PolarHBondContact N-O 3.5Å; Y162-F182 HydrophobicContact CD2-CB 4.16Å; Y162-F182 AromaticContact CD2-CD2 3.68Å; Y162-F182 HydrophobicContact CD2-CD2 3.68Å; Y162-F182 HydrophobicContact CD2-CE2 4.24Å; Y162-F182 AromaticContact CD2-CG 3.93Å; Y162-F182 HydrophobicContact CD2-CG 3.93Å; Y162-F182 HydrophobicContact CG-CB 4.4Å; Y162-F182 HydrophobicContact CG-CG 4.4Å; E165-F182 HydrophobicContact CB-CE1 4.47Å; E165-F182 HydrophobicContact CB-CZ 4.14Å; E165-F182 HydrophobicContact CG-CE1 4.01Å; E165-F182 HydrophobicContact CG-CZ 3.91Å; P177-F182 HydrophobicContact CB-CD2 4.41Å; P177-F182 HydrophobicContact CB-CE2 3.67Å; P177-F182 HydrophobicContact CB-CZ 4.29Å; K178-F182 WeakPolarHBondContact O-CD2 3.16Å; P179-F182 PolarHBondContact O-N 3.01Å; E180-F182 VanDerWaalsContact C-N 3.32Å
183	V	88.1	Confident	81.4	Confident	72 Å²	72	74.1 Å²	74.1	44%	0.436	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-61.8	131.8	174.4	179.1	0	0	0	0	110
184	P	87.2	Confident	80.2	Confident	6 Å²	6	76.6 Å²	76.6	4%	0.039	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-74.1	155	178.7	-9.8	25	0	0	0	112.9	M138 V141 I157 K159	M138-P184 HydrophobicContact CG-CG 3.99Å; M138-P184 WeakPolarHBondContact O-CG 3.27Å; V141-P184 HydrophobicContact CG2-CB 3.7Å; V141-P184 HydrophobicContact CG2-CG 3.99Å; I157-P184 HydrophobicContact CG2-CG 3.97Å; I157-P184 WeakPolarHBondContact O-CD 3.44Å; K159-P184 HydrophobicContact CG-CB 3.81Å; K159-P184 HydrophobicContact CG-CG 3.91Å
185	E	85.3	Confident	79	Confident	131 Å²	131	79.6 Å²	79.6	61%	0.612	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	146.2	176.3	-73.2	149.8	-106.9	0	0	111.2	T140 V141 K159 D187	T140-E185 CarbonylContact C-O 3.5Å; T140-E185 WeakPolarHBondContact CA-O 3.46Å; T140-E185 WeakPolarHBondContact CB-O 3.48Å; V141-E185 PolarHBondContact N-O 2.74Å; K159-E185 IonicContact NZ-OE1 3.86Å; K159-E185 PolarHBondContact NZ-OE1 2.89Å; E185-D187 PolarHBondContact O-N 3.05Å
186	I	84.2	Confident	78.3	Confident	28 Å²	28	77.8 Å²	77.8	14%	0.144	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	115.1	-179.1	-59.2	167	0	0	0	109.4	E188 L191 K193 V196 L198	I186-E188 HydrophobicContact CG2-CB 3.96Å; I186-L191 HydrophobicContact CG2-CD1 4.09Å; I186-K193 PolarHBondContact O-NZ 3.03Å; I186-V196 HydrophobicContact CD1-CB 4.04Å; I186-V196 HydrophobicContact CD1-CG1 3.88Å; I186-L198 HydrophobicContact CD1-CD1 3.94Å; I186-L198 HydrophobicContact CD1-CG 4.22Å; I186-L198 HydrophobicContact CG1-CD1 3.7Å
187	D	79.4	Confident	77.6	Confident	75 Å²	75	84.1 Å²	84.1	40%	0.401	43%	0.425	S	S	.	.			trans	-121	58.7	-177.4	-178.2	34.4	0	0	0	110	T140 V141 K142 E185	T140-D187 HydrophobicContact CG2-CB 4.08Å; T140-D187 PolarHBondContact OG1-OD2 3.37Å; V141-D187 PolarHBondContact O-N 3.14Å; K142-D187 VanDerWaalsContact CE-OD2 3.31Å; K142-D187 WeakPolarHBondContact CE-OD2 3.35Å; K142-D187 VanDerWaalsContact NZ-CG 3.29Å; K142-D187 PolarHBondContact NZ-O 3.15Å; K142-D187 IonicContact NZ-OD1 2.73Å; K142-D187 IonicContact NZ-OD2 2.92Å; K142-D187 PolarHBondContact NZ-OD2 3.42Å; E185-D187 PolarHBondContact O-N 3.05Å
188	E	75.4	Confident	76.9	Confident	35 Å²	35	84.1 Å²	84.1	16%	0.164	42%	0.424	C	S	.	.			trans	-136.4	113.1	-169.8	178.3	62.1	-118.6	0	0	109.3	V143 I186 S190 L191	V143-E188 HydrophobicContact CG2-CG 3.77Å; V143-E188 WeakPolarHBondContact CG2-OE2 3.25Å; V143-E188 PolarHBondContact N-OE2 3.24Å; I186-E188 HydrophobicContact CG2-CB 3.96Å; E188-S190 VanDerWaalsContact CG-OG 3.27Å; E188-S190 WeakPolarHBondContact CG-OG 3.4Å; E188-S190 PolarHBondContact O-N 2.79Å; E188-S190 PolarHBondContact OE1-N 3.48Å; E188-S190 PolarHBondContact OE1-OG 3.42Å; E188-L191 HydrophobicContact CB-CB 4.45Å; E188-L191 HydrophobicContact CB-CD1 4.05Å; E188-L191 HydrophobicContact CB-CG 4.3Å; E188-L191 HydrophobicContact CG-CB 4.18Å; E188-L191 HydrophobicContact CG-CD1 3.73Å; E188-L191 HydrophobicContact CG-CG 3.66Å; E188-L191 PolarHBondContact O-N 3.47Å
189	P	71.8	Confident	76.4	Confident	133 Å²	133	80.3 Å²	80.3	86%	0.864	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-16.9	-178.3	29.7	-35.7	0	0	0	113.4	L191	P189-L191 VanDerWaalsContact C-N 3.29Å; P189-L191 PolarHBondContact O-N 3.37Å
190	S	68.6	Low	76	Confident	71 Å²	71	82.8 Å²	82.8	50%	0.497	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-3.1	177.2	65.1	0	0	0	0	114.4	E188	E188-S190 VanDerWaalsContact CG-OG 3.27Å; E188-S190 WeakPolarHBondContact CG-OG 3.4Å; E188-S190 PolarHBondContact O-N 2.79Å; E188-S190 PolarHBondContact OE1-N 3.48Å; E188-S190 PolarHBondContact OE1-OG 3.42Å
191	L	74.1	Confident	75.7	Confident	16 Å²	16	79.1 Å²	79.1	8%	0.084	42%	0.421	C	S	.	.	S	Bend	trans	-118.1	137.4	-177.8	-64.9	177.3	0	0	0	112.4	V143 I186 E188 P189 V196 L297 I300 Y301	V143-L191 HydrophobicContact CG2-CD1 4.14Å; I186-L191 HydrophobicContact CG2-CD1 4.09Å; E188-L191 HydrophobicContact CB-CB 4.45Å; E188-L191 HydrophobicContact CB-CD1 4.05Å; E188-L191 HydrophobicContact CB-CG 4.3Å; E188-L191 HydrophobicContact CG-CB 4.18Å; E188-L191 HydrophobicContact CG-CD1 3.73Å; E188-L191 HydrophobicContact CG-CG 3.66Å; E188-L191 PolarHBondContact O-N 3.47Å; P189-L191 VanDerWaalsContact C-N 3.29Å; P189-L191 PolarHBondContact O-N 3.37Å; L191-V196 HydrophobicContact CB-CG2 4.38Å; L191-V196 HydrophobicContact CD1-CG2 4.46Å; L191-V196 HydrophobicContact CD2-CG2 4.26Å; L191-L297 HydrophobicContact CD2-CD2 3.76Å; L191-I300 HydrophobicContact CD1-CD1 4.26Å; L191-I300 HydrophobicContact CD1-CG2 4.21Å; L191-I300 HydrophobicContact CD2-CD1 4.33Å; L191-I300 HydrophobicContact CD2-CG2 4.11Å; L191-Y301 HydrophobicContact CD2-CE2 4.15Å
192	R	68.4	Low	75.4	Confident	168 Å²	168	79.7 Å²	79.7	63%	0.634	43%	0.425	S	S	*	.			trans	-78.4	128.4	163.9	-63.1	-174.1	-174.8	-175.4	2.3	108.1	E194 V196	R192-E194 PolarHBondContact O-N 2.81Å; R192-V196 WeakPolarHBondContact O-CG2 3.39Å
193	K	62.5	Low	75.2	Confident	127 Å²	127	80.4 Å²	80.4	55%	0.552	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-13.7	-168.5	-56.3	-161	-177.6	-153.9	0	112.7	I186	I186-K193 PolarHBondContact O-NZ 3.03Å
194	E	59.2	Low	75.2	Confident	156 Å²	156	77.1 Å²	77.1	73%	0.729	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-28	-169.4	-56.6	68.3	-144.3	0	0	112.8	R192	R192-E194 PolarHBondContact O-N 2.81Å
195	D	60.7	Low	75.3	Confident	109 Å²	109	82.1 Å²	82.1	58%	0.583	44%	0.44	S	S	*	.	S	Bend	trans	-98.6	-11.6	-173.5	-73.3	-45	0	0	0	114.1	Y301	D195-Y301 HydrophobicContact CB-CE1 4.05Å
196	V	70.2	Confident	75.6	Confident	17 Å²	17	82.9 Å²	82.9	10%	0.103	44%	0.444	C	S	.	.			trans	-95.1	106.6	-163.2	176.6	0	0	0	0	113.3	I186 L191 R192 L198 I300 Y301	I186-V196 HydrophobicContact CD1-CB 4.04Å; I186-V196 HydrophobicContact CD1-CG1 3.88Å; L191-V196 HydrophobicContact CB-CG2 4.38Å; L191-V196 HydrophobicContact CD1-CG2 4.46Å; L191-V196 HydrophobicContact CD2-CG2 4.26Å; R192-V196 WeakPolarHBondContact O-CG2 3.39Å; V196-L198 HydrophobicContact CG1-CD2 3.61Å; V196-L198 HydrophobicContact CG1-CG 3.89Å; V196-L198 PolarHBondContact O-N 3.38Å; V196-I300 HydrophobicContact CB-CG2 4.45Å; V196-I300 HydrophobicContact CG1-CG2 3.48Å; V196-I300 VanDerWaalsContact CG1-CG2 3.48Å; V196-I300 HydrophobicContact CG2-CG2 4.1Å; V196-Y301 HydrophobicContact CG2-CD1 4.47Å; V196-Y301 HydrophobicContact CG2-CE1 3.76Å
197	K	71.4	Confident	75.9	Confident	166 Å²	166	82.7 Å²	82.7	72%	0.722	44%	0.442	S	S	*	.			trans	-92.2	86.5	176.9	-65.3	178.2	-178.2	174.3	0	112.2	A199 R204	K197-A199 PolarHBondContact O-N 3.07Å; K197-R204 PolarHBondContact O-NH2 3.12Å
198	L	74.3	Confident	76.6	Confident	24 Å²	24	79.1 Å²	79.1	13%	0.126	42%	0.423	C	S	.	.			trans	-71.6	-1.9	177.1	-61.6	-175.3	0	0	0	115.3	V141 L151 I186 V196 I300	V141-L198 HydrophobicContact CB-CD1 3.96Å; V141-L198 HydrophobicContact CG1-CD1 3.79Å; V141-L198 HydrophobicContact CG2-CD1 3.7Å; L151-L198 HydrophobicContact CD1-CD2 4.31Å; L151-L198 HydrophobicContact CD2-CD2 4.32Å; I186-L198 HydrophobicContact CD1-CD1 3.94Å; I186-L198 HydrophobicContact CD1-CG 4.22Å; I186-L198 HydrophobicContact CG1-CD1 3.7Å; V196-L198 HydrophobicContact CG1-CD2 3.61Å; V196-L198 HydrophobicContact CG1-CG 3.89Å; V196-L198 PolarHBondContact O-N 3.38Å; L198-I300 HydrophobicContact CD2-CG2 4.46Å
199	A	73.1	Confident	77.4	Confident	68 Å²	68	81.5 Å²	81.5	56%	0.562	44%	0.44	S	S	*	.	S	Bend	trans	-55.5	152.4	175.6	0	0	0	0	0	112.6	K197 T201 R204	K197-A199 PolarHBondContact O-N 3.07Å; A199-T201 PolarHBondContact O-N 3.15Å; A199-T201 VanDerWaalsContact O-N 3.09Å; A199-T201 PolarHBondContact O-OG1 2.86Å; A199-R204 PolarHBondContact O-NH1 3.05Å
200	T	77.8	Confident	78.2	Confident	78 Å²	78	77.9 Å²	77.9	48%	0.479	43%	0.427	S	S	.	.			trans	-65.9	103.7	-179.9	36.2	0	0	0	0	111.6	G154 R155 P156	G154-T200 WeakPolarHBondContact O-CG2 3.21Å; R155-T200 VanDerWaalsContact C-CG2 3.47Å; P156-T200 HydrophobicContact CB-CG2 4.11Å
201	T	80	Confident	79.3	Confident	50 Å²	50	76.1 Å²	76.1	31%	0.307	41%	0.411	S	S	.	.			trans	-114.5	114.2	-175.4	-56.6	0	0	0	0	110.1	A199 A203 R204	A199-T201 PolarHBondContact O-N 3.15Å; A199-T201 VanDerWaalsContact O-N 3.09Å; A199-T201 PolarHBondContact O-OG1 2.86Å; T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 HydrophobicContact CG2-CB 4.14Å; T201-A203 PolarHBondContact O-N 2.83Å; T201-R204 WeakPolarHBondContact O-CB 3.28Å; T201-R204 PolarHBondContact O-N 3.37Å; T201-R204 VanDerWaalsContact O-N 3.17Å
202	S	81.3	Confident	80.2	Confident	97 Å²	97	76.5 Å²	76.5	68%	0.678	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-58	-35.6	-177.1	51.1	0	0	0	0	113.8	R204 K205	S202-R204 PolarHBondContact O-N 2.86Å; S202-R204 VanDerWaalsContact O-N 3.09Å; S202-K205 WeakPolarHBondContact O-CB 3.19Å; S202-K205 PolarHBondContact O-N 2.99Å; S202-K205 VanDerWaalsContact O-N 3.08Å
203	A	85.3	Confident	81.5	Confident	61 Å²	61	68.5 Å²	68.5	50%	0.504	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-56.4	-25.1	178.5	0	0	0	0	0	114	T201 K205 Q206 L207	T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 HydrophobicContact CG2-CB 4.14Å; T201-A203 PolarHBondContact O-N 2.83Å; A203-K205 PolarHBondContact O-N 3.08Å; A203-Q206 PolarHBondContact O-N 3.43Å; A203-L207 PolarHBondContact O-N 2.98Å
204	R	88.7	Confident	83	Confident	3 Å²	3	62.5 Å²	62.5	1%	0.011	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-61.2	-26.5	176.9	-71.1	-171.8	174.3	108.8	2	113.5	L151 L152 K197 A199 T201 S202 Q206 L207 A299 I300 A302	L151-R204 VanDerWaalsContact O-CB 3.31Å; L151-R204 WeakPolarHBondContact O-CB 3.32Å; L151-R204 WeakPolarHBondContact O-CD 3.45Å; L152-R204 HydrophobicContact CD2-CB 4.44Å; L152-R204 WeakPolarHBondContact CD2-O 3.4Å; K197-R204 PolarHBondContact O-NH2 3.12Å; A199-R204 PolarHBondContact O-NH1 3.05Å; T201-R204 WeakPolarHBondContact O-CB 3.28Å; T201-R204 PolarHBondContact O-N 3.37Å; T201-R204 VanDerWaalsContact O-N 3.17Å; S202-R204 PolarHBondContact O-N 2.86Å; S202-R204 VanDerWaalsContact O-N 3.09Å; R204-Q206 PolarHBondContact O-N 3.04Å; R204-L207 WeakPolarHBondContact O-CB 3.46Å; R204-L207 PolarHBondContact O-N 2.85Å; R204-A299 WeakPolarHBondContact CD-O 3.12Å; R204-A299 PolarHBondContact NE-O 3.38Å; R204-I300 PolarHBondContact NH2-O 2.99Å; R204-A302 HydrophobicContact CG-CB 3.82Å
205	K	89.9	Confident	84.6	Confident	112 Å²	112	55 Å²	55	49%	0.487	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-65.5	-14.9	175.8	-65.9	178.3	173.2	-175.5	0	113.9	L152 C153 S202 A203 G231 G232	L152-K205 WeakPolarHBondContact O-CA 3.45Å; L152-K205 WeakPolarHBondContact O-CG 3.5Å; L152-K205 PolarHBondContact O-N 2.89Å; C153-K205 WeakPolarHBondContact O-CE 3.19Å; S202-K205 WeakPolarHBondContact O-CB 3.19Å; S202-K205 PolarHBondContact O-N 2.99Å; S202-K205 VanDerWaalsContact O-N 3.08Å; A203-K205 PolarHBondContact O-N 3.08Å; K205-G231 CarbonylContact C-O 3.59Å; K205-G231 CarbonylContact O-C 3.5Å; K205-G232 PolarHBondContact O-N 2.92Å
206	Q	92.1	Very high	86	Confident	147 Å²	147	50.2 Å²	50.2	69%	0.687	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-125.6	11.3	-178.8	-68.9	178	-25	0	0	112.2	A203 R204 F208 T209 G231	A203-Q206 PolarHBondContact O-N 3.43Å; R204-Q206 PolarHBondContact O-N 3.04Å; Q206-F208 PolarHBondContact O-N 3.26Å; Q206-F208 VanDerWaalsContact O-N 3.14Å; Q206-T209 VanDerWaalsContact CA-OG1 3.29Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.31Å; Q206-T209 WeakPolarHBondContact CB-OG1 3.19Å; Q206-T209 WeakPolarHBondContact O-CB 3.17Å; Q206-T209 PolarHBondContact O-N 3.17Å; Q206-T209 VanDerWaalsContact O-N 3.08Å; Q206-T209 PolarHBondContact O-OG1 3.02Å; Q206-G231 CarbonylContact C-O 3.48Å; Q206-G231 VanDerWaalsContact C-O 3.3Å; Q206-G231 WeakPolarHBondContact CA-O 3.28Å
207	L	90.9	Very high	86.9	Confident	23 Å²	23	50.8 Å²	50.8	12%	0.12	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-31	-177.4	179.1	64.5	0	0	0	113.4	L152 A203 R204 G231 A298 C304	L152-L207 HydrophobicContact CD2-CB 4.37Å; L152-L207 HydrophobicContact CD2-CD2 3.93Å; A203-L207 PolarHBondContact O-N 2.98Å; R204-L207 WeakPolarHBondContact O-CB 3.46Å; R204-L207 PolarHBondContact O-N 2.85Å; L207-G231 PolarHBondContact N-O 3.44Å; L207-A298 HydrophobicContact CD2-CB 4.22Å; L207-A298 VanDerWaalsContact CD2-O 3.3Å; L207-A298 WeakPolarHBondContact CD2-O 3.49Å; L207-C304 HydrophobicContact CD1-CB 3.9Å; L207-C304 HydrophobicContact CG-CB 4.49Å; L207-C304 PolarHBondContact O-SG 3.33Å; L207-C304 VanDerWaalsContact O-SG 3.4Å
208	F	92.8	Very high	87.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	8.6	-178.5	-57.8	-39.1	0	0	0	112.7	L152 Q206 G210 K211 F213 G231 G233 I295 A298 C308	L152-F208 HydrophobicContact CD1-CD2 4.44Å; L152-F208 HydrophobicContact CD1-CE2 3.7Å; L152-F208 HydrophobicContact CD2-CE2 4.03Å; L152-F208 HydrophobicContact CD2-CZ 4.48Å; Q206-F208 PolarHBondContact O-N 3.26Å; Q206-F208 VanDerWaalsContact O-N 3.14Å; F208-G210 PolarHBondContact O-N 3.36Å; F208-K211 WeakPolarHBondContact O-CB 3.45Å; F208-K211 PolarHBondContact O-N 3.2Å; F208-F213 HydrophobicContact CB-CE2 3.95Å; F208-F213 AromaticContact CD1-CE2 3.8Å; F208-F213 HydrophobicContact CD1-CE2 3.8Å; F208-F213 AromaticContact CD1-CZ 3.63Å; F208-F213 HydrophobicContact CD1-CZ 3.63Å; F208-F213 HydrophobicContact CD2-CE2 4.31Å; F208-F213 HydrophobicContact CD2-CZ 4.5Å; F208-F213 HydrophobicContact CE1-CE2 4.37Å; F208-F213 AromaticContact CE1-CZ 3.78Å; F208-F213 HydrophobicContact CE1-CZ 3.78Å; F208-F213 AromaticContact CG-CE2 3.77Å; F208-F213 HydrophobicContact CG-CE2 3.77Å; F208-F213 HydrophobicContact CG-CZ 4.03Å; F208-F213 HydrophobicContact CZ-CZ 4.29Å; F208-G231 PolarHBondContact N-O 2.97Å; F208-G233 VanDerWaalsContact O-CA 3.24Å; F208-G233 WeakPolarHBondContact O-CA 3.31Å; F208-I295 HydrophobicContact CE2-CG2 4.09Å; F208-I295 HydrophobicContact CZ-CG2 3.87Å; F208-A298 HydrophobicContact CE1-CB 4.03Å; F208-A298 HydrophobicContact CZ-CB 4.33Å; F208-C308 HydrophobicContact CE1-CB 4.44Å
209	T	92.2	Very high	88.4	Confident	85 Å²	85	51.9 Å²	51.9	52%	0.521	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	130.1	178.2	-64.9	0	0	0	0	111.2	Q206 K211 G232	Q206-T209 VanDerWaalsContact CA-OG1 3.29Å; Q206-T209 WeakPolarHBondContact CA-OG1 3.31Å; Q206-T209 WeakPolarHBondContact CB-OG1 3.19Å; Q206-T209 WeakPolarHBondContact O-CB 3.17Å; Q206-T209 PolarHBondContact O-N 3.17Å; Q206-T209 VanDerWaalsContact O-N 3.08Å; Q206-T209 PolarHBondContact O-OG1 3.02Å; T209-K211 PolarHBondContact O-N 3Å; T209-G232 WeakPolarHBondContact CA-O 3.31Å
210	G	89.2	Confident	89.3	Confident	57 Å²	57	49 Å²	49	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	-3.2	-175.9	0	0	0	0	0	115.4	F208 H252	F208-G210 PolarHBondContact O-N 3.36Å; G210-H252 WeakPolarHBondContact O-CB 3.4Å
211	K	91.6	Very high	89.9	Confident	35 Å²	35	47.4 Å²	47.4	15%	0.152	28%	0.275	C	S	.	.			trans	-97.5	143.7	174.2	-64.3	-173.1	174.8	-174	0	111.8	F208 T209 F213 S234 H252 C304 C308	F208-K211 WeakPolarHBondContact O-CB 3.45Å; F208-K211 PolarHBondContact O-N 3.2Å; T209-K211 PolarHBondContact O-N 3Å; K211-F213 HydrophobicContact CB-CE2 4.07Å; K211-S234 PolarHBondContact O-N 3.47Å; K211-H252 WeakPolarHBondContact CA-O 3.28Å; K211-C304 PolarHBondContact NZ-O 3.02Å; K211-C304 PolarHBondContact NZ-SG 2.89Å; K211-C308 PolarHBondContact NZ-O 2.85Å
212	T	93.9	Very high	90.4	Very high	24 Å²	24	52.3 Å²	52.3	15%	0.147	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118	173	-61.1	0	0	0	0	110.2	V214 S234 R236 L247 H252 S253 C254	T212-V214 HydrophobicContact CG2-CG2 4.33Å; T212-S234 CarbonylContact C-O 3.54Å; T212-S234 WeakPolarHBondContact CA-O 3.4Å; T212-R236 HydrophobicContact CG2-CG 4.06Å; T212-L247 HydrophobicContact CG2-CD1 4.27Å; T212-H252 PolarHBondContact N-O 3.26Å; T212-S253 CarbonylContact O-C 3.32Å; T212-S253 WeakPolarHBondContact O-CA 3.5Å; T212-C254 PolarHBondContact O-N 3.21Å
213	F	94.4	Very high	90.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.7	175.1	-70.6	-103.6	0	0	0	109.4	F208 K211 F215 V228 S234 S235 R236 C254 V256 I290 I295 C308	F208-F213 HydrophobicContact CB-CE2 3.95Å; F208-F213 AromaticContact CD1-CE2 3.8Å; F208-F213 HydrophobicContact CD1-CE2 3.8Å; F208-F213 AromaticContact CD1-CZ 3.63Å; F208-F213 HydrophobicContact CD1-CZ 3.63Å; F208-F213 HydrophobicContact CD2-CE2 4.31Å; F208-F213 HydrophobicContact CD2-CZ 4.5Å; F208-F213 HydrophobicContact CE1-CE2 4.37Å; F208-F213 AromaticContact CE1-CZ 3.78Å; F208-F213 HydrophobicContact CE1-CZ 3.78Å; F208-F213 AromaticContact CG-CE2 3.77Å; F208-F213 HydrophobicContact CG-CE2 3.77Å; F208-F213 HydrophobicContact CG-CZ 4.03Å; F208-F213 HydrophobicContact CZ-CZ 4.29Å; K211-F213 HydrophobicContact CB-CE2 4.07Å; F213-F215 HydrophobicContact CB-CE2 3.9Å; F213-F215 HydrophobicContact CB-CZ 4.2Å; F213-V228 HydrophobicContact CB-CG1 4.12Å; F213-V228 HydrophobicContact CB-CG2 4.21Å; F213-V228 HydrophobicContact CD1-CG2 4.18Å; F213-V228 HydrophobicContact CD2-CB 4.42Å; F213-V228 HydrophobicContact CD2-CG1 3.41Å; F213-V228 VanDerWaalsContact CD2-CG1 3.41Å; F213-V228 HydrophobicContact CD2-CG2 4.07Å; F213-V228 HydrophobicContact CE2-CG1 4.07Å; F213-V228 HydrophobicContact CG-CG1 3.91Å; F213-V228 HydrophobicContact CG-CG2 3.87Å; F213-S234 PolarHBondContact N-O 3.41Å; F213-S235 WeakPolarHBondContact O-CA 3.32Å; F213-R236 PolarHBondContact O-N 3.01Å; F213-C254 WeakPolarHBondContact CA-O 3.45Å; F213-C254 HydrophobicContact CD1-CB 3.83Å; F213-C254 HydrophobicContact CE1-CB 3.92Å; F213-C254 HydrophobicContact CG-CB 4.18Å; F213-C254 HydrophobicContact CZ-CB 4.34Å; F213-V256 HydrophobicContact CD1-CG2 4.19Å; F213-I290 HydrophobicContact CD1-CD1 3.83Å; F213-I290 HydrophobicContact CE1-CD1 3.54Å; F213-I295 HydrophobicContact CD1-CD1 3.77Å; F213-I295 HydrophobicContact CD1-CG1 4.28Å; F213-I295 HydrophobicContact CE1-CD1 3.94Å; F213-I295 HydrophobicContact CE1-CG1 3.93Å; F213-C308 HydrophobicContact CE1-CB 4.13Å; F213-C308 HydrophobicContact CZ-CB 4.01Å
214	V	93.6	Very high	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	110.4	-179.7	-177.7	0	0	0	0	108	T212 L238 L247 C254 V255 V256	T212-V214 HydrophobicContact CG2-CG2 4.33Å; V214-L238 HydrophobicContact CG1-CB 4.03Å; V214-L238 HydrophobicContact CG1-CD1 4.24Å; V214-L238 HydrophobicContact CG1-CD2 4.37Å; V214-L238 HydrophobicContact CG1-CG 4.46Å; V214-L247 HydrophobicContact CG2-CD1 4.36Å; V214-L247 HydrophobicContact CG2-CD2 4.02Å; V214-L247 HydrophobicContact CG2-CG 4.06Å; V214-C254 PolarHBondContact N-O 2.65Å; V214-V255 HydrophobicContact CB-CG2 4.38Å; V214-V256 PolarHBondContact O-N 3.46Å
215	F	93.3	Very high	91.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.8	178.8	-65.2	-80.7	0	0	0	110.3	F213 Q220 L221 L224 V228 R236 L238 V256 I295	F213-F215 HydrophobicContact CB-CE2 3.9Å; F213-F215 HydrophobicContact CB-CZ 4.2Å; F215-Q220 HydrophobicContact CB-CB 4.35Å; F215-Q220 HydrophobicContact CD1-CB 3.63Å; F215-Q220 HydrophobicContact CE1-CB 4.36Å; F215-Q220 HydrophobicContact CG-CB 4.34Å; F215-L221 HydrophobicContact CB-CB 4.22Å; F215-L221 HydrophobicContact CD2-CB 4.25Å; F215-L221 HydrophobicContact CD2-CD1 3.72Å; F215-L221 HydrophobicContact CE2-CD1 4.03Å; F215-L221 HydrophobicContact CG-CB 4.3Å; F215-L224 HydrophobicContact CE1-CB 3.83Å; F215-L224 HydrophobicContact CE1-CD1 4.21Å; F215-L224 HydrophobicContact CZ-CB 3.82Å; F215-V228 HydrophobicContact CZ-CG2 4.14Å; F215-R236 PolarHBondContact N-O 2.73Å; F215-L238 PolarHBondContact O-N 3.19Å; F215-V256 HydrophobicContact CD1-CB 3.97Å; F215-V256 HydrophobicContact CD1-CG1 4.18Å; F215-V256 HydrophobicContact CD1-CG2 3.9Å; F215-V256 HydrophobicContact CE1-CB 4.26Å; F215-V256 HydrophobicContact CE1-CG1 4.24Å; F215-V256 HydrophobicContact CE1-CG2 3.8Å; F215-V256 HydrophobicContact CZ-CG2 4.38Å; F215-I295 HydrophobicContact CE1-CD1 4.39Å; F215-I295 HydrophobicContact CZ-CD1 4.43Å
216	L	90.5	Very high	91.3	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.042	26%	0.256	C	S	.	.	S	Bend	trans	-89.1	-9	-178.5	-62.5	177.1	0	0	0	113.5	L238 V255 V258 W274 A275 V278	L216-L238 HydrophobicContact CD2-CB 4.23Å; L216-L238 HydrophobicContact CD2-CD2 3.74Å; L216-V255 HydrophobicContact CD1-CG1 4.46Å; L216-V258 HydrophobicContact CB-CG2 3.62Å; L216-V258 HydrophobicContact CD1-CG2 4.08Å; L216-V258 HydrophobicContact CG-CG2 4.45Å; L216-W274 HydrophobicContact CB-CH2 4.19Å; L216-W274 HydrophobicContact CB-CZ3 4.14Å; L216-W274 HydrophobicContact CD2-CH2 3.86Å; L216-W274 HydrophobicContact CD2-CZ2 4.26Å; L216-W274 HydrophobicContact CD2-CZ3 4.29Å; L216-W274 WeakPolarHBondContact O-CH2 3.4Å; L216-W274 WeakPolarHBondContact O-CZ3 3.45Å; L216-A275 HydrophobicContact CD1-CB 4.18Å; L216-V278 HydrophobicContact CD2-CB 4.49Å; L216-V278 HydrophobicContact CD2-CG1 4.13Å; L216-V278 HydrophobicContact CD2-CG2 4.34Å
