A0A077ZCV7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZCV7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 609 aa.

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(Predicted Aligned Error values between residue pairs)

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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	34.8	Very low	43.4	Very low	243 Å²	243	126.2 Å²	126.2	100%	1.197	68%	0.683	S	S	*	*				0	144	0	-74.9	174.1	162.2	0	0	107.1
2	S	26.6	Very low	45	Very low	119 Å²	119	121.5 Å²	121.5	83%	0.832	67%	0.667	S	S	*	*			trans	-149.7	160.5	-152.3	-48.4	0	0	0	0	111
3	S	29.7	Very low	47.6	Very low	116 Å²	116	116.4 Å²	116.4	81%	0.811	64%	0.638	S	S	*	*			trans	83.7	82.4	-177.1	-162.4	0	0	0	0	115.2
4	E	36.7	Very low	50.3	Low	176 Å²	176	108.1 Å²	108.1	82%	0.822	59%	0.593	S	S	*	*			trans	-161.3	25.2	174.4	-140	170.9	-128.4	0	0	113
5	K	38.9	Very low	52.6	Low	214 Å²	214	102 Å²	102	93%	0.93	56%	0.561	S	S	*	*	S	Bend	trans	-133.7	10.8	-167.9	-77.4	-162.5	173	-169.9	0	116.7
6	G	39.4	Very low	54.3	Low	73 Å²	73	101.1 Å²	101.1	75%	0.753	56%	0.555	S	S	*	*	S	Bend	trans	-110.6	-3.7	178.5	0	0	0	0	0	114.9
7	E	40.9	Very low	56.4	Low	147 Å²	147	97.7 Å²	97.7	69%	0.687	53%	0.532	S	S	*	.			trans	-101.2	150.3	-162.3	-63.8	175.2	161.6	0	0	112.1
8	H	56.3	Low	58.2	Low	96 Å²	96	92.3 Å²	92.3	44%	0.444	50%	0.502	S	S	.	.			trans	70.5	25.8	170.4	-56.4	-69.4	0	0	0	119.5	W10 S11	H8-W10 AromaticContact CE1-CH2 3.97Å; H8-W10 AromaticContact CE1-CZ2 3.73Å; H8-W10 AromaticContact ND1-CE2 3.88Å; H8-W10 AromaticContact ND1-CH2 3.41Å; H8-W10 WeakPolarHBondContact ND1-CH2 3.4Å; H8-W10 AromaticContact ND1-CZ2 3.14Å; H8-W10 WeakPolarHBondContact ND1-CZ2 3.35Å; H8-W10 PolarHBondContact O-N 3.42Å; H8-S11 WeakPolarHBondContact O-CB 3.39Å; H8-S11 PolarHBondContact O-N 2.98Å; H8-S11 PolarHBondContact O-OG 3.48Å
9	L	53.6	Low	59.7	Low	152 Å²	152	92 Å²	92	80%	0.796	49%	0.494	S	S	*	.	H	α-helix	trans	-52.6	-35.7	167	-106.6	161.1	0	0	0	113.4	S11 S12	L9-S11 VanDerWaalsContact C-N 3.32Å; L9-S11 PolarHBondContact O-N 3.45Å; L9-S12 PolarHBondContact O-OG 2.97Å; L9-S12 VanDerWaalsContact O-OG 3.11Å
10	W	62.2	Low	61	Low	38 Å²	38	91.6 Å²	91.6	14%	0.144	49%	0.491	C	S	.	.	H	α-helix	trans	-74.9	-13.8	175.9	55.8	-101.9	0	0	0	114.2	H8 N13 F14 W17 K88 Q91	H8-W10 AromaticContact CE1-CH2 3.97Å; H8-W10 AromaticContact CE1-CZ2 3.73Å; H8-W10 AromaticContact ND1-CE2 3.88Å; H8-W10 AromaticContact ND1-CH2 3.41Å; H8-W10 WeakPolarHBondContact ND1-CH2 3.4Å; H8-W10 AromaticContact ND1-CZ2 3.14Å; H8-W10 WeakPolarHBondContact ND1-CZ2 3.35Å; H8-W10 PolarHBondContact O-N 3.42Å; W10-N13 CarbonylContact O-C 3.57Å; W10-F14 PolarHBondContact O-N 3.38Å; W10-W17 HydrophobicContact CB-CB 3.75Å; W10-W17 HydrophobicContact CB-CD2 4.14Å; W10-W17 HydrophobicContact CB-CG 3.63Å; W10-K88 HydrophobicContact CD2-CD 4.44Å; W10-K88 HydrophobicContact CD2-CG 4.04Å; W10-K88 HydrophobicContact CE3-CB 4.43Å; W10-K88 HydrophobicContact CE3-CG 4.36Å; W10-K88 HydrophobicContact CG-CD 4.15Å; W10-K88 HydrophobicContact CG-CG 4.27Å; W10-Q91 HydrophobicContact CH2-CB 3.57Å; W10-Q91 HydrophobicContact CH2-CG 4.2Å; W10-Q91 VanDerWaalsContact CH2-OE1 3.28Å; W10-Q91 HydrophobicContact CZ3-CB 3.52Å
11	S	58.8	Low	62.3	Low	14 Å²	14	91.9 Å²	91.9	10%	0.098	49%	0.486	C	S	.	.	H	α-helix	trans	-72.9	-34.6	-177.9	70.8	0	0	0	0	112.5	H8 L9 Y95	H8-S11 WeakPolarHBondContact O-CB 3.39Å; H8-S11 PolarHBondContact O-N 2.98Å; H8-S11 PolarHBondContact O-OG 3.48Å; L9-S11 VanDerWaalsContact C-N 3.32Å; L9-S11 PolarHBondContact O-N 3.45Å; S11-Y95 WeakPolarHBondContact O-CD1 3.48Å; S11-Y95 WeakPolarHBondContact O-CE1 3.27Å
12	S	61.9	Low	64.8	Low	70 Å²	70	80.3 Å²	80.3	49%	0.49	43%	0.429	S	S	.	.	H	α-helix	trans	-71.6	-38.1	177.5	30.9	0	0	0	0	112.5	L9	L9-S12 PolarHBondContact O-OG 2.97Å; L9-S12 VanDerWaalsContact O-OG 3.11Å
13	N	79.1	Confident	67.6	Low	55 Å²	55	80 Å²	80	29%	0.294	41%	0.414	S	S	.	.			trans	-152.5	101.8	178.3	-156.4	-7.1	0	0	0	111.5	W10 P15 D16 W17	W10-N13 CarbonylContact O-C 3.57Å; N13-P15 VanDerWaalsContact OD1-CD 3.25Å; N13-P15 WeakPolarHBondContact OD1-CD 3.36Å; N13-D16 HydrophobicContact CB-CB 4.12Å; N13-D16 VanDerWaalsContact CG-CG 3.43Å; N13-D16 PolarHBondContact ND2-OD1 3.08Å; N13-D16 PolarHBondContact ND2-OD2 3.1Å; N13-W17 PolarHBondContact O-N 3.35Å
14	F	86.1	Confident	70.3	Confident	0 Å²	0	81 Å²	81	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-68.1	-44	176	172.4	-91.5	0	0	0	112.8	W10 D16 W17 L18 M37 L40 I85 K88 H89 W92	W10-F14 PolarHBondContact O-N 3.38Å; F14-D16 PolarHBondContact O-N 3.2Å; F14-W17 AromaticContact CD2-CE3 3.83Å; F14-W17 HydrophobicContact CD2-CE3 3.83Å; F14-W17 HydrophobicContact CD2-CZ3 4.17Å; F14-W17 AromaticContact CE2-CE3 3.74Å; F14-W17 HydrophobicContact CE2-CE3 3.74Å; F14-W17 AromaticContact CE2-CZ3 3.6Å; F14-W17 HydrophobicContact CE2-CZ3 3.6Å; F14-W17 HydrophobicContact CZ-CZ3 4.26Å; F14-W17 PolarHBondContact O-N 3.4Å; F14-L18 HydrophobicContact CE1-CB 4.45Å; F14-L18 HydrophobicContact CE1-CD2 3.87Å; F14-L18 HydrophobicContact CZ-CD2 4.28Å; F14-L18 WeakPolarHBondContact O-CB 3.38Å; F14-L18 PolarHBondContact O-N 3.3Å; F14-M37 HydrophobicContact CD1-SD 3.64Å; F14-M37 HydrophobicContact CE1-SD 3.58Å; F14-M37 VanDerWaalsContact CE1-SD 3.58Å; F14-L40 HydrophobicContact CE1-CD1 3.81Å; F14-L40 HydrophobicContact CZ-CD1 3.88Å; F14-I85 WeakPolarHBondContact CE2-O 3.42Å; F14-I85 HydrophobicContact CZ-CG2 4.24Å; F14-K88 HydrophobicContact CD2-CB 3.89Å; F14-K88 HydrophobicContact CE2-CB 3.71Å; F14-H89 AromaticContact CD1-CD2 3.98Å; F14-H89 HydrophobicContact CE1-CB 4.23Å; F14-H89 AromaticContact CE1-CD2 3.67Å; F14-H89 HydrophobicContact CE2-CB 4.03Å; F14-H89 VanDerWaalsContact CE2-N 3.35Å; F14-H89 HydrophobicContact CZ-CB 3.8Å; F14-W92 HydrophobicContact CB-CB 3.8Å; F14-W92 HydrophobicContact CB-CD2 3.62Å; F14-W92 HydrophobicContact CB-CE3 4.24Å; F14-W92 HydrophobicContact CB-CG 3.38Å; F14-W92 HydrophobicContact CG-CB 4.36Å; F14-W92 HydrophobicContact CG-CD2 4.43Å; F14-W92 HydrophobicContact CG-CG 4.32Å
15	P	83.5	Confident	72.5	Confident	17 Å²	17	75.4 Å²	75.4	11%	0.11	38%	0.381	C	S	.	.	H	α-helix	trans	-48.9	-47.8	170.3	-32.8	35	0	0	0	115	N13 L18 Y19 M37	N13-P15 VanDerWaalsContact OD1-CD 3.25Å; N13-P15 WeakPolarHBondContact OD1-CD 3.36Å; P15-L18 PolarHBondContact O-N 3.18Å; P15-Y19 WeakPolarHBondContact O-CB 3.26Å; P15-Y19 PolarHBondContact O-N 3.36Å; P15-M37 HydrophobicContact CG-CE 4.16Å; P15-M37 HydrophobicContact CG-SD 4.19Å
16	D	81.1	Confident	74.4	Confident	88 Å²	88	68.7 Å²	68.7	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-41.5	178.7	-63	-2.1	0	0	0	111.5	N13 F14 L18 Y19 N20	N13-D16 HydrophobicContact CB-CB 4.12Å; N13-D16 VanDerWaalsContact CG-CG 3.43Å; N13-D16 PolarHBondContact ND2-OD1 3.08Å; N13-D16 PolarHBondContact ND2-OD2 3.1Å; F14-D16 PolarHBondContact O-N 3.2Å; D16-L18 VanDerWaalsContact C-N 3.33Å; D16-L18 PolarHBondContact O-N 2.89Å; D16-Y19 PolarHBondContact O-N 2.64Å; D16-N20 WeakPolarHBondContact O-CB 3.17Å; D16-N20 PolarHBondContact O-N 2.9Å; D16-N20 PolarHBondContact O-ND2 3.32Å
17	W	89.3	Confident	76.4	Confident	43 Å²	43	66.4 Å²	66.4	16%	0.163	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-43.4	176.1	169.4	72.5	0	0	0	111.5	W10 N13 F14 R21 F81 D84 I85 K88	W10-W17 HydrophobicContact CB-CB 3.75Å; W10-W17 HydrophobicContact CB-CD2 4.14Å; W10-W17 HydrophobicContact CB-CG 3.63Å; N13-W17 PolarHBondContact O-N 3.35Å; F14-W17 AromaticContact CD2-CE3 3.83Å; F14-W17 HydrophobicContact CD2-CE3 3.83Å; F14-W17 HydrophobicContact CD2-CZ3 4.17Å; F14-W17 AromaticContact CE2-CE3 3.74Å; F14-W17 HydrophobicContact CE2-CE3 3.74Å; F14-W17 AromaticContact CE2-CZ3 3.6Å; F14-W17 HydrophobicContact CE2-CZ3 3.6Å; F14-W17 HydrophobicContact CZ-CZ3 4.26Å; F14-W17 PolarHBondContact O-N 3.4Å; W17-R21 HydrophobicContact CZ2-CB 4.21Å; W17-R21 HydrophobicContact CZ2-CG 4.05Å; W17-R21 VanDerWaalsContact O-CB 3.23Å; W17-R21 WeakPolarHBondContact O-CB 3.41Å; W17-R21 PolarHBondContact O-N 2.05Å; W17-F81 HydrophobicContact CH2-CE2 4.21Å; W17-D84 WeakPolarHBondContact CH2-OD2 3.11Å; W17-D84 WeakPolarHBondContact CZ2-OD2 3.32Å; W17-I85 HydrophobicContact CH2-CG1 4.33Å; W17-I85 HydrophobicContact CZ3-CG1 4.44Å; W17-K88 HydrophobicContact CD2-CD 4Å; W17-K88 HydrophobicContact CE3-CD 3.92Å; W17-K88 HydrophobicContact CH2-CD 3.53Å; W17-K88 HydrophobicContact CZ2-CD 3.61Å; W17-K88 HydrophobicContact CZ3-CB 4.28Å; W17-K88 HydrophobicContact CZ3-CD 3.69Å
18	L	88.8	Confident	78.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-45.5	178.4	177.2	58.3	0	0	0	111.3	F14 P15 D16 R21 L22 T33 I36 M37 I85	F14-L18 HydrophobicContact CE1-CB 4.45Å; F14-L18 HydrophobicContact CE1-CD2 3.87Å; F14-L18 HydrophobicContact CZ-CD2 4.28Å; F14-L18 WeakPolarHBondContact O-CB 3.38Å; F14-L18 PolarHBondContact O-N 3.3Å; P15-L18 PolarHBondContact O-N 3.18Å; D16-L18 VanDerWaalsContact C-N 3.33Å; D16-L18 PolarHBondContact O-N 2.89Å; L18-R21 PolarHBondContact O-N 2.8Å; L18-L22 HydrophobicContact CD1-CD1 3.8Å; L18-L22 HydrophobicContact CD1-CG 4.14Å; L18-L22 HydrophobicContact CG-CD1 3.87Å; L18-L22 WeakPolarHBondContact O-CB 3.46Å; L18-L22 WeakPolarHBondContact O-CD1 3.15Å; L18-L22 VanDerWaalsContact O-CG 3.27Å; L18-L22 WeakPolarHBondContact O-CG 3.48Å; L18-L22 PolarHBondContact O-N 3.08Å; L18-T33 HydrophobicContact CD2-CG2 4.09Å; L18-T33 HydrophobicContact CG-CG2 4.27Å; L18-I36 HydrophobicContact CD1-CD1 4.38Å; L18-I36 HydrophobicContact CD1-CG2 4.27Å; L18-I36 HydrophobicContact CD2-CB 4.04Å; L18-I36 HydrophobicContact CD2-CG2 3.56Å; L18-M37 HydrophobicContact CD2-CG 4.3Å; L18-M37 HydrophobicContact CD2-SD 4.32Å; L18-I85 HydrophobicContact CD1-CD1 4.22Å; L18-I85 HydrophobicContact CD1-CG1 4.13Å
19	Y	87.2	Confident	79.4	Confident	87 Å²	87	58.9 Å²	58.9	34%	0.341	31%	0.311	S	S	.	.	H	α-helix	trans	-57.3	-56.2	175.6	-178	-79.6	0	0	0	111.2	P15 D16 R21 L22 E23 A29 L30 T33	P15-Y19 WeakPolarHBondContact O-CB 3.26Å; P15-Y19 PolarHBondContact O-N 3.36Å; D16-Y19 PolarHBondContact O-N 2.64Å; Y19-R21 PolarHBondContact O-N 3.18Å; Y19-L22 PolarHBondContact O-N 3.01Å; Y19-L22 VanDerWaalsContact O-N 3.14Å; Y19-E23 WeakPolarHBondContact CE1-OE2 3.4Å; Y19-E23 PolarHBondContact O-N 3.43Å; Y19-A29 HydrophobicContact CD1-CB 4.05Å; Y19-A29 HydrophobicContact CD2-CB 3.65Å; Y19-A29 HydrophobicContact CE1-CB 3.95Å; Y19-A29 HydrophobicContact CE2-CB 3.57Å; Y19-A29 HydrophobicContact CG-CB 3.89Å; Y19-A29 WeakPolarHBondContact O-CB 3.42Å; Y19-L30 HydrophobicContact CE2-CB 4.14Å; Y19-T33 VanDerWaalsContact CA-OG1 3.26Å; Y19-T33 WeakPolarHBondContact CA-OG1 3.33Å; Y19-T33 PolarHBondContact N-OG1 3.19Å