217	T	89.3	Confident	91.3	Very high	28 Å²	28	40.5 Å²	40.5	17%	0.172	22%	0.223	C	C	.	.	S	Bend	trans	-140.5	149.3	174.8	68.3	0	0	0	0	112.3	K219 Q220 L221 V258 L267	T217-K219 VanDerWaalsContact C-N 3.26Å; T217-K219 PolarHBondContact O-N 2.57Å; T217-Q220 PolarHBondContact O-N 2.72Å; T217-Q220 VanDerWaalsContact OG1-CG 3.25Å; T217-Q220 WeakPolarHBondContact OG1-CG 3.35Å; T217-Q220 PolarHBondContact OG1-N 2.68Å; T217-Q220 PolarHBondContact OG1-OE1 3.31Å; T217-Q220 VanDerWaalsContact OG1-OE1 3.1Å; T217-L221 PolarHBondContact O-N 3.29Å; T217-V258 HydrophobicContact CG2-CG1 4.38Å; T217-V258 HydrophobicContact CG2-CG2 4.01Å; T217-L267 HydrophobicContact CG2-CD2 4.44Å
218	S	89.7	Confident	91.5	Very high	58 Å²	58	39.4 Å²	39.4	41%	0.406	22%	0.218	S	C	.	.	H	α-helix	trans	-60	-34.8	177.7	-177.2	0	0	0	0	112.4	Q220 L221 K222	S218-Q220 VanDerWaalsContact C-N 3.33Å; S218-Q220 PolarHBondContact O-N 3.35Å; S218-L221 PolarHBondContact O-N 3.4Å; S218-K222 WeakPolarHBondContact O-CB 3.48Å; S218-K222 WeakPolarHBondContact O-CG 3.46Å; S218-K222 PolarHBondContact O-N 3.02Å
219	K	88.1	Confident	91.5	Very high	155 Å²	155	42.4 Å²	42.4	67%	0.674	24%	0.239	S	C	*	.	H	α-helix	trans	-60.7	-39.4	176.6	-65.1	-168	177.8	-168.7	0	112.2	T217 R223	T217-K219 VanDerWaalsContact C-N 3.26Å; T217-K219 PolarHBondContact O-N 2.57Å; K219-R223 WeakPolarHBondContact O-CB 3.46Å; K219-R223 PolarHBondContact O-N 3.28Å
220	Q	90.1	Very high	91.5	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-70.7	-42.7	176.5	-62.2	176.5	-70	0	0	111.8	F215 T217 S218 R223 L224 E257 E292	F215-Q220 HydrophobicContact CB-CB 4.35Å; F215-Q220 HydrophobicContact CD1-CB 3.63Å; F215-Q220 HydrophobicContact CE1-CB 4.36Å; F215-Q220 HydrophobicContact CG-CB 4.34Å; T217-Q220 PolarHBondContact O-N 2.72Å; T217-Q220 VanDerWaalsContact OG1-CG 3.25Å; T217-Q220 WeakPolarHBondContact OG1-CG 3.35Å; T217-Q220 PolarHBondContact OG1-N 2.68Å; T217-Q220 PolarHBondContact OG1-OE1 3.31Å; T217-Q220 VanDerWaalsContact OG1-OE1 3.1Å; S218-Q220 VanDerWaalsContact C-N 3.33Å; S218-Q220 PolarHBondContact O-N 3.35Å; Q220-R223 PolarHBondContact O-N 2.74Å; Q220-L224 PolarHBondContact O-N 3.36Å; Q220-E257 PolarHBondContact NE2-O 3.4Å; Q220-E257 VanDerWaalsContact NE2-O 3.11Å; Q220-E292 VanDerWaalsContact CG-OE1 3.25Å; Q220-E292 WeakPolarHBondContact CG-OE1 3.26Å; Q220-E292 PolarHBondContact NE2-OE1 2.72Å
221	L	91	Very high	91.6	Very high	45 Å²	45	37.7 Å²	37.7	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-49.7	176.5	178.6	65	0	0	0	111.7	F215 T217 S218 R223 L224 G225 L237	F215-L221 HydrophobicContact CB-CB 4.22Å; F215-L221 HydrophobicContact CD2-CB 4.25Å; F215-L221 HydrophobicContact CD2-CD1 3.72Å; F215-L221 HydrophobicContact CE2-CD1 4.03Å; F215-L221 HydrophobicContact CG-CB 4.3Å; T217-L221 PolarHBondContact O-N 3.29Å; S218-L221 PolarHBondContact O-N 3.4Å; L221-R223 PolarHBondContact O-N 3.28Å; L221-L224 PolarHBondContact O-N 3Å; L221-G225 WeakPolarHBondContact O-CA 3.1Å; L221-G225 PolarHBondContact O-N 3.17Å; L221-L237 HydrophobicContact CD2-CB 3.78Å
222	K	91.1	Very high	91.6	Very high	152 Å²	152	37.8 Å²	37.8	66%	0.661	21%	0.206	S	C	*	.	H	α-helix	trans	-55.2	-34.8	176.7	-74.7	-173.2	178.1	-174	0	111.4	S218 E574	S218-K222 WeakPolarHBondContact O-CB 3.48Å; S218-K222 WeakPolarHBondContact O-CG 3.46Å; S218-K222 PolarHBondContact O-N 3.02Å; K222-E574 IonicContact NZ-OE2 3.48Å; K222-E574 PolarHBondContact NZ-OE2 2.95Å
223	R	88.4	Confident	91.5	Very high	107 Å²	107	37 Å²	37	40%	0.404	20%	0.202	S	C	.	.	H	α-helix	trans	-85.8	-32.6	-176.2	-170.7	170.3	62.1	147	-1.9	115.4	I145 K219 Q220 L221 E292	I145-R223 HydrophobicContact CD1-CG 3.42Å; I145-R223 VanDerWaalsContact CD1-CG 3.42Å; I145-R223 HydrophobicContact CG1-CG 4.35Å; I145-R223 WeakPolarHBondContact CG2-O 3.44Å; K219-R223 WeakPolarHBondContact O-CB 3.46Å; K219-R223 PolarHBondContact O-N 3.28Å; Q220-R223 PolarHBondContact O-N 2.74Å; L221-R223 PolarHBondContact O-N 3.28Å; R223-E292 IonicContact CZ-OE1 3.95Å; R223-E292 IonicContact CZ-OE2 2.99Å; R223-E292 IonicContact NH2-OE1 3.23Å; R223-E292 PolarHBondContact NH2-OE1 3.39Å; R223-E292 IonicContact NH2-OE2 3.05Å; R223-E292 PolarHBondContact NH2-OE2 2.9Å
224	L	91.3	Very high	91.5	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-124.3	-16.4	-170.6	-69.2	168.5	0	0	0	115	I145 F215 Q220 L221 A226 A227 V228 E292 I295	I145-L224 HydrophobicContact CG1-CD2 4.15Å; F215-L224 HydrophobicContact CE1-CB 3.83Å; F215-L224 HydrophobicContact CE1-CD1 4.21Å; F215-L224 HydrophobicContact CZ-CB 3.82Å; Q220-L224 PolarHBondContact O-N 3.36Å; L221-L224 PolarHBondContact O-N 3Å; L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.47Å; L224-A227 PolarHBondContact O-N 3.38Å; L224-A227 VanDerWaalsContact O-N 3.14Å; L224-V228 PolarHBondContact O-N 3.23Å; L224-E292 HydrophobicContact CD1-CB 4.09Å; L224-E292 HydrophobicContact CD1-CG 4.28Å; L224-I295 HydrophobicContact CD1-CD1 4.41Å
225	G	92.1	Very high	91.5	Very high	4 Å²	4	42.1 Å²	42.1	4%	0.041	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-37.3	-177.3	0	0	0	0	0	114.1	L221 V228 S229	L221-G225 WeakPolarHBondContact O-CA 3.1Å; L221-G225 PolarHBondContact O-N 3.17Å; G225-V228 PolarHBondContact O-N 3.07Å; G225-S229 WeakPolarHBondContact O-CB 3.42Å; G225-S229 PolarHBondContact O-N 2.88Å; G225-S229 PolarHBondContact O-OG 3.16Å
226	A	92.3	Very high	91.5	Very high	53 Å²	53	48.7 Å²	48.7	44%	0.438	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-45.2	173.8	0	0	0	0	0	111.9	L224 S229 F230	L224-A226 VanDerWaalsContact C-N 3.34Å; L224-A226 PolarHBondContact O-N 3.47Å; A226-S229 WeakPolarHBondContact O-CB 3.35Å; A226-S229 PolarHBondContact O-N 3.39Å; A226-F230 HydrophobicContact CB-CE2 4.11Å; A226-F230 HydrophobicContact CB-CZ 4.05Å; A226-F230 WeakPolarHBondContact O-CD1 3.42Å; A226-F230 WeakPolarHBondContact O-CD2 3.42Å; A226-F230 WeakPolarHBondContact O-CE2 3.38Å; A226-F230 WeakPolarHBondContact O-CG 3.47Å; A226-F230 PolarHBondContact O-N 3Å
227	A	92.9	Very high	91.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-45.7	177.3	0	0	0	0	0	111.8	I148 L152 L224 S229 F230 G231	I148-A227 HydrophobicContact CG2-CB 4.2Å; L152-A227 HydrophobicContact CD1-CB 4.45Å; L152-A227 WeakPolarHBondContact CD1-O 3.24Å; L224-A227 PolarHBondContact O-N 3.38Å; L224-A227 VanDerWaalsContact O-N 3.14Å; A227-S229 VanDerWaalsContact C-N 3.28Å; A227-S229 PolarHBondContact O-N 2.95Å; A227-F230 PolarHBondContact O-N 2.9Å; A227-F230 VanDerWaalsContact O-N 3.17Å; A227-G231 PolarHBondContact O-N 3.24Å
228	V	93.8	Very high	91.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.7	-43.3	174.1	168.9	0	0	0	0	111.4	F213 F215 L224 G225 F230 G231 G233 I295	F213-V228 HydrophobicContact CB-CG1 4.12Å; F213-V228 HydrophobicContact CB-CG2 4.21Å; F213-V228 HydrophobicContact CD1-CG2 4.18Å; F213-V228 HydrophobicContact CD2-CB 4.42Å; F213-V228 HydrophobicContact CD2-CG1 3.41Å; F213-V228 VanDerWaalsContact CD2-CG1 3.41Å; F213-V228 HydrophobicContact CD2-CG2 4.07Å; F213-V228 HydrophobicContact CE2-CG1 4.07Å; F213-V228 HydrophobicContact CG-CG1 3.91Å; F213-V228 HydrophobicContact CG-CG2 3.87Å; F215-V228 HydrophobicContact CZ-CG2 4.14Å; L224-V228 PolarHBondContact O-N 3.23Å; G225-V228 PolarHBondContact O-N 3.07Å; V228-F230 VanDerWaalsContact C-N 3.34Å; V228-F230 PolarHBondContact O-N 3.26Å; V228-G231 PolarHBondContact O-N 3.05Å; V228-G231 VanDerWaalsContact O-N 3.14Å; V228-G233 PolarHBondContact O-N 3.32Å; V228-G233 VanDerWaalsContact O-N 3.08Å; V228-I295 HydrophobicContact CG2-CD1 4.45Å; V228-I295 HydrophobicContact CG2-CG2 4.24Å
229	S	93.6	Very high	91.5	Very high	63 Å²	63	55.2 Å²	55.2	44%	0.441	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-37.9	178.3	-56.9	0	0	0	0	112.4	G225 A226 A227 G231 G232	G225-S229 WeakPolarHBondContact O-CB 3.42Å; G225-S229 PolarHBondContact O-N 2.88Å; G225-S229 PolarHBondContact O-OG 3.16Å; A226-S229 WeakPolarHBondContact O-CB 3.35Å; A226-S229 PolarHBondContact O-N 3.39Å; A227-S229 VanDerWaalsContact C-N 3.28Å; A227-S229 PolarHBondContact O-N 2.95Å; S229-G231 PolarHBondContact O-N 2.84Å; S229-G232 PolarHBondContact O-N 2.87Å
230	F	92.6	Very high	91.2	Very high	43 Å²	43	53.8 Å²	53.8	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-67.9	-21.7	176.1	-54.6	-35.1	0	0	0	113.8	W129 P131 L152 C153 A226 A227 V228 G232	W129-F230 AromaticContact CD1-CE2 3.53Å; P131-F230 HydrophobicContact CG-CE1 3.99Å; L152-F230 HydrophobicContact CB-CB 4.06Å; C153-F230 VanDerWaalsContact SG-CG 3.57Å; A226-F230 HydrophobicContact CB-CE2 4.11Å; A226-F230 HydrophobicContact CB-CZ 4.05Å; A226-F230 WeakPolarHBondContact O-CD1 3.42Å; A226-F230 WeakPolarHBondContact O-CD2 3.42Å; A226-F230 WeakPolarHBondContact O-CE2 3.38Å; A226-F230 WeakPolarHBondContact O-CG 3.47Å; A226-F230 PolarHBondContact O-N 3Å; A227-F230 PolarHBondContact O-N 2.9Å; A227-F230 VanDerWaalsContact O-N 3.17Å; V228-F230 VanDerWaalsContact C-N 3.34Å; V228-F230 PolarHBondContact O-N 3.26Å; F230-G232 VanDerWaalsContact C-N 3.32Å
231	G	90.9	Very high	90.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.8	170.9	0	0	0	0	0	114.3	K205 Q206 L207 F208 A227 V228 S229	K205-G231 CarbonylContact C-O 3.59Å; K205-G231 CarbonylContact O-C 3.5Å; Q206-G231 CarbonylContact C-O 3.48Å; Q206-G231 VanDerWaalsContact C-O 3.3Å; Q206-G231 WeakPolarHBondContact CA-O 3.28Å; L207-G231 PolarHBondContact N-O 3.44Å; F208-G231 PolarHBondContact N-O 2.97Å; A227-G231 PolarHBondContact O-N 3.24Å; V228-G231 PolarHBondContact O-N 3.05Å; V228-G231 VanDerWaalsContact O-N 3.14Å; S229-G231 PolarHBondContact O-N 2.84Å
232	G	90.7	Very high	90.4	Very high	37 Å²	37	55.7 Å²	55.7	38%	0.381	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	12.7	-178.7	0	0	0	0	0	114.9	K205 T209 S229 F230	K205-G232 PolarHBondContact O-N 2.92Å; T209-G232 WeakPolarHBondContact CA-O 3.31Å; S229-G232 PolarHBondContact O-N 2.87Å; F230-G232 VanDerWaalsContact C-N 3.32Å
233	G	92.4	Very high	90.1	Very high	7 Å²	7	52 Å²	52	7%	0.072	30%	0.297	C	S	.	.			trans	-91.9	155.2	178.2	0	0	0	0	0	113.1	F208 V228	F208-G233 VanDerWaalsContact O-CA 3.24Å; F208-G233 WeakPolarHBondContact O-CA 3.31Å; V228-G233 PolarHBondContact O-N 3.32Å; V228-G233 VanDerWaalsContact O-N 3.08Å
234	S	93.3	Very high	89.9	Confident	68 Å²	68	49.2 Å²	49.2	48%	0.476	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	143.3	169.7	-70.9	0	0	0	0	110.8	K211 T212 F213	K211-S234 PolarHBondContact O-N 3.47Å; T212-S234 CarbonylContact C-O 3.54Å; T212-S234 WeakPolarHBondContact CA-O 3.4Å; F213-S234 PolarHBondContact N-O 3.41Å
235	S	94.5	Very high	89.6	Confident	40 Å²	40	55.4 Å²	55.4	28%	0.28	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.6	171.1	59.7	0	0	0	0	111.1	F213	F213-S235 WeakPolarHBondContact O-CA 3.32Å
236	R	92.9	Very high	89.4	Confident	138 Å²	138	62.3 Å²	62.3	52%	0.521	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.5	174	-65.2	-174.1	179.2	-170	-0.2	110.6	T212 F213 F215	T212-R236 HydrophobicContact CG2-CG 4.06Å; F213-R236 PolarHBondContact O-N 3.01Å; F215-R236 PolarHBondContact N-O 2.73Å
237	L	92.9	Very high	89.1	Confident	73 Å²	73	61.2 Å²	61.2	38%	0.382	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.9	162	179.1	59.5	0	0	0	108.5	L221	L221-L237 HydrophobicContact CD2-CB 3.78Å
238	L	90.1	Very high	88.8	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.042	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-100.7	130.8	167.5	-157.2	67.6	0	0	0	109.3	V214 F215 L216 P244 L248 W274 V278	V214-L238 HydrophobicContact CG1-CB 4.03Å; V214-L238 HydrophobicContact CG1-CD1 4.24Å; V214-L238 HydrophobicContact CG1-CD2 4.37Å; V214-L238 HydrophobicContact CG1-CG 4.46Å; F215-L238 PolarHBondContact O-N 3.19Å; L216-L238 HydrophobicContact CD2-CB 4.23Å; L216-L238 HydrophobicContact CD2-CD2 3.74Å; L238-P244 HydrophobicContact CD1-CG 3.53Å; L238-L248 HydrophobicContact CD2-CD2 4.32Å; L238-W274 HydrophobicContact CB-CH2 4.19Å; L238-W274 HydrophobicContact CB-CZ2 3.99Å; L238-W274 HydrophobicContact CD2-CH2 4.37Å; L238-W274 HydrophobicContact CD2-CZ2 3.64Å; L238-W274 HydrophobicContact CG-CH2 4.46Å; L238-W274 HydrophobicContact CG-CZ2 3.77Å; L238-V278 HydrophobicContact CD2-CG1 4.36Å; L238-V278 HydrophobicContact CD2-CG2 3.79Å
239	E	86.1	Confident	88.4	Confident	149 Å²	149	63.5 Å²	63.5	70%	0.696	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-77.8	139.1	178	-64.3	-179	167.5	0	0	110.6	G241 S242 W274	E239-G241 PolarHBondContact O-N 2.9Å; E239-S242 PolarHBondContact N-OG 2.86Å; E239-S242 VanDerWaalsContact O-CB 3.27Å; E239-S242 WeakPolarHBondContact O-CB 3.28Å; E239-S242 PolarHBondContact O-N 2.9Å; E239-S242 PolarHBondContact O-OG 2.92Å; E239-W274 WeakPolarHBondContact O-CZ2 3.48Å
240	E	82.8	Confident	88.1	Confident	125 Å²	125	62.1 Å²	62.1	58%	0.584	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	131.7	179.9	-67.9	-173.9	-159.4	0	0	111.2	S242 W274	E240-S242 PolarHBondContact O-N 3.11Å; E240-W274 HydrophobicContact CG-CE3 4.22Å; E240-W274 HydrophobicContact CG-CH2 4.3Å; E240-W274 HydrophobicContact CG-CZ3 3.98Å
241	G	78.5	Confident	87.6	Confident	58 Å²	58	63.5 Å²	63.5	60%	0.598	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-17.6	-173.4	0	0	0	0	0	115.1	E239 W274	E239-G241 PolarHBondContact O-N 2.9Å; G241-W274 VanDerWaalsContact CA-CD1 3.49Å; G241-W274 VanDerWaalsContact N-NE1 3.2Å
242	S	85.6	Confident	87.4	Confident	36 Å²	36	68.8 Å²	68.8	25%	0.252	38%	0.377	S	S	.	.			trans	-74.6	139.4	174.2	77.9	0	0	0	0	111.5	E239 E240 W274	E239-S242 PolarHBondContact N-OG 2.86Å; E239-S242 VanDerWaalsContact O-CB 3.27Å; E239-S242 WeakPolarHBondContact O-CB 3.28Å; E239-S242 PolarHBondContact O-N 2.9Å; E239-S242 PolarHBondContact O-OG 2.92Å; E240-S242 PolarHBondContact O-N 3.11Å; S242-W274 PolarHBondContact O-NE1 3.01Å
243	L	84.1	Confident	87.4	Confident	73 Å²	73	67.2 Å²	67.2	38%	0.382	36%	0.36	S	S	.	.			trans	-137.4	65.2	-179.2	-63.9	175.4	0	0	0	111.6	R245 A277 V278 I281	L243-R245 PolarHBondContact O-N 3.3Å; L243-A277 HydrophobicContact CD2-CB 4.48Å; L243-V278 HydrophobicContact CD2-CG2 3.54Å; L243-I281 HydrophobicContact CB-CD1 4.25Å; L243-I281 HydrophobicContact CD1-CD1 4.29Å; L243-I281 HydrophobicContact CD2-CD1 4.04Å; L243-I281 HydrophobicContact CG-CD1 4.43Å
244	P	85.6	Confident	87.3	Confident	50 Å²	50	66.9 Å²	66.9	33%	0.325	36%	0.356	S	S	.	.			trans	-71	94.2	-179.8	30.6	-35	0	0	0	111.1	L238 D246 L247 L248	L238-P244 HydrophobicContact CD1-CG 3.53Å; P244-D246 PolarHBondContact O-N 3.47Å; P244-L247 HydrophobicContact CB-CB 4.28Å; P244-L247 HydrophobicContact CG-CB 4.27Å; P244-L247 HydrophobicContact CG-CD2 4.32Å; P244-L247 PolarHBondContact O-N 3.15Å; P244-L247 VanDerWaalsContact O-N 3.15Å; P244-L248 WeakPolarHBondContact O-CG 3.31Å; P244-L248 PolarHBondContact O-N 3.48Å; P244-L248 VanDerWaalsContact O-N 3.07Å
245	R	84.9	Confident	87.2	Confident	138 Å²	138	63.7 Å²	63.7	52%	0.521	33%	0.334	S	S	.	.	H	α-helix	trans	-55.1	-45.9	-176.2	-70.8	175.2	-179.1	-105.2	8.6	112.9	L243 L247 L248 E249	L243-R245 PolarHBondContact O-N 3.3Å; R245-L247 PolarHBondContact O-N 2.94Å; R245-L247 VanDerWaalsContact O-N 3.12Å; R245-L248 PolarHBondContact O-N 3.47Å; R245-E249 HydrophobicContact CB-CG 4.41Å; R245-E249 IonicContact NH1-OE1 2.61Å; R245-E249 WeakPolarHBondContact O-CB 3.39Å; R245-E249 VanDerWaalsContact O-CG 3.28Å; R245-E249 WeakPolarHBondContact O-CG 3.47Å; R245-E249 PolarHBondContact O-N 3.31Å
246	D	86.4	Confident	87	Confident	148 Å²	148	61.8 Å²	61.8	79%	0.791	32%	0.32	S	S	*	.	H	α-helix	trans	-60.2	-29.2	-177.1	-42.4	-47.9	0	0	0	112.6	P244	P244-D246 PolarHBondContact O-N 3.47Å
247	L	87.1	Confident	86.7	Confident	30 Å²	30	57.7 Å²	57.7	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-80.3	-44.6	173.3	-176	64.8	0	0	0	111.6	T212 V214 P244 R245 S253	T212-L247 HydrophobicContact CG2-CD1 4.27Å; V214-L247 HydrophobicContact CG2-CD1 4.36Å; V214-L247 HydrophobicContact CG2-CD2 4.02Å; V214-L247 HydrophobicContact CG2-CG 4.06Å; P244-L247 HydrophobicContact CB-CB 4.28Å; P244-L247 HydrophobicContact CG-CB 4.27Å; P244-L247 HydrophobicContact CG-CD2 4.32Å; P244-L247 PolarHBondContact O-N 3.15Å; P244-L247 VanDerWaalsContact O-N 3.15Å; R245-L247 PolarHBondContact O-N 2.94Å; R245-L247 VanDerWaalsContact O-N 3.12Å; L247-S253 WeakPolarHBondContact O-CB 3.07Å; L247-S253 PolarHBondContact O-OG 2.72Å
248	L	85.9	Confident	86.3	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-76.2	-24.3	-175.7	-64.5	175.6	0	0	0	114.1	L238 P244 R245 V255 V278 I281	L238-L248 HydrophobicContact CD2-CD2 4.32Å; P244-L248 WeakPolarHBondContact O-CG 3.31Å; P244-L248 PolarHBondContact O-N 3.48Å; P244-L248 VanDerWaalsContact O-N 3.07Å; R245-L248 PolarHBondContact O-N 3.47Å; L248-V255 HydrophobicContact CD2-CG2 3.77Å; L248-V278 HydrophobicContact CD1-CG1 3.99Å; L248-V278 HydrophobicContact CD1-CG2 4.33Å; L248-V278 HydrophobicContact CD2-CG1 3.69Å; L248-V278 HydrophobicContact CG-CG1 4.48Å; L248-I281 HydrophobicContact CB-CG2 4.01Å; L248-I281 HydrophobicContact CD1-CD1 4.4Å; L248-I281 HydrophobicContact CD1-CG2 4.37Å
249	E	85.9	Confident	85.3	Confident	49 Å²	49	58.2 Å²	58.2	23%	0.229	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-0.4	-178.3	-63.2	-178.6	-171	0	0	112.5	R245 I281 K285	R245-E249 HydrophobicContact CB-CG 4.41Å; R245-E249 IonicContact NH1-OE1 2.61Å; R245-E249 WeakPolarHBondContact O-CB 3.39Å; R245-E249 VanDerWaalsContact O-CG 3.28Å; R245-E249 WeakPolarHBondContact O-CG 3.47Å; R245-E249 PolarHBondContact O-N 3.31Å; E249-I281 HydrophobicContact CG-CG2 3.93Å; E249-K285 HydrophobicContact CB-CG 3.91Å; E249-K285 HydrophobicContact CG-CG 3.84Å; E249-K285 WeakPolarHBondContact OE2-CE 3.4Å; E249-K285 IonicContact OE2-NZ 3.2Å; E249-K285 PolarHBondContact OE2-NZ 3.03Å
250	S	86.5	Confident	83.9	Confident	34 Å²	34	54.5 Å²	54.5	24%	0.238	30%	0.301	C	S	.	.			trans	-81	132.4	178.2	174.3	0	0	0	0	112.2	H252 S253 L287	S250-H252 PolarHBondContact O-N 3.35Å; S250-H252 VanDerWaalsContact O-N 3.12Å; S250-H252 PolarHBondContact OG-N 2.99Å; S250-S253 WeakPolarHBondContact O-CB 3.09Å; S250-S253 PolarHBondContact O-N 2.9Å; S250-L287 WeakPolarHBondContact O-CD1 3.38Å
251	P	81.8	Confident	82.4	Confident	71 Å²	71	50.4 Å²	50.4	46%	0.461	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.1	178.8	30.6	-36.5	0	0	0	113.6	L287 P310	P251-L287 HydrophobicContact CB-CD2 4.42Å; P251-P310 WeakPolarHBondContact O-CG 3.19Å
252	H	86.6	Confident	80.8	Confident	112 Å²	112	53.7 Å²	53.7	52%	0.519	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.5	175.2	-61.9	-75.2	0	0	0	113.2	G210 K211 T212 S250	G210-H252 WeakPolarHBondContact O-CB 3.4Å; K211-H252 WeakPolarHBondContact CA-O 3.28Å; T212-H252 PolarHBondContact N-O 3.26Å; S250-H252 PolarHBondContact O-N 3.35Å; S250-H252 VanDerWaalsContact O-N 3.12Å; S250-H252 PolarHBondContact OG-N 2.99Å
253	S	90.6	Very high	78.9	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.5	179.6	-68.2	0	0	0	0	112.2	T212 L247 S250	T212-S253 CarbonylContact O-C 3.32Å; T212-S253 WeakPolarHBondContact O-CA 3.5Å; L247-S253 WeakPolarHBondContact O-CB 3.07Å; L247-S253 PolarHBondContact O-OG 2.72Å; S250-S253 WeakPolarHBondContact O-CB 3.09Å; S250-S253 PolarHBondContact O-N 2.9Å
254	C	90.3	Very high	77.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	97	172.7	-63.7	0	0	0	0	109.3	T212 F213 V214 V256 I290 C308	T212-C254 PolarHBondContact O-N 3.21Å; F213-C254 WeakPolarHBondContact CA-O 3.45Å; F213-C254 HydrophobicContact CD1-CB 3.83Å; F213-C254 HydrophobicContact CE1-CB 3.92Å; F213-C254 HydrophobicContact CG-CB 4.18Å; F213-C254 HydrophobicContact CZ-CB 4.34Å; V214-C254 PolarHBondContact N-O 2.65Å; C254-V256 PolarHBondContact O-N 3.18Å; C254-I290 HydrophobicContact CB-CD1 3.74Å; C254-I290 HydrophobicContact CB-CG1 4.19Å; C254-C308 PolarHBondContact SG-O 3.02Å; C254-C308 VanDerWaalsContact SG-O 3.42Å
255	V	90.9	Very high	75.8	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.6	174	-179.2	0	0	0	0	109.5	V214 L216 L248 V278 T282 V289 I290	V214-V255 HydrophobicContact CB-CG2 4.38Å; L216-V255 HydrophobicContact CD1-CG1 4.46Å; L248-V255 HydrophobicContact CD2-CG2 3.77Å; V255-V278 HydrophobicContact CG1-CG1 3.96Å; V255-T282 HydrophobicContact CG2-CG2 4.45Å; V255-V289 HydrophobicContact CB-CG1 4.22Å; V255-V289 HydrophobicContact CG1-CG1 4.05Å; V255-V289 WeakPolarHBondContact O-CA 3.39Å; V255-I290 WeakPolarHBondContact O-CG1 3.25Å; V255-I290 PolarHBondContact O-N 3.07Å
256	V	90.7	Very high	74.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.3	-180	-173.5	0	0	0	0	109.6	F213 V214 F215 C254 I290 E292 I295	F213-V256 HydrophobicContact CD1-CG2 4.19Å; V214-V256 PolarHBondContact O-N 3.46Å; F215-V256 HydrophobicContact CD1-CB 3.97Å; F215-V256 HydrophobicContact CD1-CG1 4.18Å; F215-V256 HydrophobicContact CD1-CG2 3.9Å; F215-V256 HydrophobicContact CE1-CB 4.26Å; F215-V256 HydrophobicContact CE1-CG1 4.24Å; F215-V256 HydrophobicContact CE1-CG2 3.8Å; F215-V256 HydrophobicContact CZ-CG2 4.38Å; C254-V256 PolarHBondContact O-N 3.18Å; V256-I290 WeakPolarHBondContact CA-O 3.42Å; V256-I290 HydrophobicContact CG2-CD1 4.16Å; V256-I290 HydrophobicContact CG2-CG1 4.17Å; V256-E292 HydrophobicContact CG1-CG 3.96Å; V256-I295 HydrophobicContact CG2-CD1 4.21Å
257	E	88.2	Confident	73.8	Confident	53 Å²	53	58.9 Å²	58.9	25%	0.248	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.1	145.6	178.6	-177.2	152.4	-124.4	0	0	111.9	Q220 T259 K279 V289 I290	Q220-E257 PolarHBondContact NE2-O 3.4Å; Q220-E257 VanDerWaalsContact NE2-O 3.11Å; E257-T259 PolarHBondContact O-N 3.4Å; E257-K279 WeakPolarHBondContact OE1-CD 3.33Å; E257-K279 IonicContact OE1-NZ 3.85Å; E257-K279 PolarHBondContact OE1-NZ 3.04Å; E257-K279 IonicContact OE2-NZ 3.36Å; E257-V289 HydrophobicContact CB-CB 4.27Å; E257-V289 HydrophobicContact CB-CG2 4.17Å; E257-I290 PolarHBondContact N-O 3.03Å
258	V	82.9	Confident	73.5	Confident	28 Å²	28	60.7 Å²	60.7	17%	0.17	36%	0.362	C	S	.	.			trans	-86.1	83.4	170.1	-165.5	0	0	0	0	108.9	L216 T217 T260 L267	L216-V258 HydrophobicContact CB-CG2 3.62Å; L216-V258 HydrophobicContact CD1-CG2 4.08Å; L216-V258 HydrophobicContact CG-CG2 4.45Å; T217-V258 HydrophobicContact CG2-CG1 4.38Å; T217-V258 HydrophobicContact CG2-CG2 4.01Å; V258-T260 PolarHBondContact O-N 3.37Å; V258-L267 HydrophobicContact CB-CD1 4.1Å; V258-L267 HydrophobicContact CG1-CD1 3.97Å; V258-L267 HydrophobicContact CG1-CG 4.44Å; V258-L267 HydrophobicContact CG2-CD1 4.38Å
259	T	68.9	Low	73.1	Confident	64 Å²	64	65.2 Å²	65.2	39%	0.393	39%	0.392	S	S	.	.			trans	-68.2	97.2	170	41.7	0	0	0	0	109.9	E257 G261 T291	E257-T259 PolarHBondContact O-N 3.4Å; T259-G261 VanDerWaalsContact C-N 3.34Å; T259-G261 PolarHBondContact O-N 2.9Å; T259-T291 HydrophobicContact CG2-CG2 4.21Å
260	T	58	Low	73	Confident	70 Å²	70	66.4 Å²	66.4	43%	0.429	41%	0.405	S	S	.	.			trans	-65.8	91.7	169.7	52.2	0	0	0	0	109.5	V258	V258-T260 PolarHBondContact O-N 3.37Å
261	G	50.6	Low	72.8	Confident	40 Å²	40	64.9 Å²	64.9	41%	0.412	40%	0.395	S	S	.	.			trans	-59.1	155.1	170.4	0	0	0	0	0	111.1	T259 S263 Q264	T259-G261 VanDerWaalsContact C-N 3.34Å; T259-G261 PolarHBondContact O-N 2.9Å; G261-S263 PolarHBondContact O-N 2.93Å; G261-Q264 PolarHBondContact O-N 2.64Å
262	S	44.2	Very low	73	Confident	127 Å²	127	64.1 Å²	64.1	89%	0.888	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-3.7	-169.6	55.1	0	0	0	0	117
263	S	47.5	Very low	72.9	Confident	108 Å²	108	65.4 Å²	65.4	76%	0.755	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	8.6	-176.6	-46.2	0	0	0	0	113.4	G261	G261-S263 PolarHBondContact O-N 2.93Å
264	Q	51.1	Low	72.9	Confident	122 Å²	122	66.3 Å²	66.3	57%	0.57	40%	0.398	S	S	*	.	S	Bend	trans	-98.8	144	174.8	-67.7	-166.2	10.9	0	0	111.7	G261 L266	G261-Q264 PolarHBondContact O-N 2.64Å; Q264-L266 PolarHBondContact O-N 3.48Å
265	T	53.4	Low	72.7	Confident	136 Å²	136	67.1 Å²	67.1	83%	0.834	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-53.4	128.6	172.8	-37.7	0	0	0	0	109.9	L267	T265-L267 PolarHBondContact O-N 2.88Å
266	L	59.9	Low	72.6	Confident	145 Å²	145	70.9 Å²	70.9	76%	0.759	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-53.8	134.9	174.8	-69	169.9	0	0	0	109.7	Q264	Q264-L266 PolarHBondContact O-N 3.48Å
267	L	69.3	Low	72.5	Confident	43 Å²	43	72.6 Å²	72.6	23%	0.225	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-54.2	148	171.1	-76.5	175.5	0	0	0	109.9	T217 V258 T265 A271 T272	T217-L267 HydrophobicContact CG2-CD2 4.44Å; V258-L267 HydrophobicContact CB-CD1 4.1Å; V258-L267 HydrophobicContact CG1-CD1 3.97Å; V258-L267 HydrophobicContact CG1-CG 4.44Å; V258-L267 HydrophobicContact CG2-CD1 4.38Å; T265-L267 PolarHBondContact O-N 2.88Å; L267-A271 HydrophobicContact CB-CB 4.44Å; L267-T272 WeakPolarHBondContact CB-OG1 3.49Å
268	P	79.1	Confident	72.5	Confident	68 Å²	68	70.1 Å²	70.1	44%	0.442	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-48.9	144.5	166.5	-26.8	34.8	0	0	0	111	S270 A271 T272	P268-S270 PolarHBondContact O-N 2.73Å; P268-A271 HydrophobicContact CB-CB 4.18Å; P268-A271 HydrophobicContact CG-CB 4.38Å; P268-A271 PolarHBondContact O-N 2.89Å; P268-T272 PolarHBondContact O-N 2.86Å; P268-T272 PolarHBondContact O-OG1 3.25Å
269	P	79.5	Confident	72.7	Confident	96 Å²	96	71.4 Å²	71.4	62%	0.623	43%	0.431	S	S	*	.	H	α-helix	trans	-58.5	-37.8	-178.8	21.3	-31.7	0	0	0	111.6	T272 E273	P269-T272 WeakPolarHBondContact O-CB 3.19Å; P269-T272 PolarHBondContact O-N 3.41Å; P269-E273 WeakPolarHBondContact O-CB 3.39Å; P269-E273 WeakPolarHBondContact O-CG 3.46Å; P269-E273 PolarHBondContact O-N 2.77Å
270	S	82.9	Confident	73.6	Confident	74 Å²	74	72.6 Å²	72.6	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-58.9	-45.9	172.4	49.2	0	0	0	0	113.6	P268 T272 E273 W274	P268-S270 PolarHBondContact O-N 2.73Å; S270-T272 VanDerWaalsContact C-N 3.3Å; S270-T272 PolarHBondContact O-N 2.61Å; S270-E273 PolarHBondContact O-N 3.02Å; S270-W274 WeakPolarHBondContact O-CB 3.45Å; S270-W274 PolarHBondContact O-N 3.15Å
271	A	82.9	Confident	75	Confident	2 Å²	2	69.8 Å²	69.8	2%	0.017	42%	0.417	C	S	.	.	H	α-helix	trans	-67.4	-33.4	176.7	0	0	0	0	0	111.5	L267 P268 A275	L267-A271 HydrophobicContact CB-CB 4.44Å; P268-A271 HydrophobicContact CB-CB 4.18Å; P268-A271 HydrophobicContact CG-CB 4.38Å; P268-A271 PolarHBondContact O-N 2.89Å; A271-A275 VanDerWaalsContact O-CB 3.3Å; A271-A275 WeakPolarHBondContact O-CB 3.45Å; A271-A275 PolarHBondContact O-N 3.15Å
272	T	84.4	Confident	76.7	Confident	54 Å²	54	67.9 Å²	67.9	33%	0.331	40%	0.397	S	S	.	.	H	α-helix	trans	-69	-43.9	174.8	-52.7	0	0	0	0	111.5	L267 P268 P269 S270 A275 N276	L267-T272 WeakPolarHBondContact CB-OG1 3.49Å; P268-T272 PolarHBondContact O-N 2.86Å; P268-T272 PolarHBondContact O-OG1 3.25Å; P269-T272 WeakPolarHBondContact O-CB 3.19Å; P269-T272 PolarHBondContact O-N 3.41Å; S270-T272 VanDerWaalsContact C-N 3.3Å; S270-T272 PolarHBondContact O-N 2.61Å; T272-A275 PolarHBondContact O-N 3.2Å; T272-N276 WeakPolarHBondContact O-CB 3.26Å; T272-N276 PolarHBondContact O-N 3.46Å; T272-N276 PolarHBondContact O-ND2 2.62Å
273	E	86.1	Confident	78.7	Confident	140 Å²	140	66 Å²	66	65%	0.654	37%	0.374	S	S	*	.	H	α-helix	trans	-62.8	-43	174.2	-75	171.1	-167	0	0	111.5	P269 S270 N276 A277	P269-E273 WeakPolarHBondContact O-CB 3.39Å; P269-E273 WeakPolarHBondContact O-CG 3.46Å; P269-E273 PolarHBondContact O-N 2.77Å; S270-E273 PolarHBondContact O-N 3.02Å; E273-N276 PolarHBondContact O-N 3.12Å; E273-A277 PolarHBondContact O-N 2.8Å
274	W	89.4	Confident	80.5	Confident	21 Å²	21	69.9 Å²	69.9	8%	0.08	37%	0.372	C	S	.	.	H	α-helix	trans	-63.8	-46.2	174.6	166	75.8	0	0	0	112.7	L216 L238 E239 E240 G241 S242 S270 N276 A277 V278	L216-W274 HydrophobicContact CB-CH2 4.19Å; L216-W274 HydrophobicContact CB-CZ3 4.14Å; L216-W274 HydrophobicContact CD2-CH2 3.86Å; L216-W274 HydrophobicContact CD2-CZ2 4.26Å; L216-W274 HydrophobicContact CD2-CZ3 4.29Å; L216-W274 WeakPolarHBondContact O-CH2 3.4Å; L216-W274 WeakPolarHBondContact O-CZ3 3.45Å; L238-W274 HydrophobicContact CB-CH2 4.19Å; L238-W274 HydrophobicContact CB-CZ2 3.99Å; L238-W274 HydrophobicContact CD2-CH2 4.37Å; L238-W274 HydrophobicContact CD2-CZ2 3.64Å; L238-W274 HydrophobicContact CG-CH2 4.46Å; L238-W274 HydrophobicContact CG-CZ2 3.77Å; E239-W274 WeakPolarHBondContact O-CZ2 3.48Å; E240-W274 HydrophobicContact CG-CE3 4.22Å; E240-W274 HydrophobicContact CG-CH2 4.3Å; E240-W274 HydrophobicContact CG-CZ3 3.98Å; G241-W274 VanDerWaalsContact CA-CD1 3.49Å; G241-W274 VanDerWaalsContact N-NE1 3.2Å; S242-W274 PolarHBondContact O-NE1 3.01Å; S270-W274 WeakPolarHBondContact O-CB 3.45Å; S270-W274 PolarHBondContact O-N 3.15Å; W274-N276 VanDerWaalsContact C-N 3.28Å; W274-N276 PolarHBondContact O-N 3.21Å; W274-A277 WeakPolarHBondContact O-CA 3.5Å; W274-A277 WeakPolarHBondContact O-CB 3.31Å; W274-A277 PolarHBondContact O-N 2.88Å; W274-V278 WeakPolarHBondContact O-CG2 3.05Å; W274-V278 PolarHBondContact O-N 2.78Å
275	A	87.3	Confident	82.1	Confident	17 Å²	17	69.5 Å²	69.5	14%	0.14	37%	0.369	C	S	.	.	H	α-helix	trans	-60.6	-39.1	175.9	0	0	0	0	0	111.7	L216 A271 T272 V278 K279	L216-A275 HydrophobicContact CD1-CB 4.18Å; A271-A275 VanDerWaalsContact O-CB 3.3Å; A271-A275 WeakPolarHBondContact O-CB 3.45Å; A271-A275 PolarHBondContact O-N 3.15Å; T272-A275 PolarHBondContact O-N 3.2Å; A275-V278 PolarHBondContact O-N 3.3Å; A275-K279 WeakPolarHBondContact O-CB 3.37Å; A275-K279 PolarHBondContact O-N 3.19Å
276	N	87.7	Confident	83.4	Confident	81 Å²	81	65 Å²	65	43%	0.433	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-37.1	171.5	-78.5	-59	0	0	0	112.4	T272 E273 W274 K279 N280	T272-N276 WeakPolarHBondContact O-CB 3.26Å; T272-N276 PolarHBondContact O-N 3.46Å; T272-N276 PolarHBondContact O-ND2 2.62Å; E273-N276 PolarHBondContact O-N 3.12Å; W274-N276 VanDerWaalsContact C-N 3.28Å; W274-N276 PolarHBondContact O-N 3.21Å; N276-K279 PolarHBondContact O-N 2.99Å; N276-N280 VanDerWaalsContact O-CB 3.3Å; N276-N280 WeakPolarHBondContact O-CB 3.06Å; N276-N280 VanDerWaalsContact O-CG 3.25Å; N276-N280 PolarHBondContact O-N 3.08Å; N276-N280 PolarHBondContact O-ND2 2.78Å
277	A	88.6	Confident	84.7	Confident	36 Å²	36	58.7 Å²	58.7	30%	0.298	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-42.2	174	0	0	0	0	0	111.9	L243 E273 W274 N280 I281	L243-A277 HydrophobicContact CD2-CB 4.48Å; E273-A277 PolarHBondContact O-N 2.8Å; W274-A277 WeakPolarHBondContact O-CA 3.5Å; W274-A277 WeakPolarHBondContact O-CB 3.31Å; W274-A277 PolarHBondContact O-N 2.88Å; A277-N280 PolarHBondContact O-N 3.41Å; A277-I281 WeakPolarHBondContact O-CG1 3.38Å; A277-I281 PolarHBondContact O-N 3.34Å
278	V	88.1	Confident	85.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-52.3	172.7	174.8	0	0	0	0	110.6	L216 L238 L243 L248 V255 W274 A275 N280 I281 T282	L216-V278 HydrophobicContact CD2-CB 4.49Å; L216-V278 HydrophobicContact CD2-CG1 4.13Å; L216-V278 HydrophobicContact CD2-CG2 4.34Å; L238-V278 HydrophobicContact CD2-CG1 4.36Å; L238-V278 HydrophobicContact CD2-CG2 3.79Å; L243-V278 HydrophobicContact CD2-CG2 3.54Å; L248-V278 HydrophobicContact CD1-CG1 3.99Å; L248-V278 HydrophobicContact CD1-CG2 4.33Å; L248-V278 HydrophobicContact CD2-CG1 3.69Å; L248-V278 HydrophobicContact CG-CG1 4.48Å; V255-V278 HydrophobicContact CG1-CG1 3.96Å; W274-V278 WeakPolarHBondContact O-CG2 3.05Å; W274-V278 PolarHBondContact O-N 2.78Å; A275-V278 PolarHBondContact O-N 3.3Å; V278-N280 VanDerWaalsContact C-N 3.27Å; V278-N280 PolarHBondContact O-N 2.9Å; V278-I281 PolarHBondContact O-N 2.87Å; V278-T282 PolarHBondContact O-N 3.14Å; V278-T282 PolarHBondContact O-OG1 3.36Å; V278-T282 VanDerWaalsContact O-OG1 3.08Å
279	K	87.3	Confident	86.1	Confident	56 Å²	56	55.4 Å²	55.4	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-55.7	-40.7	177.8	-176.8	166.4	-176.9	170.2	0	112.2	E257 A275 N276 T282 H283 V289	E257-K279 WeakPolarHBondContact OE1-CD 3.33Å; E257-K279 IonicContact OE1-NZ 3.85Å; E257-K279 PolarHBondContact OE1-NZ 3.04Å; E257-K279 IonicContact OE2-NZ 3.36Å; A275-K279 WeakPolarHBondContact O-CB 3.37Å; A275-K279 PolarHBondContact O-N 3.19Å; N276-K279 PolarHBondContact O-N 2.99Å; K279-T282 PolarHBondContact O-N 3.2Å; K279-H283 WeakPolarHBondContact CE-NE2 3.27Å; K279-H283 WeakPolarHBondContact O-CB 3.19Å; K279-H283 PolarHBondContact O-CD2 3.46Å; K279-H283 VanDerWaalsContact O-CD2 3.23Å; K279-H283 PolarHBondContact O-N 3.33Å; K279-V289 HydrophobicContact CB-CG1 4.23Å; K279-V289 HydrophobicContact CD-CG1 4.42Å; K279-V289 HydrophobicContact CD-CG2 4.14Å; K279-V289 HydrophobicContact CG-CG1 3.97Å; K279-V289 HydrophobicContact CG-CG2 4.4Å
280	N	87.8	Confident	86.6	Confident	89 Å²	89	50.8 Å²	50.8	48%	0.476	26%	0.264	S	S	.	.	H	α-helix	trans	-67.5	-33.5	175.6	-78.7	-46.9	0	0	0	113.8	N276 A277 V278 R284	N276-N280 VanDerWaalsContact O-CB 3.3Å; N276-N280 WeakPolarHBondContact O-CB 3.06Å; N276-N280 VanDerWaalsContact O-CG 3.25Å; N276-N280 PolarHBondContact O-N 3.08Å; N276-N280 PolarHBondContact O-ND2 2.78Å; A277-N280 PolarHBondContact O-N 3.41Å; V278-N280 VanDerWaalsContact C-N 3.27Å; V278-N280 PolarHBondContact O-N 2.9Å; N280-R284 WeakPolarHBondContact O-CD 3.23Å; N280-R284 WeakPolarHBondContact O-CG 3.3Å; N280-R284 PolarHBondContact O-N 2.74Å
281	I	87.4	Confident	87	Confident	10 Å²	10	49.1 Å²	49.1	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-67.5	-47.8	173.6	-70.1	165.1	0	0	0	110	L243 L248 E249 A277 V278 H283 R284	L243-I281 HydrophobicContact CB-CD1 4.25Å; L243-I281 HydrophobicContact CD1-CD1 4.29Å; L243-I281 HydrophobicContact CD2-CD1 4.04Å; L243-I281 HydrophobicContact CG-CD1 4.43Å; L248-I281 HydrophobicContact CB-CG2 4.01Å; L248-I281 HydrophobicContact CD1-CD1 4.4Å; L248-I281 HydrophobicContact CD1-CG2 4.37Å; E249-I281 HydrophobicContact CG-CG2 3.93Å; A277-I281 WeakPolarHBondContact O-CG1 3.38Å; A277-I281 PolarHBondContact O-N 3.34Å; V278-I281 PolarHBondContact O-N 2.87Å; I281-H283 PolarHBondContact O-N 2.87Å; I281-R284 WeakPolarHBondContact O-CB 3.4Å; I281-R284 PolarHBondContact O-N 2.87Å
282	T	87.2	Confident	87.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-50.6	177.8	-48.7	0	0	0	0	111.1	V255 V278 K279 R284 K285 L287	V255-T282 HydrophobicContact CG2-CG2 4.45Å; V278-T282 PolarHBondContact O-N 3.14Å; V278-T282 PolarHBondContact O-OG1 3.36Å; V278-T282 VanDerWaalsContact O-OG1 3.08Å; K279-T282 PolarHBondContact O-N 3.2Å; T282-R284 VanDerWaalsContact C-N 3.32Å; T282-R284 PolarHBondContact O-N 2.9Å; T282-K285 PolarHBondContact O-N 2.93Å; T282-K285 VanDerWaalsContact O-N 3.15Å; T282-L287 CarbonylContact C-O 3.59Å; T282-L287 HydrophobicContact CG2-CB 3.58Å; T282-L287 PolarHBondContact O-N 3.19Å
283	H	86.8	Confident	87.5	Confident	88 Å²	88	51.6 Å²	51.6	41%	0.407	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-29.5	178.5	-74.5	-45.4	0	0	0	114.5	K279 I281 K285 G286 L287	K279-H283 WeakPolarHBondContact CE-NE2 3.27Å; K279-H283 WeakPolarHBondContact O-CB 3.19Å; K279-H283 PolarHBondContact O-CD2 3.46Å; K279-H283 VanDerWaalsContact O-CD2 3.23Å; K279-H283 PolarHBondContact O-N 3.33Å; I281-H283 PolarHBondContact O-N 2.87Å; H283-K285 PolarHBondContact O-N 2.9Å; H283-G286 PolarHBondContact O-N 2.89Å; H283-L287 VanDerWaalsContact CA-O 3.32Å; H283-L287 WeakPolarHBondContact CA-O 3.45Å; H283-L287 PolarHBondContact N-O 3.31Å; H283-L287 PolarHBondContact ND1-O 2.9Å
284	R	85.3	Confident	87.6	Confident	189 Å²	189	45.6 Å²	45.6	71%	0.713	24%	0.238	S	C	*	.	H	α-helix	trans	-65	-18	175.9	-79.2	166.3	-178.4	-178.8	0.9	113.9	N280 I281 T282	N280-R284 WeakPolarHBondContact O-CD 3.23Å; N280-R284 WeakPolarHBondContact O-CG 3.3Å; N280-R284 PolarHBondContact O-N 2.74Å; I281-R284 WeakPolarHBondContact O-CB 3.4Å; I281-R284 PolarHBondContact O-N 2.87Å; T282-R284 VanDerWaalsContact C-N 3.32Å; T282-R284 PolarHBondContact O-N 2.9Å
285	K	83.1	Confident	87.7	Confident	113 Å²	113	44.6 Å²	44.6	49%	0.491	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	8.8	171.6	-64	-54.7	-170	77.1	0	113.6	E249 T282 H283 L287	E249-K285 HydrophobicContact CB-CG 3.91Å; E249-K285 HydrophobicContact CG-CG 3.84Å; E249-K285 WeakPolarHBondContact OE2-CE 3.4Å; E249-K285 IonicContact OE2-NZ 3.2Å; E249-K285 PolarHBondContact OE2-NZ 3.03Å; T282-K285 PolarHBondContact O-N 2.93Å; T282-K285 VanDerWaalsContact O-N 3.15Å; H283-K285 PolarHBondContact O-N 2.9Å; K285-L287 HydrophobicContact CB-CG 4.36Å; K285-L287 PolarHBondContact O-N 2.71Å
286	G	81.9	Confident	87.8	Confident	43 Å²	43	43.8 Å²	43.8	44%	0.443	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	5.7	-174.9	0	0	0	0	0	114.1	H283	H283-G286 PolarHBondContact O-N 2.89Å
287	L	86.3	Confident	87.8	Confident	11 Å²	11	41.3 Å²	41.3	6%	0.058	22%	0.215	C	C	.	.			trans	-82.6	151.7	174.9	-58.7	176.2	0	0	0	110.1	S250 P251 T282 H283 K285 P310	S250-L287 WeakPolarHBondContact O-CD1 3.38Å; P251-L287 HydrophobicContact CB-CD2 4.42Å; T282-L287 CarbonylContact C-O 3.59Å; T282-L287 HydrophobicContact CG2-CB 3.58Å; T282-L287 PolarHBondContact O-N 3.19Å; H283-L287 VanDerWaalsContact CA-O 3.32Å; H283-L287 WeakPolarHBondContact CA-O 3.45Å; H283-L287 PolarHBondContact N-O 3.31Å; H283-L287 PolarHBondContact ND1-O 2.9Å; K285-L287 HydrophobicContact CB-CG 4.36Å; K285-L287 PolarHBondContact O-N 2.71Å; L287-P310 CarbonylContact C-O 3.59Å; L287-P310 VanDerWaalsContact CA-O 3.28Å; L287-P310 WeakPolarHBondContact CA-O 3.22Å; L287-P310 HydrophobicContact CB-CB 4.46Å; L287-P310 HydrophobicContact CD2-CB 4.28Å
288	R	88.4	Confident	87.9	Confident	27 Å²	27	39.6 Å²	39.6	10%	0.102	20%	0.201	C	C	.	.			trans	-109.6	155.1	171.7	69.2	171.7	-174.4	92.3	-2.4	112.4	E294 N309 P310 C312 I314	R288-E294 IonicContact CZ-OE1 2.7Å; R288-E294 IonicContact CZ-OE2 2.67Å; R288-E294 IonicContact NH1-OE1 2.68Å; R288-E294 PolarHBondContact NH1-OE1 2.79Å; R288-E294 IonicContact NH1-OE2 2.66Å; R288-E294 PolarHBondContact NH1-OE2 3.35Å; R288-E294 IonicContact NH2-OE1 2.97Å; R288-E294 IonicContact NH2-OE2 3.12Å; R288-E294 PolarHBondContact NH2-OE2 2.99Å; R288-N309 PolarHBondContact NE-O 3.4Å; R288-N309 PolarHBondContact NH2-O 3.37Å; R288-P310 PolarHBondContact N-O 3.47Å; R288-C312 WeakPolarHBondContact CD-O 3.48Å; R288-C312 PolarHBondContact NE-O 3.31Å; R288-I314 VanDerWaalsContact NH2-CD1 3.34Å
289	V	89.3	Confident	88	Confident	15 Å²	15	39.6 Å²	39.6	9%	0.091	20%	0.201	C	C	.	.			trans	-70.3	156.1	160.6	-62.9	0	0	0	0	110.2	V255 E257 K279	V255-V289 HydrophobicContact CB-CG1 4.22Å; V255-V289 HydrophobicContact CG1-CG1 4.05Å; V255-V289 WeakPolarHBondContact O-CA 3.39Å; E257-V289 HydrophobicContact CB-CB 4.27Å; E257-V289 HydrophobicContact CB-CG2 4.17Å; K279-V289 HydrophobicContact CB-CG1 4.23Å; K279-V289 HydrophobicContact CD-CG1 4.42Å; K279-V289 HydrophobicContact CD-CG2 4.14Å; K279-V289 HydrophobicContact CG-CG1 3.97Å; K279-V289 HydrophobicContact CG-CG2 4.4Å
290	I	91.4	Very high	88	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-115.5	149.4	175.8	64.7	155.6	0	0	0	110.1	F213 C254 V255 V256 E257 E294 I295 C308	F213-I290 HydrophobicContact CD1-CD1 3.83Å; F213-I290 HydrophobicContact CE1-CD1 3.54Å; C254-I290 HydrophobicContact CB-CD1 3.74Å; C254-I290 HydrophobicContact CB-CG1 4.19Å; V255-I290 WeakPolarHBondContact O-CG1 3.25Å; V255-I290 PolarHBondContact O-N 3.07Å; V256-I290 WeakPolarHBondContact CA-O 3.42Å; V256-I290 HydrophobicContact CG2-CD1 4.16Å; V256-I290 HydrophobicContact CG2-CG1 4.17Å; E257-I290 PolarHBondContact N-O 3.03Å; I290-E294 VanDerWaalsContact CA-OE1 3.26Å; I290-E294 WeakPolarHBondContact CA-OE1 3.3Å; I290-E294 WeakPolarHBondContact CB-OE1 3.49Å; I290-I295 HydrophobicContact CD1-CG1 4.22Å; I290-C308 HydrophobicContact CD1-CB 4.31Å
291	T	90.1	Very high	88	Confident	39 Å²	39	36.1 Å²	36.1	24%	0.239	18%	0.18	C	C	.	.			trans	-89.1	161.1	173.9	62.7	0	0	0	0	111.5	T259 S293 E294	T259-T291 HydrophobicContact CG2-CG2 4.21Å; T291-S293 VanDerWaalsContact C-N 3.29Å; T291-S293 PolarHBondContact O-N 3.27Å; T291-S293 PolarHBondContact OG1-OG 3.02Å; T291-E294 PolarHBondContact N-OE1 2.87Å; T291-E294 WeakPolarHBondContact O-CB 3.27Å; T291-E294 PolarHBondContact O-N 2.94Å
292	E	88.9	Confident	87.9	Confident	35 Å²	35	37.5 Å²	37.5	16%	0.164	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-35.5	-178.6	-54.6	-170.9	122.6	0	0	113	Q220 R223 L224 V256 E294 I295	Q220-E292 VanDerWaalsContact CG-OE1 3.25Å; Q220-E292 WeakPolarHBondContact CG-OE1 3.26Å; Q220-E292 PolarHBondContact NE2-OE1 2.72Å; R223-E292 IonicContact CZ-OE1 3.95Å; R223-E292 IonicContact CZ-OE2 2.99Å; R223-E292 IonicContact NH2-OE1 3.23Å; R223-E292 PolarHBondContact NH2-OE1 3.39Å; R223-E292 IonicContact NH2-OE2 3.05Å; R223-E292 PolarHBondContact NH2-OE2 2.9Å; L224-E292 HydrophobicContact CD1-CB 4.09Å; L224-E292 HydrophobicContact CD1-CG 4.28Å; V256-E292 HydrophobicContact CG1-CG 3.96Å; E292-E294 VanDerWaalsContact C-N 3.27Å; E292-E294 PolarHBondContact O-N 3.44Å; E292-I295 WeakPolarHBondContact O-CB 3.17Å; E292-I295 PolarHBondContact O-N 3.42Å
293	S	88.9	Confident	87.9	Confident	73 Å²	73	38.7 Å²	38.7	51%	0.51	20%	0.202	S	C	.	.	H	α-helix	trans	-65.3	-29.2	179	50.3	0	0	0	0	112.2	T291 I295 G296 L297	T291-S293 VanDerWaalsContact C-N 3.29Å; T291-S293 PolarHBondContact O-N 3.27Å; T291-S293 PolarHBondContact OG1-OG 3.02Å; S293-I295 PolarHBondContact O-N 3.19Å; S293-G296 WeakPolarHBondContact O-CA 3.25Å; S293-G296 PolarHBondContact O-N 3.23Å; S293-G296 VanDerWaalsContact O-N 3.07Å; S293-L297 WeakPolarHBondContact O-CG 3.21Å; S293-L297 PolarHBondContact O-N 3.1Å
294	E	89.4	Confident	87.8	Confident	13 Å²	13	35.2 Å²	35.2	6%	0.061	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-31.4	173.5	-70.4	-174.1	-117.6	0	0	113.3	R288 I290 T291 E292 G296 L297 A298 Y307 C308	R288-E294 IonicContact CZ-OE1 2.7Å; R288-E294 IonicContact CZ-OE2 2.67Å; R288-E294 IonicContact NH1-OE1 2.68Å; R288-E294 PolarHBondContact NH1-OE1 2.79Å; R288-E294 IonicContact NH1-OE2 2.66Å; R288-E294 PolarHBondContact NH1-OE2 3.35Å; R288-E294 IonicContact NH2-OE1 2.97Å; R288-E294 IonicContact NH2-OE2 3.12Å; R288-E294 PolarHBondContact NH2-OE2 2.99Å; I290-E294 VanDerWaalsContact CA-OE1 3.26Å; I290-E294 WeakPolarHBondContact CA-OE1 3.3Å; I290-E294 WeakPolarHBondContact CB-OE1 3.49Å; T291-E294 PolarHBondContact N-OE1 2.87Å; T291-E294 WeakPolarHBondContact O-CB 3.27Å; T291-E294 PolarHBondContact O-N 2.94Å; E292-E294 VanDerWaalsContact C-N 3.27Å; E292-E294 PolarHBondContact O-N 3.44Å; E294-G296 VanDerWaalsContact C-N 3.26Å; E294-G296 PolarHBondContact O-N 2.85Å; E294-L297 PolarHBondContact O-N 2.91Å; E294-A298 WeakPolarHBondContact O-CB 3.46Å; E294-A298 PolarHBondContact O-N 3.11Å; E294-Y307 HydrophobicContact CG-CD1 4.18Å; E294-C308 PolarHBondContact O-SG 3.38Å; E294-C308 VanDerWaalsContact O-SG 3.36Å; E294-C308 PolarHBondContact OE2-N 2.9Å
295	I	90.6	Very high	87.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.8	-37.7	177.7	-51.4	-174.8	0	0	0	109.5	F208 F213 F215 L224 V228 V256 I290 E292 S293 A299 C308	F208-I295 HydrophobicContact CE2-CG2 4.09Å; F208-I295 HydrophobicContact CZ-CG2 3.87Å; F213-I295 HydrophobicContact CD1-CD1 3.77Å; F213-I295 HydrophobicContact CD1-CG1 4.28Å; F213-I295 HydrophobicContact CE1-CD1 3.94Å; F213-I295 HydrophobicContact CE1-CG1 3.93Å; F215-I295 HydrophobicContact CE1-CD1 4.39Å; F215-I295 HydrophobicContact CZ-CD1 4.43Å; L224-I295 HydrophobicContact CD1-CD1 4.41Å; V228-I295 HydrophobicContact CG2-CD1 4.45Å; V228-I295 HydrophobicContact CG2-CG2 4.24Å; V256-I295 HydrophobicContact CG2-CD1 4.21Å; I290-I295 HydrophobicContact CD1-CG1 4.22Å; E292-I295 WeakPolarHBondContact O-CB 3.17Å; E292-I295 PolarHBondContact O-N 3.42Å; S293-I295 PolarHBondContact O-N 3.19Å; I295-A299 PolarHBondContact O-N 3.24Å; I295-C308 VanDerWaalsContact CA-SG 3.55Å
296	G	89.6	Confident	87.5	Confident	1 Å²	1	33 Å²	33	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-68.9	-48.8	171.7	0	0	0	0	0	113	I148 S293 E294 A298 A299 I300	I148-G296 VanDerWaalsContact CD1-CA 3.4Å; S293-G296 WeakPolarHBondContact O-CA 3.25Å; S293-G296 PolarHBondContact O-N 3.23Å; S293-G296 VanDerWaalsContact O-N 3.07Å; E294-G296 VanDerWaalsContact C-N 3.26Å; E294-G296 PolarHBondContact O-N 2.85Å; G296-A298 VanDerWaalsContact C-N 3.35Å; G296-A298 PolarHBondContact O-N 3.27Å; G296-A299 WeakPolarHBondContact O-CB 3.48Å; G296-A299 PolarHBondContact O-N 3.21Å; G296-I300 VanDerWaalsContact O-CD1 3.27Å; G296-I300 WeakPolarHBondContact O-CD1 3.45Å; G296-I300 WeakPolarHBondContact O-CG1 3.37Å; G296-I300 PolarHBondContact O-N 2.64Å