20	N	85.8	Confident	80.3	Confident	83 Å²	83	55.8 Å²	55.8	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-58.4	-38.6	179.9	-68.7	-41.9	0	0	0	111.3	D16 E23 E24	D16-N20 WeakPolarHBondContact O-CB 3.17Å; D16-N20 PolarHBondContact O-N 2.9Å; D16-N20 PolarHBondContact O-ND2 3.32Å; N20-E23 PolarHBondContact O-N 2.85Å; N20-E24 WeakPolarHBondContact O-CB 3.01Å; N20-E24 WeakPolarHBondContact O-CG 3.33Å; N20-E24 PolarHBondContact O-N 3.04Å
21	R	87	Confident	80.9	Confident	99 Å²	99	57.9 Å²	57.9	37%	0.374	31%	0.311	S	S	.	.	H	α-helix	trans	-73.7	-29.2	-179.5	-170.6	54	175.2	175.5	6.8	113.5	W17 L18 Y19 E24 L25 F81	W17-R21 HydrophobicContact CZ2-CB 4.21Å; W17-R21 HydrophobicContact CZ2-CG 4.05Å; W17-R21 VanDerWaalsContact O-CB 3.23Å; W17-R21 WeakPolarHBondContact O-CB 3.41Å; W17-R21 PolarHBondContact O-N 2.05Å; L18-R21 PolarHBondContact O-N 2.8Å; Y19-R21 PolarHBondContact O-N 3.18Å; R21-E24 WeakPolarHBondContact CD-OE2 3.42Å; R21-E24 IonicContact CZ-OE2 3.34Å; R21-E24 IonicContact NE-OE2 2.89Å; R21-E24 IonicContact NH1-OE2 2.69Å; R21-E24 PolarHBondContact NH1-OE2 3.43Å; R21-L25 HydrophobicContact CG-CD1 4.49Å; R21-L25 WeakPolarHBondContact O-CD1 3.5Å; R21-L25 VanDerWaalsContact O-CG 3.29Å; R21-L25 WeakPolarHBondContact O-CG 3.3Å; R21-L25 PolarHBondContact O-N 3.32Å; R21-F81 HydrophobicContact CB-CE2 4.41Å; R21-F81 HydrophobicContact CG-CD2 4.46Å; R21-F81 HydrophobicContact CG-CE2 3.54Å; R21-F81 HydrophobicContact CG-CZ 3.89Å
22	L	87.3	Confident	81.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.6	-39.3	171.5	-74.8	163.5	0	0	0	111.3	L18 Y19 L25 G26 F27 A29 Y32 T33 I36 L68 F81	L18-L22 HydrophobicContact CD1-CD1 3.8Å; L18-L22 HydrophobicContact CD1-CG 4.14Å; L18-L22 HydrophobicContact CG-CD1 3.87Å; L18-L22 WeakPolarHBondContact O-CB 3.46Å; L18-L22 WeakPolarHBondContact O-CD1 3.15Å; L18-L22 VanDerWaalsContact O-CG 3.27Å; L18-L22 WeakPolarHBondContact O-CG 3.48Å; L18-L22 PolarHBondContact O-N 3.08Å; Y19-L22 PolarHBondContact O-N 3.01Å; Y19-L22 VanDerWaalsContact O-N 3.14Å; L22-L25 CarbonylContact O-C 3.47Å; L22-L25 PolarHBondContact O-N 3.2Å; L22-L25 VanDerWaalsContact O-N 3.17Å; L22-G26 PolarHBondContact O-N 3.25Å; L22-G26 VanDerWaalsContact O-N 3.13Å; L22-F27 HydrophobicContact CB-CB 4.14Å; L22-F27 HydrophobicContact CD2-CB 4.07Å; L22-F27 HydrophobicContact CD2-CD2 3.71Å; L22-F27 HydrophobicContact CD2-CE2 4.24Å; L22-F27 HydrophobicContact CD2-CG 3.87Å; L22-F27 PolarHBondContact O-N 3.04Å; L22-A29 HydrophobicContact CB-CB 4.03Å; L22-Y32 HydrophobicContact CD2-CG 4.5Å; L22-T33 WeakPolarHBondContact CD1-OG1 3.42Å; L22-I36 HydrophobicContact CD1-CD1 4.14Å; L22-I36 HydrophobicContact CD2-CD1 4.14Å; L22-L68 HydrophobicContact CD2-CD2 4.14Å; L22-F81 HydrophobicContact CD2-CE1 4.07Å; L22-F81 HydrophobicContact CD2-CZ 4.22Å; L22-F81 HydrophobicContact CG-CZ 4.47Å
23	E	86.2	Confident	82.9	Confident	113 Å²	113	57 Å²	57	53%	0.528	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-43.7	174.7	-169.7	169.4	-152	0	0	111.5	Y19 N20 L25 G26 A29	Y19-E23 WeakPolarHBondContact CE1-OE2 3.4Å; Y19-E23 PolarHBondContact O-N 3.43Å; N20-E23 PolarHBondContact O-N 2.85Å; E23-L25 PolarHBondContact O-N 2.99Å; E23-G26 PolarHBondContact O-N 2.98Å; E23-A29 HydrophobicContact CB-CB 3.95Å
24	E	85.5	Confident	82.7	Confident	137 Å²	137	62.3 Å²	62.3	64%	0.64	31%	0.313	S	S	*	.	H	α-helix	trans	-57.2	-27.4	171.2	-79.4	178.8	170.3	0	0	113.8	N20 R21	N20-E24 WeakPolarHBondContact O-CB 3.01Å; N20-E24 WeakPolarHBondContact O-CG 3.33Å; N20-E24 PolarHBondContact O-N 3.04Å; R21-E24 WeakPolarHBondContact CD-OE2 3.42Å; R21-E24 IonicContact CZ-OE2 3.34Å; R21-E24 IonicContact NE-OE2 2.89Å; R21-E24 IonicContact NH1-OE2 2.69Å; R21-E24 PolarHBondContact NH1-OE2 3.43Å
25	L	83.3	Confident	82.4	Confident	58 Å²	58	67.4 Å²	67.4	30%	0.304	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	1.4	179.2	-71	170.5	0	0	0	113.2	R21 L22 E23 F27 M73 F81	R21-L25 HydrophobicContact CG-CD1 4.49Å; R21-L25 WeakPolarHBondContact O-CD1 3.5Å; R21-L25 VanDerWaalsContact O-CG 3.29Å; R21-L25 WeakPolarHBondContact O-CG 3.3Å; R21-L25 PolarHBondContact O-N 3.32Å; L22-L25 CarbonylContact O-C 3.47Å; L22-L25 PolarHBondContact O-N 3.2Å; L22-L25 VanDerWaalsContact O-N 3.17Å; E23-L25 PolarHBondContact O-N 2.99Å; L25-F27 HydrophobicContact CB-CD2 3.67Å; L25-F27 HydrophobicContact CB-CE2 3.77Å; L25-F27 HydrophobicContact CD1-CE2 4.3Å; L25-M73 HydrophobicContact CD1-CE 4.2Å; L25-M73 HydrophobicContact CD1-SD 4.12Å; L25-M73 HydrophobicContact CD2-CE 4.26Å; L25-M73 HydrophobicContact CD2-SD 4.32Å; L25-F81 HydrophobicContact CD1-CD1 3.73Å; L25-F81 HydrophobicContact CD1-CE1 3.42Å; L25-F81 VanDerWaalsContact CD1-CE1 3.42Å; L25-F81 HydrophobicContact CD1-CE2 4.32Å; L25-F81 HydrophobicContact CD1-CG 4.31Å; L25-F81 HydrophobicContact CD1-CZ 3.75Å
26	G	79.9	Confident	82.5	Confident	73 Å²	73	66.6 Å²	66.6	75%	0.753	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	12.8	176.6	0	0	0	0	0	115.9	L22 E23	L22-G26 PolarHBondContact O-N 3.25Å; L22-G26 VanDerWaalsContact O-N 3.13Å; E23-G26 PolarHBondContact O-N 2.98Å
27	F	80.9	Confident	82.6	Confident	24 Å²	24	63.3 Å²	63.3	11%	0.105	31%	0.31	C	S	.	.	S	Bend	trans	-77	161.3	172.9	-68	-90.4	0	0	0	111.7	L22 L25 A29 Y32 L68 S71 M73	L22-F27 HydrophobicContact CB-CB 4.14Å; L22-F27 HydrophobicContact CD2-CB 4.07Å; L22-F27 HydrophobicContact CD2-CD2 3.71Å; L22-F27 HydrophobicContact CD2-CE2 4.24Å; L22-F27 HydrophobicContact CD2-CG 3.87Å; L22-F27 PolarHBondContact O-N 3.04Å; L25-F27 HydrophobicContact CB-CD2 3.67Å; L25-F27 HydrophobicContact CB-CE2 3.77Å; L25-F27 HydrophobicContact CD1-CE2 4.3Å; F27-A29 VanDerWaalsContact C-N 3.28Å; F27-A29 PolarHBondContact O-N 3.18Å; F27-Y32 HydrophobicContact CB-CD2 4.09Å; F27-Y32 HydrophobicContact CB-CG 4.2Å; F27-Y32 AromaticContact CD1-CD1 3.69Å; F27-Y32 HydrophobicContact CD1-CD1 3.69Å; F27-Y32 AromaticContact CD1-CD2 3.97Å; F27-Y32 HydrophobicContact CD1-CD2 3.97Å; F27-Y32 AromaticContact CD1-CE1 3.51Å; F27-Y32 HydrophobicContact CD1-CE1 3.51Å; F27-Y32 AromaticContact CD1-CE2 3.81Å; F27-Y32 HydrophobicContact CD1-CE2 3.81Å; F27-Y32 AromaticContact CD1-CG 3.92Å; F27-Y32 HydrophobicContact CD1-CG 3.92Å; F27-Y32 AromaticContact CD1-CZ 3.57Å; F27-Y32 HydrophobicContact CE1-CD1 4.07Å; F27-Y32 AromaticContact CE1-CE1 3.65Å; F27-Y32 HydrophobicContact CE1-CE1 3.65Å; F27-Y32 AromaticContact CE1-CZ 3.97Å; F27-Y32 HydrophobicContact CG-CD1 4.43Å; F27-Y32 HydrophobicContact CG-CD2 4.48Å; F27-Y32 HydrophobicContact CG-CG 4.36Å; F27-L68 HydrophobicContact CE1-CD2 3.76Å; F27-L68 HydrophobicContact CE2-CD2 4.05Å; F27-L68 HydrophobicContact CZ-CD2 3.48Å; F27-L68 VanDerWaalsContact CZ-CD2 3.48Å; F27-S71 WeakPolarHBondContact CZ-OG 3.29Å; F27-M73 HydrophobicContact CE2-SD 3.8Å; F27-M73 HydrophobicContact CZ-SD 3.95Å
28	D	79.4	Confident	82.1	Confident	81 Å²	81	63.9 Å²	63.9	43%	0.433	32%	0.32	S	S	.	.			trans	-66.5	92.2	158	-176.2	-36.4	0	0	0	108.4	L30 V31 Y32	D28-L30 PolarHBondContact O-N 3.42Å; D28-L30 PolarHBondContact OD1-N 3.48Å; D28-L30 VanDerWaalsContact OD1-N 3.13Å; D28-V31 HydrophobicContact CB-CB 4.16Å; D28-V31 HydrophobicContact CB-CG2 4.44Å; D28-V31 PolarHBondContact O-N 3.34Å; D28-V31 WeakPolarHBondContact OD1-CG2 3.11Å; D28-V31 PolarHBondContact OD1-N 3.46Å; D28-V31 WeakPolarHBondContact OD2-CG2 3.17Å; D28-Y32 HydrophobicContact CB-CD2 4.38Å; D28-Y32 WeakPolarHBondContact O-CB 3.45Å; D28-Y32 WeakPolarHBondContact O-CD2 3.45Å; D28-Y32 PolarHBondContact O-N 3.47Å
29	A	80.5	Confident	81.7	Confident	5 Å²	5	64 Å²	64	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-30.8	-174.9	0	0	0	0	0	112.8	Y19 L22 E23 F27 T33	Y19-A29 HydrophobicContact CD1-CB 4.05Å; Y19-A29 HydrophobicContact CD2-CB 3.65Å; Y19-A29 HydrophobicContact CE1-CB 3.95Å; Y19-A29 HydrophobicContact CE2-CB 3.57Å; Y19-A29 HydrophobicContact CG-CB 3.89Å; Y19-A29 WeakPolarHBondContact O-CB 3.42Å; L22-A29 HydrophobicContact CB-CB 4.03Å; E23-A29 HydrophobicContact CB-CB 3.95Å; F27-A29 VanDerWaalsContact C-N 3.28Å; F27-A29 PolarHBondContact O-N 3.18Å; A29-T33 WeakPolarHBondContact O-CB 3.3Å; A29-T33 PolarHBondContact O-N 3.38Å; A29-T33 PolarHBondContact O-OG1 3.13Å
30	L	72.4	Confident	81.4	Confident	86 Å²	86	60.4 Å²	60.4	45%	0.45	31%	0.308	S	S	.	.	H	α-helix	trans	-71.8	-47.9	179	-175.2	64.7	0	0	0	111.2	Y19 D28 R34	Y19-L30 HydrophobicContact CE2-CB 4.14Å; D28-L30 PolarHBondContact O-N 3.42Å; D28-L30 PolarHBondContact OD1-N 3.48Å; D28-L30 VanDerWaalsContact OD1-N 3.13Å; L30-R34 WeakPolarHBondContact O-CB 3.28Å; L30-R34 WeakPolarHBondContact O-CD 2.99Å; L30-R34 WeakPolarHBondContact O-CG 3.4Å; L30-R34 PolarHBondContact O-N 2.78Å
31	V	74.2	Confident	80.8	Confident	82 Å²	82	60.4 Å²	60.4	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-48.8	179.3	173.5	0	0	0	0	110.8	D28 R34 Y35	D28-V31 HydrophobicContact CB-CB 4.16Å; D28-V31 HydrophobicContact CB-CG2 4.44Å; D28-V31 PolarHBondContact O-N 3.34Å; D28-V31 WeakPolarHBondContact OD1-CG2 3.11Å; D28-V31 PolarHBondContact OD1-N 3.46Å; D28-V31 WeakPolarHBondContact OD2-CG2 3.17Å; V31-R34 PolarHBondContact O-N 3.43Å; V31-Y35 PolarHBondContact O-N 3.04Å
32	Y	81.3	Confident	79.9	Confident	52 Å²	52	58.4 Å²	58.4	20%	0.204	30%	0.299	C	S	.	.	H	α-helix	trans	-68.5	-38.4	-177.7	-83.1	-100.7	0	0	0	112.3	L22 F27 D28 R34 Y35 I36 C67 L68 S70	L22-Y32 HydrophobicContact CD2-CG 4.5Å; F27-Y32 HydrophobicContact CB-CD2 4.09Å; F27-Y32 HydrophobicContact CB-CG 4.2Å; F27-Y32 AromaticContact CD1-CD1 3.69Å; F27-Y32 HydrophobicContact CD1-CD1 3.69Å; F27-Y32 AromaticContact CD1-CD2 3.97Å; F27-Y32 HydrophobicContact CD1-CD2 3.97Å; F27-Y32 AromaticContact CD1-CE1 3.51Å; F27-Y32 HydrophobicContact CD1-CE1 3.51Å; F27-Y32 AromaticContact CD1-CE2 3.81Å; F27-Y32 HydrophobicContact CD1-CE2 3.81Å; F27-Y32 AromaticContact CD1-CG 3.92Å; F27-Y32 HydrophobicContact CD1-CG 3.92Å; F27-Y32 AromaticContact CD1-CZ 3.57Å; F27-Y32 HydrophobicContact CE1-CD1 4.07Å; F27-Y32 AromaticContact CE1-CE1 3.65Å; F27-Y32 HydrophobicContact CE1-CE1 3.65Å; F27-Y32 AromaticContact CE1-CZ 3.97Å; F27-Y32 HydrophobicContact CG-CD1 4.43Å; F27-Y32 HydrophobicContact CG-CD2 4.48Å; F27-Y32 HydrophobicContact CG-CG 4.36Å; D28-Y32 HydrophobicContact CB-CD2 4.38Å; D28-Y32 WeakPolarHBondContact O-CB 3.45Å; D28-Y32 WeakPolarHBondContact O-CD2 3.45Å; D28-Y32 PolarHBondContact O-N 3.47Å; Y32-R34 PolarHBondContact O-N 2.91Å; Y32-Y35 PolarHBondContact O-N 3.38Å; Y32-I36 VanDerWaalsContact O-CB 3.24Å; Y32-I36 WeakPolarHBondContact O-CB 3.25Å; Y32-I36 VanDerWaalsContact O-CG1 3.22Å; Y32-I36 WeakPolarHBondContact O-CG1 3.35Å; Y32-I36 PolarHBondContact O-N 2.87Å; Y32-C67 VanDerWaalsContact CE1-SG 3.55Å; Y32-L68 HydrophobicContact CD1-CD2 4.25Å; Y32-L68 HydrophobicContact CE1-CD2 4.5Å; Y32-S70 PolarHBondContact OH-OG 3.49Å
33	T	82.3	Confident	78.3	Confident	14 Å²	14	63 Å²	63	9%	0.086	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.8	-60.3	0	0	0	0	110.8	L18 Y19 L22 A29 M37	L18-T33 HydrophobicContact CD2-CG2 4.09Å; L18-T33 HydrophobicContact CG-CG2 4.27Å; Y19-T33 VanDerWaalsContact CA-OG1 3.26Å; Y19-T33 WeakPolarHBondContact CA-OG1 3.33Å; Y19-T33 PolarHBondContact N-OG1 3.19Å; L22-T33 WeakPolarHBondContact CD1-OG1 3.42Å; A29-T33 WeakPolarHBondContact O-CB 3.3Å; A29-T33 PolarHBondContact O-N 3.38Å; A29-T33 PolarHBondContact O-OG1 3.13Å; T33-M37 HydrophobicContact CG2-CG 4.22Å; T33-M37 VanDerWaalsContact O-CB 3.27Å; T33-M37 WeakPolarHBondContact O-CB 3.28Å; T33-M37 WeakPolarHBondContact O-CG 3.38Å; T33-M37 PolarHBondContact O-N 2.99Å
34	R	74.7	Confident	76.7	Confident	167 Å²	167	62.5 Å²	62.5	63%	0.63	33%	0.328	S	S	*	.	H	α-helix	trans	-62	-44.7	178.2	-73.7	172	176.9	-154.9	-3	112	L30 V31 Y32 S38	L30-R34 WeakPolarHBondContact O-CB 3.28Å; L30-R34 WeakPolarHBondContact O-CD 2.99Å; L30-R34 WeakPolarHBondContact O-CG 3.4Å; L30-R34 PolarHBondContact O-N 2.78Å; V31-R34 PolarHBondContact O-N 3.43Å; Y32-R34 PolarHBondContact O-N 2.91Å; R34-S38 WeakPolarHBondContact O-CB 3.36Å; R34-S38 PolarHBondContact O-N 3.33Å; R34-S38 VanDerWaalsContact O-N 3.08Å
35	Y	79.6	Confident	74.6	Confident	106 Å²	106	59.3 Å²	59.3	42%	0.416	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-49.8	177.8	-178.4	-93.2	0	0	0	112.2	V31 Y32 M37 S38 V39 T63 C67	V31-Y35 PolarHBondContact O-N 3.04Å; Y32-Y35 PolarHBondContact O-N 3.38Å; Y35-M37 PolarHBondContact O-N 2.82Å; Y35-S38 WeakPolarHBondContact O-CA 3.27Å; Y35-S38 VanDerWaalsContact O-CB 3.3Å; Y35-S38 WeakPolarHBondContact O-CB 3.44Å; Y35-S38 PolarHBondContact O-N 3.17Å; Y35-V39 HydrophobicContact CD1-CG2 4.1Å; Y35-V39 HydrophobicContact CE1-CG2 3.6Å; Y35-V39 HydrophobicContact CE2-CG2 4.42Å; Y35-V39 PolarHBondContact O-N 3.47Å; Y35-T63 WeakPolarHBondContact OH-CG2 3.28Å; Y35-C67 HydrophobicContact CD1-CB 4.28Å; Y35-C67 VanDerWaalsContact CD1-SG 3.51Å; Y35-C67 HydrophobicContact CE1-CB 3.73Å; Y35-C67 VanDerWaalsContact CE1-SG 3.56Å
36	I	85.7	Confident	72.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-41.5	-178.8	-70.2	169.6	0	0	0	110.8	L18 L22 Y32 S38 V39 L40 L64 L68 I85	L18-I36 HydrophobicContact CD1-CD1 4.38Å; L18-I36 HydrophobicContact CD1-CG2 4.27Å; L18-I36 HydrophobicContact CD2-CB 4.04Å; L18-I36 HydrophobicContact CD2-CG2 3.56Å; L22-I36 HydrophobicContact CD1-CD1 4.14Å; L22-I36 HydrophobicContact CD2-CD1 4.14Å; Y32-I36 VanDerWaalsContact O-CB 3.24Å; Y32-I36 WeakPolarHBondContact O-CB 3.25Å; Y32-I36 VanDerWaalsContact O-CG1 3.22Å; Y32-I36 WeakPolarHBondContact O-CG1 3.35Å; Y32-I36 PolarHBondContact O-N 2.87Å; I36-S38 VanDerWaalsContact C-N 3.32Å; I36-S38 PolarHBondContact O-N 3.23Å; I36-V39 PolarHBondContact O-N 2.77Å; I36-L40 HydrophobicContact CG2-CD1 3.63Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.48Å; I36-L40 VanDerWaalsContact O-CG 3.24Å; I36-L40 WeakPolarHBondContact O-CG 3.48Å; I36-L40 PolarHBondContact O-N 3.46Å; I36-L64 HydrophobicContact CB-CD2 3.97Å; I36-L64 HydrophobicContact CG1-CD2 3.7Å; I36-L64 HydrophobicContact CG2-CD2 3.67Å; I36-L68 HydrophobicContact CD1-CD2 4.19Å; I36-I85 HydrophobicContact CD1-CD1 4.44Å; I36-I85 HydrophobicContact CG2-CG2 3.91Å
37	M	83.8	Confident	70.9	Confident	20 Å²	20	66.4 Å²	66.4	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-36	172.6	-72.7	-60.6	-58.2	0	0	112.6	F14 P15 L18 T33 Y35 K41 W92	F14-M37 HydrophobicContact CD1-SD 3.64Å; F14-M37 HydrophobicContact CE1-SD 3.58Å; F14-M37 VanDerWaalsContact CE1-SD 3.58Å; P15-M37 HydrophobicContact CG-CE 4.16Å; P15-M37 HydrophobicContact CG-SD 4.19Å; L18-M37 HydrophobicContact CD2-CG 4.3Å; L18-M37 HydrophobicContact CD2-SD 4.32Å; T33-M37 HydrophobicContact CG2-CG 4.22Å; T33-M37 VanDerWaalsContact O-CB 3.27Å; T33-M37 WeakPolarHBondContact O-CB 3.28Å; T33-M37 WeakPolarHBondContact O-CG 3.38Å; T33-M37 PolarHBondContact O-N 2.99Å; Y35-M37 PolarHBondContact O-N 2.82Å; M37-K41 WeakPolarHBondContact O-CB 3.07Å; M37-K41 VanDerWaalsContact O-CG 3.29Å; M37-K41 WeakPolarHBondContact O-CG 3.46Å; M37-K41 PolarHBondContact O-N 2.9Å; M37-W92 HydrophobicContact CE-CH2 4.45Å; M37-W92 HydrophobicContact CE-CZ3 4.35Å
38	S	78.4	Confident	69.3	Low	55 Å²	55	72.7 Å²	72.7	39%	0.385	37%	0.37	S	S	.	.	H	α-helix	trans	-65	-46	175.2	-170.3	0	0	0	0	111.7	R34 Y35 I36 K41 Q42	R34-S38 WeakPolarHBondContact O-CB 3.36Å; R34-S38 PolarHBondContact O-N 3.33Å; R34-S38 VanDerWaalsContact O-N 3.08Å; Y35-S38 WeakPolarHBondContact O-CA 3.27Å; Y35-S38 VanDerWaalsContact O-CB 3.3Å; Y35-S38 WeakPolarHBondContact O-CB 3.44Å; Y35-S38 PolarHBondContact O-N 3.17Å; I36-S38 VanDerWaalsContact C-N 3.32Å; I36-S38 PolarHBondContact O-N 3.23Å; S38-K41 PolarHBondContact O-N 3.32Å; S38-Q42 PolarHBondContact O-N 2.92Å
39	V	80.3	Confident	67.7	Low	3 Å²	3	73.1 Å²	73.1	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-63.3	-44.8	176.1	174.9	0	0	0	0	111.3	Y35 I36 K41 Q42 N60 T63 L64	Y35-V39 HydrophobicContact CD1-CG2 4.1Å; Y35-V39 HydrophobicContact CE1-CG2 3.6Å; Y35-V39 HydrophobicContact CE2-CG2 4.42Å; Y35-V39 PolarHBondContact O-N 3.47Å; I36-V39 PolarHBondContact O-N 2.77Å; V39-K41 VanDerWaalsContact C-N 3.31Å; V39-K41 PolarHBondContact O-N 2.97Å; V39-Q42 WeakPolarHBondContact O-CB 3.35Å; V39-Q42 WeakPolarHBondContact O-CG 3.11Å; V39-Q42 PolarHBondContact O-N 3.46Å; V39-N60 HydrophobicContact CG1-CB 4.05Å; V39-N60 PolarHBondContact O-ND2 3.36Å; V39-N60 VanDerWaalsContact O-ND2 3.1Å; V39-T63 HydrophobicContact CG1-CG2 4Å; V39-T63 HydrophobicContact CG2-CG2 3.8Å; V39-L64 HydrophobicContact CB-CD2 4.17Å; V39-L64 HydrophobicContact CG1-CD2 4.04Å; V39-L64 HydrophobicContact CG1-CG 3.96Å
40	L	81	Confident	65.9	Low	11 Å²	11	77.7 Å²	77.7	6%	0.058	39%	0.39	C	S	.	.	H	α-helix	trans	-65.3	-31.7	179.3	-72.6	166.8	0	0	0	113.2	F14 I36 Q42 L64 I85 I86 H89	F14-L40 HydrophobicContact CE1-CD1 3.81Å; F14-L40 HydrophobicContact CZ-CD1 3.88Å; I36-L40 HydrophobicContact CG2-CD1 3.63Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.48Å; I36-L40 VanDerWaalsContact O-CG 3.24Å; I36-L40 WeakPolarHBondContact O-CG 3.48Å; I36-L40 PolarHBondContact O-N 3.46Å; L40-Q42 VanDerWaalsContact C-N 3.29Å; L40-Q42 PolarHBondContact O-N 2.87Å; L40-L64 HydrophobicContact CD2-CD1 3.85Å; L40-L64 HydrophobicContact CG-CD1 4.26Å; L40-I85 HydrophobicContact CD1-CG2 3.8Å; L40-I85 HydrophobicContact CD2-CG2 4.37Å; L40-I86 HydrophobicContact CD2-CG1 4.33Å; L40-H89 HydrophobicContact CD1-CB 4.14Å; L40-H89 HydrophobicContact CD2-CB 4.15Å
41	K	73.6	Confident	64.3	Low	83 Å²	83	77.3 Å²	77.3	36%	0.361	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.9	175.3	-77.4	-171.7	-178.1	-157.1	0	114.7	M37 S38 V39 Y123 D124	M37-K41 WeakPolarHBondContact O-CB 3.07Å; M37-K41 VanDerWaalsContact O-CG 3.29Å; M37-K41 WeakPolarHBondContact O-CG 3.46Å; M37-K41 PolarHBondContact O-N 2.9Å; S38-K41 PolarHBondContact O-N 3.32Å; V39-K41 VanDerWaalsContact C-N 3.31Å; V39-K41 PolarHBondContact O-N 2.97Å; K41-Y123 PolarHBondContact NZ-O 3.22Å; K41-D124 IonicContact NZ-OD1 3.17Å; K41-D124 PolarHBondContact NZ-OD1 2.87Å
42	Q	67	Low	62.8	Low	56 Å²	56	83 Å²	83	26%	0.262	42%	0.419	S	S	.	.	S	Bend	trans	-62.4	131.2	178.3	-68.7	-174.9	-1.2	0	0	110.5	S38 V39 L40 M44	S38-Q42 PolarHBondContact O-N 2.92Å; V39-Q42 WeakPolarHBondContact O-CB 3.35Å; V39-Q42 WeakPolarHBondContact O-CG 3.11Å; V39-Q42 PolarHBondContact O-N 3.46Å; L40-Q42 VanDerWaalsContact C-N 3.29Å; L40-Q42 PolarHBondContact O-N 2.87Å; Q42-M44 PolarHBondContact O-N 2.91Å
43	P	55.3	Low	60.9	Low	98 Å²	98	82.8 Å²	82.8	64%	0.636	42%	0.418	S	S	*	.			trans	-67.7	110.3	-173.7	26.4	-34	0	0	0	110.6	P45	P43-P45 WeakPolarHBondContact O-CD 3.4Å; P43-P45 VanDerWaalsContact O-N 3.09Å
44	M	51.5	Low	58.8	Low	102 Å²	102	89.5 Å²	89.5	50%	0.502	45%	0.453	S	S	.	.			trans	-47.1	116	169.7	-74	-69.8	-72.9	0	0	109.4	Q42	Q42-M44 PolarHBondContact O-N 2.91Å
45	P	40.9	Very low	57.2	Low	69 Å²	69	86.2 Å²	86.2	45%	0.448	46%	0.462	S	S	.	.			trans	-65.2	147.1	-167.7	-13.9	23	0	0	0	111	P43 R53	P43-P45 WeakPolarHBondContact O-CD 3.4Å; P43-P45 VanDerWaalsContact O-N 3.09Å; P45-R53 PolarHBondContact O-NH1 3.37Å; P45-R53 PolarHBondContact O-NH2 3.4Å
46	T	43.5	Very low	55.2	Low	105 Å²	105	87.8 Å²	87.8	64%	0.644	48%	0.475	S	S	*	.			trans	-62.4	165.2	-154.4	46	0	0	0	0	115.9	D48 E49	T46-D48 PolarHBondContact O-N 3.45Å; T46-E49 PolarHBondContact O-N 2.83Å; T46-E49 VanDerWaalsContact O-N 3.09Å
47	K	42.3	Very low	53.6	Low	176 Å²	176	91.8 Å²	91.8	77%	0.765	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-57.6	-14.6	-167.4	-72.4	-179.2	176	177.2	0	115.8	E49 Q50	K47-E49 PolarHBondContact O-N 3.25Å; K47-Q50 WeakPolarHBondContact O-CB 3.19Å; K47-Q50 PolarHBondContact O-N 2.85Å
48	D	46.9	Very low	52.5	Low	155 Å²	155	93.2 Å²	93.2	83%	0.829	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-67.3	-21	176.7	-48.4	-59.4	0	0	0	112.3	T46	T46-D48 PolarHBondContact O-N 3.45Å
49	E	46	Very low	51.8	Low	90 Å²	90	93.4 Å²	93.4	42%	0.421	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-88.5	-7.6	167.7	-79	-132.8	122.6	0	0	114.4	T46 K47 G51 R52 R53	T46-E49 PolarHBondContact O-N 2.83Å; T46-E49 VanDerWaalsContact O-N 3.09Å; K47-E49 PolarHBondContact O-N 3.25Å; E49-G51 PolarHBondContact O-N 3.45Å; E49-G51 VanDerWaalsContact O-N 3.13Å; E49-R52 PolarHBondContact O-N 3.41Å; E49-R53 IonicContact OE2-CZ 3.83Å; E49-R53 IonicContact OE2-NE 3.42Å; E49-R53 IonicContact OE2-NH2 3.62Å; E49-R53 PolarHBondContact OE2-NH2 2.98Å
50	Q	43.3	Very low	51.6	Low	101 Å²	101	93.6 Å²	93.6	47%	0.472	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-59.8	-34.6	-169.4	-166.5	65.7	42.8	0	0	112.3	K47 R52 R53	K47-Q50 WeakPolarHBondContact O-CB 3.19Å; K47-Q50 PolarHBondContact O-N 2.85Å; Q50-R52 PolarHBondContact O-N 2.91Å; Q50-R52 VanDerWaalsContact O-N 3.15Å; Q50-R53 PolarHBondContact O-N 3.29Å
51	G	38.3	Very low	51.7	Low	78 Å²	78	96.1 Å²	96.1	80%	0.804	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-70.3	1	176	0	0	0	0	0	115.9	E49	E49-G51 PolarHBondContact O-N 3.45Å; E49-G51 VanDerWaalsContact O-N 3.13Å
52	R	43.6	Very low	51.8	Low	203 Å²	203	94.8 Å²	94.8	77%	0.766	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-108.2	-9.2	171.6	-92.8	-177.2	171.5	175.9	-2.5	113.9	E49 Q50	E49-R52 PolarHBondContact O-N 3.41Å; Q50-R52 PolarHBondContact O-N 2.91Å; Q50-R52 VanDerWaalsContact O-N 3.15Å
53	R	41.5	Very low	52.4	Low	46 Å²	46	94.1 Å²	94.1	17%	0.174	52%	0.521	C	S	.	.			trans	-98.1	-2.5	-163.9	-70.4	-167.2	-171.6	145.1	7.2	116.8	P45 E49 Q50 A55 M56	P45-R53 PolarHBondContact O-NH1 3.37Å; P45-R53 PolarHBondContact O-NH2 3.4Å; E49-R53 IonicContact OE2-CZ 3.83Å; E49-R53 IonicContact OE2-NE 3.42Å; E49-R53 IonicContact OE2-NH2 3.62Å; E49-R53 PolarHBondContact OE2-NH2 2.98Å; Q50-R53 PolarHBondContact O-N 3.29Å; R53-A55 PolarHBondContact O-N 3.42Å; R53-M56 HydrophobicContact CB-CB 4.43Å; R53-M56 HydrophobicContact CG-CB 4.33Å; R53-M56 PolarHBondContact O-N 3.08Å