297	L	88.3	Confident	87.6	Confident	29 Å²	29	33.9 Å²	33.9	15%	0.152	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-41.5	179.8	-64.3	172.4	0	0	0	111.9	L191 S293 E294 A299 I300 Y301 Y307	L191-L297 HydrophobicContact CD2-CD2 3.76Å; S293-L297 WeakPolarHBondContact O-CG 3.21Å; S293-L297 PolarHBondContact O-N 3.1Å; E294-L297 PolarHBondContact O-N 2.91Å; L297-A299 PolarHBondContact O-N 2.87Å; L297-I300 PolarHBondContact O-N 3.2Å; L297-Y301 HydrophobicContact CB-CD2 4.45Å; L297-Y301 HydrophobicContact CD2-CE2 4.24Å; L297-Y301 VanDerWaalsContact O-CD2 3.25Å; L297-Y301 WeakPolarHBondContact O-CD2 3.48Å; L297-Y301 PolarHBondContact O-N 2.65Å; L297-Y307 HydrophobicContact CB-CD1 3.95Å; L297-Y307 HydrophobicContact CB-CD2 3.82Å; L297-Y307 HydrophobicContact CB-CE1 4.12Å; L297-Y307 HydrophobicContact CB-CE2 4.01Å; L297-Y307 HydrophobicContact CB-CG 3.78Å; L297-Y307 HydrophobicContact CD1-CD1 3.99Å; L297-Y307 HydrophobicContact CD1-CE1 3.65Å
298	A	89.4	Confident	87.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.3	-48.4	173.2	0	0	0	0	0	111.4	L207 F208 E294 G296 I300 A302 S303 C308	L207-A298 HydrophobicContact CD2-CB 4.22Å; L207-A298 VanDerWaalsContact CD2-O 3.3Å; L207-A298 WeakPolarHBondContact CD2-O 3.49Å; F208-A298 HydrophobicContact CE1-CB 4.03Å; F208-A298 HydrophobicContact CZ-CB 4.33Å; E294-A298 WeakPolarHBondContact O-CB 3.46Å; E294-A298 PolarHBondContact O-N 3.11Å; G296-A298 VanDerWaalsContact C-N 3.35Å; G296-A298 PolarHBondContact O-N 3.27Å; A298-I300 VanDerWaalsContact C-N 3.31Å; A298-I300 PolarHBondContact O-N 3.25Å; A298-A302 VanDerWaalsContact O-CA 3.31Å; A298-A302 WeakPolarHBondContact O-CA 3.42Å; A298-A302 PolarHBondContact O-N 2.9Å; A298-S303 WeakPolarHBondContact CA-O 3.3Å; A298-S303 PolarHBondContact O-N 2.91Å; A298-C308 HydrophobicContact CB-CB 4.33Å
299	A	89.9	Confident	87.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-39.2	177	0	0	0	0	0	112.3	I148 L152 R204 I295 G296 L297	I148-A299 HydrophobicContact CG2-CB 3.92Å; L152-A299 HydrophobicContact CD1-CB 4.24Å; L152-A299 HydrophobicContact CD2-CB 3.79Å; L152-A299 HydrophobicContact CG-CB 3.88Å; R204-A299 WeakPolarHBondContact CD-O 3.12Å; R204-A299 PolarHBondContact NE-O 3.38Å; I295-A299 PolarHBondContact O-N 3.24Å; G296-A299 WeakPolarHBondContact O-CB 3.48Å; G296-A299 PolarHBondContact O-N 3.21Å; L297-A299 PolarHBondContact O-N 2.87Å
300	I	88.3	Confident	86.9	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-68.2	-55.3	-179.9	-68.2	157	0	0	0	111.2	V143 L151 L191 V196 L198 R204 G296 L297 A298 A302	V143-I300 HydrophobicContact CB-CD1 4.27Å; V143-I300 HydrophobicContact CG1-CD1 3.8Å; V143-I300 HydrophobicContact CG2-CD1 3.42Å; V143-I300 VanDerWaalsContact CG2-CD1 3.42Å; L151-I300 HydrophobicContact CD1-CG1 3.91Å; L191-I300 HydrophobicContact CD1-CD1 4.26Å; L191-I300 HydrophobicContact CD1-CG2 4.21Å; L191-I300 HydrophobicContact CD2-CD1 4.33Å; L191-I300 HydrophobicContact CD2-CG2 4.11Å; V196-I300 HydrophobicContact CB-CG2 4.45Å; V196-I300 HydrophobicContact CG1-CG2 3.48Å; V196-I300 VanDerWaalsContact CG1-CG2 3.48Å; V196-I300 HydrophobicContact CG2-CG2 4.1Å; L198-I300 HydrophobicContact CD2-CG2 4.46Å; R204-I300 PolarHBondContact NH2-O 2.99Å; G296-I300 VanDerWaalsContact O-CD1 3.27Å; G296-I300 WeakPolarHBondContact O-CD1 3.45Å; G296-I300 WeakPolarHBondContact O-CG1 3.37Å; G296-I300 PolarHBondContact O-N 2.64Å; L297-I300 PolarHBondContact O-N 3.2Å; A298-I300 VanDerWaalsContact C-N 3.31Å; A298-I300 PolarHBondContact O-N 3.25Å; I300-A302 PolarHBondContact O-N 2.72Å
301	Y	86.9	Confident	86.3	Confident	68 Å²	68	36 Å²	36	27%	0.267	20%	0.196	S	C	.	.	H	α-helix	trans	-75	-8.1	179.8	-67.7	-71.4	0	0	0	113.7	L191 D195 V196 L297 S303 Y307	L191-Y301 HydrophobicContact CD2-CE2 4.15Å; D195-Y301 HydrophobicContact CB-CE1 4.05Å; V196-Y301 HydrophobicContact CG2-CD1 4.47Å; V196-Y301 HydrophobicContact CG2-CE1 3.76Å; L297-Y301 HydrophobicContact CB-CD2 4.45Å; L297-Y301 HydrophobicContact CD2-CE2 4.24Å; L297-Y301 VanDerWaalsContact O-CD2 3.25Å; L297-Y301 WeakPolarHBondContact O-CD2 3.48Å; L297-Y301 PolarHBondContact O-N 2.65Å; Y301-S303 PolarHBondContact O-N 2.65Å; Y301-Y307 AromaticContact CD2-CD2 3.98Å; Y301-Y307 HydrophobicContact CD2-CD2 3.98Å; Y301-Y307 AromaticContact CD2-CE2 3.42Å; Y301-Y307 HydrophobicContact CD2-CE2 3.42Å; Y301-Y307 VanDerWaalsContact CD2-CE2 3.42Å; Y301-Y307 AromaticContact CE2-CE2 3.72Å; Y301-Y307 HydrophobicContact CE2-CE2 3.72Å; Y301-Y307 HydrophobicContact CG-CE2 4.34Å
302	A	86.6	Confident	85.4	Confident	38 Å²	38	36.5 Å²	36.5	31%	0.314	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	28.6	-176.9	0	0	0	0	0	113.9	R204 A298 I300	R204-A302 HydrophobicContact CG-CB 3.82Å; A298-A302 VanDerWaalsContact O-CA 3.31Å; A298-A302 WeakPolarHBondContact O-CA 3.42Å; A298-A302 PolarHBondContact O-N 2.9Å; I300-A302 PolarHBondContact O-N 2.72Å
303	S	86.3	Confident	84	Confident	27 Å²	27	41.6 Å²	41.6	19%	0.189	23%	0.228	C	C	.	.			trans	-130.6	137.6	180	155.8	0	0	0	0	109.3	A298 Y301 D305	A298-S303 WeakPolarHBondContact CA-O 3.3Å; A298-S303 PolarHBondContact O-N 2.91Å; Y301-S303 PolarHBondContact O-N 2.65Å; S303-D305 WeakPolarHBondContact CB-OD2 3.35Å; S303-D305 PolarHBondContact OG-N 2.94Å; S303-D305 PolarHBondContact OG-OD2 3.37Å
304	C	85.3	Confident	82.4	Confident	15 Å²	15	42 Å²	42	10%	0.101	22%	0.224	C	C	.	.	S	Bend	trans	-109.7	19.4	179.5	-125.9	0	0	0	0	111.9	L207 K211 Y307	L207-C304 HydrophobicContact CD1-CB 3.9Å; L207-C304 HydrophobicContact CG-CB 4.49Å; L207-C304 PolarHBondContact O-SG 3.33Å; L207-C304 VanDerWaalsContact O-SG 3.4Å; K211-C304 PolarHBondContact NZ-O 3.02Å; K211-C304 PolarHBondContact NZ-SG 2.89Å; C304-Y307 CarbonylContact C-O 3.56Å; C304-Y307 VanDerWaalsContact C-O 3.32Å; C304-Y307 WeakPolarHBondContact CA-O 3.47Å
305	D	82.3	Confident	80.2	Confident	107 Å²	107	46.9 Å²	46.9	57%	0.572	25%	0.254	S	S	*	.	S	Bend	trans	-95.3	-47	-172.7	-44.4	-67.4	0	0	0	111	S303 N309 C312	S303-D305 WeakPolarHBondContact CB-OD2 3.35Å; S303-D305 PolarHBondContact OG-N 2.94Å; S303-D305 PolarHBondContact OG-OD2 3.37Å; D305-N309 VanDerWaalsContact O-CB 3.31Å; D305-N309 WeakPolarHBondContact O-CB 3.37Å; D305-N309 PolarHBondContact O-ND2 2.89Å; D305-C312 PolarHBondContact O-SG 2.79Å
306	K	79.6	Confident	77.7	Confident	149 Å²	149	54.3 Å²	54.3	65%	0.648	29%	0.294	S	S	*	.	S	Bend	trans	-81.7	-47.5	175	-63.9	-179.8	-179	177.4	0	111.6
307	Y	83.6	Confident	75.1	Confident	60 Å²	60	59.1 Å²	59.1	24%	0.235	33%	0.328	C	S	.	.	S	Bend	trans	-110.9	147.3	-174.7	-55.6	-67.3	0	0	0	110.3	E294 L297 Y301 C304 N309	E294-Y307 HydrophobicContact CG-CD1 4.18Å; L297-Y307 HydrophobicContact CB-CD1 3.95Å; L297-Y307 HydrophobicContact CB-CD2 3.82Å; L297-Y307 HydrophobicContact CB-CE1 4.12Å; L297-Y307 HydrophobicContact CB-CE2 4.01Å; L297-Y307 HydrophobicContact CB-CG 3.78Å; L297-Y307 HydrophobicContact CD1-CD1 3.99Å; L297-Y307 HydrophobicContact CD1-CE1 3.65Å; Y301-Y307 AromaticContact CD2-CD2 3.98Å; Y301-Y307 HydrophobicContact CD2-CD2 3.98Å; Y301-Y307 AromaticContact CD2-CE2 3.42Å; Y301-Y307 HydrophobicContact CD2-CE2 3.42Å; Y301-Y307 VanDerWaalsContact CD2-CE2 3.42Å; Y301-Y307 AromaticContact CE2-CE2 3.72Å; Y301-Y307 HydrophobicContact CE2-CE2 3.72Å; Y301-Y307 HydrophobicContact CG-CE2 4.34Å; C304-Y307 CarbonylContact C-O 3.56Å; C304-Y307 VanDerWaalsContact C-O 3.32Å; C304-Y307 WeakPolarHBondContact CA-O 3.47Å; Y307-N309 PolarHBondContact O-N 2.89Å
308	C	84.5	Confident	72.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.355	C	S	.	.	S	Bend	trans	56.8	32.1	-175	-60.9	0	0	0	0	113.8	F208 K211 F213 C254 I290 E294 I295 A298	F208-C308 HydrophobicContact CE1-CB 4.44Å; K211-C308 PolarHBondContact NZ-O 2.85Å; F213-C308 HydrophobicContact CE1-CB 4.13Å; F213-C308 HydrophobicContact CZ-CB 4.01Å; C254-C308 PolarHBondContact SG-O 3.02Å; C254-C308 VanDerWaalsContact SG-O 3.42Å; I290-C308 HydrophobicContact CD1-CB 4.31Å; E294-C308 PolarHBondContact O-SG 3.38Å; E294-C308 VanDerWaalsContact O-SG 3.36Å; E294-C308 PolarHBondContact OE2-N 2.9Å; I295-C308 VanDerWaalsContact CA-SG 3.55Å; A298-C308 HydrophobicContact CB-CB 4.33Å
309	N	84.9	Confident	69.7	Low	30 Å²	30	69 Å²	69	16%	0.16	39%	0.386	C	S	.	.			trans	-112.7	105.4	175.5	-171.3	-14.8	0	0	0	109.9	R288 D305 Y307 S311 C312	R288-N309 PolarHBondContact NE-O 3.4Å; R288-N309 PolarHBondContact NH2-O 3.37Å; D305-N309 VanDerWaalsContact O-CB 3.31Å; D305-N309 WeakPolarHBondContact O-CB 3.37Å; D305-N309 PolarHBondContact O-ND2 2.89Å; Y307-N309 PolarHBondContact O-N 2.89Å; N309-S311 VanDerWaalsContact C-N 3.27Å; N309-S311 PolarHBondContact O-N 2.88Å; N309-S311 PolarHBondContact OD1-N 3.49Å; N309-S311 VanDerWaalsContact OD1-N 3.1Å; N309-C312 HydrophobicContact CB-CB 3.94Å; N309-C312 PolarHBondContact ND2-SG 2.82Å; N309-C312 PolarHBondContact O-N 3.17Å; N309-C312 PolarHBondContact OD1-N 2.99Å
310	P	81.2	Confident	66.9	Low	2 Å²	2	74.7 Å²	74.7	1%	0.013	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-21.7	-177.6	31.4	-35.6	0	0	0	112.3	P251 L287 R288	P251-P310 WeakPolarHBondContact O-CG 3.19Å; L287-P310 CarbonylContact C-O 3.59Å; L287-P310 VanDerWaalsContact CA-O 3.28Å; L287-P310 WeakPolarHBondContact CA-O 3.22Å; L287-P310 HydrophobicContact CB-CB 4.46Å; L287-P310 HydrophobicContact CD2-CB 4.28Å; R288-P310 PolarHBondContact N-O 3.47Å
311	S	78.3	Confident	64.3	Low	67 Å²	67	82.7 Å²	82.7	47%	0.469	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15	178.7	-54.4	0	0	0	0	113.5	N309 L313	N309-S311 VanDerWaalsContact C-N 3.27Å; N309-S311 PolarHBondContact O-N 2.88Å; N309-S311 PolarHBondContact OD1-N 3.49Å; N309-S311 VanDerWaalsContact OD1-N 3.1Å; S311-L313 PolarHBondContact O-N 3.39Å
312	C	70.3	Confident	61.6	Low	49 Å²	49	88.6 Å²	88.6	33%	0.331	49%	0.485	S	S	.	.			trans	-79.4	108.8	172.5	-91.5	0	0	0	0	110.2	R288 D305 N309 I314	R288-C312 WeakPolarHBondContact CD-O 3.48Å; R288-C312 PolarHBondContact NE-O 3.31Å; D305-C312 PolarHBondContact O-SG 2.79Å; N309-C312 HydrophobicContact CB-CB 3.94Å; N309-C312 PolarHBondContact ND2-SG 2.82Å; N309-C312 PolarHBondContact O-N 3.17Å; N309-C312 PolarHBondContact OD1-N 2.99Å; C312-I314 VanDerWaalsContact C-N 3.26Å; C312-I314 PolarHBondContact O-N 3.04Å
313	L	60.2	Low	59.2	Low	141 Å²	141	92.9 Å²	92.9	74%	0.738	51%	0.507	S	S	*	.			trans	-64.8	89.8	158.7	-62.6	179.3	0	0	0	108.9	S311 V315	S311-L313 PolarHBondContact O-N 3.39Å; L313-V315 VanDerWaalsContact C-N 3.32Å; L313-V315 PolarHBondContact O-N 3.35Å
314	I	54.2	Low	56.4	Low	81 Å²	81	100.1 Å²	100.1	42%	0.415	54%	0.535	S	S	.	.			trans	-64.4	101.8	159.2	-58.8	-179.7	0	0	0	105.8	R288 C312 D316	R288-I314 VanDerWaalsContact NH2-CD1 3.34Å; C312-I314 VanDerWaalsContact C-N 3.26Å; C312-I314 PolarHBondContact O-N 3.04Å; I314-D316 PolarHBondContact O-N 3.25Å
315	V	43.3	Very low	54	Low	116 Å²	116	104.8 Å²	104.8	70%	0.703	57%	0.565	S	S	*	*			trans	-62.5	127.4	156.3	177	0	0	0	0	105.7	L313 S317	L313-V315 VanDerWaalsContact C-N 3.32Å; L313-V315 PolarHBondContact O-N 3.35Å; V315-S317 VanDerWaalsContact C-N 3.31Å; V315-S317 PolarHBondContact O-N 2.92Å
316	D	38.3	Very low	51.5	Low	157 Å²	157	110.9 Å²	110.9	84%	0.84	58%	0.58	S	S	*	*			trans	-57.5	94.9	177.4	-77.4	-45.1	0	0	0	110.2	I314	I314-D316 PolarHBondContact O-N 3.25Å
317	S	35.6	Very low	49.7	Very low	102 Å²	102	110.6 Å²	110.6	71%	0.713	58%	0.584	S	S	*	*			trans	-119.6	30.1	-177.9	75.7	0	0	0	0	111.1	V315	V315-S317 VanDerWaalsContact C-N 3.31Å; V315-S317 PolarHBondContact O-N 2.92Å
318	D	29.2	Very low	47.3	Very low	137 Å²	137	113.4 Å²	113.4	73%	0.733	61%	0.61	S	S	*	*	S	Bend	trans	-60.2	131.4	147.6	-117.8	-25.6	0	0	0	107.5	V320	D318-V320 PolarHBondContact O-N 3.33Å
319	P	34.5	Very low	44.9	Very low	100 Å²	100	119.3 Å²	119.3	65%	0.649	65%	0.651	S	S	*	*			trans	-74.8	75.9	175.4	32.4	-34.5	0	0	0	109	Q321	P319-Q321 PolarHBondContact O-N 3.42Å
320	V	32.3	Very low	42.5	Very low	119 Å²	119	122.8 Å²	122.8	72%	0.721	68%	0.684	S	S	*	*			trans	-50.5	107.8	165.1	175.2	0	0	0	0	106.6	D318 K322	D318-V320 PolarHBondContact O-N 3.33Å; V320-K322 PolarHBondContact O-N 2.82Å
321	Q	33	Very low	40.3	Very low	172 Å²	172	127.7 Å²	127.7	80%	0.804	72%	0.718	S	S	*	*			trans	-59.5	106.9	174.7	-76.4	-170.1	-10.8	0	0	106.9	P319 V323	P319-Q321 PolarHBondContact O-N 3.42Å; Q321-V323 PolarHBondContact O-N 3.22Å
322	K	30	Very low	38.2	Very low	192 Å²	192	131.6 Å²	131.6	84%	0.835	73%	0.733	S	S	*	*			trans	-68.6	80.8	177.8	-73.3	-176.3	177.8	177.2	0	109	V320 K324	V320-K322 PolarHBondContact O-N 2.82Å; K322-K324 PolarHBondContact O-N 3.49Å
323	V	35.3	Very low	36.4	Very low	128 Å²	128	133.9 Å²	133.9	78%	0.776	75%	0.75	S	S	*	*			trans	-57.8	94.1	159.4	180	0	0	0	0	105.7	Q321 P325	Q321-V323 PolarHBondContact O-N 3.22Å; V323-P325 WeakPolarHBondContact O-CD 3.43Å
324	K	28.6	Very low	35.2	Very low	178 Å²	178	136.7 Å²	136.7	77%	0.774	76%	0.759	S	S	*	*			trans	-55.7	123.8	176.8	-77.7	-178.2	173.9	179.5	0	107.5	K322 R326	K322-K324 PolarHBondContact O-N 3.49Å; K324-R326 PolarHBondContact O-N 3.05Å
325	P	34.1	Very low	34.4	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	78%	0.775	S	S	*	*			trans	-61	106.3	164.8	25.5	-31.8	0	0	0	107	V323 I327	V323-P325 WeakPolarHBondContact O-CD 3.43Å; P325-I327 PolarHBondContact O-N 2.9Å
326	R	29.8	Very low	33.9	Very low	235 Å²	235	138.5 Å²	138.5	89%	0.887	78%	0.778	S	S	*	*			trans	-80.5	65.3	-172.5	-168.3	-178.5	-176.5	163.5	0.8	110.1	K324 P328	K324-R326 PolarHBondContact O-N 3.05Å; R326-P328 VanDerWaalsContact O-CD 3.22Å; R326-P328 WeakPolarHBondContact O-CD 3.48Å
327	I	41.5	Very low	33.5	Very low	143 Å²	143	136.4 Å²	136.4	73%	0.733	77%	0.771	S	S	*	*			trans	-62.6	118.4	169.1	-57	175.9	0	0	0	107.4	P325 S329	P325-I327 PolarHBondContact O-N 2.9Å; I327-S329 PolarHBondContact O-N 3.24Å
328	P	34.7	Very low	33.5	Very low	119 Å²	119	137.7 Å²	137.7	77%	0.773	78%	0.775	S	S	*	*			trans	-73.5	112.4	173.7	-13.4	30.6	0	0	0	108.9	R326 A330	R326-P328 VanDerWaalsContact O-CD 3.22Å; R326-P328 WeakPolarHBondContact O-CD 3.48Å; P328-A330 PolarHBondContact O-N 2.97Å
329	S	33.3	Very low	33.5	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	78%	0.776	S	S	*	*			trans	-73.6	118.5	173.3	54.7	0	0	0	0	110.7	I327	I327-S329 PolarHBondContact O-N 3.24Å
330	A	35.3	Very low	33.6	Very low	103 Å²	103	141.2 Å²	141.2	85%	0.851	78%	0.782	S	S	*	*			trans	-125	149.6	161.4	0	0	0	0	0	108.4	P328	P328-A330 PolarHBondContact O-N 2.97Å
331	S	34	Very low	33.7	Very low	105 Å²	105	142 Å²	142	73%	0.734	79%	0.788	S	S	*	*			trans	-137.3	152.3	-162	-163.8	0	0	0	0	113.2
332	L	33.8	Very low	33.6	Very low	150 Å²	150	139.9 Å²	139.9	79%	0.785	79%	0.786	S	S	*	*			trans	57.6	119.2	168.5	-96.8	75	0	0	0	119.6
333	S	33.7	Very low	33.8	Very low	97 Å²	97	138.5 Å²	138.5	68%	0.678	79%	0.787	S	S	*	*				54.4	114.5	125.3	-53	0	0	0	0	121
334	Q	33.9	Very low	34.2	Very low	199 Å²	199	138.5 Å²	138.5	93%	0.93	79%	0.79	S	S	*	*				-165.6	155.3	101.6	-100.9	163.3	51.5	0	0	111.9
335	S	38.2	Very low	34.3	Very low	107 Å²	107	135 Å²	135	75%	0.748	79%	0.794	S	S	*	*			trans	-96.5	150.9	175.1	53.7	0	0	0	0	111.5
336	V	32.4	Very low	34.1	Very low	128 Å²	128	134.2 Å²	134.2	78%	0.776	80%	0.797	S	S	*	*			trans	177.5	117.5	140.3	142.5	0	0	0	0	112.8
337	T	31.1	Very low	34.4	Very low	114 Å²	114	127.7 Å²	127.7	70%	0.699	79%	0.788	S	S	*	*			trans	39.5	141.3	145.5	72.5	0	0	0	0	125.6
338	V	35.2	Very low	34	Very low	129 Å²	129	129 Å²	129	78%	0.782	79%	0.791	S	S	*	*			trans	74.3	139.4	133	161.7	0	0	0	0	117.6
339	D	29.4	Very low	33.9	Very low	141 Å²	141	129.8 Å²	129.8	75%	0.754	79%	0.788	S	S	*	*			cis	-145.3	-179.6	0.7	-140.4	-22.3	0	0	0	113.6
340	E	35.9	Very low	33.9	Very low	169 Å²	169	132.3 Å²	132.3	79%	0.79	79%	0.79	S	S	*	*			trans	-64.6	150.2	164.8	-56.7	-172.4	125.4	0	0	113.8
341	T	34.3	Very low	33.8	Very low	135 Å²	135	133.4 Å²	133.4	83%	0.828	79%	0.787	S	S	*	*			trans	-167.8	115	131.4	9.5	0	0	0	0	114.6
342	V	30.8	Very low	33.7	Very low	128 Å²	128	131.9 Å²	131.9	78%	0.776	78%	0.78	S	S	*	*			trans	56.1	113.6	133.3	179	0	0	0	0	120.3
343	L	35.7	Very low	33.7	Very low	164 Å²	164	135.8 Å²	135.8	86%	0.859	79%	0.786	S	S	*	*			trans	-73.1	154.8	153.1	-69.1	167.7	0	0	0	111.3
344	P	42.3	Very low	33.6	Very low	127 Å²	127	135.3 Å²	135.3	83%	0.825	79%	0.788	S	S	*	*				-135.6	164.2	118.1	36.9	-27.6	0	0	0	114
345	A	30.5	Very low	33.7	Very low	104 Å²	104	132 Å²	132	86%	0.86	78%	0.782	S	S	*	*			trans	-118.4	145.7	-168.8	0	0	0	0	0	114.4
346	A	30.6	Very low	33.3	Very low	98 Å²	98	133.7 Å²	133.7	81%	0.81	78%	0.782	S	S	*	*			trans	-170.8	149.5	160.1	0	0	0	0	0	109.2
347	S	34.9	Very low	34	Very low	99 Å²	99	133.4 Å²	133.4	69%	0.692	78%	0.78	S	S	*	*			cis	-167.2	128.7	-16.6	51.1	0	0	0	0	111.2
348	Q	34.5	Very low	33.9	Very low	170 Å²	170	137.3 Å²	137.3	79%	0.794	79%	0.791	S	S	*	*			trans	56.9	154.3	144.3	-59.8	-174	-6.7	0	0	122.9
349	N	32.9	Very low	33.6	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	79%	0.79	S	S	*	*			trans	75.5	80.8	155.9	-55.1	-29.5	0	0	0	118.9
350	I	32.3	Very low	33.7	Very low	176 Å²	176	135.2 Å²	135.2	90%	0.903	79%	0.788	S	S	*	*			trans	-78.6	126.7	154.4	-64.4	168.8	0	0	0	108.7
351	T	34.2	Very low	33.3	Very low	127 Å²	127	135.4 Å²	135.4	78%	0.779	79%	0.789	S	S	*	*			trans	-123.7	111.1	170.9	-53.2	0	0	0	0	110.6
352	A	30.7	Very low	33	Very low	72 Å²	72	139.8 Å²	139.8	60%	0.595	79%	0.79	S	S	*	*			trans	33.9	129.2	153.2	0	0	0	0	0	122.1
353	Y	33.4	Very low	32.8	Very low	233 Å²	233	140.5 Å²	140.5	91%	0.914	79%	0.787	S	S	*	*			trans	33.9	143.9	130.8	-65.3	-98.2	0	0	0	121.3
354	A	32.5	Very low	32.2	Very low	87 Å²	87	139.8 Å²	139.8	72%	0.719	78%	0.779	S	S	*	*			cis	-168.3	144.1	-18.8	0	0	0	0	0	107
355	V	35.1	Very low	31.6	Very low	130 Å²	130	139.1 Å²	139.1	79%	0.788	77%	0.772	S	S	*	*			trans	-79.1	132.3	177	173.6	0	0	0	0	109.9
356	N	31.1	Very low	31.4	Very low	142 Å²	142	145.2 Å²	145.2	76%	0.759	77%	0.773	S	S	*	*			trans	-159	124.5	133.9	-100.6	-28.2	0	0	0	113.3
357	T	45.6	Very low	31.1	Very low	121 Å²	121	147.4 Å²	147.4	74%	0.742	77%	0.766	S	S	*	*			trans	51.1	117.4	143.7	61.5	0	0	0	0	120.3
358	E	29.2	Very low	30.7	Very low	197 Å²	197	150.4 Å²	150.4	92%	0.921	77%	0.771	S	S	*	*				-152.4	172.7	120.9	-127.1	177.2	-143.8	0	0	113.1
359	T	30.6	Very low	30.5	Very low	125 Å²	125	148.9 Å²	148.9	77%	0.767	77%	0.774	S	S	*	*			trans	-101.3	149.6	-156.5	45.3	0	0	0	0	116.2
360	S	30.3	Very low	30.3	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	77%	0.771	S	S	*	*			trans	83.7	147.8	137.4	-157.1	0	0	0	0	121.7
361	Q	28.6	Very low	31.1	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	77%	0.769	S	S	*	*			trans	63.8	99.3	154.8	-80.1	171.2	35.1	0	0	122.7
362	R	27.8	Very low	30.8	Very low	226 Å²	226	142 Å²	142	85%	0.853	77%	0.77	S	S	*	*				68	147.7	109.4	-154.2	-169.8	175.2	157.5	0.2	120.2
363	M	26	Very low	30.7	Very low	143 Å²	143	143.9 Å²	143.9	70%	0.704	79%	0.785	S	S	*	*			trans	83.2	142.5	171.3	-58.3	179.8	63.7	0	0	114.7
364	E	23.4	Very low	30.5	Very low	150 Å²	150	140 Å²	140	70%	0.701	79%	0.786	S	S	*	*			cis	-154.1	151.5	-3.3	-128.3	-173.2	152.4	0	0	115.3
365	V	28.9	Very low	30.3	Very low	112 Å²	112	139.4 Å²	139.4	68%	0.679	79%	0.788	S	S	*	*			trans	32.7	130	142.3	168.1	0	0	0	0	121.8
366	R	25.9	Very low	30.1	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	79%	0.793	S	S	*	*			trans	-153.2	127	130.4	-121.1	172.5	-173.4	-178	3.1	114.7
367	H	24.2	Very low	30.2	Very low	144 Å²	144	141.9 Å²	141.9	67%	0.667	80%	0.795	S	S	*	*			trans	34.8	127.1	147.4	-74.4	-108.1	0	0	0	121
368	M	28.1	Very low	30.4	Very low	162 Å²	162	141.3 Å²	141.3	80%	0.798	79%	0.793	S	S	*	*				68.2	144.7	51.7	-61.7	-175	-178.5	0	0	114
369	T	29.5	Very low	30.4	Very low	138 Å²	138	139.8 Å²	139.8	85%	0.847	79%	0.787	S	S	*	*			cis	-143.8	173.2	4.9	-11.7	0	0	0	0	107.7
370	G	29.9	Very low	30.4	Very low	64 Å²	64	140.5 Å²	140.5	66%	0.66	78%	0.781	S	S	*	*			cis	172.8	-153.8	8.8	0	0	0	0	0	106.6
371	P	48.2	Very low	30.3	Very low	134 Å²	134	143.8 Å²	143.8	87%	0.87	78%	0.783	S	S	*	*			cis	-120.4	-164.5	-18.1	41.9	-27.4	0	0	0	111.4
372	A	28.3	Very low	30.2	Very low	96 Å²	96	143.2 Å²	143.2	79%	0.793	78%	0.78	S	S	*	*				-175.7	122.3	-58.3	0	0	0	0	0	109.1
373	A	28.1	Very low	30	Very low	110 Å²	110	141.3 Å²	141.3	91%	0.909	78%	0.778	S	S	*	*			trans	-169.1	138.4	160	0	0	0	0	0	113.2
374	V	28.7	Very low	30	Very low	153 Å²	153	139.4 Å²	139.4	93%	0.927	79%	0.785	S	S	*	*			trans	-74	153.9	-173.2	179	0	0	0	0	114.1
375	G	29.1	Very low	30.1	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	78%	0.784	S	S	*	*			trans	174.4	136.1	161.6	0	0	0	0	0	114.8
376	E	30.7	Very low	30	Very low	191 Å²	191	139 Å²	139	89%	0.893	79%	0.79	S	S	*	*			trans	-103.1	171.4	-168	-61.5	175.4	127.2	0	0	115.1
377	T	33.1	Very low	30.2	Very low	132 Å²	132	134.8 Å²	134.8	81%	0.81	78%	0.784	S	S	*	*			trans	-63.3	166.5	166.1	47.7	0	0	0	0	113.1
378	P	50.7	Low	30.9	Very low	109 Å²	109	133.2 Å²	133.2	71%	0.708	79%	0.786	S	S	*	*			cis	-144.4	-173.6	22	44	-24.1	0	0	0	117.5
379	E	28.3	Very low	30.9	Very low	166 Å²	166	129.3 Å²	129.3	78%	0.776	79%	0.788	S	S	*	*			trans	53.4	148.1	150	-79.2	-156.8	96.3	0	0	125.4
380	Q	30.6	Very low	31.1	Very low	140 Å²	140	127.5 Å²	127.5	65%	0.654	79%	0.787	S	S	*	*			trans	71.2	116	154.8	-78.3	-166.1	51.7	0	0	123.8
381	K	27.7	Very low	31.3	Very low	170 Å²	170	133.8 Å²	133.8	74%	0.739	80%	0.796	S	S	*	*				64.5	137.6	128.1	-79.6	179	-176.7	160.7	0	123.3
382	Q	27.3	Very low	30.4	Very low	161 Å²	161	131.6 Å²	131.6	75%	0.752	79%	0.789	S	S	*	*			trans	89.3	114.6	147.1	-75	-176.1	22.2	0	0	122.5