54	D	38.7	Very low	53.8	Low	155 Å²	155	89.4 Å²	89.4	83%	0.829	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-2	176.2	-62.6	-28.4	0	0	0	114.2
55	A	40.3	Very low	55.4	Low	99 Å²	99	86.4 Å²	86.4	82%	0.818	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.9	7	173.2	0	0	0	0	0	114.2	R53	R53-A55 PolarHBondContact O-N 3.42Å
56	M	37.7	Very low	57.3	Low	138 Å²	138	89.8 Å²	89.8	68%	0.68	48%	0.484	S	S	*	.	S	Bend	trans	-108.5	127.3	-172.4	-155.8	74.8	129	0	0	110.5	R53	R53-M56 HydrophobicContact CB-CB 4.43Å; R53-M56 HydrophobicContact CG-CB 4.33Å; R53-M56 PolarHBondContact O-N 3.08Å
57	P	52.3	Low	59	Low	85 Å²	85	85.8 Å²	85.8	55%	0.552	46%	0.461	S	S	*	.			trans	-61.8	143.9	175.5	26.4	-33.7	0	0	0	110.6	S59	P57-S59 PolarHBondContact O-N 3.22Å
58	N	59.8	Low	60.9	Low	50 Å²	50	77.4 Å²	77.4	27%	0.267	42%	0.424	S	S	.	.			trans	-51.2	126.1	171.7	177.3	-7.7	0	0	0	109.1	N60 R61	N58-N60 PolarHBondContact O-N 3.47Å; N58-N60 VanDerWaalsContact O-N 3.11Å; N58-N60 WeakPolarHBondContact OD1-CB 3.5Å; N58-N60 PolarHBondContact OD1-N 2.88Å; N58-R61 HydrophobicContact CB-CB 4.27Å; N58-R61 WeakPolarHBondContact O-CA 3.41Å; N58-R61 WeakPolarHBondContact O-CB 3.4Å; N58-R61 PolarHBondContact O-N 3.3Å
59	S	63.9	Low	62.4	Low	59 Å²	59	73.4 Å²	73.4	41%	0.413	40%	0.401	S	S	.	.	H	α-helix	trans	-48.9	-41.8	179.7	42	0	0	0	0	111.7	P57 R61 S62	P57-S59 PolarHBondContact O-N 3.22Å; S59-R61 VanDerWaalsContact C-N 3.25Å; S59-R61 PolarHBondContact O-N 3.37Å; S59-S62 PolarHBondContact O-N 3.07Å
60	N	77.1	Confident	63.4	Low	7 Å²	7	73 Å²	73	4%	0.037	41%	0.409	C	S	.	.	H	α-helix	trans	-71	-24.9	-175.4	-53.5	10	0	0	0	110.4	V39 N58 L64	V39-N60 HydrophobicContact CG1-CB 4.05Å; V39-N60 PolarHBondContact O-ND2 3.36Å; V39-N60 VanDerWaalsContact O-ND2 3.1Å; N58-N60 PolarHBondContact O-N 3.47Å; N58-N60 VanDerWaalsContact O-N 3.11Å; N58-N60 WeakPolarHBondContact OD1-CB 3.5Å; N58-N60 PolarHBondContact OD1-N 2.88Å; N60-L64 VanDerWaalsContact O-CB 3.24Å; N60-L64 WeakPolarHBondContact O-CB 3.22Å; N60-L64 WeakPolarHBondContact O-CD1 3.27Å; N60-L64 WeakPolarHBondContact O-CG 3.35Å; N60-L64 PolarHBondContact O-N 2.91Å
61	R	81.2	Confident	64.5	Low	64 Å²	64	69.7 Å²	69.7	24%	0.242	40%	0.396	C	S	.	.	H	α-helix	trans	-60.5	-46.1	174.7	-169.1	-161.1	-179.3	95.8	13	111.1	N58 S59 F65 N79 V82 D83 I86	N58-R61 HydrophobicContact CB-CB 4.27Å; N58-R61 WeakPolarHBondContact O-CA 3.41Å; N58-R61 WeakPolarHBondContact O-CB 3.4Å; N58-R61 PolarHBondContact O-N 3.3Å; S59-R61 VanDerWaalsContact C-N 3.25Å; S59-R61 PolarHBondContact O-N 3.37Å; R61-F65 WeakPolarHBondContact O-CB 3.39Å; R61-F65 PolarHBondContact O-N 2.79Å; R61-N79 PolarHBondContact NH2-OD1 2.94Å; R61-V82 HydrophobicContact CB-CG1 4.38Å; R61-V82 HydrophobicContact CG-CG1 3.69Å; R61-D83 IonicContact CZ-OD1 2.66Å; R61-D83 IonicContact CZ-OD2 3.55Å; R61-D83 VanDerWaalsContact CZ-OD2 3.25Å; R61-D83 IonicContact NH1-OD1 2.69Å; R61-D83 PolarHBondContact NH1-OD1 3.49Å; R61-D83 IonicContact NH1-OD2 2.66Å; R61-D83 PolarHBondContact NH1-OD2 3.07Å; R61-D83 IonicContact NH2-OD1 2.78Å; R61-D83 IonicContact NH2-OD2 3.81Å; R61-D83 PolarHBondContact NH2-OD2 2.91Å; R61-I86 HydrophobicContact CB-CD1 3.86Å; R61-I86 HydrophobicContact CG-CD1 4.22Å
62	S	76.7	Confident	66.1	Low	55 Å²	55	74 Å²	74	39%	0.385	40%	0.401	S	S	.	.	H	α-helix	trans	-63.7	-49.7	-178.1	-57.2	0	0	0	0	111.1	S59 L64 F65 E66	S59-S62 PolarHBondContact O-N 3.07Å; S62-L64 PolarHBondContact O-N 2.8Å; S62-F65 PolarHBondContact O-N 3.02Å; S62-E66 WeakPolarHBondContact O-CG 3.5Å; S62-E66 PolarHBondContact O-N 3.48Å
63	T	79	Confident	67.6	Low	41 Å²	41	66 Å²	66	25%	0.252	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-40.2	-179.9	-49.5	0	0	0	0	112.8	Y35 V39 C67	Y35-T63 WeakPolarHBondContact OH-CG2 3.28Å; V39-T63 HydrophobicContact CG1-CG2 4Å; V39-T63 HydrophobicContact CG2-CG2 3.8Å; T63-C67 VanDerWaalsContact O-CB 3.24Å; T63-C67 WeakPolarHBondContact O-CB 3.36Å; T63-C67 PolarHBondContact O-N 3Å
64	L	85.2	Confident	69.6	Low	0 Å²	0	70.4 Å²	70.4	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-67.7	-37.8	174.8	-67.9	172.1	0	0	0	111.9	I36 V39 L40 N60 S62 L68 V82 I85 I86	I36-L64 HydrophobicContact CB-CD2 3.97Å; I36-L64 HydrophobicContact CG1-CD2 3.7Å; I36-L64 HydrophobicContact CG2-CD2 3.67Å; V39-L64 HydrophobicContact CB-CD2 4.17Å; V39-L64 HydrophobicContact CG1-CD2 4.04Å; V39-L64 HydrophobicContact CG1-CG 3.96Å; L40-L64 HydrophobicContact CD2-CD1 3.85Å; L40-L64 HydrophobicContact CG-CD1 4.26Å; N60-L64 VanDerWaalsContact O-CB 3.24Å; N60-L64 WeakPolarHBondContact O-CB 3.22Å; N60-L64 WeakPolarHBondContact O-CD1 3.27Å; N60-L64 WeakPolarHBondContact O-CG 3.35Å; N60-L64 PolarHBondContact O-N 2.91Å; S62-L64 PolarHBondContact O-N 2.8Å; L64-L68 WeakPolarHBondContact O-CB 3.27Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 3.41Å; L64-V82 HydrophobicContact CB-CG1 4.05Å; L64-V82 HydrophobicContact CB-CG2 4.12Å; L64-I85 HydrophobicContact CD1-CG2 4.1Å; L64-I86 HydrophobicContact CD1-CD1 4.22Å; L64-I86 HydrophobicContact CD1-CG1 3.92Å
65	F	84.5	Confident	71.7	Confident	39 Å²	39	70.4 Å²	70.4	17%	0.171	38%	0.384	C	S	.	.	H	α-helix	trans	-65.6	-48.6	176.2	-178.3	-97.9	0	0	0	111.4	R61 S62 C67 L68 M69 R75 V78 N79 V82	R61-F65 WeakPolarHBondContact O-CB 3.39Å; R61-F65 PolarHBondContact O-N 2.79Å; S62-F65 PolarHBondContact O-N 3.02Å; F65-C67 VanDerWaalsContact C-N 3.33Å; F65-C67 PolarHBondContact O-N 2.92Å; F65-L68 PolarHBondContact O-N 3.4Å; F65-M69 HydrophobicContact CD1-CG 3.86Å; F65-M69 HydrophobicContact CD2-CG 4.14Å; F65-M69 HydrophobicContact CE1-CG 3.48Å; F65-M69 VanDerWaalsContact CE1-CG 3.48Å; F65-M69 HydrophobicContact CE1-SD 4.15Å; F65-M69 HydrophobicContact CE2-CG 3.75Å; F65-M69 HydrophobicContact CE2-SD 3.73Å; F65-M69 HydrophobicContact CG-CG 4.16Å; F65-M69 HydrophobicContact CZ-CG 3.41Å; F65-M69 VanDerWaalsContact CZ-CG 3.41Å; F65-M69 HydrophobicContact CZ-SD 3.48Å; F65-M69 WeakPolarHBondContact CZ-SD 3.49Å; F65-M69 WeakPolarHBondContact O-CB 3.23Å; F65-M69 WeakPolarHBondContact O-CG 3.46Å; F65-M69 PolarHBondContact O-N 3.26Å; F65-R75 HydrophobicContact CE2-CG 4.22Å; F65-R75 HydrophobicContact CZ-CG 3.75Å; F65-V78 HydrophobicContact CD2-CB 4.36Å; F65-V78 HydrophobicContact CD2-CG1 3.68Å; F65-V78 HydrophobicContact CE2-CB 4.14Å; F65-V78 HydrophobicContact CE2-CG1 3.92Å; F65-N79 WeakPolarHBondContact CE2-ND2 3.45Å; F65-V82 HydrophobicContact CB-CG2 4.28Å
66	E	80.8	Confident	73.7	Confident	140 Å²	140	71.9 Å²	71.9	65%	0.654	37%	0.373	S	S	*	.	H	α-helix	trans	-60.4	-40.8	175.9	-72.9	171	174.4	0	0	112.3	S62	S62-E66 WeakPolarHBondContact O-CG 3.5Å; S62-E66 PolarHBondContact O-N 3.48Å
67	C	79.7	Confident	76	Confident	21 Å²	21	67.9 Å²	67.9	14%	0.142	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-47.3	175.4	178.1	0	0	0	0	112.4	Y32 Y35 T63 F65 S70	Y32-C67 VanDerWaalsContact CE1-SG 3.55Å; Y35-C67 HydrophobicContact CD1-CB 4.28Å; Y35-C67 VanDerWaalsContact CD1-SG 3.51Å; Y35-C67 HydrophobicContact CE1-CB 3.73Å; Y35-C67 VanDerWaalsContact CE1-SG 3.56Å; T63-C67 VanDerWaalsContact O-CB 3.24Å; T63-C67 WeakPolarHBondContact O-CB 3.36Å; T63-C67 PolarHBondContact O-N 3Å; F65-C67 VanDerWaalsContact C-N 3.33Å; F65-C67 PolarHBondContact O-N 2.92Å; C67-S70 PolarHBondContact O-OG 2.91Å
68	L	82.7	Confident	77.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-82.5	-24.3	-175.6	-68.4	167.7	0	0	0	113.5	L22 F27 Y32 I36 L64 F65 S70 S71 V78 F81 V82 I85	L22-L68 HydrophobicContact CD2-CD2 4.14Å; F27-L68 HydrophobicContact CE1-CD2 3.76Å; F27-L68 HydrophobicContact CE2-CD2 4.05Å; F27-L68 HydrophobicContact CZ-CD2 3.48Å; F27-L68 VanDerWaalsContact CZ-CD2 3.48Å; Y32-L68 HydrophobicContact CD1-CD2 4.25Å; Y32-L68 HydrophobicContact CE1-CD2 4.5Å; I36-L68 HydrophobicContact CD1-CD2 4.19Å; L64-L68 WeakPolarHBondContact O-CB 3.27Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 3.41Å; F65-L68 PolarHBondContact O-N 3.4Å; L68-S70 PolarHBondContact O-N 2.92Å; L68-S70 VanDerWaalsContact O-N 3.16Å; L68-S71 PolarHBondContact O-N 2.93Å; L68-S71 PolarHBondContact O-OG 2.97Å; L68-V78 HydrophobicContact CB-CG1 3.67Å; L68-F81 HydrophobicContact CD1-CD1 3.85Å; L68-F81 HydrophobicContact CD1-CE1 4.1Å; L68-F81 HydrophobicContact CD2-CD1 4.37Å; L68-F81 HydrophobicContact CD2-CE1 4.08Å; L68-V82 HydrophobicContact CD1-CG2 3.82Å; L68-I85 HydrophobicContact CD1-CD1 3.76Å
69	M	79.1	Confident	78.9	Confident	71 Å²	71	63.5 Å²	63.5	35%	0.35	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-5.5	170.3	-79.2	-59.7	-44.2	0	0	114	F65 R75 V78	F65-M69 HydrophobicContact CD1-CG 3.86Å; F65-M69 HydrophobicContact CD2-CG 4.14Å; F65-M69 HydrophobicContact CE1-CG 3.48Å; F65-M69 VanDerWaalsContact CE1-CG 3.48Å; F65-M69 HydrophobicContact CE1-SD 4.15Å; F65-M69 HydrophobicContact CE2-CG 3.75Å; F65-M69 HydrophobicContact CE2-SD 3.73Å; F65-M69 HydrophobicContact CG-CG 4.16Å; F65-M69 HydrophobicContact CZ-CG 3.41Å; F65-M69 VanDerWaalsContact CZ-CG 3.41Å; F65-M69 HydrophobicContact CZ-SD 3.48Å; F65-M69 WeakPolarHBondContact CZ-SD 3.49Å; F65-M69 WeakPolarHBondContact O-CB 3.23Å; F65-M69 WeakPolarHBondContact O-CG 3.46Å; F65-M69 PolarHBondContact O-N 3.26Å; M69-R75 HydrophobicContact CE-CG 4.45Å; M69-R75 HydrophobicContact SD-CB 4.34Å; M69-R75 HydrophobicContact SD-CG 4Å; M69-V78 HydrophobicContact CG-CG1 4.1Å; M69-V78 HydrophobicContact SD-CB 3.91Å; M69-V78 HydrophobicContact SD-CG1 4.12Å; M69-V78 HydrophobicContact SD-CG2 3.82Å
70	S	66.8	Low	80.1	Confident	82 Å²	82	65.6 Å²	65.6	57%	0.573	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-2.9	171.9	70.8	0	0	0	0	114	Y32 C67 L68	Y32-S70 PolarHBondContact OH-OG 3.49Å; C67-S70 PolarHBondContact O-OG 2.91Å; L68-S70 PolarHBondContact O-N 2.92Å; L68-S70 VanDerWaalsContact O-N 3.16Å
71	S	66.6	Low	80.7	Confident	31 Å²	31	65.8 Å²	65.8	22%	0.217	34%	0.342	C	S	.	.	S	Bend	trans	-100.4	167.1	173.8	68.6	0	0	0	0	112.3	F27 L68 M73	F27-S71 WeakPolarHBondContact CZ-OG 3.29Å; L68-S71 PolarHBondContact O-N 2.93Å; L68-S71 PolarHBondContact O-OG 2.97Å; S71-M73 PolarHBondContact O-N 3.13Å; S71-M73 WeakPolarHBondContact OG-CB 3.45Å; S71-M73 WeakPolarHBondContact OG-CG 3.3Å
72	D	70.1	Confident	81	Confident	168 Å²	168	62.8 Å²	62.8	90%	0.898	33%	0.33	S	S	*	.	S	Bend	trans	-70.4	15.4	175.4	-57.4	-61.3	0	0	0	114.4
73	M	77	Confident	81.6	Confident	35 Å²	35	63.6 Å²	63.6	17%	0.172	33%	0.331	C	S	.	.			trans	-73.7	136	177.9	-71.6	-176.5	68.1	0	0	112.2	L25 F27 S71 V78 F81	L25-M73 HydrophobicContact CD1-CE 4.2Å; L25-M73 HydrophobicContact CD1-SD 4.12Å; L25-M73 HydrophobicContact CD2-CE 4.26Å; L25-M73 HydrophobicContact CD2-SD 4.32Å; F27-M73 HydrophobicContact CE2-SD 3.8Å; F27-M73 HydrophobicContact CZ-SD 3.95Å; S71-M73 PolarHBondContact O-N 3.13Å; S71-M73 WeakPolarHBondContact OG-CB 3.45Å; S71-M73 WeakPolarHBondContact OG-CG 3.3Å; M73-V78 HydrophobicContact CB-CG2 3.44Å; M73-V78 VanDerWaalsContact CB-CG2 3.44Å; M73-V78 HydrophobicContact CE-CG2 4.36Å; M73-V78 HydrophobicContact CG-CG2 4.48Å; M73-V78 HydrophobicContact SD-CG2 4.39Å; M73-F81 HydrophobicContact CE-CB 4.3Å; M73-F81 HydrophobicContact CE-CD1 4.23Å
74	E	82.8	Confident	82.1	Confident	139 Å²	139	64.2 Å²	64.2	65%	0.65	33%	0.332	S	S	*	.			trans	-58	143.6	171.8	-64	-178.7	152	0	0	111.7	E76 S77 V78	E74-E76 PolarHBondContact O-N 2.93Å; E74-E76 VanDerWaalsContact O-N 3.15Å; E74-S77 CarbonylContact O-C 3.51Å; E74-S77 WeakPolarHBondContact O-CA 3.26Å; E74-S77 WeakPolarHBondContact O-CB 3.29Å; E74-S77 PolarHBondContact O-N 2.77Å; E74-V78 PolarHBondContact O-N 2.65Å
75	R	81.9	Confident	82.3	Confident	155 Å²	155	64.2 Å²	64.2	59%	0.585	33%	0.332	S	S	*	.	H	α-helix	trans	-57.3	-35.5	-173.9	-163.4	-169.4	-177.4	173.4	2.7	113.1	F65 M69 N79	F65-R75 HydrophobicContact CE2-CG 4.22Å; F65-R75 HydrophobicContact CZ-CG 3.75Å; M69-R75 HydrophobicContact CE-CG 4.45Å; M69-R75 HydrophobicContact SD-CB 4.34Å; M69-R75 HydrophobicContact SD-CG 4Å; R75-N79 PolarHBondContact O-N 3Å; R75-N79 VanDerWaalsContact O-N 3.07Å; R75-N79 PolarHBondContact O-ND2 3.13Å
76	E	83.9	Confident	82.4	Confident	129 Å²	129	63.8 Å²	63.8	60%	0.603	33%	0.332	S	S	*	.	H	α-helix	trans	-68.8	-43.6	176.4	-69.5	60.6	-138.7	0	0	110.5	E74 N79 V80	E74-E76 PolarHBondContact O-N 2.93Å; E74-E76 VanDerWaalsContact O-N 3.15Å; E76-N79 PolarHBondContact O-N 3.16Å; E76-V80 WeakPolarHBondContact O-CG2 3.29Å; E76-V80 PolarHBondContact O-N 3.31Å
77	S	85.1	Confident	82.6	Confident	54 Å²	54	58.4 Å²	58.4	38%	0.378	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.6	-68.5	0	0	0	0	112.3	E74 V80 F81	E74-S77 CarbonylContact O-C 3.51Å; E74-S77 WeakPolarHBondContact O-CA 3.26Å; E74-S77 WeakPolarHBondContact O-CB 3.29Å; E74-S77 PolarHBondContact O-N 2.77Å; S77-V80 PolarHBondContact O-N 3.09Å; S77-F81 WeakPolarHBondContact O-CB 3.47Å; S77-F81 PolarHBondContact O-N 3.4Å
78	V	86.4	Confident	83	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-42.6	173.3	-178.6	0	0	0	0	111.1	F65 L68 M69 M73 E74 V80 F81 V82	F65-V78 HydrophobicContact CD2-CB 4.36Å; F65-V78 HydrophobicContact CD2-CG1 3.68Å; F65-V78 HydrophobicContact CE2-CB 4.14Å; F65-V78 HydrophobicContact CE2-CG1 3.92Å; L68-V78 HydrophobicContact CB-CG1 3.67Å; M69-V78 HydrophobicContact CG-CG1 4.1Å; M69-V78 HydrophobicContact SD-CB 3.91Å; M69-V78 HydrophobicContact SD-CG1 4.12Å; M69-V78 HydrophobicContact SD-CG2 3.82Å; M73-V78 HydrophobicContact CB-CG2 3.44Å; M73-V78 VanDerWaalsContact CB-CG2 3.44Å; M73-V78 HydrophobicContact CE-CG2 4.36Å; M73-V78 HydrophobicContact CG-CG2 4.48Å; M73-V78 HydrophobicContact SD-CG2 4.39Å; E74-V78 PolarHBondContact O-N 2.65Å; V78-V80 PolarHBondContact O-N 2.71Å; V78-F81 PolarHBondContact O-N 2.95Å; V78-V82 HydrophobicContact CG1-CG2 4.17Å; V78-V82 WeakPolarHBondContact O-CB 3.37Å; V78-V82 VanDerWaalsContact O-CG2 3.27Å; V78-V82 WeakPolarHBondContact O-CG2 3.35Å; V78-V82 PolarHBondContact O-N 3.36Å
79	N	86.1	Confident	83.1	Confident	44 Å²	44	59.2 Å²	59.2	24%	0.235	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-48.4	175.5	-90	-77.1	0	0	0	112.2	R61 F65 R75 E76 F81 V82 D83	R61-N79 PolarHBondContact NH2-OD1 2.94Å; F65-N79 WeakPolarHBondContact CE2-ND2 3.45Å; R75-N79 PolarHBondContact O-N 3Å; R75-N79 VanDerWaalsContact O-N 3.07Å; R75-N79 PolarHBondContact O-ND2 3.13Å; E76-N79 PolarHBondContact O-N 3.16Å; N79-F81 VanDerWaalsContact C-N 3.31Å; N79-F81 PolarHBondContact O-N 3.1Å; N79-V82 PolarHBondContact O-N 3.15Å; N79-D83 PolarHBondContact O-N 2.92Å
80	V	88.6	Confident	83.2	Confident	103 Å²	103	57.5 Å²	57.5	62%	0.624	31%	0.312	S	S	*	.	H	α-helix	trans	-61.7	-39.9	178.1	172.2	0	0	0	0	111.3	E76 S77 V78 D83 D84	E76-V80 WeakPolarHBondContact O-CG2 3.29Å; E76-V80 PolarHBondContact O-N 3.31Å; S77-V80 PolarHBondContact O-N 3.09Å; V78-V80 PolarHBondContact O-N 2.71Å; V80-D83 PolarHBondContact O-N 2.79Å; V80-D84 WeakPolarHBondContact O-CB 3.41Å; V80-D84 PolarHBondContact O-N 3.19Å
81	F	89.7	Confident	83.8	Confident	11 Å²	11	57.6 Å²	57.6	5%	0.048	30%	0.303	C	S	.	.	H	α-helix	trans	-70.5	-39.8	178.5	-174.2	-144.9	0	0	0	112.7	W17 R21 L22 L25 L68 M73 S77 V78 N79 D83 D84 I85	W17-F81 HydrophobicContact CH2-CE2 4.21Å; R21-F81 HydrophobicContact CB-CE2 4.41Å; R21-F81 HydrophobicContact CG-CD2 4.46Å; R21-F81 HydrophobicContact CG-CE2 3.54Å; R21-F81 HydrophobicContact CG-CZ 3.89Å; L22-F81 HydrophobicContact CD2-CE1 4.07Å; L22-F81 HydrophobicContact CD2-CZ 4.22Å; L22-F81 HydrophobicContact CG-CZ 4.47Å; L25-F81 HydrophobicContact CD1-CD1 3.73Å; L25-F81 HydrophobicContact CD1-CE1 3.42Å; L25-F81 VanDerWaalsContact CD1-CE1 3.42Å; L25-F81 HydrophobicContact CD1-CE2 4.32Å; L25-F81 HydrophobicContact CD1-CG 4.31Å; L25-F81 HydrophobicContact CD1-CZ 3.75Å; L68-F81 HydrophobicContact CD1-CD1 3.85Å; L68-F81 HydrophobicContact CD1-CE1 4.1Å; L68-F81 HydrophobicContact CD2-CD1 4.37Å; L68-F81 HydrophobicContact CD2-CE1 4.08Å; M73-F81 HydrophobicContact CE-CB 4.3Å; M73-F81 HydrophobicContact CE-CD1 4.23Å; S77-F81 WeakPolarHBondContact O-CB 3.47Å; S77-F81 PolarHBondContact O-N 3.4Å; V78-F81 PolarHBondContact O-N 2.95Å; N79-F81 VanDerWaalsContact C-N 3.31Å; N79-F81 PolarHBondContact O-N 3.1Å; F81-D83 VanDerWaalsContact C-N 3.35Å; F81-D83 PolarHBondContact O-N 3.21Å; F81-D84 PolarHBondContact O-N 3.03Å; F81-I85 HydrophobicContact CD1-CD1 4.06Å; F81-I85 HydrophobicContact CD2-CD1 3.96Å; F81-I85 HydrophobicContact CD2-CG1 3.98Å; F81-I85 HydrophobicContact CE1-CD1 3.87Å; F81-I85 HydrophobicContact CE2-CD1 3.76Å; F81-I85 HydrophobicContact CE2-CG1 3.75Å; F81-I85 HydrophobicContact CG-CD1 4.11Å; F81-I85 HydrophobicContact CZ-CD1 3.72Å; F81-I85 HydrophobicContact CZ-CG1 4.17Å; F81-I85 WeakPolarHBondContact O-CB 3.5Å; F81-I85 VanDerWaalsContact O-CG1 3.23Å; F81-I85 WeakPolarHBondContact O-CG1 3.43Å; F81-I85 PolarHBondContact O-N 2.73Å
82	V	88.9	Confident	84.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-41.9	173.2	171.4	0	0	0	0	111.3	R61 L64 F65 L68 V78 N79 I85 I86	R61-V82 HydrophobicContact CB-CG1 4.38Å; R61-V82 HydrophobicContact CG-CG1 3.69Å; L64-V82 HydrophobicContact CB-CG1 4.05Å; L64-V82 HydrophobicContact CB-CG2 4.12Å; F65-V82 HydrophobicContact CB-CG2 4.28Å; L68-V82 HydrophobicContact CD1-CG2 3.82Å; V78-V82 HydrophobicContact CG1-CG2 4.17Å; V78-V82 WeakPolarHBondContact O-CB 3.37Å; V78-V82 VanDerWaalsContact O-CG2 3.27Å; V78-V82 WeakPolarHBondContact O-CG2 3.35Å; V78-V82 PolarHBondContact O-N 3.36Å; N79-V82 PolarHBondContact O-N 3.15Å; V82-I85 PolarHBondContact O-N 3.03Å; V82-I86 HydrophobicContact CG1-CD1 3.78Å; V82-I86 WeakPolarHBondContact O-CB 3.3Å; V82-I86 VanDerWaalsContact O-CG1 3.31Å; V82-I86 WeakPolarHBondContact O-CG1 3.37Å; V82-I86 PolarHBondContact O-N 2.96Å
83	D	88.2	Confident	85	Confident	73 Å²	73	54.6 Å²	54.6	39%	0.39	28%	0.278	S	S	.	.	H	α-helix	trans	-66.6	-36.2	175.4	-83	-45.5	0	0	0	112.7	R61 N79 V80 F81 G87	R61-D83 IonicContact CZ-OD1 2.66Å; R61-D83 IonicContact CZ-OD2 3.55Å; R61-D83 VanDerWaalsContact CZ-OD2 3.25Å; R61-D83 IonicContact NH1-OD1 2.69Å; R61-D83 PolarHBondContact NH1-OD1 3.49Å; R61-D83 IonicContact NH1-OD2 2.66Å; R61-D83 PolarHBondContact NH1-OD2 3.07Å; R61-D83 IonicContact NH2-OD1 2.78Å; R61-D83 IonicContact NH2-OD2 3.81Å; R61-D83 PolarHBondContact NH2-OD2 2.91Å; N79-D83 PolarHBondContact O-N 2.92Å; V80-D83 PolarHBondContact O-N 2.79Å; F81-D83 VanDerWaalsContact C-N 3.35Å; F81-D83 PolarHBondContact O-N 3.21Å; D83-G87 WeakPolarHBondContact O-CA 3.24Å; D83-G87 PolarHBondContact O-N 2.9Å
84	D	89.6	Confident	84.9	Confident	54 Å²	54	60.9 Å²	60.9	29%	0.289	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-41.6	174.3	-172.3	45.4	0	0	0	112.2	W17 V80 F81 K88	W17-D84 WeakPolarHBondContact CH2-OD2 3.11Å; W17-D84 WeakPolarHBondContact CZ2-OD2 3.32Å; V80-D84 WeakPolarHBondContact O-CB 3.41Å; V80-D84 PolarHBondContact O-N 3.19Å; F81-D84 PolarHBondContact O-N 3.03Å; D84-K88 VanDerWaalsContact O-CB 3.28Å; D84-K88 WeakPolarHBondContact O-CB 3.34Å; D84-K88 WeakPolarHBondContact O-CG 3.48Å; D84-K88 PolarHBondContact O-N 2.85Å; D84-K88 WeakPolarHBondContact OD1-CD 3.37Å; D84-K88 WeakPolarHBondContact OD1-CE 3.39Å; D84-K88 IonicContact OD1-NZ 3.77Å; D84-K88 PolarHBondContact OD1-NZ 2.94Å; D84-K88 IonicContact OD2-NZ 3.87Å; D84-K88 PolarHBondContact OD2-NZ 2.9Å
85	I	89.1	Confident	84.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.6	-54.1	172.9	-73.4	166.7	0	0	0	110.5	F14 W17 L18 I36 L40 L64 L68 F81 V82 K88 H89	F14-I85 WeakPolarHBondContact CE2-O 3.42Å; F14-I85 HydrophobicContact CZ-CG2 4.24Å; W17-I85 HydrophobicContact CH2-CG1 4.33Å; W17-I85 HydrophobicContact CZ3-CG1 4.44Å; L18-I85 HydrophobicContact CD1-CD1 4.22Å; L18-I85 HydrophobicContact CD1-CG1 4.13Å; I36-I85 HydrophobicContact CD1-CD1 4.44Å; I36-I85 HydrophobicContact CG2-CG2 3.91Å; L40-I85 HydrophobicContact CD1-CG2 3.8Å; L40-I85 HydrophobicContact CD2-CG2 4.37Å; L64-I85 HydrophobicContact CD1-CG2 4.1Å; L68-I85 HydrophobicContact CD1-CD1 3.76Å; F81-I85 HydrophobicContact CD1-CD1 4.06Å; F81-I85 HydrophobicContact CD2-CD1 3.96Å; F81-I85 HydrophobicContact CD2-CG1 3.98Å; F81-I85 HydrophobicContact CE1-CD1 3.87Å; F81-I85 HydrophobicContact CE2-CD1 3.76Å; F81-I85 HydrophobicContact CE2-CG1 3.75Å; F81-I85 HydrophobicContact CG-CD1 4.11Å; F81-I85 HydrophobicContact CZ-CD1 3.72Å; F81-I85 HydrophobicContact CZ-CG1 4.17Å; F81-I85 WeakPolarHBondContact O-CB 3.5Å; F81-I85 VanDerWaalsContact O-CG1 3.23Å; F81-I85 WeakPolarHBondContact O-CG1 3.43Å; F81-I85 PolarHBondContact O-N 2.73Å; V82-I85 PolarHBondContact O-N 3.03Å; I85-K88 PolarHBondContact O-N 3.17Å; I85-H89 WeakPolarHBondContact O-CB 3.46Å; I85-H89 PolarHBondContact O-N 3.46Å
86	I	87.2	Confident	84.2	Confident	30 Å²	30	51.7 Å²	51.7	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-43.5	-179.1	-68.5	169.6	0	0	0	110.5	L40 R61 L64 V82 H89 A90	L40-I86 HydrophobicContact CD2-CG1 4.33Å; R61-I86 HydrophobicContact CB-CD1 3.86Å; R61-I86 HydrophobicContact CG-CD1 4.22Å; L64-I86 HydrophobicContact CD1-CD1 4.22Å; L64-I86 HydrophobicContact CD1-CG1 3.92Å; V82-I86 HydrophobicContact CG1-CD1 3.78Å; V82-I86 WeakPolarHBondContact O-CB 3.3Å; V82-I86 VanDerWaalsContact O-CG1 3.31Å; V82-I86 WeakPolarHBondContact O-CG1 3.37Å; V82-I86 PolarHBondContact O-N 2.96Å; I86-H89 PolarHBondContact O-N 3.3Å; I86-A90 WeakPolarHBondContact O-CB 3.32Å; I86-A90 PolarHBondContact O-N 3.44Å