383	K	24.3	Very low	30.4	Very low	185 Å²	185	132.8 Å²	132.8	80%	0.804	79%	0.787	S	S	*	*				59.5	120.6	127.9	-67.8	-174.5	172.3	-174.3	0	122.7
384	A	24.8	Very low	30.6	Very low	104 Å²	104	133.4 Å²	133.4	86%	0.86	78%	0.779	S	S	*	*			trans	69.8	160.9	139.3	0	0	0	0	0	117.5
385	A	26.5	Very low	30.8	Very low	83 Å²	83	133.3 Å²	133.3	69%	0.686	77%	0.769	S	S	*	*			cis	-152	161.1	2.4	0	0	0	0	0	112.4
386	Q	26.5	Very low	31	Very low	171 Å²	171	137.1 Å²	137.1	80%	0.799	76%	0.764	S	S	*	*				30.4	132	127.6	-80.8	-176.1	28.5	0	0	119.4
387	L	29.5	Very low	31.1	Very low	144 Å²	144	132.2 Å²	132.2	75%	0.754	75%	0.751	S	S	*	*			cis	-178.2	-162.9	44.8	-96.6	146.6	0	0	0	107.7
388	P	38.9	Very low	30.8	Very low	110 Å²	110	131.3 Å²	131.3	71%	0.714	75%	0.745	S	S	*	*				-133.3	150.7	-51.4	34.2	-17.8	0	0	0	115.7
389	G	27.6	Very low	29.9	Very low	81 Å²	81	130.8 Å²	130.8	84%	0.835	74%	0.744	S	S	*	*			trans	63.1	-173.8	150.5	0	0	0	0	0	117.3
390	A	35.1	Very low	29.8	Very low	99 Å²	99	131.1 Å²	131.1	82%	0.818	75%	0.746	S	S	*	*			cis	-154.7	156.1	-15	0	0	0	0	0	107.7
391	K	34	Very low	30	Very low	197 Å²	197	132 Å²	132	86%	0.857	75%	0.754	S	S	*	*			cis	-146.4	172.6	4.8	-145.5	173.6	-173.1	174.9	0	108.3
392	A	29.6	Very low	30	Very low	88 Å²	88	131.8 Å²	131.8	73%	0.727	76%	0.759	S	S	*	*				168.4	164.4	113.3	0	0	0	0	0	109.7
393	T	26.9	Very low	30.3	Very low	120 Å²	120	130.1 Å²	130.1	74%	0.736	76%	0.76	S	S	*	*			cis	-164.3	148.9	-28.2	-89.2	0	0	0	0	107.4
394	V	32.9	Very low	30.5	Very low	124 Å²	124	130 Å²	130	75%	0.752	76%	0.762	S	S	*	*			trans	-73.8	126.7	173	179.5	0	0	0	0	108.2
395	Q	32.9	Very low	30.6	Very low	151 Å²	151	131.4 Å²	131.4	71%	0.706	76%	0.755	S	S	*	*				-132.1	157	53.2	-65.8	-179.1	100.9	0	0	112
396	K	32.7	Very low	30.8	Very low	154 Å²	154	133.2 Å²	133.2	67%	0.67	76%	0.758	S	S	*	*			cis	-161.4	156.6	-7.6	-109.2	169.8	178.1	160.6	0	106
397	S	32.4	Very low	30.9	Very low	88 Å²	88	133.8 Å²	133.8	62%	0.615	76%	0.763	S	S	*	*			cis	70.9	136.1	41.5	134.6	0	0	0	0	113.7
398	T	28.4	Very low	30.7	Very low	113 Å²	113	132 Å²	132	69%	0.693	76%	0.762	S	S	*	*			cis	-161.4	166.7	-8.2	8.4	0	0	0	0	106.5
399	S	30.2	Very low	30	Very low	97 Å²	97	132.3 Å²	132.3	68%	0.678	77%	0.767	S	S	*	*			cis	-160.1	162.1	4.2	21.8	0	0	0	0	107.5
400	E	27	Very low	29.9	Very low	173 Å²	173	133.5 Å²	133.5	81%	0.808	76%	0.763	S	S	*	*			cis	-151.3	170.4	-5.4	-120	152.1	-159	0	0	110.2
401	L	34.2	Very low	29.5	Very low	158 Å²	158	138.2 Å²	138.2	83%	0.827	77%	0.765	S	S	*	*			trans	-104.6	174	-178.2	-69.6	163.7	0	0	0	110.6
402	I	27.9	Very low	29.2	Very low	167 Å²	167	134.6 Å²	134.6	86%	0.856	77%	0.765	S	S	*	*				-169.7	160.3	83	-86.5	162.7	0	0	0	109.8
403	V	34.5	Very low	29.2	Very low	126 Å²	126	135.1 Å²	135.1	76%	0.764	77%	0.769	S	S	*	*			trans	-126.6	140.5	-174.9	173.9	0	0	0	0	109.7
404	E	27.3	Very low	29.5	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	78%	0.775	S	S	*	*			trans	-161.8	154.4	140.1	-129.6	170.1	-148.3	0	0	115.3
405	D	27.8	Very low	29.3	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	78%	0.778	S	S	*	*			trans	39	122.8	159.5	-110.5	-29.2	0	0	0	125.9
406	T	30.7	Very low	29.2	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	77%	0.774	S	S	*	*			trans	25.3	102.5	130.8	-49.1	0	0	0	0	120
407	M	28.1	Very low	29.2	Very low	182 Å²	182	131.4 Å²	131.4	90%	0.897	78%	0.779	S	S	*	*			trans	-161.7	162.3	143.2	-105.8	-67.9	170.4	0	0	111.1
408	S	25	Very low	29.2	Very low	107 Å²	107	134.3 Å²	134.3	75%	0.748	79%	0.787	S	S	*	*			trans	-69.7	134.3	-176.6	-50.6	0	0	0	0	114.1
409	S	25.3	Very low	29.5	Very low	117 Å²	117	133 Å²	133	82%	0.818	78%	0.782	S	S	*	*				164.8	140.6	119.9	51.2	0	0	0	0	114.7
410	S	24.3	Very low	29.6	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	79%	0.785	S	S	*	*			trans	-166.9	148.6	158.6	-78.3	0	0	0	0	106.1
411	F	26.9	Very low	29.9	Very low	199 Å²	199	137.2 Å²	137.2	87%	0.873	78%	0.783	S	S	*	*			cis	-129.9	148.1	21.3	-70.3	-104.5	0	0	0	112.9
412	S	27.8	Very low	29.6	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	78%	0.781	S	S	*	*			trans	-126.5	140.5	138.5	52.4	0	0	0	0	107.3
413	A	30.1	Very low	30	Very low	98 Å²	98	141 Å²	141	81%	0.81	78%	0.781	S	S	*	*			trans	-106.9	136.4	-172.4	0	0	0	0	0	111.5
414	A	33.9	Very low	30.9	Very low	106 Å²	106	139.3 Å²	139.3	88%	0.876	77%	0.772	S	S	*	*			trans	176.5	133.6	134.7	0	0	0	0	0	111.7
415	D	28.9	Very low	31.1	Very low	153 Å²	153	137.5 Å²	137.5	82%	0.818	77%	0.769	S	S	*	*			trans	-148.1	145.4	156.7	-147.5	6.8	0	0	0	104.6
416	S	30.7	Very low	32.3	Very low	88 Å²	88	136.7 Å²	136.7	62%	0.615	77%	0.771	S	S	*	*			cis	-154.6	-165.9	13.6	-154.3	0	0	0	0	113.7
417	T	31.9	Very low	32.4	Very low	125 Å²	125	141 Å²	141	77%	0.767	78%	0.779	S	S	*	*			trans	72.6	92.1	163.3	48.4	0	0	0	0	119.9
418	D	31.4	Very low	33.6	Very low	149 Å²	149	138 Å²	138	80%	0.797	77%	0.773	S	S	*	*				49	145	103.9	-144.5	41.7	0	0	0	119.2
419	S	36.2	Very low	33.9	Very low	84 Å²	84	142.5 Å²	142.5	59%	0.587	78%	0.779	S	S	*	*			cis	-155.6	172.2	23.2	-31.9	0	0	0	0	116.4
420	Q	32.5	Very low	34.5	Very low	157 Å²	157	143.1 Å²	143.1	73%	0.734	78%	0.777	S	S	*	*			trans	74.3	100.8	153.7	-61.1	-73.7	-8	0	0	122
421	R	32.5	Very low	35.8	Very low	203 Å²	203	144.1 Å²	144.1	77%	0.766	78%	0.781	S	S	*	*				39.7	137.1	109.8	-86.7	-179.1	170.5	-165.1	-0.9	119.7
422	R	28.6	Very low	35.8	Very low	210 Å²	210	138 Å²	138	79%	0.792	78%	0.775	S	S	*	*			cis	-158.5	134.8	39.1	-79.4	-161.3	-179.8	-144.6	3.2	116
423	K	35.5	Very low	35.9	Very low	195 Å²	195	142.8 Å²	142.8	85%	0.848	78%	0.781	S	S	*	*				54.3	157.1	129.9	-83.1	-135.9	163.9	-162.6	0	124
424	P	53.3	Low	35.8	Very low	90 Å²	90	141.1 Å²	141.1	58%	0.584	77%	0.773	S	S	*	*			trans	-137.2	-170.1	-151.4	35.6	-11	0	0	0	115.3
425	D	31.1	Very low	35.6	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	77%	0.769	S	S	*	*				167.6	135.2	116.2	-88.7	-29	0	0	0	113.9
426	P	52.7	Low	35.7	Very low	116 Å²	116	140.7 Å²	140.7	75%	0.753	76%	0.76	S	S	*	*			trans	-109.4	161	170.6	39.2	-32.1	0	0	0	113.8
427	K	33.4	Very low	35.7	Very low	213 Å²	213	142.1 Å²	142.1	93%	0.926	76%	0.76	S	S	*	*			trans	-145	161.8	171.1	-81.3	-162.5	176.1	173.8	0	115.9
428	P	54.6	Low	35.5	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	76%	0.761	S	S	*	*			trans	-124	-178.1	-159.4	44.1	-31.3	0	0	0	115.9
429	K	30.7	Very low	35.4	Very low	202 Å²	202	148.7 Å²	148.7	88%	0.878	77%	0.765	S	S	*	*			trans	-168.8	159.9	160.1	-87.9	-155.4	177.3	173.3	0	112
430	V	37.9	Very low	35.9	Very low	129 Å²	129	149.9 Å²	149.9	78%	0.782	77%	0.771	S	S	*	*				-130.7	-119.5	-58	-161.1	0	0	0	0	110.6
431	P	50.6	Low	36.9	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	77%	0.771	S	S	*	*			trans	-131.5	-171.2	-162.1	47.3	-27.2	0	0	0	118.3
432	G	28.1	Very low	37.7	Very low	71 Å²	71	143.1 Å²	143.1	73%	0.732	77%	0.767	S	S	*	*			trans	-168.5	139.4	163.3	0	0	0	0	0	115.3
433	F	30.4	Very low	37.8	Very low	222 Å²	222	138.8 Å²	138.8	97%	0.974	77%	0.769	S	S	*	*			trans	-58.5	165	-176.1	-61.7	-101.6	0	0	0	116.3
434	G	27.6	Very low	37.8	Very low	62 Å²	62	133.8 Å²	133.8	64%	0.639	76%	0.764	S	S	*	*			cis	159.6	167.1	-5.1	0	0	0	0	0	114
435	N	29.3	Very low	37.3	Very low	151 Å²	151	134.6 Å²	134.6	81%	0.807	77%	0.769	S	S	*	*			trans	66.4	151.2	164.8	-69.2	11.2	0	0	0	120.6
436	T	31.8	Very low	37.2	Very low	100 Å²	100	136.6 Å²	136.6	61%	0.613	77%	0.771	S	S	*	*			cis	-172.2	168.1	-28.2	34.5	0	0	0	0	111.7
437	N	29.4	Very low	36.1	Very low	118 Å²	118	137 Å²	137	63%	0.631	77%	0.771	S	S	*	*			trans	97.7	135.3	153.2	-57.9	-28.6	0	0	0	118.1
438	F	28.9	Very low	35.9	Very low	179 Å²	179	134.3 Å²	134.3	79%	0.785	77%	0.767	S	S	*	*			cis	-144.5	135.4	-22.1	-84.9	-64.1	0	0	0	106.3
439	R	27.7	Very low	34.6	Very low	233 Å²	233	132.7 Å²	132.7	88%	0.879	77%	0.772	S	S	*	*				81.3	139.5	69.2	-126.4	-100.5	170.8	144.5	-0	113.9
440	P	46.6	Very low	34.5	Very low	109 Å²	109	126.6 Å²	126.6	71%	0.708	77%	0.766	S	S	*	*			trans	-116.7	-124.3	-152.2	24.6	0.2	0	0	0	115.8
441	P	54.1	Low	34.1	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	77%	0.765	S	S	*	*				-100.4	-144.1	-115.4	44.8	-30.4	0	0	0	111.6
442	P	50.5	Low	33.4	Very low	106 Å²	106	130.1 Å²	130.1	69%	0.688	77%	0.766	S	S	*	*			cis	-131.5	-156	-22	41.5	-22.8	0	0	0	112.9
443	S	30.1	Very low	33.5	Very low	119 Å²	119	131.7 Å²	131.7	83%	0.832	76%	0.761	S	S	*	*			trans	76.2	156.9	155	59.4	0	0	0	0	121.2
444	A	35.1	Very low	33.4	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	75%	0.751	S	S	*	*			trans	-110.4	-177.1	179.2	0	0	0	0	0	109.5
445	P	42.8	Very low	33.4	Very low	107 Å²	107	132 Å²	132	70%	0.695	76%	0.756	S	S	*	*			cis	-147.5	-177.3	11	45.6	-26.2	0	0	0	118.5
446	K	28.3	Very low	33.4	Very low	185 Å²	185	132.2 Å²	132.2	80%	0.804	75%	0.752	S	S	*	*			trans	70.7	151.4	147.5	-82.2	175.4	179	180	0	121.9
447	T	30.5	Very low	33.2	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	75%	0.754	S	S	*	*			trans	69.8	154.4	163.1	59.7	0	0	0	0	119.3
448	N	28.8	Very low	33.1	Very low	157 Å²	157	135.9 Å²	135.9	84%	0.84	77%	0.766	S	S	*	*			cis	-165.6	137.7	-43.4	-112.6	4	0	0	0	111.3
449	G	26.6	Very low	32.9	Very low	85 Å²	85	132.4 Å²	132.4	88%	0.876	76%	0.763	S	S	*	*			trans	75	158.6	157.2	0	0	0	0	0	118.5
450	G	29.3	Very low	32.9	Very low	73 Å²	73	126 Å²	126	75%	0.753	75%	0.754	S	S	*	*			cis	151.4	129.9	-13.8	0	0	0	0	0	116
451	S	30.5	Very low	32.1	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	76%	0.756	S	S	*	*			trans	178.5	145.9	158.5	-86.5	0	0	0	0	107.9
452	R	35.5	Very low	30.8	Very low	222 Å²	222	130.8 Å²	130.8	84%	0.838	76%	0.755	S	S	*	*			cis	-163.9	156.4	-5	-116.3	171.2	172.9	172.5	-3.8	104.8
453	T	28.8	Very low	29.8	Very low	103 Å²	103	133 Å²	133	63%	0.632	76%	0.756	S	S	*	*			cis	-168.9	144.9	35.1	11.2	0	0	0	0	110.2
454	I	28.1	Very low	29.6	Very low	147 Å²	147	135.1 Å²	135.1	75%	0.754	75%	0.751	S	S	*	*			trans	64	136.8	136	-64.9	169.7	0	0	0	119.1
455	L	28.5	Very low	29.1	Very low	144 Å²	144	136.5 Å²	136.5	75%	0.754	75%	0.75	S	S	*	*			cis	-170.6	168.3	-10.3	-100.8	-174.3	0	0	0	107.2
456	H	29.5	Very low	28.3	Very low	156 Å²	156	136.5 Å²	136.5	72%	0.722	75%	0.753	S	S	*	*			cis	-142.5	-85.1	-9.2	-173	-131.5	0	0	0	112.4
457	T	27.3	Very low	28.8	Very low	107 Å²	107	132.9 Å²	132.9	66%	0.656	75%	0.748	S	S	*	*			trans	-150.8	166.3	-162.8	55.1	0	0	0	0	116.6
458	Q	27.3	Very low	28.6	Very low	188 Å²	188	135 Å²	135	88%	0.879	75%	0.749	S	S	*	*			trans	-46.4	152.7	166.4	-55	163.4	-12.8	0	0	116
459	S	25.3	Very low	28.5	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	75%	0.745	S	S	*	*				-171.2	126.2	124	-167.6	0	0	0	0	115.2
460	S	26.8	Very low	28.6	Very low	99 Å²	99	134.5 Å²	134.5	69%	0.692	74%	0.739	S	S	*	*			trans	15.4	124.8	137.5	-25.9	0	0	0	0	122.4
461	Q	30	Very low	29.1	Very low	158 Å²	158	135.9 Å²	135.9	74%	0.738	74%	0.735	S	S	*	*				162.1	149.9	101.6	-83.8	-160.8	22.4	0	0	114.6
462	K	26.7	Very low	28.9	Very low	164 Å²	164	138.6 Å²	138.6	71%	0.713	74%	0.736	S	S	*	*			trans	23.3	142	142	-59.3	173.9	-176.4	168.6	0	119
463	Q	29.6	Very low	28.6	Very low	152 Å²	152	137.1 Å²	137.1	71%	0.71	74%	0.736	S	S	*	*			cis	-162.3	-160.4	12.8	-125.8	176.1	9.1	0	0	108
464	K	26.4	Very low	29	Very low	164 Å²	164	141 Å²	141	71%	0.713	75%	0.746	S	S	*	*			cis	-160.1	146.1	11	-139.1	166.9	-179.1	177.5	0	112.2
465	T	25.6	Very low	29.2	Very low	119 Å²	119	138.5 Å²	138.5	73%	0.73	74%	0.742	S	S	*	*			trans	22.8	141.7	146.5	59.9	0	0	0	0	124.9
466	S	25.1	Very low	29.3	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	75%	0.746	S	S	*	*			trans	-72.2	-161.2	152.3	58.8	0	0	0	0	111.8
467	P	38.7	Very low	29.5	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	75%	0.753	S	S	*	*			cis	-140.1	-145.1	2.4	39.3	-14.5	0	0	0	114.4
468	Q	27.5	Very low	29.7	Very low	170 Å²	170	138.9 Å²	138.9	79%	0.794	76%	0.755	S	S	*	*			trans	82.2	143.6	169.5	-58.3	-161.8	-37.7	0	0	117.1
469	T	26.7	Very low	29.9	Very low	121 Å²	121	136.4 Å²	136.4	74%	0.742	75%	0.747	S	S	*	*			cis	-157.6	151.1	-8.9	9.4	0	0	0	0	111.4
470	S	27.4	Very low	30.1	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	75%	0.749	S	S	*	*			trans	-82.7	158.8	152.9	-44.2	0	0	0	0	109.8
471	P	39.2	Very low	30.5	Very low	103 Å²	103	144.4 Å²	144.4	67%	0.669	76%	0.757	S	S	*	*				-157.4	-178.7	95.5	41.8	-23.1	0	0	0	117.6
472	Q	28	Very low	30.7	Very low	164 Å²	164	145 Å²	145	77%	0.766	76%	0.76	S	S	*	*			trans	75.6	103.4	147.1	-83.8	163.7	-45.9	0	0	122.7
473	K	29	Very low	31	Very low	192 Å²	192	143.3 Å²	143.3	84%	0.835	77%	0.766	S	S	*	*				36.5	118.2	117.1	-61.3	-176.9	178.5	-175.1	0	119.9
474	Q	36.8	Very low	31	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	77%	0.767	S	S	*	*				-178.9	112	124	-100.1	162.1	21.4	0	0	108.5
475	S	33	Very low	31	Very low	95 Å²	95	141.8 Å²	141.8	66%	0.664	77%	0.774	S	S	*	*				89	112.5	79.6	71.2	0	0	0	0	114.2
476	T	30.1	Very low	31.4	Very low	135 Å²	135	145.5 Å²	145.5	83%	0.828	78%	0.78	S	S	*	*			trans	7.1	130.2	151.3	51.9	0	0	0	0	119.6
477	L	33.6	Very low	31.8	Very low	169 Å²	169	150 Å²	150	89%	0.885	79%	0.786	S	S	*	*				-155.4	137.9	126.3	-113.9	173.2	0	0	0	112
478	T	31.3	Very low	31.5	Very low	111 Å²	111	154.9 Å²	154.9	68%	0.681	79%	0.791	S	S	*	*			trans	-106.8	168.1	171.4	42.2	0	0	0	0	110.7
479	N	31.6	Very low	31.6	Very low	136 Å²	136	152.9 Å²	152.9	73%	0.727	79%	0.793	S	S	*	*			trans	92.4	165.5	167.8	-51.8	-71.2	0	0	0	118
480	F	29.9	Very low	31.8	Very low	177 Å²	177	152.4 Å²	152.4	78%	0.776	79%	0.785	S	S	*	*			trans	72.4	121.8	-172.1	-56.9	-86.1	0	0	0	113.8
481	F	34.5	Very low	31.7	Very low	195 Å²	195	156.3 Å²	156.3	86%	0.855	79%	0.791	S	S	*	*			cis	-128.5	154.6	15.5	-78.2	-92.4	0	0	0	114.6
482	Q	34.6	Very low	31.3	Very low	169 Å²	169	159.6 Å²	159.6	79%	0.79	80%	0.798	S	S	*	*			trans	-101.8	148.7	165.1	-66.3	174.5	-18	0	0	110.1
483	P	32	Very low	31.2	Very low	129 Å²	129	161.3 Å²	161.3	84%	0.838	81%	0.806	S	S	*	*			trans	-74.1	132.8	167.4	30.8	-32.9	0	0	0	111
484	V	30	Very low	31.1	Very low	122 Å²	122	156.9 Å²	156.9	74%	0.739	80%	0.799	S	S	*	*			trans	-104.2	118.7	-174.4	175.5	0	0	0	0	111.9
485	N	26.8	Very low	30.6	Very low	162 Å²	162	153.9 Å²	153.9	87%	0.866	80%	0.798	S	S	*	*			trans	-72.6	132.8	168.4	-87.1	-73.5	0	0	0	112
486	K	34.9	Very low	30.3	Very low	198 Å²	198	155.8 Å²	155.8	86%	0.861	80%	0.801	S	S	*	*			trans	-142.2	134.9	156.9	-74.5	-167.1	176.9	-179.7	0	110.9
487	K	31.6	Very low	30.1	Very low	201 Å²	201	156.2 Å²	156.2	87%	0.874	80%	0.797	S	S	*	*			trans	-96.5	151.9	172.2	-69.3	-174.7	177	-177.1	0	110.6
488	R	34	Very low	29.7	Very low	210 Å²	210	156.1 Å²	156.1	79%	0.792	79%	0.793	S	S	*	*			trans	8.7	148	150.4	-86	-172.2	-95.9	163.9	-9.2	120.2
489	P	29.5	Very low	29.7	Very low	128 Å²	128	155.9 Å²	155.9	83%	0.831	80%	0.796	S	S	*	*				-94	170.3	113.5	-23.8	36.3	0	0	0	114.6
490	L	30.4	Very low	29.5	Very low	112 Å²	112	153.7 Å²	153.7	59%	0.586	80%	0.798	S	S	*	*			trans	-126	138.4	175.6	168	71.2	0	0	0	106.5	E492	L490-E492 HydrophobicContact CD1-CB 4.42Å; L490-E492 HydrophobicContact CG-CB 4.49Å
491	E	26.1	Very low	29.9	Very low	191 Å²	191	151.7 Å²	151.7	89%	0.893	80%	0.802	S	S	*	*			trans	-128.7	139.6	159.2	-70.2	-76.8	124.4	0	0	106
492	E	30.3	Very low	29.6	Very low	171 Å²	171	151.9 Å²	151.9	80%	0.799	80%	0.802	S	S	*	*			trans	-147.7	113.8	-170.9	175.2	174.3	-134.8	0	0	107.2	L490	L490-E492 HydrophobicContact CD1-CB 4.42Å; L490-E492 HydrophobicContact CG-CB 4.49Å
493	E	25.8	Very low	29.3	Very low	201 Å²	201	155.4 Å²	155.4	94%	0.939	81%	0.809	S	S	*	*			trans	-145.7	151.6	177	-155.5	168.3	-140.7	0	0	110.7
494	S	26.5	Very low	29.3	Very low	98 Å²	98	155.5 Å²	155.5	69%	0.685	81%	0.809	S	S	*	*			trans	-129.4	146.8	-153.7	54.1	0	0	0	0	113.6
495	S	26	Very low	29.2	Very low	121 Å²	121	154 Å²	154	85%	0.846	81%	0.809	S	S	*	*			trans	-157.6	94.8	157.6	-23.1	0	0	0	0	114.1
496	D	26.7	Very low	29.7	Very low	136 Å²	136	152.3 Å²	152.3	73%	0.727	81%	0.808	S	S	*	*				24.7	129.1	125.3	-75.6	-42.2	0	0	0	124.2
497	I	25.9	Very low	29.1	Very low	144 Å²	144	152.3 Å²	152.3	74%	0.738	81%	0.811	S	S	*	*			trans	61.5	115.1	131.3	-44.1	161.3	0	0	0	119.9
498	M	26.3	Very low	29	Very low	166 Å²	166	148.2 Å²	148.2	82%	0.818	81%	0.807	S	S	*	*				173.8	130.4	111.9	-90.5	-163.5	94.5	0	0	115.3
499	S	29.4	Very low	28.8	Very low	106 Å²	106	144 Å²	144	74%	0.741	81%	0.81	S	S	*	*			trans	54.4	134.2	140.9	-57	0	0	0	0	124.3
500	A	28.8	Very low	28.6	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	81%	0.811	S	S	*	*			trans	-86.9	170.8	161.8	0	0	0	0	0	112.3
501	P	36.9	Very low	28.5	Very low	134 Å²	134	143 Å²	143	87%	0.87	82%	0.822	S	S	*	*				-146.1	-169.4	99.1	39.6	-22.9	0	0	0	116.4
502	K	28.3	Very low	28.7	Very low	199 Å²	199	139 Å²	139	87%	0.865	82%	0.815	S	S	*	*			trans	-68.7	155.6	-160.6	-63.8	171.8	175.6	176.4	0	118.4
503	R	30.1	Very low	28.8	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	81%	0.811	S	S	*	*			trans	-13.3	147.1	146.7	-65.3	-179.7	178.4	164.2	0.6	116.7
504	P	31.8	Very low	29	Very low	131 Å²	131	134.4 Å²	134.4	85%	0.851	80%	0.795	S	S	*	*				-131.5	-172.3	85.5	39.9	-30.3	0	0	0	115.5
505	A	27.8	Very low	29.1	Very low	90 Å²	90	135.8 Å²	135.8	74%	0.744	80%	0.799	S	S	*	*			trans	-94	173.8	-173.4	0	0	0	0	0	112.6
506	P	35.8	Very low	29.2	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	80%	0.795	S	S	*	*			trans	-87.6	155.8	-165.3	35.2	-35.1	0	0	0	114.7
507	E	22.7	Very low	29.3	Very low	197 Å²	197	134.4 Å²	134.4	92%	0.921	79%	0.789	S	S	*	*			trans	-107.8	161.3	169.9	-76.8	-159.5	152.5	0	0	113.8
508	S	30.6	Very low	29.5	Very low	115 Å²	115	136 Å²	136	80%	0.804	80%	0.798	S	S	*	*			trans	-82.5	157.2	-170.1	54.8	0	0	0	0	116.3
509	S	29.1	Very low	29.5	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	80%	0.795	S	S	*	*			trans	-164.5	152	145.9	48	0	0	0	0	109.9
510	A	26.3	Very low	29.4	Very low	104 Å²	104	133 Å²	133	86%	0.86	80%	0.799	S	S	*	*			cis	-155.8	-179.1	-19.2	0	0	0	0	0	108.7
511	S	27.4	Very low	29.4	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	80%	0.799	S	S	*	*			trans	-126.2	160.5	-170.2	66.4	0	0	0	0	115.6
512	S	30.7	Very low	29	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	80%	0.801	S	S	*	*			trans	-144.3	119.5	153.3	43.6	0	0	0	0	107.1
513	K	31.9	Very low	29	Very low	165 Å²	165	136.6 Å²	136.6	72%	0.717	80%	0.797	S	S	*	*				80.2	136.2	71.4	-78.5	-175.2	148.5	-70.1	0	112.7
514	D	30.8	Very low	28.9	Very low	111 Å²	111	132.5 Å²	132.5	59%	0.594	79%	0.79	S	S	*	*			cis	-153.3	176.8	13	-122.2	-27.8	0	0	0	115.6
515	T	27.7	Very low	30	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	78%	0.783	S	S	*	*			trans	79.9	162.9	-177.3	79	0	0	0	0	114.8
516	N	28.5	Very low	29.9	Very low	143 Å²	143	132.6 Å²	132.6	77%	0.765	79%	0.786	S	S	*	*			cis	-147.4	-178.9	8.7	-152.3	1.8	0	0	0	114.2
517	S	28.3	Very low	29.9	Very low	85 Å²	85	134.6 Å²	134.6	59%	0.594	79%	0.789	S	S	*	*			trans	-55.6	129.9	174	50.8	0	0	0	0	114.3
518	L	29.8	Very low	30.8	Very low	178 Å²	178	130.2 Å²	130.2	93%	0.932	78%	0.778	S	S	*	*				84.4	123.1	59.8	-72.7	166.1	0	0	0	114.2
519	G	26.3	Very low	30.7	Very low	74 Å²	74	131.9 Å²	131.9	76%	0.763	78%	0.777	S	S	*	*			trans	-166.1	8.9	-170.2	0	0	0	0	0	122.4
520	V	28.6	Very low	30.5	Very low	136 Å²	136	134.6 Å²	134.6	82%	0.824	78%	0.776	S	S	*	*			trans	59.3	109.6	151.5	-178.3	0	0	0	0	122.1
521	S	27.6	Very low	30.4	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	77%	0.765	S	S	*	*			trans	77.8	145.2	137.7	-84	0	0	0	0	127.4
522	K	29.1	Very low	31.8	Very low	210 Å²	210	133 Å²	133	91%	0.913	77%	0.766	S	S	*	*			trans	86.7	163.8	147	-81.5	178	178.5	-178.7	0	120.4
523	K	27.8	Very low	31.6	Very low	183 Å²	183	133.1 Å²	133.1	80%	0.796	77%	0.766	S	S	*	*			trans	-146.6	123.5	-142.4	-146.1	-152.7	-179.8	-177.6	0	113.1
524	M	29	Very low	31.7	Very low	156 Å²	156	128.9 Å²	128.9	77%	0.768	76%	0.762	S	S	*	*			trans	66.4	170	159.2	-43.8	-146.7	77.2	0	0	118.3
525	P	54.1	Low	31.7	Very low	106 Å²	106	129.3 Å²	129.3	69%	0.688	77%	0.768	S	S	*	*				-141.9	166.1	-66.2	41.9	-26.6	0	0	0	115
526	S	24.9	Very low	31.9	Very low	118 Å²	118	128 Å²	128	83%	0.825	76%	0.764	S	S	*	*			trans	177.3	161.5	145.3	38	0	0	0	0	113.5
527	L	35.8	Very low	31.9	Very low	169 Å²	169	128.1 Å²	128.1	89%	0.885	76%	0.76	S	S	*	*			trans	-102.7	153.1	155.5	-67.8	168.7	0	0	0	108.1
528	P	42.1	Very low	32	Very low	106 Å²	106	130.6 Å²	130.6	69%	0.688	77%	0.772	S	S	*	*				-155.2	156.9	120	36.9	-19.5	0	0	0	117.1
529	L	29.1	Very low	32.8	Very low	149 Å²	149	127.4 Å²	127.4	78%	0.78	76%	0.762	S	S	*	*			trans	56.2	165.8	147.9	-86.8	62.3	0	0	0	118.6
530	E	24.8	Very low	33.2	Very low	179 Å²	179	130.6 Å²	130.6	84%	0.836	76%	0.761	S	S	*	*			cis	-146.2	173	-3.4	-140.3	164.3	164	0	0	110.8
531	G	24.5	Very low	33.2	Very low	61 Å²	61	130.9 Å²	130.9	63%	0.629	75%	0.753	S	S	*	*			trans	-103.5	-131.3	-178.8	0	0	0	0	0	113.9
532	P	56.2	Low	33.5	Very low	125 Å²	125	130.3 Å²	130.3	81%	0.812	75%	0.749	S	S	*	*			cis	-83.9	-142.9	-5	38.6	-37.3	0	0	0	110.9
533	S	27.3	Very low	33.9	Very low	110 Å²	110	124.1 Å²	124.1	77%	0.769	74%	0.737	S	S	*	*			cis	-166.1	173.4	6.9	-118.4	0	0	0	0	108.6
534	A	32.5	Very low	34.2	Very low	76 Å²	76	120.7 Å²	120.7	63%	0.628	74%	0.736	S	S	*	*			cis	176.8	162.3	-36.1	0	0	0	0	0	108.6
535	V	31.3	Very low	34.3	Very low	120 Å²	120	119.8 Å²	119.8	73%	0.727	73%	0.734	S	S	*	*			trans	68.1	113.3	170.2	-165.7	0	0	0	0	115.2
536	S	31.5	Very low	33.4	Very low	97 Å²	97	121 Å²	121	68%	0.678	73%	0.734	S	S	*	*			cis	-169.3	152.5	-3.7	49.8	0	0	0	0	110.9
537	E	28.4	Very low	33.5	Very low	146 Å²	146	124 Å²	124	68%	0.682	73%	0.733	S	S	*	*			cis	-164	158.4	-22.8	-131.7	70.4	-98	0	0	106.5
538	T	30.9	Very low	33.2	Very low	138 Å²	138	121.2 Å²	121.2	85%	0.847	73%	0.728	S	S	*	*			trans	-134.3	106.4	-166.9	55.1	0	0	0	0	116.4
539	P	46.5	Very low	32.4	Very low	110 Å²	110	119.6 Å²	119.6	71%	0.714	73%	0.73	S	S	*	*			trans	-89.7	178.7	145.2	36.4	-30.4	0	0	0	110.6
540	L	35.4	Very low	32.3	Very low	141 Å²	141	124.8 Å²	124.8	74%	0.738	74%	0.739	S	S	*	*			cis	-157.3	164.7	-40.8	-88.3	179.8	0	0	0	104.2