87	G	85.5	Confident	83.5	Confident	27 Å²	27	49 Å²	49	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-63.5	-40.1	179.8	0	0	0	0	0	113.2	D83 Q91	D83-G87 WeakPolarHBondContact O-CA 3.24Å; D83-G87 PolarHBondContact O-N 2.9Å; G87-Q91 WeakPolarHBondContact O-CG 3.17Å; G87-Q91 PolarHBondContact O-N 3.31Å; G87-Q91 PolarHBondContact O-NE2 3.36Å
88	K	87.4	Confident	82.9	Confident	30 Å²	30	52.3 Å²	52.3	13%	0.13	27%	0.267	C	S	.	.	H	α-helix	trans	-77.4	-36.2	175.9	-76.2	167.2	176.4	156.6	0	112.8	W10 F14 W17 D84 I85 Q91 W92	W10-K88 HydrophobicContact CD2-CD 4.44Å; W10-K88 HydrophobicContact CD2-CG 4.04Å; W10-K88 HydrophobicContact CE3-CB 4.43Å; W10-K88 HydrophobicContact CE3-CG 4.36Å; W10-K88 HydrophobicContact CG-CD 4.15Å; W10-K88 HydrophobicContact CG-CG 4.27Å; F14-K88 HydrophobicContact CD2-CB 3.89Å; F14-K88 HydrophobicContact CE2-CB 3.71Å; W17-K88 HydrophobicContact CD2-CD 4Å; W17-K88 HydrophobicContact CE3-CD 3.92Å; W17-K88 HydrophobicContact CH2-CD 3.53Å; W17-K88 HydrophobicContact CZ2-CD 3.61Å; W17-K88 HydrophobicContact CZ3-CB 4.28Å; W17-K88 HydrophobicContact CZ3-CD 3.69Å; D84-K88 VanDerWaalsContact O-CB 3.28Å; D84-K88 WeakPolarHBondContact O-CB 3.34Å; D84-K88 WeakPolarHBondContact O-CG 3.48Å; D84-K88 PolarHBondContact O-N 2.85Å; D84-K88 WeakPolarHBondContact OD1-CD 3.37Å; D84-K88 WeakPolarHBondContact OD1-CE 3.39Å; D84-K88 IonicContact OD1-NZ 3.77Å; D84-K88 PolarHBondContact OD1-NZ 2.94Å; D84-K88 IonicContact OD2-NZ 3.87Å; D84-K88 PolarHBondContact OD2-NZ 2.9Å; I85-K88 PolarHBondContact O-N 3.17Å; K88-Q91 PolarHBondContact O-N 3.15Å; K88-W92 WeakPolarHBondContact O-CB 3.42Å; K88-W92 PolarHBondContact O-N 3.39Å
89	H	85	Confident	82	Confident	8 Å²	8	57.3 Å²	57.3	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-50.7	173.3	-171.1	-94.7	0	0	0	110.5	F14 L40 I85 I86 Q91 W92 E93	F14-H89 AromaticContact CD1-CD2 3.98Å; F14-H89 HydrophobicContact CE1-CB 4.23Å; F14-H89 AromaticContact CE1-CD2 3.67Å; F14-H89 HydrophobicContact CE2-CB 4.03Å; F14-H89 VanDerWaalsContact CE2-N 3.35Å; F14-H89 HydrophobicContact CZ-CB 3.8Å; L40-H89 HydrophobicContact CD1-CB 4.14Å; L40-H89 HydrophobicContact CD2-CB 4.15Å; I85-H89 WeakPolarHBondContact O-CB 3.46Å; I85-H89 PolarHBondContact O-N 3.46Å; I86-H89 PolarHBondContact O-N 3.3Å; H89-Q91 PolarHBondContact O-N 3.09Å; H89-W92 PolarHBondContact O-N 2.83Å; H89-W92 VanDerWaalsContact O-N 3.08Å; H89-E93 IonicContact CE1-OE1 3.81Å; H89-E93 PolarHBondContact CE1-OE1 2.96Å; H89-E93 IonicContact CE1-OE2 2.89Å; H89-E93 PolarHBondContact CE1-OE2 3.2Å; H89-E93 IonicContact ND1-OE1 2.99Å; H89-E93 IonicContact ND1-OE2 2.56Å; H89-E93 PolarHBondContact ND1-OE2 2.95Å; H89-E93 WeakPolarHBondContact O-CG 3.39Å; H89-E93 PolarHBondContact O-N 3.49Å
90	A	80.4	Confident	80.7	Confident	34 Å²	34	60 Å²	60	28%	0.281	30%	0.296	S	S	.	.	H	α-helix	trans	-63.2	-24.8	179.3	0	0	0	0	0	113.8	I86 R94	I86-A90 WeakPolarHBondContact O-CB 3.32Å; I86-A90 PolarHBondContact O-N 3.44Å; A90-R94 WeakPolarHBondContact O-CD 3.3Å; A90-R94 VanDerWaalsContact O-CG 3.24Å; A90-R94 WeakPolarHBondContact O-CG 3.37Å; A90-R94 PolarHBondContact O-NE 3.24Å
91	Q	80.1	Confident	78.9	Confident	85 Å²	85	59.3 Å²	59.3	40%	0.397	30%	0.295	S	S	.	.	H	α-helix	trans	-81.8	-38.9	172.3	-73.9	171.6	83.1	0	0	112.2	W10 G87 K88 H89 R94 Y95	W10-Q91 HydrophobicContact CH2-CB 3.57Å; W10-Q91 HydrophobicContact CH2-CG 4.2Å; W10-Q91 VanDerWaalsContact CH2-OE1 3.28Å; W10-Q91 HydrophobicContact CZ3-CB 3.52Å; G87-Q91 WeakPolarHBondContact O-CG 3.17Å; G87-Q91 PolarHBondContact O-N 3.31Å; G87-Q91 PolarHBondContact O-NE2 3.36Å; K88-Q91 PolarHBondContact O-N 3.15Å; H89-Q91 PolarHBondContact O-N 3.09Å; Q91-R94 PolarHBondContact O-N 3.03Å; Q91-Y95 WeakPolarHBondContact O-CB 3.45Å; Q91-Y95 PolarHBondContact O-N 3.24Å
92	W	82.9	Confident	77.1	Confident	47 Å²	47	65.7 Å²	65.7	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-42.3	174.8	176.1	80.3	0	0	0	111.8	F14 M37 K88 H89 R94 Y95 V96	F14-W92 HydrophobicContact CB-CB 3.8Å; F14-W92 HydrophobicContact CB-CD2 3.62Å; F14-W92 HydrophobicContact CB-CE3 4.24Å; F14-W92 HydrophobicContact CB-CG 3.38Å; F14-W92 HydrophobicContact CG-CB 4.36Å; F14-W92 HydrophobicContact CG-CD2 4.43Å; F14-W92 HydrophobicContact CG-CG 4.32Å; M37-W92 HydrophobicContact CE-CH2 4.45Å; M37-W92 HydrophobicContact CE-CZ3 4.35Å; K88-W92 WeakPolarHBondContact O-CB 3.42Å; K88-W92 PolarHBondContact O-N 3.39Å; H89-W92 PolarHBondContact O-N 2.83Å; H89-W92 VanDerWaalsContact O-N 3.08Å; W92-R94 VanDerWaalsContact C-N 3.35Å; W92-R94 PolarHBondContact O-N 2.91Å; W92-Y95 PolarHBondContact O-N 2.97Å; W92-V96 HydrophobicContact CD2-CG2 4.07Å; W92-V96 HydrophobicContact CG-CG2 4.41Å; W92-V96 HydrophobicContact CZ2-CG2 4Å; W92-V96 WeakPolarHBondContact O-CB 3.49Å; W92-V96 WeakPolarHBondContact O-CG2 3.37Å; W92-V96 PolarHBondContact O-N 3.42Å
93	E	78.2	Confident	74.9	Confident	89 Å²	89	71.1 Å²	71.1	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-57.7	-45.3	172.9	-74.6	-179.2	110.3	0	0	111.8	H89 V96 C97	H89-E93 IonicContact CE1-OE1 3.81Å; H89-E93 PolarHBondContact CE1-OE1 2.96Å; H89-E93 IonicContact CE1-OE2 2.89Å; H89-E93 PolarHBondContact CE1-OE2 3.2Å; H89-E93 IonicContact ND1-OE1 2.99Å; H89-E93 IonicContact ND1-OE2 2.56Å; H89-E93 PolarHBondContact ND1-OE2 2.95Å; H89-E93 WeakPolarHBondContact O-CG 3.39Å; H89-E93 PolarHBondContact O-N 3.49Å; E93-V96 PolarHBondContact O-N 3.23Å; E93-C97 VanDerWaalsContact O-CB 3.3Å; E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 3.02Å; E93-C97 PolarHBondContact O-SG 3.22Å; E93-C97 VanDerWaalsContact O-SG 3.33Å
94	R	74.9	Confident	72.3	Confident	167 Å²	167	74.4 Å²	74.4	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-60.1	-47.8	174.9	-72	170.2	-165.8	-175.8	4.8	111.3	A90 Q91 W92 V96 C97 E98	A90-R94 WeakPolarHBondContact O-CD 3.3Å; A90-R94 VanDerWaalsContact O-CG 3.24Å; A90-R94 WeakPolarHBondContact O-CG 3.37Å; A90-R94 PolarHBondContact O-NE 3.24Å; Q91-R94 PolarHBondContact O-N 3.03Å; W92-R94 VanDerWaalsContact C-N 3.35Å; W92-R94 PolarHBondContact O-N 2.91Å; R94-V96 PolarHBondContact O-N 3.22Å; R94-C97 PolarHBondContact O-N 3.04Å; R94-E98 WeakPolarHBondContact O-CB 3.42Å; R94-E98 WeakPolarHBondContact O-CG 3.24Å; R94-E98 PolarHBondContact O-N 3.47Å
95	Y	77.3	Confident	69.4	Low	72 Å²	72	76.5 Å²	76.5	28%	0.282	40%	0.395	S	S	.	.	H	α-helix	trans	-61.8	-40.5	178.5	179.5	-97.9	0	0	0	113	S11 Q91 W92 K99	S11-Y95 WeakPolarHBondContact O-CD1 3.48Å; S11-Y95 WeakPolarHBondContact O-CE1 3.27Å; Q91-Y95 WeakPolarHBondContact O-CB 3.45Å; Q91-Y95 PolarHBondContact O-N 3.24Å; W92-Y95 PolarHBondContact O-N 2.97Å; Y95-K99 HydrophobicContact CD1-CD 4.24Å; Y95-K99 HydrophobicContact CE1-CD 3.73Å; Y95-K99 VanDerWaalsContact CZ-NZ 3.35Å; Y95-K99 WeakPolarHBondContact O-CB 3.47Å; Y95-K99 PolarHBondContact O-N 2.92Å; Y95-K99 WeakPolarHBondContact OH-CE 3.37Å; Y95-K99 PolarHBondContact OH-NZ 2.89Å
96	V	73.5	Confident	66.7	Low	28 Å²	28	83.7 Å²	83.7	17%	0.17	43%	0.432	C	S	.	.	H	α-helix	trans	-67.7	-42.2	174.7	170.8	0	0	0	0	110.8	W92 E93 R94 K99 R100	W92-V96 HydrophobicContact CD2-CG2 4.07Å; W92-V96 HydrophobicContact CG-CG2 4.41Å; W92-V96 HydrophobicContact CZ2-CG2 4Å; W92-V96 WeakPolarHBondContact O-CB 3.49Å; W92-V96 WeakPolarHBondContact O-CG2 3.37Å; W92-V96 PolarHBondContact O-N 3.42Å; E93-V96 PolarHBondContact O-N 3.23Å; R94-V96 PolarHBondContact O-N 3.22Å; V96-K99 PolarHBondContact O-N 3.28Å; V96-R100 HydrophobicContact CG1-CG 4.32Å; V96-R100 VanDerWaalsContact O-CB 3.29Å; V96-R100 WeakPolarHBondContact O-CB 3.49Å; V96-R100 VanDerWaalsContact O-CG 3.26Å; V96-R100 WeakPolarHBondContact O-CG 3.23Å; V96-R100 PolarHBondContact O-N 3.31Å
97	C	68.9	Low	64	Low	74 Å²	74	88.8 Å²	88.8	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-62.6	-47.4	174	-77.5	0	0	0	0	112.1	E93 R94 K99 R100 C101	E93-C97 VanDerWaalsContact O-CB 3.3Å; E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 3.02Å; E93-C97 PolarHBondContact O-SG 3.22Å; E93-C97 VanDerWaalsContact O-SG 3.33Å; R94-C97 PolarHBondContact O-N 3.04Å; C97-K99 PolarHBondContact O-N 3.33Å; C97-R100 PolarHBondContact O-N 3.45Å; C97-C101 WeakPolarHBondContact O-CB 3.4Å; C97-C101 PolarHBondContact O-N 2.83Å; C97-C101 PolarHBondContact O-SG 3.04Å
98	E	72.1	Confident	61.5	Low	122 Å²	122	95.4 Å²	95.4	57%	0.57	49%	0.487	S	S	*	.	H	α-helix	trans	-59.4	-44.9	176.5	-75.4	170.9	-161.8	0	0	111.3	R94 C101 L102	R94-E98 WeakPolarHBondContact O-CB 3.42Å; R94-E98 WeakPolarHBondContact O-CG 3.24Å; R94-E98 PolarHBondContact O-N 3.47Å; E98-C101 PolarHBondContact O-N 3.3Å; E98-L102 WeakPolarHBondContact O-CB 3.28Å; E98-L102 VanDerWaalsContact O-CG 3.29Å; E98-L102 WeakPolarHBondContact O-CG 3.45Å; E98-L102 PolarHBondContact O-N 3.19Å
99	K	69	Low	58.7	Low	105 Å²	105	98.9 Å²	98.9	46%	0.457	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-40.9	174.1	-82.6	-175.4	162.3	-179.4	0	113.4	Y95 V96 C97 C101 L102 T103	Y95-K99 HydrophobicContact CD1-CD 4.24Å; Y95-K99 HydrophobicContact CE1-CD 3.73Å; Y95-K99 VanDerWaalsContact CZ-NZ 3.35Å; Y95-K99 WeakPolarHBondContact O-CB 3.47Å; Y95-K99 PolarHBondContact O-N 2.92Å; Y95-K99 WeakPolarHBondContact OH-CE 3.37Å; Y95-K99 PolarHBondContact OH-NZ 2.89Å; V96-K99 PolarHBondContact O-N 3.28Å; C97-K99 PolarHBondContact O-N 3.33Å; K99-C101 VanDerWaalsContact C-N 3.3Å; K99-C101 PolarHBondContact O-N 3.22Å; K99-L102 PolarHBondContact O-N 3.48Å; K99-T103 PolarHBondContact O-N 2.84Å; K99-T103 PolarHBondContact O-OG1 3.34Å
100	R	58.7	Low	56.1	Low	102 Å²	102	106.6 Å²	106.6	39%	0.385	56%	0.556	S	S	.	*	H	α-helix	trans	-64.7	-33	174.6	-75.6	176.4	175.9	-177.4	-2.1	111.4	V96 C97 T103 F120 D124	V96-R100 HydrophobicContact CG1-CG 4.32Å; V96-R100 VanDerWaalsContact O-CB 3.29Å; V96-R100 WeakPolarHBondContact O-CB 3.49Å; V96-R100 VanDerWaalsContact O-CG 3.26Å; V96-R100 WeakPolarHBondContact O-CG 3.23Å; V96-R100 PolarHBondContact O-N 3.31Å; C97-R100 PolarHBondContact O-N 3.45Å; R100-T103 PolarHBondContact O-OG1 3.49Å; R100-F120 PolarHBondContact NH2-O 3.02Å; R100-D124 IonicContact NH1-OD2 2.71Å; R100-D124 IonicContact NH2-OD2 2.69Å; R100-D124 PolarHBondContact NH2-OD2 3.1Å
101	C	50.7	Low	53.7	Low	88 Å²	88	110.3 Å²	110.3	60%	0.595	59%	0.586	S	S	*	*	H	α-helix	trans	-73	-40	172.7	-69.6	0	0	0	0	112.7	C97 E98 K99 T103 L104	C97-C101 WeakPolarHBondContact O-CB 3.4Å; C97-C101 PolarHBondContact O-N 2.83Å; C97-C101 PolarHBondContact O-SG 3.04Å; E98-C101 PolarHBondContact O-N 3.3Å; K99-C101 VanDerWaalsContact C-N 3.3Å; K99-C101 PolarHBondContact O-N 3.22Å; C101-T103 PolarHBondContact O-N 3.04Å; C101-L104 CarbonylContact O-C 3.55Å; C101-L104 PolarHBondContact O-N 3.2Å