541	E	27.8	Very low	32.4	Very low	142 Å²	142	120.5 Å²	120.5	66%	0.664	73%	0.734	S	S	*	*			cis	-133.7	162.5	13.6	-148.1	60.9	-100.7	0	0	105.8
542	S	34.5	Very low	32.5	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	75%	0.745	S	S	*	*			cis	64.5	142.9	39.2	-87.2	0	0	0	0	113.9
543	A	37.6	Very low	31.1	Very low	80 Å²	80	131.2 Å²	131.2	66%	0.661	75%	0.747	S	S	*	*			cis	-159.3	-179.8	-12.2	0	0	0	0	0	110.3
544	S	34.6	Very low	31	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	75%	0.749	S	S	*	*			trans	69.8	161.8	173.6	83.3	0	0	0	0	115.8
545	D	31.6	Very low	30.6	Very low	137 Å²	137	136.7 Å²	136.7	73%	0.733	75%	0.752	S	S	*	*			cis	-168	160.7	-20.6	-108.4	13.3	0	0	0	107.5
546	L	35.1	Very low	30.3	Very low	132 Å²	132	139.1 Å²	139.1	69%	0.691	76%	0.755	S	S	*	*			cis	-140.4	-125.9	-10.1	-129.4	170.6	0	0	0	106.5
547	F	26.9	Very low	30	Very low	182 Å²	182	143 Å²	143	80%	0.798	76%	0.763	S	S	*	*			cis	-151.8	-151.3	-9.4	-149.7	-11.1	0	0	0	111.1
548	S	27.7	Very low	30.5	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	76%	0.757	S	S	*	*			trans	-110	160.1	-175.1	-62.7	0	0	0	0	112.5
549	G	25.7	Very low	30.2	Very low	71 Å²	71	145.1 Å²	145.1	73%	0.732	76%	0.76	S	S	*	*			cis	155.6	161	-7.2	0	0	0	0	0	114.2
550	R	27.2	Very low	29.5	Very low	258 Å²	258	145 Å²	145	97%	0.974	76%	0.762	S	S	*	*			trans	75.7	163.6	170.7	-155.9	165.6	-178.5	163.4	1.4	117.8
551	A	28.3	Very low	29.5	Very low	89 Å²	89	150.5 Å²	150.5	74%	0.736	77%	0.773	S	S	*	*			trans	-148.9	167.8	-165.6	0	0	0	0	0	113.7
552	E	24.9	Very low	29.9	Very low	185 Å²	185	152.2 Å²	152.2	86%	0.864	78%	0.778	S	S	*	*			trans	-166	174.8	160.2	-106	-56	143.7	0	0	110.5
553	R	27.1	Very low	30.1	Very low	226 Å²	226	157.5 Å²	157.5	85%	0.853	78%	0.784	S	S	*	*			trans	-107.7	169.8	-179.2	-72.9	-177.1	173.4	-173.7	-1.1	114.1
554	L	25.8	Very low	30	Very low	152 Å²	152	160.3 Å²	160.3	80%	0.796	78%	0.781	S	S	*	*				173.4	144.6	126.2	-90.3	161.9	0	0	0	115
555	E	24.6	Very low	30.2	Very low	150 Å²	150	161.2 Å²	161.2	70%	0.701	77%	0.773	S	S	*	*			trans	49	121.6	153.8	-47.4	-49.1	78.1	0	0	127.2
556	E	23.4	Very low	30.5	Very low	171 Å²	171	161.3 Å²	161.3	80%	0.799	77%	0.771	S	S	*	*				43.3	108.2	129.5	-58.5	-158.8	149.3	0	0	126.2
557	E	26	Very low	30.8	Very low	179 Å²	179	160.3 Å²	160.3	84%	0.836	76%	0.762	S	S	*	*				75	177.5	117.5	-119.3	-130.3	155.6	0	0	121.3
558	P	39.9	Very low	31.6	Very low	87 Å²	87	156.6 Å²	156.6	57%	0.565	75%	0.747	S	S	*	*				-119.6	166.7	-96.3	43.3	-32.6	0	0	0	116.1
559	R	24.6	Very low	32.2	Very low	241 Å²	241	158 Å²	158	91%	0.909	74%	0.742	S	S	*	*			trans	-167.7	159.6	151.5	-112.8	153.1	-169.5	-171.2	2.7	117
560	S	30.5	Very low	33.2	Very low	107 Å²	107	158.2 Å²	158.2	75%	0.748	73%	0.729	S	S	*	*			trans	83.7	44	157.3	74.7	0	0	0	0	121.6	K562	S560-K562 PolarHBondContact O-N 3.44Å
561	R	35.4	Very low	34.1	Very low	256 Å²	256	151.1 Å²	151.1	97%	0.966	71%	0.709	S	S	*	*			trans	-66.8	88.6	141.5	-78.8	-173.2	179.3	176.6	0.3	108.9
562	K	35.8	Very low	35.1	Very low	179 Å²	179	153.9 Å²	153.9	78%	0.778	71%	0.705	S	S	*	*			trans	-158.4	25.8	170.6	-142.7	-175.5	179.4	-177.8	0	116.1	S560	S560-K562 PolarHBondContact O-N 3.44Å
563	R	38.6	Very low	35.7	Very low	205 Å²	205	151.2 Å²	151.2	77%	0.774	69%	0.694	S	S	*	*	S	Bend	trans	-117.4	-15.5	179.1	-161.5	169.2	-177.4	163.8	3.1	114.8
564	K	37.4	Very low	36.7	Very low	139 Å²	139	145.3 Å²	145.3	60%	0.604	68%	0.676	S	S	*	*	S	Bend	trans	-92.3	-35.1	-172.7	-158.7	168.8	-171	-80	0	114.4	M566 E567 E568	K564-M566 VanDerWaalsContact C-N 3.29Å; K564-M566 PolarHBondContact O-N 2.99Å; K564-E567 PolarHBondContact O-N 2.7Å; K564-E568 IonicContact NZ-OE1 3.69Å; K564-E568 PolarHBondContact NZ-OE1 2.98Å; K564-E568 PolarHBondContact O-N 3.35Å; K564-E568 VanDerWaalsContact O-N 3.16Å
565	E	38.7	Very low	37.9	Very low	129 Å²	129	144.2 Å²	144.2	60%	0.603	67%	0.666	S	S	*	*	H	α-helix	trans	-61.8	-37.7	177.6	-67.4	161.9	141	0	0	111.4	E567 E568 E569	E565-E567 VanDerWaalsContact C-N 3.29Å; E565-E567 PolarHBondContact O-N 3.09Å; E565-E568 PolarHBondContact O-N 3.42Å; E565-E569 PolarHBondContact O-N 3.5Å
566	M	36.3	Very low	38.6	Very low	139 Å²	139	142.2 Å²	142.2	69%	0.685	66%	0.66	S	S	*	*	H	α-helix	trans	-68.6	-25	178.6	-158.8	-178.9	86.5	0	0	113.3	K564 V570	K564-M566 VanDerWaalsContact C-N 3.29Å; K564-M566 PolarHBondContact O-N 2.99Å; M566-V570 WeakPolarHBondContact O-CB 3.46Å; M566-V570 WeakPolarHBondContact O-CG2 3.36Å; M566-V570 PolarHBondContact O-N 3.37Å
567	E	42.2	Very low	39.7	Very low	111 Å²	111	139.7 Å²	139.7	52%	0.519	65%	0.648	S	S	.	*	H	α-helix	trans	-79	-41.7	173.1	-69.1	173.1	159.9	0	0	110.3	K564 E565 V570 I571	K564-E567 PolarHBondContact O-N 2.7Å; E565-E567 VanDerWaalsContact C-N 3.29Å; E565-E567 PolarHBondContact O-N 3.09Å; E567-V570 PolarHBondContact O-N 3.25Å; E567-I571 WeakPolarHBondContact O-CD1 3.49Å; E567-I571 VanDerWaalsContact O-CG1 3.23Å; E567-I571 WeakPolarHBondContact O-CG1 3.4Å; E567-I571 PolarHBondContact O-N 3.29Å
568	E	43.7	Very low	40.5	Very low	104 Å²	104	134.9 Å²	134.9	49%	0.486	64%	0.635	S	S	.	*	H	α-helix	trans	-69.3	-34.2	178.5	-71.7	172.5	-168.8	0	0	113	K564 E565 K572	K564-E568 IonicContact NZ-OE1 3.69Å; K564-E568 PolarHBondContact NZ-OE1 2.98Å; K564-E568 PolarHBondContact O-N 3.35Å; K564-E568 VanDerWaalsContact O-N 3.16Å; E565-E568 PolarHBondContact O-N 3.42Å; E568-K572 WeakPolarHBondContact O-CB 3.38Å; E568-K572 PolarHBondContact O-N 2.64Å
569	E	39.9	Very low	40.7	Very low	141 Å²	141	136.3 Å²	136.3	66%	0.659	64%	0.636	S	S	*	*	H	α-helix	trans	-71.2	-38.8	172.7	-73.7	-173.2	144.7	0	0	112.9	E565 K572 M573	E565-E569 PolarHBondContact O-N 3.5Å; E569-K572 PolarHBondContact O-N 3.44Å; E569-M573 PolarHBondContact O-N 3.23Å
570	V	47	Very low	41.1	Very low	74 Å²	74	132.4 Å²	132.4	45%	0.448	63%	0.63	S	S	.	*	H	α-helix	trans	-64.8	-47.2	176.3	165.6	0	0	0	0	111	M566 E567 K572 M573 E574	M566-V570 WeakPolarHBondContact O-CB 3.46Å; M566-V570 WeakPolarHBondContact O-CG2 3.36Å; M566-V570 PolarHBondContact O-N 3.37Å; E567-V570 PolarHBondContact O-N 3.25Å; V570-K572 PolarHBondContact O-N 3.44Å; V570-M573 PolarHBondContact O-N 3.33Å; V570-M573 VanDerWaalsContact O-N 3.14Å; V570-E574 PolarHBondContact O-N 3.22Å
571	I	45.9	Very low	41.9	Very low	110 Å²	110	131.3 Å²	131.3	56%	0.564	62%	0.623	S	S	*	*	H	α-helix	trans	-55.7	-42.4	175.5	-69.9	163.8	0	0	0	110.9	E567 M573 E574 E575	E567-I571 WeakPolarHBondContact O-CD1 3.49Å; E567-I571 VanDerWaalsContact O-CG1 3.23Å; E567-I571 WeakPolarHBondContact O-CG1 3.4Å; E567-I571 PolarHBondContact O-N 3.29Å; I571-M573 PolarHBondContact O-N 2.94Å; I571-E574 PolarHBondContact O-N 3.22Å; I571-E575 WeakPolarHBondContact O-CB 3.39Å; I571-E575 PolarHBondContact O-N 3.23Å
572	K	48.6	Very low	42.2	Very low	147 Å²	147	127.1 Å²	127.1	64%	0.639	61%	0.614	S	S	*	*	H	α-helix	trans	-71.1	-28.6	-178.5	-161.9	172.5	-170.7	175.6	0	113.4	E568 E569 V570 L576	E568-K572 WeakPolarHBondContact O-CB 3.38Å; E568-K572 PolarHBondContact O-N 2.64Å; E569-K572 PolarHBondContact O-N 3.44Å; V570-K572 PolarHBondContact O-N 3.44Å; K572-L576 PolarHBondContact O-N 3.04Å
573	M	39.3	Very low	42.7	Very low	129 Å²	129	126 Å²	126	64%	0.635	62%	0.617	S	S	*	*	H	α-helix	trans	-76.1	-42	173	-164.5	172	-65.9	0	0	111.3	E569 V570 I571 E575 L576 E577	E569-M573 PolarHBondContact O-N 3.23Å; V570-M573 PolarHBondContact O-N 3.33Å; V570-M573 VanDerWaalsContact O-N 3.14Å; I571-M573 PolarHBondContact O-N 2.94Å; M573-E575 VanDerWaalsContact C-N 3.33Å; M573-E575 PolarHBondContact O-N 3.5Å; M573-L576 PolarHBondContact O-N 3.14Å; M573-E577 PolarHBondContact O-N 3.28Å
574	E	48.1	Very low	42.7	Very low	101 Å²	101	123.9 Å²	123.9	47%	0.472	62%	0.617	S	S	.	*	H	α-helix	trans	-61	-38.3	173.6	-74.6	-169.6	-139.7	0	0	112.8	K222 V570 I571 E577 S578	K222-E574 IonicContact NZ-OE2 3.48Å; K222-E574 PolarHBondContact NZ-OE2 2.95Å; V570-E574 PolarHBondContact O-N 3.22Å; I571-E574 PolarHBondContact O-N 3.22Å; E574-E577 PolarHBondContact O-N 3.34Å; E574-S578 WeakPolarHBondContact O-CB 3.23Å; E574-S578 PolarHBondContact O-N 3.41Å
575	E	49.3	Very low	42.6	Very low	129 Å²	129	125.6 Å²	125.6	60%	0.603	63%	0.633	S	S	*	*	H	α-helix	trans	-67.2	-38.1	176.3	-167.7	168.7	-132.9	0	0	111.5	I571 M573 S578 I579	I571-E575 WeakPolarHBondContact O-CB 3.39Å; I571-E575 PolarHBondContact O-N 3.23Å; M573-E575 VanDerWaalsContact C-N 3.33Å; M573-E575 PolarHBondContact O-N 3.5Å; E575-S578 WeakPolarHBondContact O-CB 3.17Å; E575-S578 PolarHBondContact O-N 3.42Å; E575-I579 WeakPolarHBondContact O-CG1 3.48Å; E575-I579 PolarHBondContact O-N 2.98Å; E575-I579 VanDerWaalsContact O-N 3.09Å
576	L	39.3	Very low	42.1	Very low	108 Å²	108	128.8 Å²	128.8	57%	0.565	64%	0.641	S	S	*	*	H	α-helix	trans	-66.7	-43.4	174.2	-126.4	72.1	0	0	0	112.5	K572 M573 S578 I579 M580	K572-L576 PolarHBondContact O-N 3.04Å; M573-L576 PolarHBondContact O-N 3.14Å; L576-S578 VanDerWaalsContact C-N 3.28Å; L576-S578 PolarHBondContact O-N 2.99Å; L576-I579 PolarHBondContact O-N 2.83Å; L576-M580 WeakPolarHBondContact O-CG 3.05Å; L576-M580 PolarHBondContact O-N 3.33Å
577	E	46.2	Very low	42.1	Very low	119 Å²	119	130 Å²	130	56%	0.556	65%	0.649	S	S	*	*	H	α-helix	trans	-63	-34.6	174.1	-74.5	-164.4	177.6	0	0	112.2	M573 E574 M580 S581	M573-E577 PolarHBondContact O-N 3.28Å; E574-E577 PolarHBondContact O-N 3.34Å; E577-M580 PolarHBondContact O-N 3.21Å; E577-S581 WeakPolarHBondContact O-CB 3.43Å; E577-S581 PolarHBondContact O-N 2.82Å; E577-S581 PolarHBondContact O-OG 2.74Å
578	S	43.2	Very low	41.5	Very low	78 Å²	78	127.4 Å²	127.4	55%	0.545	65%	0.652	S	S	.	*	H	α-helix	trans	-65.1	-41.4	174.8	-164.5	0	0	0	0	111.8	E574 E575 L576 S581	E574-S578 WeakPolarHBondContact O-CB 3.23Å; E574-S578 PolarHBondContact O-N 3.41Å; E575-S578 WeakPolarHBondContact O-CB 3.17Å; E575-S578 PolarHBondContact O-N 3.42Å; L576-S578 VanDerWaalsContact C-N 3.28Å; L576-S578 PolarHBondContact O-N 2.99Å; S578-S581 PolarHBondContact O-N 2.95Å
579	I	43.9	Very low	40.8	Very low	117 Å²	117	129.1 Å²	129.1	60%	0.6	67%	0.665	S	S	*	*	H	α-helix	trans	-66.4	-40.4	176.4	-69	164.3	0	0	0	111.1	E575 L576 S581	E575-I579 WeakPolarHBondContact O-CG1 3.48Å; E575-I579 PolarHBondContact O-N 2.98Å; E575-I579 VanDerWaalsContact O-N 3.09Å; L576-I579 PolarHBondContact O-N 2.83Å; I579-S581 PolarHBondContact O-N 3.31Å
580	M	33.4	Very low	40.1	Very low	159 Å²	159	131.8 Å²	131.8	78%	0.783	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-1.7	177.5	-68.1	-174.4	66.9	0	0	114.2	L576 E577	L576-M580 WeakPolarHBondContact O-CG 3.05Å; L576-M580 PolarHBondContact O-N 3.33Å; E577-M580 PolarHBondContact O-N 3.21Å
581	S	47.1	Very low	39.2	Very low	84 Å²	84	132.6 Å²	132.6	59%	0.587	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-4.8	-178.9	-63.1	0	0	0	0	114.8	E577 S578 I579	E577-S581 WeakPolarHBondContact O-CB 3.43Å; E577-S581 PolarHBondContact O-N 2.82Å; E577-S581 PolarHBondContact O-OG 2.74Å; S578-S581 PolarHBondContact O-N 2.95Å; I579-S581 PolarHBondContact O-N 3.31Å
582	E	42.5	Very low	38.8	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	70%	0.698	S	S	*	*	S	Bend	trans	-96	-12.4	-165.8	-120.9	-171.8	169.3	0	0	116.8
583	D	45.4	Very low	37.7	Very low	156 Å²	156	132.2 Å²	132.2	83%	0.834	71%	0.709	S	S	*	*			trans	-130.3	96.8	179.4	-86.8	-46	0	0	0	112.1
584	M	39.3	Very low	37	Very low	159 Å²	159	130 Å²	130	78%	0.783	72%	0.719	S	S	*	*			trans	-147.7	44.3	172.7	-90.6	-54.7	-57.6	0	0	114	Y586	M584-Y586 PolarHBondContact O-N 3.36Å
585	D	35.8	Very low	36.1	Very low	175 Å²	175	134.9 Å²	134.9	94%	0.936	74%	0.742	S	S	*	*			trans	-83.5	85.2	167.2	-83.9	-22.4	0	0	0	110.6
586	Y	28.6	Very low	34.9	Very low	197 Å²	197	132.3 Å²	132.3	77%	0.773	75%	0.75	S	S	*	*			trans	-145.6	117.7	171.5	-159.9	-95.9	0	0	0	113.7	M584	M584-Y586 PolarHBondContact O-N 3.36Å
587	L	35	Very low	34.3	Very low	163 Å²	163	136.5 Å²	136.5	85%	0.853	77%	0.766	S	S	*	*			trans	-134.1	118.1	165.5	-71.7	175	0	0	0	108.6
588	G	29.3	Very low	33.3	Very low	57 Å²	57	139.9 Å²	139.9	59%	0.588	78%	0.779	S	S	*	*			trans	-88.2	-177.2	162.5	0	0	0	0	0	111.2
589	D	30.6	Very low	32.4	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	80%	0.795	S	S	*	*			cis	-153.5	146.7	5.8	175.4	39.6	0	0	0	109.9
590	E	25.1	Very low	31.4	Very low	197 Å²	197	147.5 Å²	147.5	92%	0.921	80%	0.803	S	S	*	*			trans	-154.9	140.9	153	-138.9	-178.1	168.9	0	0	109.9
591	S	28	Very low	31	Very low	91 Å²	91	146 Å²	146	64%	0.636	80%	0.803	S	S	*	*			trans	-149.5	178.4	-161.9	61.5	0	0	0	0	112.4
592	P	37.4	Very low	29.8	Very low	124 Å²	124	147.5 Å²	147.5	81%	0.805	81%	0.809	S	S	*	*				-128.5	162.5	-64.7	37.8	-25.6	0	0	0	113
593	S	24.4	Very low	29	Very low	125 Å²	125	145.4 Å²	145.4	87%	0.874	81%	0.807	S	S	*	*			trans	-152.2	137.3	169.2	71.1	0	0	0	0	114.8
594	G	25.5	Very low	27.9	Very low	82 Å²	82	149 Å²	149	85%	0.845	81%	0.809	S	S	*	*			trans	108.9	114.7	163.7	0	0	0	0	0	115.5
595	H	28.3	Very low	27.2	Very low	204 Å²	204	153.7 Å²	153.7	94%	0.944	82%	0.818	S	S	*	*			trans	-84.5	140.3	172.1	-83.3	-51	0	0	0	112.5
596	G	24.3	Very low	26.6	Very low	75 Å²	75	148.6 Å²	148.6	77%	0.773	81%	0.807	S	S	*	*			trans	-141.3	139.6	157.7	0	0	0	0	0	108.7
597	Q	27.4	Very low	26.6	Very low	195 Å²	195	147.3 Å²	147.3	91%	0.911	81%	0.813	S	S	*	*			trans	-94.3	156.2	-170.2	-71.3	-179.5	-48.6	0	0	113.5
598	K	25.2	Very low	26.1	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	81%	0.812	S	S	*	*			trans	-66.2	153.3	170.1	-60.1	-178.4	174.8	-169	0	111.1
599	E	24	Very low	26.1	Very low	189 Å²	189	150.3 Å²	150.3	88%	0.883	82%	0.821	S	S	*	*			trans	-141.2	143.9	131.5	-156.4	162.7	-132.4	0	0	110.1
600	E	23.3	Very low	25.9	Very low	165 Å²	165	152.5 Å²	152.5	77%	0.771	83%	0.827	S	S	*	*			trans	-140.3	110.6	-176.6	178.7	-166.8	169.7	0	0	108.1
601	V	24.8	Very low	26	Very low	128 Å²	128	150.2 Å²	150.2	78%	0.776	82%	0.818	S	S	*	*			trans	-137.5	127.6	169.3	-170.1	0	0	0	0	110.3
602	T	22.6	Very low	25.9	Very low	116 Å²	116	155.2 Å²	155.2	71%	0.712	83%	0.832	S	S	*	*			trans	-66.2	162.6	174	48.2	0	0	0	0	112.5
603	V	23.8	Very low	25.3	Very low	123 Å²	123	154.3 Å²	154.3	75%	0.745	83%	0.828	S	S	*	*				-175	121.8	119.5	145.4	0	0	0	0	113.2
604	R	23.8	Very low	25.4	Very low	233 Å²	233	153.5 Å²	153.5	88%	0.879	82%	0.822	S	S	*	*			trans	21.8	121.7	147.2	-53.2	174.3	176.5	159.6	-0.7	120.1
605	R	23.7	Very low	25.4	Very low	256 Å²	256	157.8 Å²	157.8	97%	0.966	82%	0.82	S	S	*	*			trans	-72.3	135.7	148.9	-163.2	-178.5	-158.2	173.6	7.5	109.6
606	G	24	Very low	25.2	Very low	69 Å²	69	154.6 Å²	154.6	71%	0.711	82%	0.815	S	S	*	*			trans	-153.1	142.1	176	0	0	0	0	0	111.8
607	L	28.7	Very low	25.3	Very low	170 Å²	170	156.7 Å²	156.7	89%	0.89	81%	0.813	S	S	*	*			trans	-82.5	151	-176.9	-79.3	77.2	0	0	0	112.3
608	A	24.8	Very low	25.1	Very low	101 Å²	101	155.9 Å²	155.9	84%	0.835	81%	0.809	S	S	*	*			trans	-130.7	136.7	145.5	0	0	0	0	0	109.2
609	K	28.7	Very low	25.2	Very low	181 Å²	181	151.4 Å²	151.4	79%	0.787	80%	0.802	S	S	*	*			trans	-87.9	158.9	167.5	-60.9	175.4	-179.6	177.1	0	108.6
610	Q	26	Very low	25.3	Very low	188 Å²	188	147.5 Å²	147.5	88%	0.879	80%	0.796	S	S	*	*			trans	-135.9	140.5	138.7	-161.7	161.8	3.1	0	0	109.8
611	M	27.1	Very low	25.6	Very low	148 Å²	148	144 Å²	144	73%	0.729	80%	0.795	S	S	*	*			trans	-107.7	149.7	174.1	-61.5	-174.5	72.5	0	0	108.8
612	Q	27.1	Very low	25.7	Very low	197 Å²	197	147 Å²	147	92%	0.921	80%	0.797	S	S	*	*			trans	-144.9	148.5	143.3	-114.3	170.1	8.5	0	0	109.2
613	S	24.2	Very low	25.9	Very low	104 Å²	104	150.9 Å²	150.9	73%	0.727	80%	0.804	S	S	*	*			trans	-137.9	137.6	-169.3	54.9	0	0	0	0	109.9
614	S	25.8	Very low	26	Very low	108 Å²	108	153.5 Å²	153.5	76%	0.755	81%	0.808	S	S	*	*			trans	-150.5	130.3	159.8	29.5	0	0	0	0	110.5
615	H	25.7	Very low	26	Very low	173 Å²	173	153.1 Å²	153.1	80%	0.801	81%	0.807	S	S	*	*			trans	3	151.9	149.1	-45.4	-78.7	0	0	0	119
616	T	24	Very low	26.2	Very low	136 Å²	136	146.4 Å²	146.4	83%	0.834	79%	0.794	S	S	*	*			cis	-149.9	163.7	32.8	-42.2	0	0	0	0	114
617	V	25.8	Very low	26.3	Very low	120 Å²	120	152 Å²	152	73%	0.727	80%	0.795	S	S	*	*			trans	-71	143.1	172	174.1	0	0	0	0	111.5
618	E	23.5	Very low	26.2	Very low	177 Å²	177	151.8 Å²	151.8	83%	0.827	79%	0.789	S	S	*	*				-177.3	-174.7	112.7	-153.3	110.4	-96.8	0	0	110.5
619	S	27.7	Very low	26.3	Very low	98 Å²	98	153.2 Å²	153.2	69%	0.685	78%	0.779	S	S	*	*			trans	-150.7	161.2	-155.7	71.7	0	0	0	0	116.7
620	S	27.1	Very low	26.4	Very low	107 Å²	107	153.4 Å²	153.4	75%	0.748	78%	0.782	S	S	*	*			trans	81	116.8	147.1	78.4	0	0	0	0	122.2
621	A	27.8	Very low	26.4	Very low	91 Å²	91	149.8 Å²	149.8	75%	0.752	77%	0.773	S	S	*	*				84.3	148.7	123.6	0	0	0	0	0	124.1
622	K	28.2	Very low	26.4	Very low	192 Å²	192	149.9 Å²	149.9	84%	0.835	78%	0.782	S	S	*	*			trans	70	111.2	155.2	-76.4	174.7	178.8	172.5	0	121.3
623	K	27.1	Very low	26.3	Very low	196 Å²	196	144.3 Å²	144.3	85%	0.852	78%	0.777	S	S	*	*				43.4	152.7	119.6	-71.5	-171	174.3	-175.2	0	122.1
624	Q	24.8	Very low	26.6	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	79%	0.786	S	S	*	*			trans	90.2	105.1	158.7	-141.9	157.9	-61.2	0	0	113.9
625	R	25.2	Very low	26.5	Very low	226 Å²	226	142.8 Å²	142.8	85%	0.853	79%	0.785	S	S	*	*				76.2	117.4	63.5	-177.6	-155.7	-171.4	-169.1	4.5	112.7
626	V	26.5	Very low	26.7	Very low	115 Å²	115	143.4 Å²	143.4	70%	0.697	79%	0.788	S	S	*	*			trans	170.7	123.5	139.6	143.9	0	0	0	0	112.9
627	Y	26.3	Very low	27	Very low	186 Å²	186	148.2 Å²	148.2	73%	0.729	79%	0.791	S	S	*	*			trans	61.2	164.3	150.3	-74.1	-116.9	0	0	0	119.6
628	Q	27.3	Very low	27.5	Very low	165 Å²	165	148.4 Å²	148.4	77%	0.771	80%	0.795	S	S	*	*			cis	-134.2	178.6	10	-163.4	143.4	16.1	0	0	114.8
629	E	27.5	Very low	27.7	Very low	132 Å²	132	143.3 Å²	143.3	62%	0.617	79%	0.789	S	S	*	*			trans	-93.3	165.7	-163.9	-48.1	131.2	104.6	0	0	115.1
630	Q	28.8	Very low	27.8	Very low	184 Å²	184	147.2 Å²	147.2	86%	0.86	80%	0.801	S	S	*	*				-163.1	122.5	112.2	-106.4	-179.9	11.2	0	0	114.7
631	T	27.4	Very low	27.7	Very low	112 Å²	112	145.4 Å²	145.4	69%	0.687	80%	0.8	S	S	*	*			trans	16.2	118.6	140.8	48	0	0	0	0	119.8
632	V	27.3	Very low	27.9	Very low	150 Å²	150	149.4 Å²	149.4	91%	0.909	81%	0.808	S	S	*	*				83.6	123.6	73.2	165.9	0	0	0	0	114.3
633	G	25.5	Very low	27.9	Very low	80 Å²	80	147.8 Å²	147.8	83%	0.825	81%	0.808	S	S	*	*			trans	-173.5	120.4	168.3	0	0	0	0	0	110.4
634	A	28.4	Very low	28	Very low	109 Å²	109	148.5 Å²	148.5	90%	0.901	81%	0.811	S	S	*	*			trans	-126.4	150.4	-175.3	0	0	0	0	0	111.1
635	G	25.2	Very low	28	Very low	71 Å²	71	146.6 Å²	146.6	73%	0.732	80%	0.802	S	S	*	*			trans	171.9	109.6	172.9	0	0	0	0	0	117.3
636	Q	28.5	Very low	28.1	Very low	187 Å²	187	145.8 Å²	145.8	87%	0.874	80%	0.799	S	S	*	*			trans	59.9	120.5	136.1	-56.9	-174.9	12.6	0	0	121.1
637	R	31.3	Very low	28	Very low	237 Å²	237	145 Å²	145	89%	0.894	80%	0.798	S	S	*	*			trans	-70.5	155.1	136.9	-64.1	175.7	177.1	165.9	-2.5	108.5
638	P	36	Very low	28.2	Very low	124 Å²	124	144.8 Å²	144.8	81%	0.805	80%	0.804	S	S	*	*				-119.1	164	110	-6.3	25.5	0	0	0	112.4
639	G	28.3	Very low	28.2	Very low	69 Å²	69	144.8 Å²	144.8	71%	0.711	80%	0.804	S	S	*	*			trans	-119.2	146.1	164.3	0	0	0	0	0	110.1
640	L	28.6	Very low	28	Very low	180 Å²	180	144.2 Å²	144.2	94%	0.942	81%	0.805	S	S	*	*			trans	-138.6	132.5	163.5	-80.6	174.1	0	0	0	107.5
641	G	26.4	Very low	28	Very low	69 Å²	69	143.2 Å²	143.2	71%	0.711	81%	0.805	S	S	*	*			trans	-96.5	157.7	165.7	0	0	0	0	0	110.4
642	L	31.8	Very low	27.8	Very low	176 Å²	176	140.9 Å²	140.9	92%	0.921	80%	0.803	S	S	*	*			trans	-145.2	121.1	160.6	-88.6	179.6	0	0	0	108.7
643	D	27.9	Very low	27.8	Very low	157 Å²	157	142.9 Å²	142.9	84%	0.84	80%	0.803	S	S	*	*			trans	-69.3	154.4	166.5	-56.7	-83.1	0	0	0	111.1
644	K	29.6	Very low	27.9	Very low	211 Å²	211	147.7 Å²	147.7	92%	0.917	80%	0.804	S	S	*	*			trans	-149.6	124.9	146.9	-136.4	168.9	-173.9	176	0	112.5
645	E	25.1	Very low	27.9	Very low	138 Å²	138	147.3 Å²	147.3	65%	0.645	79%	0.794	S	S	*	*			trans	-78.5	170.1	179.5	-47	171.8	79.6	0	0	113.1
646	R	25.4	Very low	27.9	Very low	210 Å²	210	149.6 Å²	149.6	79%	0.792	79%	0.79	S	S	*	*			trans	64.9	151	143.1	-76.4	164	-161.3	-104.5	4.3	117.8
647	S	26.2	Very low	27.9	Very low	97 Å²	97	150.8 Å²	150.8	68%	0.678	79%	0.786	S	S	*	*			cis	-132.5	158.8	-5.1	-48.7	0	0	0	0	107.3
648	Q	29.1	Very low	27.6	Very low	182 Å²	182	147.2 Å²	147.2	85%	0.85	78%	0.779	S	S	*	*			cis	58.5	151.7	46.4	-85.8	-166.1	-10	0	0	115.7
649	Q	27.7	Very low	27.2	Very low	165 Å²	165	146.9 Å²	146.9	77%	0.771	78%	0.775	S	S	*	*			trans	79.7	140.9	-177.9	-59	-167.1	-3.9	0	0	115.5
650	N	24.2	Very low	27.1	Very low	121 Å²	121	149.1 Å²	149.1	65%	0.647	78%	0.775	S	S	*	*			cis	-160	169.8	-4.3	-118.4	-10.6	0	0	0	113.2
651	L	27.7	Very low	27.2	Very low	162 Å²	162	144.7 Å²	144.7	85%	0.848	76%	0.759	S	S	*	*			trans	69.1	149.9	165.7	-58.4	136.1	0	0	0	116.8
652	G	23.9	Very low	27.3	Very low	63 Å²	63	147.6 Å²	147.6	65%	0.649	76%	0.758	S	S	*	*			cis	168.7	135.7	-10	0	0	0	0	0	114.7
653	E	27.1	Very low	27.3	Very low	192 Å²	192	147.4 Å²	147.4	90%	0.897	75%	0.75	S	S	*	*			trans	64.8	173.7	150.7	-63.4	-175.2	123.5	0	0	121.4
654	Q	27.3	Very low	27.6	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	74%	0.738	S	S	*	*			trans	-97.8	149.7	-160.2	-55.4	157.4	-36.4	0	0	111.6
655	S	28.1	Very low	27.7	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	72%	0.723	S	S	*	*				161.8	168.2	94.4	-148.8	0	0	0	0	113.7
656	D	25.6	Very low	27.8	Very low	119 Å²	119	138.8 Å²	138.8	64%	0.636	72%	0.722	S	S	*	*			trans	43.8	119.2	153.3	-75.4	-67.3	0	0	0	123.8
657	R	27.6	Very low	28	Very low	212 Å²	212	134.6 Å²	134.6	80%	0.8	72%	0.715	S	S	*	*				30.8	127.4	118.5	-58.2	177.3	171.1	-171.7	-2.9	118.9
658	H	26.1	Very low	28	Very low	162 Å²	162	137.7 Å²	137.7	75%	0.75	72%	0.722	S	S	*	*				-172.1	132	109.1	-110.3	-113.8	0	0	0	109.3
659	V	27.5	Very low	28.1	Very low	118 Å²	118	134 Å²	134	72%	0.715	72%	0.716	S	S	*	*				76.8	136	98.2	120.4	0	0	0	0	113.7
660	V	26.4	Very low	28.7	Very low	116 Å²	116	132.1 Å²	132.1	70%	0.703	72%	0.719	S	S	*	*			cis	-167.2	167.8	5.4	69.7	0	0	0	0	113.4
661	S	30.3	Very low	29	Very low	87 Å²	87	133 Å²	133	61%	0.608	72%	0.724	S	S	*	*			trans	70.3	151.9	152.1	-79.1	0	0	0	0	120.3
662	N	28.3	Very low	29.3	Very low	129 Å²	129	132.9 Å²	132.9	69%	0.69	72%	0.718	S	S	*	*			cis	-141.2	149.8	-4	-97.4	-23.4	0	0	0	108.1
663	K	33	Very low	29.4	Very low	173 Å²	173	137.5 Å²	137.5	75%	0.752	73%	0.728	S	S	*	*				64.9	143.8	55.2	-81.3	-141.2	164.2	-160.8	0	113.5
664	T	33.3	Very low	29.5	Very low	98 Å²	98	133.6 Å²	133.6	60%	0.601	72%	0.722	S	S	*	*			cis	-167.7	171.3	-9.8	17.1	0	0	0	0	106.2
665	D	30.9	Very low	29.5	Very low	112 Å²	112	130.9 Å²	130.9	60%	0.599	72%	0.723	S	S	*	*			cis	-161.5	-176.8	3.7	-116.8	-30.8	0	0	0	106.2
666	N	28.9	Very low	29.5	Very low	115 Å²	115	137 Å²	137	62%	0.615	73%	0.731	S	S	*	*			cis	-148.2	143.9	-1.6	-109.4	-49.7	0	0	0	104.7
667	N	27.8	Very low	30.8	Very low	122 Å²	122	136.3 Å²	136.3	65%	0.652	73%	0.732	S	S	*	*				55.3	132	78.1	-60.7	-52.7	0	0	0	117.2
668	I	28.1	Very low	31.5	Very low	161 Å²	161	131.3 Å²	131.3	83%	0.826	73%	0.727	S	S	*	*				-170.7	147.6	101.9	-91.4	159.1	0	0	0	110.1
669	S	29.4	Very low	31.5	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	73%	0.734	S	S	*	*			trans	-115.5	-156.2	177.8	-39.1	0	0	0	0	109.1
670	P	41.5	Very low	31.7	Very low	127 Å²	127	135 Å²	135	83%	0.825	74%	0.736	S	S	*	*			cis	-137.9	-142.9	6.7	44	-21.2	0	0	0	114.7
671	N	29.8	Very low	32.5	Very low	140 Å²	140	135.2 Å²	135.2	75%	0.749	74%	0.74	S	S	*	*			trans	-94.8	158.8	-159.4	-90	-11.2	0	0	0	118
672	H	33.9	Very low	32.6	Very low	158 Å²	158	134.8 Å²	134.8	73%	0.731	74%	0.741	S	S	*	*			trans	40.8	117.5	148	-69.4	-73.4	0	0	0	121.5
673	N	25.7	Very low	32.9	Very low	161 Å²	161	132.9 Å²	132.9	86%	0.861	74%	0.744	S	S	*	*				-175.2	166	97.1	-103.1	-37.7	0	0	0	116.6
674	S	30.7	Very low	32.6	Very low	110 Å²	110	130.8 Å²	130.8	77%	0.769	75%	0.746	S	S	*	*			trans	-42	140.6	-176.3	-177	0	0	0	0	119.9
675	S	27.1	Very low	32.6	Very low	124 Å²	124	130.2 Å²	130.2	87%	0.867	75%	0.751	S	S	*	*				177.8	-177.9	123.3	47.2	0	0	0	0	113.5
676	R	26.8	Very low	32.6	Very low	229 Å²	229	130.4 Å²	130.4	86%	0.864	76%	0.756	S	S	*	*			trans	-137.4	-164.8	-165.5	-157	-160.7	176.1	-174.9	0.4	109.3
677	P	53.1	Low	32.9	Very low	104 Å²	104	132.5 Å²	132.5	68%	0.675	76%	0.762	S	S	*	*				-80	-151.2	-86.2	30.8	-9.8	0	0	0	111.5
678	P	43.8	Very low	33.1	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	76%	0.76	S	S	*	*			cis	-147.5	160.2	3.6	42.7	-21.9	0	0	0	120.8
679	K	25.1	Very low	33.2	Very low	205 Å²	205	133 Å²	133	89%	0.891	75%	0.754	S	S	*	*				157.2	158	121.3	-88.8	-179.1	177.5	179.1	0	114.6
680	M	30.7	Very low	33.2	Very low	154 Å²	154	136.8 Å²	136.8	76%	0.759	76%	0.758	S	S	*	*			trans	-112.4	173.7	-174.9	-95	-75.3	-85.8	0	0	109.8	A682	M680-A682 HydrophobicContact CE-CB 3.65Å
681	P	44.5	Very low	32.7	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	75%	0.748	S	S	*	*			cis	-128.4	155	39.7	16	10.8	0	0	0	116
682	A	32.2	Very low	32.8	Very low	78 Å²	78	137.2 Å²	137.2	65%	0.645	75%	0.749	S	S	*	*				90.3	142.6	56.1	0	0	0	0	0	113.1	M680	M680-A682 HydrophobicContact CE-CB 3.65Å
683	A	33.8	Very low	32.6	Very low	90 Å²	90	138.5 Å²	138.5	74%	0.744	76%	0.755	S	S	*	*			cis	-141.3	-162.9	-5.8	0	0	0	0	0	108.5
684	T	27.7	Very low	33.1	Very low	129 Å²	129	138.3 Å²	138.3	79%	0.791	75%	0.754	S	S	*	*			cis	-155.2	141.1	6.8	1.8	0	0	0	0	106.1
685	A	33.5	Very low	33.1	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	76%	0.761	S	S	*	*				62.9	133	85.7	0	0	0	0	0	115
686	T	30.2	Very low	33.4	Very low	116 Å²	116	143.1 Å²	143.1	71%	0.712	76%	0.761	S	S	*	*			cis	-135.1	137.6	8.7	34.5	0	0	0	0	110.1
687	E	36	Very low	33.6	Very low	160 Å²	160	137.3 Å²	137.3	75%	0.748	76%	0.762	S	S	*	*				70.2	136.4	76.4	-65.8	-177.2	155.2	0	0	114.2
688	E	31	Very low	32.3	Very low	128 Å²	128	137.8 Å²	137.8	60%	0.598	77%	0.768	S	S	*	*			cis	-155.9	161.4	8.6	-130.6	-173.7	-177.9	0	0	115.6
689	K	29.8	Very low	31.4	Very low	165 Å²	165	140.9 Å²	140.9	72%	0.717	77%	0.771	S	S	*	*			trans	35.2	132.6	144.8	-79.6	167.2	-163.9	159	0	121.6
690	K	30	Very low	31.6	Very low	183 Å²	183	136.5 Å²	136.5	80%	0.796	76%	0.756	S	S	*	*			cis	64	139.2	20.4	-103	-171.2	176.4	-168.8	0	114
691	V	30.8	Very low	31.6	Very low	104 Å²	104	137.2 Å²	137.2	63%	0.63	76%	0.758	S	S	*	*			cis	-172.8	144.2	38.9	86.6	0	0	0	0	112
692	F	32	Very low	30.8	Very low	172 Å²	172	138.3 Å²	138.3	75%	0.754	76%	0.757	S	S	*	*			trans	62.5	174.8	146.3	-77.4	-133.8	0	0	0	119.5
693	E	29.7	Very low	30.7	Very low	186 Å²	186	140.1 Å²	140.1	87%	0.869	76%	0.76	S	S	*	*			cis	-130.1	163.9	13.6	-72.5	176.2	139.3	0	0	114.3
694	D	35.7	Very low	30.6	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	76%	0.761	S	S	*	*			trans	-90.4	156.7	165.7	-67.9	-60.6	0	0	0	110.4
695	D	31.3	Very low	30.8	Very low	172 Å²	172	143.1 Å²	143.1	92%	0.92	75%	0.753	S	S	*	*			trans	-157.3	150.2	152.8	-136.4	-15.4	0	0	0	112.7
696	D	32.7	Very low	30.6	Very low	163 Å²	163	146 Å²	146	87%	0.872	76%	0.756	S	S	*	*			trans	-103.4	128.9	-175.4	-102.8	-44.4	0	0	0	112
697	A	31.3	Very low	30.4	Very low	107 Å²	107	147.6 Å²	147.6	88%	0.884	76%	0.755	S	S	*	*			trans	-156.6	152.7	164.3	0	0	0	0	0	113.6
698	S	27.4	Very low	30	Very low	115 Å²	115	146 Å²	146	80%	0.804	76%	0.756	S	S	*	*			trans	-116.8	168.6	179.1	60.1	0	0	0	0	112.3
699	F	24.5	Very low	29.7	Very low	171 Å²	171	146.9 Å²	146.9	75%	0.75	77%	0.765	S	S	*	*			trans	137.6	96.8	140.5	-160.9	-89.9	0	0	0	115.8
700	I	28.4	Very low	29.8	Very low	113 Å²	113	145.4 Å²	145.4	58%	0.579	76%	0.763	S	S	*	*				49.9	126.4	120.8	-67.9	173.8	0	0	0	121.6
701	E	31.7	Very low	29.6	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.794	77%	0.765	S	S	*	*			trans	80.2	148.4	148.8	-80.6	160.6	178.9	0	0	124.7
702	D	26.5	Very low	29.5	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	78%	0.775	S	S	*	*			trans	67.6	152.9	156.4	-67.4	-4.8	0	0	0	124.3
703	V	30.4	Very low	30	Very low	116 Å²	116	143.9 Å²	143.9	70%	0.703	78%	0.776	S	S	*	*			cis	179	159.2	-46.3	138.5	0	0	0	0	109.5
704	E	32.2	Very low	29.9	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	77%	0.771	S	S	*	*			trans	73.4	122.5	164.2	-85.5	-176.2	156.7	0	0	124.2
705	L	30.9	Very low	29.5	Very low	120 Å²	120	139.8 Å²	139.8	63%	0.628	77%	0.768	S	S	*	*			trans	67.4	123.9	130.4	-66.6	166.2	0	0	0	124
706	L	30.4	Very low	29.4	Very low	145 Å²	145	141 Å²	141	76%	0.759	77%	0.768	S	S	*	*				172.4	114.1	100.6	-83.4	177.5	0	0	0	107.9
707	Q	25.9	Very low	29.1	Very low	150 Å²	150	137.1 Å²	137.1	70%	0.701	75%	0.75	S	S	*	*				91.5	124.7	71.6	-90.3	-166.9	-1.9	0	0	115.4
708	V	26.6	Very low	29	Very low	125 Å²	125	143.6 Å²	143.6	76%	0.758	75%	0.752	S	S	*	*			trans	71.8	139	152.3	179.6	0	0	0	0	115.5
709	D	25.6	Very low	28.9	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	76%	0.755	S	S	*	*			cis	-141.5	175.5	22.6	-141.7	-25.4	0	0	0	115.1
710	I	32	Very low	29	Very low	134 Å²	134	139.5 Å²	139.5	69%	0.687	76%	0.756	S	S	*	*			trans	-120.5	139.8	178.5	-65.3	170.7	0	0	0	111.3	Q712	I710-Q712 HydrophobicContact CG2-CG 4.3Å
711	P	26.8	Very low	29.1	Very low	130 Å²	130	141.3 Å²	141.3	84%	0.844	77%	0.772	S	S	*	*			trans	-115.8	141.1	140.4	-7.7	27.8	0	0	0	113.1
712	Q	27.8	Very low	29	Very low	179 Å²	179	144 Å²	144	84%	0.836	78%	0.775	S	S	*	*			trans	-101.5	167	178	-102.1	-161.8	8.3	0	0	113.3	I710	I710-Q712 HydrophobicContact CG2-CG 4.3Å
713	P	41.5	Very low	29.6	Very low	119 Å²	119	143.3 Å²	143.3	77%	0.773	78%	0.779	S	S	*	*			trans	-94.4	161.7	-170.9	37.9	-36.7	0	0	0	115.2
714	A	27.9	Very low	29.4	Very low	92 Å²	92	144 Å²	144	76%	0.76	78%	0.783	S	S	*	*			trans	-158.9	155.4	166.9	0	0	0	0	0	107.8
715	E	28.8	Very low	29.5	Very low	163 Å²	163	145.1 Å²	145.1	76%	0.762	79%	0.788	S	S	*	*			cis	-161.3	150.3	-10.4	-124	-167.2	126.9	0	0	108.3	T717	E715-T717 PolarHBondContact OE1-OG1 3.37Å
716	E	27.7	Very low	29.3	Very low	198 Å²	198	146.9 Å²	146.9	93%	0.925	80%	0.796	S	S	*	*			trans	-167.3	146.8	134.8	-116.7	-178.3	-169.7	0	0	111.2
717	T	27.9	Very low	29.3	Very low	82 Å²	82	147.3 Å²	147.3	50%	0.503	79%	0.792	S	S	.	*			trans	-149.5	133	-141.6	-67.2	0	0	0	0	114.5	E715	E715-T717 PolarHBondContact OE1-OG1 3.37Å
718	R	27.9	Very low	29.6	Very low	243 Å²	243	147.4 Å²	147.4	92%	0.917	79%	0.792	S	S	*	*			trans	71.2	155.5	168.5	-68	161.6	-168.1	170.9	4.2	115.6
719	A	25.6	Very low	29.8	Very low	105 Å²	105	149.7 Å²	149.7	87%	0.868	80%	0.795	S	S	*	*			cis	-143.1	-173.9	29.1	0	0	0	0	0	115.4
720	A	27	Very low	30.1	Very low	94 Å²	94	149.9 Å²	149.9	78%	0.777	80%	0.801	S	S	*	*			trans	-130.3	158.4	-170.3	0	0	0	0	0	113.8
721	V	29.8	Very low	30.1	Very low	151 Å²	151	152.5 Å²	152.5	92%	0.915	81%	0.807	S	S	*	*			trans	-142.3	159.3	168.4	173.1	0	0	0	0	111.1
722	R	30	Very low	30.4	Very low	226 Å²	226	155.6 Å²	155.6	85%	0.853	81%	0.811	S	S	*	*			trans	-87.6	165.5	-174.2	-74	176.1	177.4	170.4	-1.5	114.1
723	P	39.6	Very low	31	Very low	129 Å²	129	152.3 Å²	152.3	84%	0.838	81%	0.808	S	S	*	*			trans	-78.1	154.3	-178.3	32.3	-37.8	0	0	0	114.6
724	V	26.4	Very low	30.8	Very low	130 Å²	130	156.6 Å²	156.6	79%	0.788	81%	0.814	S	S	*	*			trans	-142.8	149.7	177.5	179.2	0	0	0	0	110.6	I726	V724-I726 HydrophobicContact CG1-CD1 4.38Å
725	Q	32.8	Very low	31.6	Very low	185 Å²	185	158.2 Å²	158.2	86%	0.864	81%	0.814	S	S	*	*			trans	-90.8	146.9	175.6	-57.7	170.6	-10.7	0	0	111.9
726	I	28.6	Very low	32.5	Very low	158 Å²	158	155.5 Å²	155.5	81%	0.81	81%	0.805	S	S	*	*			trans	-140.8	150.7	158.7	-81.5	103.7	0	0	0	109.6	V724	V724-I726 HydrophobicContact CG1-CD1 4.38Å
727	K	29.7	Very low	33.8	Very low	153 Å²	153	153.2 Å²	153.2	67%	0.665	79%	0.794	S	S	*	*			trans	-110.8	157.8	175.6	-56.5	175.3	73.1	-133	0	111.1
728	E	31.9	Very low	35.3	Very low	152 Å²	152	156.9 Å²	156.9	71%	0.71	81%	0.811	S	S	*	*			trans	70.2	150.3	144.5	-79.7	153.1	170	0	0	122
729	E	31	Very low	36.8	Very low	174 Å²	174	150.8 Å²	150.8	81%	0.813	80%	0.796	S	S	*	*			trans	52.4	104.7	161.1	-65.2	-169.9	173.1	0	0	121.2
730	V	32.5	Very low	38.5	Very low	151 Å²	151	150.4 Å²	150.4	92%	0.915	78%	0.784	S	S	*	*			trans	-118.7	140.7	143.4	178.5	0	0	0	0	108.4
731	K	31.5	Very low	39.8	Very low	188 Å²	188	151.8 Å²	151.8	82%	0.817	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-80.9	150.8	-163.1	-67.4	161.3	-178.5	167.4	0	113.6
732	E	33.4	Very low	41.2	Very low	195 Å²	195	154.3 Å²	154.3	91%	0.911	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-59.6	133.3	168.7	-60	177.2	136.2	0	0	111.4
733	S	39	Very low	42.5	Very low	111 Å²	111	151 Å²	151	78%	0.776	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-85.4	137.8	168.8	54.3	0	0	0	0	110.5
734	K	37.1	Very low	43.2	Very low	208 Å²	208	152.3 Å²	152.3	90%	0.904	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-54.3	136.1	-175	-61.4	179.4	-179.4	-179.6	0	112.8
735	V	45.3	Very low	44.4	Very low	126 Å²	126	154.3 Å²	154.3	76%	0.764	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-86	144.9	170.9	179.9	0	0	0	0	109.7
736	D	47.4	Very low	45.8	Very low	107 Å²	107	150.3 Å²	150.3	57%	0.572	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-73.8	143.3	177.1	-162.3	-3.9	0	0	0	111.9
737	E	55.6	Low	46.9	Very low	150 Å²	150	148.4 Å²	148.4	70%	0.701	75%	0.747	S	S	*	*	S	Bend	trans	-92.3	-30.7	-170.3	-90	-75.9	77.8	0	0	114	L739 K741	E737-L739 VanDerWaalsContact C-N 3.33Å; E737-L739 PolarHBondContact O-N 3.19Å; E737-K741 PolarHBondContact O-NZ 3.38Å; E737-K741 IonicContact OE1-NZ 2.61Å; E737-K741 PolarHBondContact OE1-NZ 3.27Å
738	D	58.4	Low	48.3	Very low	159 Å²	159	150.3 Å²	150.3	85%	0.85	76%	0.756	S	S	*	*			trans	-85.6	10.2	-170.9	-81.7	-46.6	0	0	0	115.6
739	L	60.9	Low	49.1	Very low	114 Å²	114	151.7 Å²	151.7	60%	0.597	76%	0.755	S	S	*	*	S	Bend	trans	-78.6	128.6	172.9	-82.5	161.9	0	0	0	111.8	E737 K741	E737-L739 VanDerWaalsContact C-N 3.33Å; E737-L739 PolarHBondContact O-N 3.19Å; L739-K741 PolarHBondContact O-N 3.39Å
740	P	60.9	Low	50.4	Low	97 Å²	97	148 Å²	148	63%	0.63	75%	0.748	S	S	*	*			trans	-71	90.4	-173.2	27.7	-35.1	0	0	0	112.9
741	K	54.4	Low	51.4	Low	124 Å²	124	148.8 Å²	148.8	54%	0.539	75%	0.747	S	S	.	*			trans	-67.6	128.1	174.8	-64.8	135.2	-176.7	160.5	0	109.8	E737 L739	E737-K741 PolarHBondContact O-NZ 3.38Å; E737-K741 IonicContact OE1-NZ 2.61Å; E737-K741 PolarHBondContact OE1-NZ 3.27Å; L739-K741 PolarHBondContact O-N 3.39Å
742	K	58.5	Low	52.7	Low	204 Å²	204	144.9 Å²	144.9	89%	0.887	74%	0.739	S	S	*	*			trans	95	52.9	-177.3	-53.4	169.2	-177.5	171.8	0	117.9
743	L	57.9	Low	53.5	Low	155 Å²	155	142.7 Å²	142.7	81%	0.812	74%	0.738	S	S	*	*			trans	-87.8	-3	165.5	-76.1	171.4	0	0	0	115
744	L	53.1	Low	54.1	Low	157 Å²	157	143.3 Å²	143.3	82%	0.822	74%	0.738	S	S	*	*			trans	-127.6	124.3	176.8	-74	169.9	0	0	0	110.7
745	M	52.1	Low	54.6	Low	173 Å²	173	137.7 Å²	137.7	85%	0.852	73%	0.73	S	S	*	*			trans	-112.7	101.6	169.5	-176.6	175.4	73.9	0	0	108.4	E747	M745-E747 PolarHBondContact O-N 3.16Å
746	V	61.8	Low	54.6	Low	101 Å²	101	137.8 Å²	137.8	61%	0.612	73%	0.733	S	S	*	*			trans	-91.6	100.2	-178.6	-172.9	0	0	0	0	109.4	F748	V746-F748 HydrophobicContact CB-CE2 4.3Å; V746-F748 HydrophobicContact CG1-CD2 4.04Å; V746-F748 HydrophobicContact CG1-CE1 4.16Å; V746-F748 HydrophobicContact CG1-CE2 3.49Å; V746-F748 VanDerWaalsContact CG1-CE2 3.49Å; V746-F748 HydrophobicContact CG1-CZ 3.56Å
747	E	52.6	Low	54	Low	117 Å²	117	138.4 Å²	138.4	55%	0.547	75%	0.745	S	S	.	*			trans	-93.9	102.9	177.1	-165.5	-170.6	166.5	0	0	111.1	M745 R749	M745-E747 PolarHBondContact O-N 3.16Å; E747-R749 VanDerWaalsContact CD-NE 3.28Å; E747-R749 HydrophobicContact CG-CG 4.26Å; E747-R749 PolarHBondContact O-N 2.88Å; E747-R749 IonicContact OE1-CZ 2.72Å; E747-R749 VanDerWaalsContact OE1-CZ 3.24Å; E747-R749 IonicContact OE1-NE 2.64Å; E747-R749 PolarHBondContact OE1-NE 3.01Å; E747-R749 IonicContact OE1-NH2 3.35Å; E747-R749 PolarHBondContact OE1-NH2 3.16Å; E747-R749 IonicContact OE2-CZ 3.63Å; E747-R749 IonicContact OE2-NE 2.74Å; E747-R749 PolarHBondContact OE2-NE 2.77Å; E747-R749 IonicContact OE2-NH2 3.62Å; E747-R749 PolarHBondContact OE2-NH2 3.21Å
748	F	58.8	Low	53.2	Low	193 Å²	193	140.5 Å²	140.5	85%	0.846	75%	0.752	S	S	*	*			trans	-79.3	96.3	175.3	-67	-81	0	0	0	111.4	V746	V746-F748 HydrophobicContact CB-CE2 4.3Å; V746-F748 HydrophobicContact CG1-CD2 4.04Å; V746-F748 HydrophobicContact CG1-CE1 4.16Å; V746-F748 HydrophobicContact CG1-CE2 3.49Å; V746-F748 VanDerWaalsContact CG1-CE2 3.49Å; V746-F748 HydrophobicContact CG1-CZ 3.56Å
749	R	49.1	Very low	52.2	Low	181 Å²	181	138.9 Å²	138.9	68%	0.683	75%	0.75	S	S	*	*			trans	-90.9	127	170.6	-66.4	-170.4	179.6	163	12.7	111.3	E747	E747-R749 VanDerWaalsContact CD-NE 3.28Å; E747-R749 HydrophobicContact CG-CG 4.26Å; E747-R749 PolarHBondContact O-N 2.88Å; E747-R749 IonicContact OE1-CZ 2.72Å; E747-R749 VanDerWaalsContact OE1-CZ 3.24Å; E747-R749 IonicContact OE1-NE 2.64Å; E747-R749 PolarHBondContact OE1-NE 3.01Å; E747-R749 IonicContact OE1-NH2 3.35Å; E747-R749 PolarHBondContact OE1-NH2 3.16Å; E747-R749 IonicContact OE2-CZ 3.63Å; E747-R749 IonicContact OE2-NE 2.74Å; E747-R749 PolarHBondContact OE2-NE 2.77Å; E747-R749 IonicContact OE2-NH2 3.62Å; E747-R749 PolarHBondContact OE2-NH2 3.21Å
750	S	58.2	Low	51.2	Low	96 Å²	96	143 Å²	143	67%	0.671	76%	0.763	S	S	*	*			trans	-77.4	135.3	166.5	-176.5	0	0	0	0	110.4	T752	S750-T752 PolarHBondContact OG-N 2.95Å; S750-T752 PolarHBondContact OG-OG1 3.4Å; S750-T752 VanDerWaalsContact OG-OG1 3.06Å
751	L	54.1	Low	50.1	Low	169 Å²	169	144.6 Å²	144.6	89%	0.885	77%	0.774	S	S	*	*			trans	-98.4	2	178.7	-62.4	176.3	0	0	0	113.3
752	T	58.6	Low	49.3	Very low	106 Å²	106	148.7 Å²	148.7	65%	0.65	79%	0.792	S	S	*	*			trans	-88.1	119.4	-178.1	59.1	0	0	0	0	112.2	S750 T754	S750-T752 PolarHBondContact OG-N 2.95Å; S750-T752 PolarHBondContact OG-OG1 3.4Å; S750-T752 VanDerWaalsContact OG-OG1 3.06Å; T752-T754 PolarHBondContact O-N 3.46Å
753	V	49.4	Very low	48.2	Very low	148 Å²	148	147.6 Å²	147.6	90%	0.897	79%	0.79	S	S	*	*			trans	-77.9	104.4	175	-178.1	0	0	0	0	110.5
754	T	51.5	Low	47.3	Very low	125 Å²	125	145.9 Å²	145.9	77%	0.767	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-81.3	120.4	173.6	49.1	0	0	0	0	111.7	T752	T752-T754 PolarHBondContact O-N 3.46Å
755	A	48.9	Very low	46.5	Very low	89 Å²	89	146.9 Å²	146.9	74%	0.736	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70	146.4	173.2	0	0	0	0	0	112.4
756	P	43.5	Very low	45.6	Very low	129 Å²	129	145.3 Å²	145.3	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.9	135.5	-173.4	28.4	-35.1	0	0	0	113.6
757	S	36.7	Very low	44.2	Very low	119 Å²	119	148.1 Å²	148.1	83%	0.832	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.5	136.7	179.4	59.5	0	0	0	0	113.2
758	K	37.3	Very low	43.4	Very low	195 Å²	195	145.5 Å²	145.5	85%	0.848	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-79.2	143.5	173.8	-68.4	-179.6	178.9	176.8	0	111.8
759	P	38.9	Very low	42.4	Very low	124 Å²	124	145.8 Å²	145.8	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73.5	150.7	-176.7	30.1	-35.9	0	0	0	113.1
760	K	39	Very low	41.9	Very low	201 Å²	201	141.6 Å²	141.6	87%	0.874	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-86.9	138.6	172	-69.2	-179.5	178.8	176.2	0	111.1
761	P	38	Very low	41.5	Very low	131 Å²	131	146.1 Å²	146.1	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.1	157.9	173.9	31	-34.9	0	0	0	112.4
762	K	37.3	Very low	41.1	Very low	209 Å²	209	144.9 Å²	144.9	91%	0.909	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.6	154.5	179.9	-62.5	178.8	-179.5	178.5	0	111.8
763	Q	35.9	Very low	40.5	Very low	182 Å²	182	148.1 Å²	148.1	85%	0.85	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-99.6	134.9	176.8	-173	175.3	-1.6	0	0	110.7
764	P	37.8	Very low	40.3	Very low	118 Å²	118	149.3 Å²	149.3	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.8	164.8	175.6	33.4	-34.7	0	0	0	112.9
765	Q	36.1	Very low	40.1	Very low	179 Å²	179	149.2 Å²	149.2	84%	0.836	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.8	168.6	-176.1	-65.4	-178.6	-35	0	0	113.7
766	N	34.4	Very low	39.9	Very low	140 Å²	140	153.8 Å²	153.8	75%	0.749	81%	0.814	S	S	*	*			trans	17.7	134.8	146.1	-63.2	4.1	0	0	0	118.6
767	N	32.4	Very low	40.2	Very low	159 Å²	159	159.3 Å²	159.3	85%	0.85	82%	0.818	S	S	*	*			cis	-151.4	170.9	41	-105.4	-28.3	0	0	0	112
768	G	35.4	Very low	40.6	Very low	63 Å²	63	163.4 Å²	163.4	65%	0.649	82%	0.821	S	S	*	*			trans	-98.3	177.6	178	0	0	0	0	0	114.6
769	H	37.6	Very low	40.9	Very low	198 Å²	198	163.5 Å²	163.5	92%	0.917	82%	0.821	S	S	*	*			trans	-170.9	152.2	149.8	-101.7	-68.5	0	0	0	112.5
770	A	39.5	Very low	41.2	Very low	93 Å²	93	164.8 Å²	164.8	77%	0.769	82%	0.817	S	S	*	*			trans	56.3	120.5	159.2	0	0	0	0	0	120.9
771	K	48.5	Very low	41.7	Very low	191 Å²	191	162 Å²	162	83%	0.83	81%	0.81	S	S	*	*			trans	-73.6	140.6	156.9	-62	174.3	-178.1	174.5	0	109.3
772	N	45.6	Very low	42.1	Very low	143 Å²	143	162.2 Å²	162.2	77%	0.765	81%	0.812	S	S	*	*			trans	-143.5	113.3	171.3	-160.1	-26.3	0	0	0	110.6
773	F	46.9	Very low	43	Very low	174 Å²	174	155.9 Å²	155.9	76%	0.763	81%	0.806	S	S	*	*			trans	-93.9	122.9	-177.2	-72.2	-88.2	0	0	0	111
774	K	44.1	Very low	43.7	Very low	173 Å²	173	150.3 Å²	150.3	75%	0.752	79%	0.791	S	S	*	*			trans	-126.7	107.3	161.2	-75.5	-169.9	175	-178.3	0	110	F776	K774-F776 HydrophobicContact CB-CE2 4.15Å; K774-F776 WeakPolarHBondContact O-CD2 3.33Å; K774-F776 PolarHBondContact O-N 2.85Å
775	C	48.8	Very low	44.2	Very low	123 Å²	123	152.4 Å²	152.4	83%	0.831	79%	0.791	S	S	*	*			trans	-79.1	110.9	-175	-57.4	0	0	0	0	111.1
776	F	43.2	Very low	45	Very low	186 Å²	186	147.2 Å²	147.2	82%	0.816	79%	0.785	S	S	*	*			trans	-94.6	102.9	173.8	-74.1	-86	0	0	0	111.1	K774 K778	K774-F776 HydrophobicContact CB-CE2 4.15Å; K774-F776 WeakPolarHBondContact O-CD2 3.33Å; K774-F776 PolarHBondContact O-N 2.85Å; F776-K778 PolarHBondContact O-N 3.36Å; F776-K778 VanDerWaalsContact O-N 3.11Å
777	R	50.1	Low	45.8	Very low	244 Å²	244	150.4 Å²	150.4	92%	0.921	79%	0.792	S	S	*	*			trans	-61.9	107.8	165	-88.7	-178.9	163.4	177.8	-5.9	109.2
778	K	46.7	Very low	46.6	Very low	205 Å²	205	147.7 Å²	147.7	89%	0.891	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-68.1	131.9	161.9	-74.6	-174	175.6	-178.7	0	108.7	F776	F776-K778 PolarHBondContact O-N 3.36Å; F776-K778 VanDerWaalsContact O-N 3.11Å
779	K	42.9	Very low	47.6	Very low	197 Å²	197	152.8 Å²	152.8	86%	0.857	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.4	144.3	168.8	-65.5	-176.5	177.5	-177	0	108.9
780	H	45.4	Very low	48.5	Very low	152 Å²	152	150.1 Å²	150.1	70%	0.704	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63.6	141.6	167.1	-97.9	-127.3	0	0	0	110.3
781	L	48.3	Very low	49.1	Very low	142 Å²	142	151.1 Å²	151.1	74%	0.743	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-91.2	134.7	163.8	-81.5	157.2	0	0	0	108.1	G783 A784	L781-G783 PolarHBondContact O-N 3.41Å; L781-A784 PolarHBondContact O-N 2.78Å
782	P	46.7	Very low	48.9	Very low	136 Å²	136	143.1 Å²	143.1	88%	0.883	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	132.2	171.9	-22.3	33.6	0	0	0	110.3
783	G	55.9	Low	49.3	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.2	-3	-172.4	0	0	0	0	0	115	L781 E785	L781-G783 PolarHBondContact O-N 3.41Å; G783-E785 VanDerWaalsContact C-N 3.27Å
784	A	52.3	Low	49.6	Very low	66 Å²	66	136.8 Å²	136.8	55%	0.545	75%	0.746	S	S	.	*			trans	-89.2	16.1	167.1	0	0	0	0	0	113.6	L781	L781-A784 PolarHBondContact O-N 2.78Å
785	E	46.7	Very low	49.9	Very low	162 Å²	162	134.3 Å²	134.3	76%	0.757	74%	0.741	S	S	*	*	S	Bend	trans	-83.9	132.4	169	-67.3	-67.3	129.6	0	0	108.7	G783	G783-E785 VanDerWaalsContact C-N 3.27Å
786	G	53	Low	50.2	Low	69 Å²	69	134.7 Å²	134.7	71%	0.711	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-70.2	154.5	180	0	0	0	0	0	112.9
787	F	51.9	Low	50.8	Low	207 Å²	207	133.8 Å²	133.8	91%	0.908	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-58.1	141.8	168.6	-77	-85.8	0	0	0	110.5