102	L	51.3	Low	51.2	Low	144 Å²	144	109 Å²	109	75%	0.754	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-18.6	178.4	-73.8	167.2	0	0	0	113.8	E98 K99	E98-L102 WeakPolarHBondContact O-CB 3.28Å; E98-L102 VanDerWaalsContact O-CG 3.29Å; E98-L102 WeakPolarHBondContact O-CG 3.45Å; E98-L102 PolarHBondContact O-N 3.19Å; K99-L102 PolarHBondContact O-N 3.48Å
103	T	43.8	Very low	48.7	Very low	114 Å²	114	114 Å²	114	70%	0.699	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	6.4	170.5	44.7	0	0	0	0	114.2	K99 R100 C101	K99-T103 PolarHBondContact O-N 2.84Å; K99-T103 PolarHBondContact O-OG1 3.34Å; R100-T103 PolarHBondContact O-OG1 3.49Å; C101-T103 PolarHBondContact O-N 3.04Å
104	L	31.7	Very low	46.7	Very low	143 Å²	143	116.4 Å²	116.4	75%	0.749	64%	0.641	S	S	*	*			trans	-127.9	68.5	177.1	-85.2	161.3	0	0	0	110.3	C101	C101-L104 CarbonylContact O-C 3.55Å; C101-L104 PolarHBondContact O-N 3.2Å
105	P	29.3	Very low	44.7	Very low	98 Å²	98	117.3 Å²	117.3	64%	0.636	65%	0.649	S	S	*	*	S	Bend		-145.1	178.5	105.5	39	-25.3	0	0	0	115.1
106	I	33.1	Very low	42.7	Very low	150 Å²	150	121 Å²	121	77%	0.769	67%	0.669	S	S	*	*	S	Bend	trans	87.6	132.3	170.9	-54.2	166.2	0	0	0	115.1
107	N	31.3	Very low	40.8	Very low	138 Å²	138	122.4 Å²	122.4	74%	0.738	68%	0.684	S	S	*	*			trans	62.4	75.3	170.7	-63.8	-6.9	0	0	0	118.4
108	I	31.3	Very low	39	Very low	166 Å²	166	128 Å²	128	85%	0.851	69%	0.694	S	S	*	*	S	Bend		-41.3	138.9	126.5	-60.1	166.9	0	0	0	109.2
109	S	28.4	Very low	37.1	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	71%	0.705	S	S	*	*			trans	63.6	81.2	-172.9	79.8	0	0	0	0	117
110	L	32.2	Very low	35.4	Very low	170 Å²	170	134.4 Å²	134.4	89%	0.89	72%	0.715	S	S	*	*				-148.7	137.3	121.3	-136.5	74.2	0	0	0	110.7	G112	L110-G112 PolarHBondContact O-N 2.65Å
111	A	28.4	Very low	34.2	Very low	112 Å²	112	133.1 Å²	133.1	93%	0.926	72%	0.715	S	S	*	*			trans	-87.8	100.2	177.4	0	0	0	0	0	110.3
112	G	27.8	Very low	33.3	Very low	58 Å²	58	132.5 Å²	132.5	60%	0.598	71%	0.712	S	S	*	*			trans	173.9	151.5	175.5	0	0	0	0	0	113.5	L110 L114	L110-G112 PolarHBondContact O-N 2.65Å; G112-L114 PolarHBondContact O-N 3.35Å
113	N	31.7	Very low	32.3	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	71%	0.709	S	S	*	*			trans	61.7	23	162.4	-57.4	-2.3	0	0	0	119	K115	N113-K115 PolarHBondContact O-N 2.78Å
114	L	35.7	Very low	31.8	Very low	140 Å²	140	132.7 Å²	132.7	73%	0.733	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	1.3	169.9	-108.2	167	0	0	0	115.3	G112	G112-L114 PolarHBondContact O-N 3.35Å
115	K	33.1	Very low	31.9	Very low	185 Å²	185	132.5 Å²	132.5	80%	0.804	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-31.6	-177.9	-80.1	-161.3	171.4	-164.3	0	114.1	N113	N113-K115 PolarHBondContact O-N 2.78Å
116	E	34.4	Very low	31.9	Very low	150 Å²	150	128.3 Å²	128.3	70%	0.701	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-33.1	-174.6	-67	-174.4	120.3	0	0	113	R118 R119	E116-R118 VanDerWaalsContact C-N 3.27Å; E116-R118 PolarHBondContact O-N 3.32Å; E116-R119 PolarHBondContact O-N 3Å
117	A	32.9	Very low	31.9	Very low	57 Å²	57	127.1 Å²	127.1	47%	0.471	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-64	-30	176.5	0	0	0	0	0	113.2	R119 F120	A117-R119 VanDerWaalsContact C-N 3.28Å; A117-R119 PolarHBondContact O-N 3.11Å; A117-F120 PolarHBondContact O-N 3.35Å
118	R	32.6	Very low	31.9	Very low	191 Å²	191	123.9 Å²	123.9	72%	0.721	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-66.8	-24.3	-178	-75	-171.3	170.4	-159.2	-4.5	114	E116 F120 L121	E116-R118 VanDerWaalsContact C-N 3.27Å; E116-R118 PolarHBondContact O-N 3.32Å; R118-F120 PolarHBondContact O-N 3.33Å; R118-F120 VanDerWaalsContact O-N 3.11Å; R118-L121 PolarHBondContact O-N 3.42Å; R118-L121 VanDerWaalsContact O-N 3.11Å
119	R	31.8	Very low	31.8	Very low	210 Å²	210	119.6 Å²	119.6	79%	0.792	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-63.8	-14.9	177.9	-71.5	-174.9	171.9	177.9	-3.8	114	E116 A117	E116-R119 PolarHBondContact O-N 3Å; A117-R119 VanDerWaalsContact C-N 3.28Å; A117-R119 PolarHBondContact O-N 3.11Å
120	F	33.9	Very low	31.9	Very low	152 Å²	152	119.4 Å²	119.4	67%	0.667	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-106.3	19.8	176.7	-67.6	-81.9	0	0	0	113.7	R100 A117 R118	R100-F120 PolarHBondContact NH2-O 3.02Å; A117-F120 PolarHBondContact O-N 3.35Å; R118-F120 PolarHBondContact O-N 3.33Å; R118-F120 VanDerWaalsContact O-N 3.11Å
121	L	32	Very low	31.9	Very low	75 Å²	75	118 Å²	118	39%	0.393	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.5	-21.2	-175.9	-75.2	164.3	0	0	0	115	R118 Y123 D124	R118-L121 PolarHBondContact O-N 3.42Å; R118-L121 VanDerWaalsContact O-N 3.11Å; L121-Y123 PolarHBondContact O-N 3.02Å; L121-Y123 VanDerWaalsContact O-N 3.11Å; L121-D124 PolarHBondContact O-N 3.11Å
122	S	31.8	Very low	32	Very low	75 Å²	75	119.2 Å²	119.2	52%	0.524	60%	0.595	S	S	.	*	H	α-helix	trans	-59	-27.1	-175.9	51.5	0	0	0	0	114.8	D124	S122-D124 VanDerWaalsContact C-N 3.3Å; S122-D124 PolarHBondContact O-N 3.37Å
123	Y	31.6	Very low	32.1	Very low	179 Å²	179	121.7 Å²	121.7	70%	0.702	60%	0.603	S	S	*	*	H	α-helix	trans	-75.8	-8.3	176.9	-94	-81.7	0	0	0	115.1	K41 L121	K41-Y123 PolarHBondContact NZ-O 3.22Å; L121-Y123 PolarHBondContact O-N 3.02Å; L121-Y123 VanDerWaalsContact O-N 3.11Å
124	D	33.8	Very low	31.9	Very low	84 Å²	84	119.1 Å²	119.1	45%	0.449	60%	0.603	S	S	.	*	H	α-helix	trans	-100.1	-26.7	179	-70.6	-28.8	0	0	0	112.9	K41 R100 L121 S122	K41-D124 IonicContact NZ-OD1 3.17Å; K41-D124 PolarHBondContact NZ-OD1 2.87Å; R100-D124 IonicContact NH1-OD2 2.71Å; R100-D124 IonicContact NH2-OD2 2.69Å; R100-D124 PolarHBondContact NH2-OD2 3.1Å; L121-D124 PolarHBondContact O-N 3.11Å; S122-D124 VanDerWaalsContact C-N 3.3Å; S122-D124 PolarHBondContact O-N 3.37Å
125	E	33.4	Very low	31.5	Very low	138 Å²	138	115.4 Å²	115.4	65%	0.645	60%	0.598	S	S	*	*	H	α-helix	trans	-87.9	-9.9	178.1	-63.5	-166.7	105.7	0	0	113.9
126	A	28.6	Very low	31.3	Very low	11 Å²	11	114.7 Å²	114.7	9%	0.091	60%	0.597	C	S	.	*	S	Bend	trans	-74.7	-39	-169.2	0	0	0	0	0	114.9	R225	A126-R225 PolarHBondContact O-NE 3.19Å
127	F	32.6	Very low	31	Very low	124 Å²	124	115.2 Å²	115.2	54%	0.544	60%	0.603	S	S	.	*			trans	-142.6	124.5	-173.5	-64.2	-80.1	0	0	0	112.1	L228	F127-L228 HydrophobicContact CD1-CD1 4.2Å; F127-L228 HydrophobicContact CE1-CD1 3.99Å
128	P	31.1	Very low	30.7	Very low	71 Å²	71	120.9 Å²	120.9	46%	0.461	62%	0.62	S	S	.	*			trans	-68.4	153	168.8	30.4	-34	0	0	0	110.5	L130	P128-L130 PolarHBondContact O-N 3.08Å
129	P	30	Very low	30.4	Very low	76 Å²	76	118.3 Å²	118.3	49%	0.494	63%	0.626	S	S	.	*			trans	-64.3	112	-177	25.8	-34.1	0	0	0	111.5	L131	P129-L131 PolarHBondContact O-N 3.39Å
130	L	30.1	Very low	30	Very low	99 Å²	99	116.2 Å²	116.2	52%	0.518	63%	0.63	S	S	.	*	S	Bend	trans	-63.3	131.7	163.8	-60.1	172.6	0	0	0	107.7	P128 N232	P128-L130 PolarHBondContact O-N 3.08Å; L130-N232 WeakPolarHBondContact CD2-ND2 3.46Å
131	L	32.2	Very low	29.6	Very low	139 Å²	139	115.7 Å²	115.7	73%	0.728	64%	0.639	S	S	*	*			trans	86.2	64	-168.3	-52.7	168.1	0	0	0	116.3	P129	P129-L131 PolarHBondContact O-N 3.39Å
132	Q	30.7	Very low	29.3	Very low	139 Å²	139	122.1 Å²	122.1	65%	0.65	66%	0.664	S	S	*	*			trans	-114	-8.4	155.1	-100	-175.6	-16.3	0	0	114.2	A134	Q132-A134 VanDerWaalsContact C-N 3.29Å; Q132-A134 PolarHBondContact O-N 3.26Å
133	S	29.4	Very low	28.9	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	2.7	-172.5	42.6	0	0	0	0	116.2
134	A	28.5	Very low	28.7	Very low	98 Å²	98	128.1 Å²	128.1	81%	0.81	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-4.5	-177.3	0	0	0	0	0	115	Q132	Q132-A134 VanDerWaalsContact C-N 3.29Å; Q132-A134 PolarHBondContact O-N 3.26Å
135	G	27.8	Very low	28.4	Very low	61 Å²	61	127.8 Å²	127.8	63%	0.629	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-36.8	-173.7	0	0	0	0	0	115.8	I137	G135-I137 PolarHBondContact O-N 2.91Å; G135-I137 VanDerWaalsContact O-N 3.13Å
136	E	28.9	Very low	28.2	Very low	170 Å²	170	128 Å²	128	79%	0.794	71%	0.707	S	S	*	*			trans	-91.6	47	-165	-62.3	-163.4	141.9	0	0	114.9
137	I	27.5	Very low	28.4	Very low	161 Å²	161	134.9 Å²	134.9	83%	0.826	74%	0.743	S	S	*	*			trans	-118.6	42.2	168	-39.4	-176.3	0	0	0	111.4	G135	G135-I137 PolarHBondContact O-N 2.91Å; G135-I137 VanDerWaalsContact O-N 3.13Å
138	Q	25.8	Very low	28.4	Very low	176 Å²	176	132.2 Å²	132.2	82%	0.822	75%	0.75	S	S	*	*	S	Bend	trans	-136.7	64.8	171.2	-68	-162.4	28.9	0	0	113.1
139	T	26.5	Very low	28.4	Very low	138 Å²	138	137.9 Å²	137.9	85%	0.847	77%	0.771	S	S	*	*	S	Bend	trans	-166.9	24.8	159.1	9.1	0	0	0	0	116.8
140	N	24.7	Very low	28.5	Very low	165 Å²	165	144.6 Å²	144.6	88%	0.882	79%	0.786	S	S	*	*			trans	-135.4	33.4	-176.8	-99.6	-43.5	0	0	0	116.7
141	V	24.9	Very low	28.5	Very low	141 Å²	141	147.6 Å²	147.6	86%	0.855	80%	0.798	S	S	*	*			trans	-132.5	74.7	173.1	-170.9	0	0	0	0	111.6
142	K	25.7	Very low	28.6	Very low	210 Å²	210	146.2 Å²	146.2	91%	0.913	80%	0.795	S	S	*	*			trans	-168.4	61.6	162.5	-115.9	167.1	-173	175.4	0	115.4
143	R	23.8	Very low	28.7	Very low	257 Å²	257	145.5 Å²	145.5	97%	0.97	80%	0.796	S	S	*	*			trans	-140.9	92.9	159.6	-80.2	-166.3	175.8	160.5	1.2	112.1
144	S	26	Very low	28.9	Very low	123 Å²	123	149.1 Å²	149.1	86%	0.86	80%	0.8	S	S	*	*			trans	-158.3	153.8	156.8	-165.9	0	0	0	0	109.7
145	A	27.9	Very low	29	Very low	77 Å²	77	147.5 Å²	147.5	64%	0.636	79%	0.793	S	S	*	*			trans	66.2	110.5	176.3	0	0	0	0	0	119.2
146	N	30.5	Very low	29.3	Very low	142 Å²	142	154.4 Å²	154.4	76%	0.759	81%	0.806	S	S	*	*				91.3	114.9	128.4	-65.8	5.7	0	0	0	123.1
147	N	32.7	Very low	29.4	Very low	156 Å²	156	150.1 Å²	150.1	83%	0.834	80%	0.8	S	S	*	*			trans	95.3	135.7	135.8	-57.9	-4.9	0	0	0	121.1
148	G	31.6	Very low	29.6	Very low	68 Å²	68	149.3 Å²	149.3	70%	0.701	80%	0.797	S	S	*	*			trans	87.1	91.4	169.8	0	0	0	0	0	114
149	E	31.9	Very low	29.9	Very low	191 Å²	191	148.8 Å²	148.8	89%	0.893	80%	0.799	S	S	*	*				82.4	138.7	64	-69.8	-164.1	159.8	0	0	115.8
150	R	31.1	Very low	30.1	Very low	216 Å²	216	145.7 Å²	145.7	82%	0.815	80%	0.795	S	S	*	*			trans	73.3	124	-176.6	-62.4	-178	172.3	168.8	-0.3	115.8
151	E	31	Very low	30.8	Very low	163 Å²	163	146.4 Å²	146.4	76%	0.762	79%	0.79	S	S	*	*			cis	74.2	131.5	46.5	-61.1	178.7	144.3	0	0	112.4
152	T	33	Very low	31.3	Very low	109 Å²	109	145.6 Å²	145.6	67%	0.669	78%	0.781	S	S	*	*			cis	-164.7	159	3.5	11.7	0	0	0	0	111.1
153	N	32.8	Very low	31.7	Very low	125 Å²	125	140.3 Å²	140.3	67%	0.668	78%	0.776	S	S	*	*			trans	68.4	126.5	151.1	-64.1	13.4	0	0	0	118.6
154	E	34	Very low	32.1	Very low	184 Å²	184	133.7 Å²	133.7	86%	0.86	77%	0.77	S	S	*	*				60.3	132.3	85.5	-58.7	178.7	162.5	0	0	114.5
155	G	31.9	Very low	32.7	Very low	64 Å²	64	131.8 Å²	131.8	66%	0.66	76%	0.761	S	S	*	*			cis	174.2	-171.9	-1.3	0	0	0	0	0	112.6