788	P	49.5	Very low	51.2	Low	103 Å²	103	127.7 Å²	127.7	67%	0.669	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-61.5	142.1	-174.5	24.6	-34.3	0	0	0	112	I790	P788-I790 PolarHBondContact O-N 3.27Å
789	H	57	Low	50.9	Low	170 Å²	170	125.4 Å²	125.4	79%	0.787	72%	0.718	S	S	*	*			trans	-73.1	94.2	-172.1	-158.4	69.3	0	0	0	111.1
790	I	55.7	Low	51.1	Low	141 Å²	141	121.9 Å²	121.9	72%	0.723	71%	0.709	S	S	*	*			trans	-118.9	124.8	176.9	-59	177.5	0	0	0	107.7	P788	P788-I790 PolarHBondContact O-N 3.27Å
791	I	52	Low	51.4	Low	114 Å²	114	125 Å²	125	59%	0.585	71%	0.714	S	S	*	*	S	Bend	trans	68.5	105.9	-161.6	-49.2	174.4	0	0	0	111.3	D795 L796	I791-D795 HydrophobicContact CG2-CB 4.06Å; I791-L796 HydrophobicContact CG2-CD2 4.46Å; I791-L796 HydrophobicContact CG2-CG 4.42Å
792	G	44	Very low	51.4	Low	23 Å²	23	121 Å²	121	24%	0.237	71%	0.707	C	S	.	*			trans	-72.3	154	171.4	0	0	0	0	0	111.3	S794 D795	G792-S794 PolarHBondContact O-N 2.84Å; G792-D795 PolarHBondContact O-N 2.94Å; G792-D795 VanDerWaalsContact O-N 3.12Å
793	G	54	Low	51.8	Low	83 Å²	83	120.2 Å²	120.2	86%	0.856	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	3.6	-173.2	0	0	0	0	0	117
794	S	54.3	Low	51.9	Low	102 Å²	102	122 Å²	122	71%	0.713	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-21.3	175.6	52.6	0	0	0	0	114.4	G792	G792-S794 PolarHBondContact O-N 2.84Å
795	D	48.6	Very low	52.5	Low	121 Å²	121	122 Å²	122	65%	0.647	69%	0.688	S	S	*	*	S	Bend	trans	-87	-8.5	-170.8	-72.7	0.6	0	0	0	113.2	I791 G792 L797	I791-D795 HydrophobicContact CG2-CB 4.06Å; G792-D795 PolarHBondContact O-N 2.94Å; G792-D795 VanDerWaalsContact O-N 3.12Å; D795-L797 VanDerWaalsContact C-N 3.3Å; D795-L797 PolarHBondContact O-N 2.93Å
796	L	55.4	Low	53.3	Low	130 Å²	130	120 Å²	120	68%	0.681	68%	0.683	S	S	*	*			trans	-77.9	82.6	168.3	-66.5	-179.8	0	0	0	109.7	I791 V798	I791-L796 HydrophobicContact CG2-CD2 4.46Å; I791-L796 HydrophobicContact CG2-CG 4.42Å; L796-V798 PolarHBondContact O-N 2.99Å
797	L	56.5	Low	54.1	Low	168 Å²	168	121 Å²	121	88%	0.88	67%	0.672	S	S	*	*			trans	-53.4	106.7	158.2	-78.2	175.1	0	0	0	108.1	D795 H799	D795-L797 VanDerWaalsContact C-N 3.3Å; D795-L797 PolarHBondContact O-N 2.93Å; L797-H799 PolarHBondContact O-N 3.17Å
798	V	57.4	Low	55.1	Low	116 Å²	116	116.8 Å²	116.8	70%	0.703	66%	0.658	S	S	*	*			trans	-58.7	109.6	174.5	177.5	0	0	0	0	107.1	L796 N800	L796-V798 PolarHBondContact O-N 2.99Å; V798-N800 VanDerWaalsContact C-N 3.25Å; V798-N800 PolarHBondContact O-N 3.36Å
799	H	41.5	Very low	56.5	Low	157 Å²	157	118.3 Å²	118.3	73%	0.727	66%	0.657	S	S	*	*			trans	-69.5	92.8	171.9	-180	71.6	0	0	0	107.7	L797 R801	L797-H799 PolarHBondContact O-N 3.17Å; H799-R801 PolarHBondContact O-N 2.88Å
800	N	47.8	Very low	57.6	Low	123 Å²	123	118.6 Å²	118.6	66%	0.658	65%	0.651	S	S	*	*			trans	-60.8	83.8	170.2	-73.3	-15.3	0	0	0	109	V798 G802	V798-N800 VanDerWaalsContact C-N 3.25Å; V798-N800 PolarHBondContact O-N 3.36Å; N800-G802 PolarHBondContact O-N 3.47Å
801	R	49.9	Very low	58.8	Low	216 Å²	216	116.4 Å²	116.4	82%	0.815	64%	0.64	S	S	*	*			trans	-49.2	127.8	141.3	-74.3	-172.3	167.7	-157.1	-5	105.6	H799 T803	H799-R801 PolarHBondContact O-N 2.88Å; R801-T803 PolarHBondContact O-N 2.83Å
802	G	48.9	Very low	60.3	Low	58 Å²	58	117.6 Å²	117.6	60%	0.598	64%	0.641	S	S	*	*			trans	-45.2	137.4	-167.3	0	0	0	0	0	111.7	N800 N804	N800-G802 PolarHBondContact O-N 3.47Å; G802-N804 PolarHBondContact O-N 2.86Å
803	T	55.2	Low	62.3	Low	120 Å²	120	118.6 Å²	118.6	74%	0.736	65%	0.651	S	S	*	*			trans	-57.3	100	175.1	43	0	0	0	0	108.7	R801 S805	R801-T803 PolarHBondContact O-N 2.83Å; T803-S805 PolarHBondContact O-N 3.39Å
804	N	58.8	Low	63.8	Low	114 Å²	114	117 Å²	117	61%	0.61	63%	0.63	S	S	*	*			trans	-71	71.7	163.3	-71.3	0.2	0	0	0	107.1	G802 D806 L807 D808	G802-N804 PolarHBondContact O-N 2.86Å; N804-D806 PolarHBondContact O-N 3.07Å; N804-L807 HydrophobicContact CB-CB 3.78Å; N804-L807 PolarHBondContact O-N 3.12Å; N804-D808 PolarHBondContact O-N 2.7Å
805	S	64.3	Low	65.3	Low	65 Å²	65	114.7 Å²	114.7	46%	0.455	62%	0.617	S	S	.	*	H	α-helix	trans	-41.6	-49	169.3	27.9	0	0	0	0	109.8	T803 L807 D808 E809	T803-S805 PolarHBondContact O-N 3.39Å; S805-L807 PolarHBondContact O-N 3.24Å; S805-D808 PolarHBondContact O-N 2.86Å; S805-D808 VanDerWaalsContact O-N 3.16Å; S805-E809 WeakPolarHBondContact O-CB 3.4Å; S805-E809 PolarHBondContact O-N 2.92Å
806	D	64	Low	67.2	Low	119 Å²	119	113.9 Å²	113.9	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-59.6	-31	-176.4	-45.2	22	0	0	0	112.1	N804 W810	N804-D806 PolarHBondContact O-N 3.07Å; D806-W810 WeakPolarHBondContact O-CB 3.18Å; D806-W810 PolarHBondContact O-N 3.01Å
807	L	69.3	Low	68.7	Low	92 Å²	92	109.5 Å²	109.5	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-83.3	-38.3	178.8	-175.9	63.4	0	0	0	112.1	N804 S805 W810 L811	N804-L807 HydrophobicContact CB-CB 3.78Å; N804-L807 PolarHBondContact O-N 3.12Å; S805-L807 PolarHBondContact O-N 3.24Å; L807-W810 HydrophobicContact CD1-CE3 4.47Å; L807-L811 WeakPolarHBondContact O-CB 3.35Å; L807-L811 VanDerWaalsContact O-CG 3.24Å; L807-L811 WeakPolarHBondContact O-CG 3.24Å; L807-L811 PolarHBondContact O-N 3.26Å
808	D	74.1	Confident	70	Confident	117 Å²	117	106.7 Å²	106.7	63%	0.626	58%	0.578	S	S	*	*	H	α-helix	trans	-71.9	-38.8	175.1	-164.2	57.9	0	0	0	110.8	N804 S805 L811 K812	N804-D808 PolarHBondContact O-N 2.7Å; S805-D808 PolarHBondContact O-N 2.86Å; S805-D808 VanDerWaalsContact O-N 3.16Å; D808-L811 PolarHBondContact O-N 3.19Å; D808-K812 WeakPolarHBondContact O-CB 3.41Å; D808-K812 PolarHBondContact O-N 3.45Å
809	E	77.6	Confident	71.4	Confident	136 Å²	136	109 Å²	109	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-40.1	172	-174.5	161.1	-141.6	0	0	111.9	S805 K812 G813	S805-E809 WeakPolarHBondContact O-CB 3.4Å; S805-E809 PolarHBondContact O-N 2.92Å; E809-K812 PolarHBondContact O-N 2.98Å; E809-G813 PolarHBondContact O-N 3.17Å
810	W	81.3	Confident	73.3	Confident	176 Å²	176	104.9 Å²	104.9	67%	0.667	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-43	172.1	-177.9	88	0	0	0	112.5	D806 L807 K812 G813 A814	D806-W810 WeakPolarHBondContact O-CB 3.18Å; D806-W810 PolarHBondContact O-N 3.01Å; L807-W810 HydrophobicContact CD1-CE3 4.47Å; W810-K812 VanDerWaalsContact C-N 3.33Å; W810-K812 PolarHBondContact O-N 2.87Å; W810-G813 PolarHBondContact O-N 3.28Å; W810-A814 WeakPolarHBondContact O-CB 3.33Å; W810-A814 PolarHBondContact O-N 2.87Å
811	L	80.8	Confident	75.1	Confident	95 Å²	95	103.9 Å²	103.9	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-62.1	-40.5	174.6	-77.1	167.8	0	0	0	111.9	L807 D808 A815	L807-L811 WeakPolarHBondContact O-CB 3.35Å; L807-L811 VanDerWaalsContact O-CG 3.24Å; L807-L811 WeakPolarHBondContact O-CG 3.24Å; L807-L811 PolarHBondContact O-N 3.26Å; D808-L811 PolarHBondContact O-N 3.19Å; L811-A815 WeakPolarHBondContact O-CB 3.41Å; L811-A815 PolarHBondContact O-N 2.92Å
812	K	83.6	Confident	76.9	Confident	139 Å²	139	98.5 Å²	98.5	60%	0.604	53%	0.532	S	S	*	.	H	α-helix	trans	-66.6	-45.1	175.6	-173.8	-178.4	176.9	-169.1	0	111.6	D808 E809 W810 A815 E816	D808-K812 WeakPolarHBondContact O-CB 3.41Å; D808-K812 PolarHBondContact O-N 3.45Å; E809-K812 PolarHBondContact O-N 2.98Å; W810-K812 VanDerWaalsContact C-N 3.33Å; W810-K812 PolarHBondContact O-N 2.87Å; K812-A815 PolarHBondContact O-N 2.86Å; K812-E816 WeakPolarHBondContact O-CB 3.21Å; K812-E816 PolarHBondContact O-N 2.83Å
813	G	85.6	Confident	78.6	Confident	43 Å²	43	101.9 Å²	101.9	44%	0.443	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-38.6	175.6	0	0	0	0	0	112.8	E809 W810 E816 G817	E809-G813 PolarHBondContact O-N 3.17Å; W810-G813 PolarHBondContact O-N 3.28Å; G813-E816 PolarHBondContact O-N 3.29Å; G813-G817 PolarHBondContact O-N 3.29Å
814	A	84.2	Confident	80	Confident	51 Å²	51	101 Å²	101	42%	0.421	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-43	172.8	0	0	0	0	0	111.9	W810 G817 E818	W810-A814 WeakPolarHBondContact O-CB 3.33Å; W810-A814 PolarHBondContact O-N 2.87Å; A814-G817 PolarHBondContact O-N 3.25Å; A814-E818 WeakPolarHBondContact O-CB 3.5Å; A814-E818 PolarHBondContact O-N 2.67Å
815	A	87.2	Confident	81.3	Confident	52 Å²	52	102 Å²	102	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-69.4	-31	176.2	0	0	0	0	0	113.4	L811 K812 R819	L811-A815 WeakPolarHBondContact O-CB 3.41Å; L811-A815 PolarHBondContact O-N 2.92Å; K812-A815 PolarHBondContact O-N 2.86Å; A815-R819 VanDerWaalsContact O-CG 3.29Å; A815-R819 WeakPolarHBondContact O-CG 3.43Å; A815-R819 PolarHBondContact O-N 2.92Å
816	E	86.9	Confident	82.2	Confident	104 Å²	104	101.6 Å²	101.6	49%	0.486	52%	0.516	S	S	.	.	H	α-helix	trans	-73.5	-41.8	173.8	-166.7	114.8	-116.9	0	0	111.2	K812 G813 R819 Q820	K812-E816 WeakPolarHBondContact O-CB 3.21Å; K812-E816 PolarHBondContact O-N 2.83Å; G813-E816 PolarHBondContact O-N 3.29Å; E816-R819 WeakPolarHBondContact O-CB 3.32Å; E816-R819 PolarHBondContact O-N 3.44Å; E816-Q820 PolarHBondContact O-N 2.82Å
817	G	87.6	Confident	83.2	Confident	38 Å²	38	100.8 Å²	100.8	39%	0.392	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-42.6	172.9	0	0	0	0	0	112.8	G813 A814 R819 Q820 N821	G813-G817 PolarHBondContact O-N 3.29Å; A814-G817 PolarHBondContact O-N 3.25Å; G817-R819 VanDerWaalsContact C-N 3.26Å; G817-R819 PolarHBondContact O-N 3.24Å; G817-Q820 PolarHBondContact O-N 2.73Å; G817-Q820 VanDerWaalsContact O-N 3.17Å; G817-N821 WeakPolarHBondContact O-CB 3.45Å; G817-N821 PolarHBondContact O-N 2.85Å
818	E	84.9	Confident	83.9	Confident	109 Å²	109	97.7 Å²	97.7	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-33.5	174.5	-156.9	-139.5	-162.6	0	0	111.9	A814 K822	A814-E818 WeakPolarHBondContact O-CB 3.5Å; A814-E818 PolarHBondContact O-N 2.67Å; E818-K822 WeakPolarHBondContact O-CB 3.31Å; E818-K822 WeakPolarHBondContact O-CD 3.45Å; E818-K822 VanDerWaalsContact O-CG 3.23Å; E818-K822 WeakPolarHBondContact O-CG 3.33Å; E818-K822 PolarHBondContact O-N 3.37Å; E818-K822 WeakPolarHBondContact OE1-CE 3.38Å; E818-K822 IonicContact OE1-NZ 3.92Å; E818-K822 PolarHBondContact OE1-NZ 3.45Å; E818-K822 IonicContact OE2-NZ 3.24Å; E818-K822 PolarHBondContact OE2-NZ 3Å
819	R	85.1	Confident	84	Confident	165 Å²	165	95.6 Å²	95.6	62%	0.623	49%	0.489	S	S	*	.	H	α-helix	trans	-71.8	-37.3	172.6	-76.3	171.7	172.5	-155.3	-1.3	112.9	A815 E816 G817 R823	A815-R819 VanDerWaalsContact O-CG 3.29Å; A815-R819 WeakPolarHBondContact O-CG 3.43Å; A815-R819 PolarHBondContact O-N 2.92Å; E816-R819 WeakPolarHBondContact O-CB 3.32Å; E816-R819 PolarHBondContact O-N 3.44Å; G817-R819 VanDerWaalsContact C-N 3.26Å; G817-R819 PolarHBondContact O-N 3.24Å; R819-R823 WeakPolarHBondContact O-CG 3.41Å; R819-R823 PolarHBondContact O-N 3.27Å
820	Q	83	Confident	84	Confident	71 Å²	71	94.6 Å²	94.6	33%	0.332	49%	0.488	S	S	.	.	H	α-helix	trans	-69.9	-47.3	178.4	179.8	61.5	13.5	0	0	111	E816 G817 K822 R823 E824	E816-Q820 PolarHBondContact O-N 2.82Å; G817-Q820 PolarHBondContact O-N 2.73Å; G817-Q820 VanDerWaalsContact O-N 3.17Å; Q820-K822 VanDerWaalsContact C-N 3.27Å; Q820-K822 PolarHBondContact O-N 3.23Å; Q820-R823 WeakPolarHBondContact O-CA 3.4Å; Q820-R823 WeakPolarHBondContact O-CB 3.14Å; Q820-R823 PolarHBondContact O-N 3.22Å; Q820-E824 WeakPolarHBondContact CG-OE1 3.23Å; Q820-E824 PolarHBondContact NE2-OE1 3.02Å; Q820-E824 PolarHBondContact O-N 3.32Å
821	N	84.2	Confident	83.6	Confident	102 Å²	102	92.1 Å²	92.1	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-56.3	-41.7	175.2	-170	15.5	0	0	0	111.3	G817 R823 E824 E825	G817-N821 WeakPolarHBondContact O-CB 3.45Å; G817-N821 PolarHBondContact O-N 2.85Å; N821-R823 VanDerWaalsContact C-N 3.27Å; N821-R823 PolarHBondContact O-N 2.98Å; N821-E824 PolarHBondContact O-N 3.1Å; N821-E824 VanDerWaalsContact O-N 3.17Å; N821-E825 WeakPolarHBondContact O-CB 3.29Å; N821-E825 PolarHBondContact O-N 2.61Å
822	K	88	Confident	83.1	Confident	103 Å²	103	96.6 Å²	96.6	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-67.4	-17.5	173.6	-72.9	170.8	-173	171.9	0	115	E818 Q820 A826	E818-K822 WeakPolarHBondContact O-CB 3.31Å; E818-K822 WeakPolarHBondContact O-CD 3.45Å; E818-K822 VanDerWaalsContact O-CG 3.23Å; E818-K822 WeakPolarHBondContact O-CG 3.33Å; E818-K822 PolarHBondContact O-N 3.37Å; E818-K822 WeakPolarHBondContact OE1-CE 3.38Å; E818-K822 IonicContact OE1-NZ 3.92Å; E818-K822 PolarHBondContact OE1-NZ 3.45Å; E818-K822 IonicContact OE2-NZ 3.24Å; E818-K822 PolarHBondContact OE2-NZ 3Å; Q820-K822 VanDerWaalsContact C-N 3.27Å; Q820-K822 PolarHBondContact O-N 3.23Å; K822-A826 WeakPolarHBondContact O-CB 3.23Å
823	R	84.9	Confident	82.3	Confident	129 Å²	129	97.7 Å²	97.7	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-81.3	-43.9	167.8	-64.9	169.8	-164.6	151.2	0.3	110.4	R819 Q820 N821 A826 I827	R819-R823 WeakPolarHBondContact O-CG 3.41Å; R819-R823 PolarHBondContact O-N 3.27Å; Q820-R823 WeakPolarHBondContact O-CA 3.4Å; Q820-R823 WeakPolarHBondContact O-CB 3.14Å; Q820-R823 PolarHBondContact O-N 3.22Å; N821-R823 VanDerWaalsContact C-N 3.27Å; N821-R823 PolarHBondContact O-N 2.98Å; R823-A826 PolarHBondContact O-N 3.13Å; R823-I827 WeakPolarHBondContact O-CB 3.48Å; R823-I827 WeakPolarHBondContact O-CD1 3.43Å; R823-I827 VanDerWaalsContact O-CG1 3.23Å; R823-I827 WeakPolarHBondContact O-CG1 3.23Å; R823-I827 PolarHBondContact O-N 3.17Å
824	E	85.6	Confident	81.2	Confident	102 Å²	102	103.5 Å²	103.5	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-43.9	-178.7	-71.4	162.5	-178.9	0	0	111.4	Q820 N821 A826 I827 G828	Q820-E824 WeakPolarHBondContact CG-OE1 3.23Å; Q820-E824 PolarHBondContact NE2-OE1 3.02Å; Q820-E824 PolarHBondContact O-N 3.32Å; N821-E824 PolarHBondContact O-N 3.1Å; N821-E824 VanDerWaalsContact O-N 3.17Å; E824-A826 VanDerWaalsContact C-N 3.34Å; E824-A826 PolarHBondContact O-N 3.15Å; E824-I827 PolarHBondContact O-N 2.92Å; E824-G828 PolarHBondContact O-N 3.19Å
825	E	85.6	Confident	79.9	Confident	134 Å²	134	105.6 Å²	105.6	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-55.2	-47	169.3	-175.2	-176.1	-163.8	0	0	111.4	N821 G828 D829	N821-E825 WeakPolarHBondContact O-CB 3.29Å; N821-E825 PolarHBondContact O-N 2.61Å; E825-G828 PolarHBondContact O-N 3.46Å; E825-D829 VanDerWaalsContact O-CB 3.31Å; E825-D829 WeakPolarHBondContact O-CB 3.44Å; E825-D829 PolarHBondContact O-N 2.99Å
826	A	83.8	Confident	78.5	Confident	56 Å²	56	107.3 Å²	107.3	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-70	-32.7	179.9	0	0	0	0	0	113.6	K822 R823 E824 D830	K822-A826 WeakPolarHBondContact O-CB 3.23Å; R823-A826 PolarHBondContact O-N 3.13Å; E824-A826 VanDerWaalsContact C-N 3.34Å; E824-A826 PolarHBondContact O-N 3.15Å; A826-D830 WeakPolarHBondContact O-CB 3.43Å; A826-D830 PolarHBondContact O-N 3.31Å; A826-D830 VanDerWaalsContact O-N 3.1Å
827	I	83.4	Confident	76.8	Confident	103 Å²	103	107.3 Å²	107.3	53%	0.528	53%	0.532	S	S	.	.	H	α-helix	trans	-72.3	-42.6	175.1	-71.8	163.1	0	0	0	110	R823 E824 D830 L831	R823-I827 WeakPolarHBondContact O-CB 3.48Å; R823-I827 WeakPolarHBondContact O-CD1 3.43Å; R823-I827 VanDerWaalsContact O-CG1 3.23Å; R823-I827 WeakPolarHBondContact O-CG1 3.23Å; R823-I827 PolarHBondContact O-N 3.17Å; E824-I827 PolarHBondContact O-N 2.92Å; I827-D830 PolarHBondContact O-N 3.23Å; I827-L831 HydrophobicContact CG2-CD1 3.92Å; I827-L831 VanDerWaalsContact O-CD1 3.23Å; I827-L831 WeakPolarHBondContact O-CD1 3.36Å; I827-L831 PolarHBondContact O-N 3.45Å
828	G	84.6	Confident	75.1	Confident	26 Å²	26	113.8 Å²	113.8	27%	0.268	55%	0.549	S	S	.	.	H	α-helix	trans	-60	-48.2	173.3	0	0	0	0	0	112.1	E824 E825 D830 L831 F832	E824-G828 PolarHBondContact O-N 3.19Å; E825-G828 PolarHBondContact O-N 3.46Å; G828-D830 VanDerWaalsContact C-N 3.26Å; G828-D830 PolarHBondContact O-N 2.94Å; G828-L831 WeakPolarHBondContact O-CB 3.49Å; G828-L831 PolarHBondContact O-N 3.17Å; G828-F832 WeakPolarHBondContact O-CD2 3.28Å; G828-F832 PolarHBondContact O-N 2.9Å
829	D	76.9	Confident	73.5	Confident	74 Å²	74	115.2 Å²	115.2	40%	0.396	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-26.8	177.5	-174	40.2	0	0	0	112.6	E825 R833	E825-D829 VanDerWaalsContact O-CB 3.31Å; E825-D829 WeakPolarHBondContact O-CB 3.44Å; E825-D829 PolarHBondContact O-N 2.99Å; D829-R833 VanDerWaalsContact CG-NE 3.29Å; D829-R833 WeakPolarHBondContact O-CD 3.1Å; D829-R833 WeakPolarHBondContact O-CG 3.05Å; D829-R833 PolarHBondContact O-N 2.71Å; D829-R833 PolarHBondContact O-NE 3.06Å; D829-R833 VanDerWaalsContact O-NE 3.15Å; D829-R833 IonicContact OD1-CZ 2.8Å; D829-R833 IonicContact OD1-NE 2.9Å; D829-R833 PolarHBondContact OD1-NE 3.26Å; D829-R833 IonicContact OD1-NH2 2.68Å; D829-R833 PolarHBondContact OD1-NH2 2.74Å; D829-R833 IonicContact OD2-CZ 3.49Å; D829-R833 IonicContact OD2-NE 2.74Å; D829-R833 PolarHBondContact OD2-NE 2.86Å; D829-R833 IonicContact OD2-NH1 2.71Å; D829-R833 IonicContact OD2-NH2 3.49Å; D829-R833 PolarHBondContact OD2-NH2 3.01Å
830	D	76.3	Confident	71.7	Confident	114 Å²	114	113.7 Å²	113.7	61%	0.61	57%	0.568	S	S	*	*	H	α-helix	trans	-79.3	-36	171.6	-154	47.2	0	0	0	112.8	A826 I827 G828 F832 R833 Y834	A826-D830 WeakPolarHBondContact O-CB 3.43Å; A826-D830 PolarHBondContact O-N 3.31Å; A826-D830 VanDerWaalsContact O-N 3.1Å; I827-D830 PolarHBondContact O-N 3.23Å; G828-D830 VanDerWaalsContact C-N 3.26Å; G828-D830 PolarHBondContact O-N 2.94Å; D830-F832 VanDerWaalsContact C-N 3.34Å; D830-F832 PolarHBondContact O-N 3.49Å; D830-R833 CarbonylContact O-C 3.54Å; D830-R833 WeakPolarHBondContact O-CA 3.49Å; D830-R833 PolarHBondContact O-N 3.34Å; D830-Y834 PolarHBondContact O-N 3.1Å; D830-Y834 VanDerWaalsContact O-N 3.17Å
831	L	73.3	Confident	70.2	Confident	125 Å²	125	119.3 Å²	119.3	65%	0.654	59%	0.592	S	S	*	*	H	α-helix	trans	-57.3	-45.7	168.9	-99.3	80.7	0	0	0	111.3	I827 G828 R833 Y834	I827-L831 HydrophobicContact CG2-CD1 3.92Å; I827-L831 VanDerWaalsContact O-CD1 3.23Å; I827-L831 WeakPolarHBondContact O-CD1 3.36Å; I827-L831 PolarHBondContact O-N 3.45Å; G828-L831 WeakPolarHBondContact O-CB 3.49Å; G828-L831 PolarHBondContact O-N 3.17Å; L831-R833 PolarHBondContact O-N 3.39Å; L831-Y834 VanDerWaalsContact O-CB 3.28Å; L831-Y834 WeakPolarHBondContact O-CB 3.38Å; L831-Y834 PolarHBondContact O-N 2.8Å; L831-Y834 VanDerWaalsContact O-N 3.13Å
832	F	69.8	Low	68.2	Low	188 Å²	188	126.1 Å²	126.1	83%	0.825	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-10.4	176.1	-72.8	-64.8	0	0	0	114	G828 D830	G828-F832 WeakPolarHBondContact O-CD2 3.28Å; G828-F832 PolarHBondContact O-N 2.9Å; D830-F832 VanDerWaalsContact C-N 3.34Å; D830-F832 PolarHBondContact O-N 3.49Å
833	R	67.1	Low	65.9	Low	163 Å²	163	136.6 Å²	136.6	62%	0.615	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-3.3	173.1	-69.5	162.7	-164.5	-132.8	-2.4	113.4	D829 D830 L831 N835	D829-R833 VanDerWaalsContact CG-NE 3.29Å; D829-R833 WeakPolarHBondContact O-CD 3.1Å; D829-R833 WeakPolarHBondContact O-CG 3.05Å; D829-R833 PolarHBondContact O-N 2.71Å; D829-R833 PolarHBondContact O-NE 3.06Å; D829-R833 VanDerWaalsContact O-NE 3.15Å; D829-R833 IonicContact OD1-CZ 2.8Å; D829-R833 IonicContact OD1-NE 2.9Å; D829-R833 PolarHBondContact OD1-NE 3.26Å; D829-R833 IonicContact OD1-NH2 2.68Å; D829-R833 PolarHBondContact OD1-NH2 2.74Å; D829-R833 IonicContact OD2-CZ 3.49Å; D829-R833 IonicContact OD2-NE 2.74Å; D829-R833 PolarHBondContact OD2-NE 2.86Å; D829-R833 IonicContact OD2-NH1 2.71Å; D829-R833 IonicContact OD2-NH2 3.49Å; D829-R833 PolarHBondContact OD2-NH2 3.01Å; D830-R833 CarbonylContact O-C 3.54Å; D830-R833 WeakPolarHBondContact O-CA 3.49Å; D830-R833 PolarHBondContact O-N 3.34Å; L831-R833 PolarHBondContact O-N 3.39Å; R833-N835 PolarHBondContact O-N 2.69Å
834	Y	62	Low	65	Low	164 Å²	164	137 Å²	137	64%	0.643	65%	0.654	S	S	*	*			trans	-63.1	102	-178.8	-173.6	-96.1	0	0	0	111.5	D830 L831 P836	D830-Y834 PolarHBondContact O-N 3.1Å; D830-Y834 VanDerWaalsContact O-N 3.17Å; L831-Y834 VanDerWaalsContact O-CB 3.28Å; L831-Y834 WeakPolarHBondContact O-CB 3.38Å; L831-Y834 PolarHBondContact O-N 2.8Å; L831-Y834 VanDerWaalsContact O-N 3.13Å; Y834-P836 HydrophobicContact CE1-CB 4.02Å
835	N	57.4	Low	63.9	Low	96 Å²	96	138.8 Å²	138.8	51%	0.513	66%	0.664	S	S	.	*			trans	-111.5	101.5	-179.1	-166.9	-41.5	0	0	0	109.6	R833 T837	R833-N835 PolarHBondContact O-N 2.69Å; N835-T837 PolarHBondContact O-N 3.42Å; N835-T837 PolarHBondContact OD1-OG1 3.11Å
836	P	58	Low	62.7	Low	88 Å²	88	139.1 Å²	139.1	57%	0.571	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-67.3	-9.2	-168.1	25.1	-34.6	0	0	0	114.6	Y834 K838	Y834-P836 HydrophobicContact CE1-CB 4.02Å; P836-K838 PolarHBondContact O-N 3.01Å; P836-K838 VanDerWaalsContact O-N 3.1Å
837	T	51.8	Low	61.5	Low	104 Å²	104	143.9 Å²	143.9	64%	0.638	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-70.6	-3.6	-173.2	60.9	0	0	0	0	115.6	N835	N835-T837 PolarHBondContact O-N 3.42Å; N835-T837 PolarHBondContact OD1-OG1 3.11Å
838	K	52.5	Low	60.1	Low	173 Å²	173	146.5 Å²	146.5	75%	0.752	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-107.9	-6.4	-169.7	-68.5	-174.4	178.5	175.8	0	116.6	P836	P836-K838 PolarHBondContact O-N 3.01Å; P836-K838 VanDerWaalsContact O-N 3.1Å
839	L	50.9	Low	58.5	Low	140 Å²	140	154.5 Å²	154.5	73%	0.733	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-2.2	-173.4	-79.2	167.9	0	0	0	115.6	K841	L839-K841 PolarHBondContact O-N 3.38Å
840	T	47.5	Very low	57.1	Low	132 Å²	132	160.3 Å²	160.3	81%	0.81	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	12	-174.9	50.3	0	0	0	0	115.5
841	K	50.3	Low	55.7	Low	190 Å²	190	163.8 Å²	163.8	83%	0.826	75%	0.748	S	S	*	*			trans	-137.9	76.5	174.4	-76.6	-166.8	175.4	-178.8	0	114.2	L839	L839-K841 PolarHBondContact O-N 3.38Å
842	R	42	Very low	54.2	Low	244 Å²	244	167.1 Å²	167.1	92%	0.921	76%	0.756	S	S	*	*			trans	-165.1	101.4	141.5	-105.4	161.6	-171.4	-165.4	-0.1	110.3
843	R	41.1	Very low	52.8	Low	323 Å²	323	165.2 Å²	165.2	100%	1.219	75%	0.749	S	S	*	*			trans	-87.9	0	137	-88.6	-174.6	172.4	179.1	-2.3	107.1

Retrieved 843 of 843 residues in 858.7 ms (Link to these results)

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