156	F	32.3	Very low	33.3	Very low	207 Å²	207	136.1 Å²	136.1	91%	0.908	77%	0.765	S	S	*	*			trans	60.4	98.9	165.6	-69.4	-85.1	0	0	0	121.5
157	A	32.3	Very low	33.7	Very low	80 Å²	80	133.9 Å²	133.9	66%	0.661	75%	0.754	S	S	*	*				56.1	139.8	111.1	0	0	0	0	0	124
158	N	32.4	Very low	34.1	Very low	144 Å²	144	134.4 Å²	134.4	77%	0.77	75%	0.751	S	S	*	*			trans	89.1	127.7	142.1	-74.4	-20.1	0	0	0	123
159	L	31.8	Very low	34.3	Very low	164 Å²	164	139.4 Å²	139.4	86%	0.859	76%	0.756	S	S	*	*			trans	65.2	88	138.4	-61.9	169.6	0	0	0	120.7
160	G	31	Very low	34.5	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	75%	0.748	S	S	*	*				96.5	154.5	100.2	0	0	0	0	0	121.5
161	K	38.5	Very low	34.8	Very low	181 Å²	181	131.5 Å²	131.5	79%	0.787	74%	0.743	S	S	*	*			trans	77.6	119	154.7	-80.2	-177.2	148.6	-98.1	0	122.2
162	D	35.1	Very low	34.9	Very low	124 Å²	124	126.7 Å²	126.7	66%	0.663	74%	0.738	S	S	*	*				77.1	145.5	125.9	-54.2	-15.3	0	0	0	121.8
163	A	35.1	Very low	35	Very low	98 Å²	98	127.5 Å²	127.5	81%	0.81	75%	0.746	S	S	*	*			trans	62	120.9	171.8	0	0	0	0	0	117.4
164	S	32.2	Very low	35.1	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	75%	0.746	S	S	*	*			cis	96.7	137.8	25.1	-167.1	0	0	0	0	115.5
165	A	38.4	Very low	35	Very low	83 Å²	83	124.7 Å²	124.7	69%	0.686	74%	0.741	S	S	*	*			trans	95.1	138.1	152.1	0	0	0	0	0	120.1
166	K	39.8	Very low	35.1	Very low	167 Å²	167	132.7 Å²	132.7	73%	0.726	75%	0.751	S	S	*	*			trans	80.3	140.4	153.8	-57.7	-160.8	143	-69.7	0	119.1
167	D	38.9	Very low	35.3	Very low	96 Å²	96	127.7 Å²	127.7	51%	0.513	74%	0.742	S	S	.	*			cis	-161.4	157.6	-10.9	-93.4	-23.5	0	0	0	110.1
168	E	40.2	Very low	35.4	Very low	167 Å²	167	129.4 Å²	129.4	78%	0.78	75%	0.749	S	S	*	*			trans	44.8	162.6	136.9	-62.5	161.5	-179	0	0	120.9
169	E	37.7	Very low	35.4	Very low	172 Å²	172	126.5 Å²	126.5	80%	0.804	75%	0.753	S	S	*	*			cis	-162.3	170.3	-9.7	-121.6	-161.3	168.9	0	0	105.4
170	E	35.9	Very low	35.4	Very low	156 Å²	156	123 Å²	123	73%	0.729	75%	0.748	S	S	*	*			cis	-164.4	-178.9	-18.7	-142.3	-65	86.7	0	0	106.3
171	A	36.3	Very low	35.5	Very low	86 Å²	86	126.1 Å²	126.1	71%	0.711	75%	0.752	S	S	*	*			trans	77.7	136.7	157.1	0	0	0	0	0	119
172	G	34.1	Very low	35.3	Very low	62 Å²	62	123.3 Å²	123.3	64%	0.639	75%	0.753	S	S	*	*			cis	167.6	166.3	-8.4	0	0	0	0	0	114.7
173	C	33.6	Very low	34.9	Very low	126 Å²	126	122.5 Å²	122.5	85%	0.851	76%	0.757	S	S	*	*			trans	70	146.8	161	-57.9	0	0	0	0	119.4
174	T	35.8	Very low	34.9	Very low	109 Å²	109	127.7 Å²	127.7	67%	0.669	76%	0.761	S	S	*	*			cis	-164.6	141.7	-13.1	19.4	0	0	0	0	113.6
175	N	31.9	Very low	34.7	Very low	141 Å²	141	131.7 Å²	131.7	75%	0.754	76%	0.758	S	S	*	*			trans	51.9	125.5	137	-56.6	-17.7	0	0	0	124.5
176	R	34.3	Very low	34.4	Very low	232 Å²	232	133.8 Å²	133.8	88%	0.875	77%	0.765	S	S	*	*				166.1	115.3	120	-89.2	168.6	-174.7	-151.2	0.9	110.1
177	S	34.9	Very low	34	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	76%	0.764	S	S	*	*				71.3	135.5	70.8	74.5	0	0	0	0	114.5
178	S	36.4	Very low	33.7	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	78%	0.779	S	S	*	*			cis	179.9	153.1	4.1	41.3	0	0	0	0	114.1
179	G	31.2	Very low	33	Very low	82 Å²	82	135 Å²	135	85%	0.845	78%	0.775	S	S	*	*			trans	82.1	167.4	157	0	0	0	0	0	117.7
180	A	32.7	Very low	32.7	Very low	92 Å²	92	134.2 Å²	134.2	76%	0.76	77%	0.771	S	S	*	*			cis	-177.3	158.8	-10.3	0	0	0	0	0	108.3
181	T	31.6	Very low	32.3	Very low	137 Å²	137	135.7 Å²	135.7	84%	0.84	78%	0.778	S	S	*	*			cis	-163.3	161.1	-13.1	20.6	0	0	0	0	109.2
182	P	34.1	Very low	32.1	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	78%	0.78	S	S	*	*			trans	-100.7	179.1	-168.7	39.9	-38	0	0	0	117
183	S	26.9	Very low	31.7	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	79%	0.787	S	S	*	*			trans	104.6	118	153.7	-163.7	0	0	0	0	119.7
184	K	35.4	Very low	31.6	Very low	207 Å²	207	138.5 Å²	138.5	90%	0.9	78%	0.784	S	S	*	*				-178.8	158.8	111.5	-96.1	167.9	-175	176.2	0	113.2
185	R	27.8	Very low	31.7	Very low	203 Å²	203	138.6 Å²	138.6	77%	0.766	79%	0.787	S	S	*	*			trans	-115.5	164.8	179	-155.7	-172.1	-168.9	160.4	7.6	109.6
186	P	32.6	Very low	31.6	Very low	127 Å²	127	138.8 Å²	138.8	83%	0.825	79%	0.788	S	S	*	*				-140.3	174	115.2	34.7	-20.5	0	0	0	114.9
187	K	31.6	Very low	31.2	Very low	162 Å²	162	132.5 Å²	132.5	70%	0.704	78%	0.779	S	S	*	*			trans	-113.7	149.4	169.9	-75.4	-178.5	169.8	-172.4	0	109.7
188	L	31.6	Very low	30.8	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	78%	0.784	S	S	*	*			trans	-143.4	141.6	142.1	-77.5	168.7	0	0	0	105.2
189	L	27	Very low	30.4	Very low	133 Å²	133	132.3 Å²	132.3	70%	0.696	78%	0.782	S	S	*	*				60.4	132.2	60.5	-86.6	74.2	0	0	0	111.8
190	E	31	Very low	30.1	Very low	156 Å²	156	132.9 Å²	132.9	73%	0.729	78%	0.779	S	S	*	*			cis	-137.5	146.7	10	-98	142.5	145.9	0	0	110.4
191	E	26.9	Very low	30	Very low	187 Å²	187	133.7 Å²	133.7	87%	0.874	78%	0.776	S	S	*	*				61.2	107.3	89	-59.4	-153.3	151.4	0	0	118.6
192	A	32	Very low	29.5	Very low	90 Å²	90	134.8 Å²	134.8	74%	0.744	78%	0.776	S	S	*	*			trans	172.5	114.7	144.3	0	0	0	0	0	107.6
193	S	27.3	Very low	29.1	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	78%	0.783	S	S	*	*			cis	59.2	122	48.6	87.6	0	0	0	0	111.7
194	V	30.7	Very low	28.9	Very low	129 Å²	129	147.3 Å²	147.3	78%	0.782	79%	0.791	S	S	*	*				-162.7	158	56.4	148.2	0	0	0	0	110.4
195	P	37	Very low	28.4	Very low	111 Å²	111	144 Å²	144	72%	0.721	79%	0.789	S	S	*	*			trans	-107.3	178.5	-173.4	41.7	-36.7	0	0	0	115.3
196	N	30	Very low	28.1	Very low	145 Å²	145	141.5 Å²	141.5	78%	0.775	79%	0.79	S	S	*	*			trans	-170	125.9	149.3	-99.9	-49.5	0	0	0	109.1
197	S	27	Very low	27.8	Very low	100 Å²	100	147.4 Å²	147.4	70%	0.699	80%	0.796	S	S	*	*				76	146	79	85.9	0	0	0	0	113.4
198	C	25.9	Very low	27.3	Very low	122 Å²	122	144.9 Å²	144.9	82%	0.824	80%	0.798	S	S	*	*			cis	-157.5	166.7	17	-144.3	0	0	0	0	112.9
199	A	28.2	Very low	26.8	Very low	93 Å²	93	142.9 Å²	142.9	77%	0.769	80%	0.797	S	S	*	*			trans	53.9	125.1	165.7	0	0	0	0	0	120
200	A	24.5	Very low	26.7	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	80%	0.799	S	S	*	*			cis	95.2	162	40.4	0	0	0	0	0	113.4
201	P	30.6	Very low	26.3	Very low	109 Å²	109	139.8 Å²	139.8	71%	0.708	80%	0.796	S	S	*	*				-133.7	-173.8	-92.9	34.1	-13	0	0	0	116
202	L	22.6	Very low	26.2	Very low	160 Å²	160	135.2 Å²	135.2	84%	0.838	78%	0.784	S	S	*	*			trans	73.9	118	170.6	-58.1	127.8	0	0	0	117.7
203	R	25.3	Very low	26	Very low	251 Å²	251	138 Å²	138	95%	0.947	79%	0.787	S	S	*	*				-159.5	163.2	104.3	-84.7	-119	168	171.9	-2.1	110.7
204	R	22.1	Very low	26.3	Very low	242 Å²	242	138.5 Å²	138.5	91%	0.913	78%	0.781	S	S	*	*			trans	-87.5	137.2	179.3	-58.6	169.3	178.1	150.4	-4.9	110.4
205	T	24.4	Very low	26.6	Very low	138 Å²	138	138.2 Å²	138.2	85%	0.847	77%	0.774	S	S	*	*			trans	-159.7	152.9	140.4	15	0	0	0	0	108.9
206	D	22.2	Very low	26.6	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	78%	0.775	S	S	*	*			trans	-75.5	154.1	-168.5	-51.5	-90.3	0	0	0	113.1
207	R	25.9	Very low	26.7	Very low	252 Å²	252	134.8 Å²	134.8	95%	0.951	76%	0.762	S	S	*	*			trans	-120.6	91.9	165.9	-80.3	-170.3	171.5	-166.4	-4.4	109.4
208	C	21	Very low	27.1	Very low	109 Å²	109	136.2 Å²	136.2	74%	0.736	76%	0.758	S	S	*	*			trans	-81.7	171.2	157.3	-68.5	0	0	0	0	110
209	S	21.7	Very low	27.6	Very low	117 Å²	117	132.1 Å²	132.1	82%	0.818	73%	0.727	S	S	*	*			trans	70.1	147.7	169.5	-44.7	0	0	0	0	115.1
210	I	24.5	Very low	28	Very low	144 Å²	144	135 Å²	135	74%	0.738	72%	0.723	S	S	*	*			cis	-119.6	141.3	1.9	-63	165.4	0	0	0	108.8
211	A	22.7	Very low	29	Very low	80 Å²	80	133.7 Å²	133.7	66%	0.661	70%	0.703	S	S	*	*			trans	-103.4	137.9	158.1	0	0	0	0	0	107.5	D213	A211-D213 PolarHBondContact O-N 3.29Å
212	S	25.6	Very low	29.7	Very low	90 Å²	90	129.5 Å²	129.5	63%	0.629	67%	0.674	S	S	*	*			trans	-85.8	107.2	177.6	61.3	0	0	0	0	109.6	D214	S212-D214 VanDerWaalsContact CB-OD2 3.28Å; S212-D214 WeakPolarHBondContact CB-OD2 3.19Å; S212-D214 PolarHBondContact O-N 3.3Å; S212-D214 PolarHBondContact OG-OD2 3.45Å; S212-D214 VanDerWaalsContact OG-OD2 3.05Å
213	D	27.5	Very low	30.7	Very low	148 Å²	148	123.8 Å²	123.8	79%	0.791	64%	0.644	S	S	*	*			trans	-79.4	65.2	178.3	-71.6	-26.6	0	0	0	110.5	A211 D215	A211-D213 PolarHBondContact O-N 3.29Å; D213-D215 PolarHBondContact O-N 2.94Å
214	D	33.4	Very low	31.7	Very low	126 Å²	126	113.7 Å²	113.7	67%	0.674	61%	0.612	S	S	*	*			trans	-82.2	10.7	178	-64.3	-62.1	0	0	0	113.3	S212 D216	S212-D214 VanDerWaalsContact CB-OD2 3.28Å; S212-D214 WeakPolarHBondContact CB-OD2 3.19Å; S212-D214 PolarHBondContact O-N 3.3Å; S212-D214 PolarHBondContact OG-OD2 3.45Å; S212-D214 VanDerWaalsContact OG-OD2 3.05Å; D214-D216 PolarHBondContact O-N 2.8Å
215	D	36.5	Very low	32.9	Very low	122 Å²	122	104.6 Å²	104.6	65%	0.652	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-20.3	-167.1	-79.5	1.1	0	0	0	114.8	D213 G217 E218	D213-D215 PolarHBondContact O-N 2.94Å; D215-G217 PolarHBondContact O-N 3.16Å; D215-E218 PolarHBondContact O-N 3.34Å
216	D	36.5	Very low	34	Very low	135 Å²	135	98.2 Å²	98.2	72%	0.722	54%	0.538	S	S	*	.	H	α-helix	trans	-67.4	-22.6	-177.5	-90.5	-25.3	0	0	0	113.4	D214 L219 F220	D214-D216 PolarHBondContact O-N 2.8Å; D216-L219 PolarHBondContact O-N 3.4Å; D216-F220 PolarHBondContact O-N 2.73Å
217	G	33.2	Very low	35.2	Very low	50 Å²	50	94.7 Å²	94.7	52%	0.515	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-39.8	177.6	0	0	0	0	0	113.2	D215 L219 F220 D221	D215-G217 PolarHBondContact O-N 3.16Å; G217-L219 VanDerWaalsContact C-N 3.29Å; G217-L219 PolarHBondContact O-N 3.24Å; G217-F220 PolarHBondContact O-N 3.4Å; G217-D221 PolarHBondContact O-N 2.98Å
218	E	35.1	Very low	36.1	Very low	130 Å²	130	85.9 Å²	85.9	61%	0.607	49%	0.493	S	S	*	.	H	α-helix	trans	-64.5	-35.7	178.9	-63.7	-163.7	159.8	0	0	111.5	D215 E222	D215-E218 PolarHBondContact O-N 3.34Å; E218-E222 VanDerWaalsContact O-CB 3.28Å; E218-E222 WeakPolarHBondContact O-CB 3.06Å; E218-E222 PolarHBondContact O-N 3.4Å
219	L	35.4	Very low	37.3	Very low	35 Å²	35	80.9 Å²	80.9	18%	0.183	46%	0.46	C	S	.	.	H	α-helix	trans	-66	-39.8	178.7	-177.8	61.7	0	0	0	112.3	D216 G217 E222 I223 A281 F282	D216-L219 PolarHBondContact O-N 3.4Å; G217-L219 VanDerWaalsContact C-N 3.29Å; G217-L219 PolarHBondContact O-N 3.24Å; L219-E222 PolarHBondContact O-N 3.28Å; L219-I223 HydrophobicContact CD1-CD1 4Å; L219-I223 HydrophobicContact CD1-CG1 4.29Å; L219-I223 HydrophobicContact CG-CD1 3.95Å; L219-I223 WeakPolarHBondContact O-CB 3.42Å; L219-I223 VanDerWaalsContact O-CG1 3.27Å; L219-I223 WeakPolarHBondContact O-CG1 3.33Å; L219-I223 PolarHBondContact O-N 3.36Å; L219-A281 HydrophobicContact CD1-CB 3.96Å; L219-A281 HydrophobicContact CD2-CB 3.83Å; L219-F282 HydrophobicContact CD1-CB 4.06Å
220	F	36.7	Very low	38.6	Very low	153 Å²	153	78.7 Å²	78.7	67%	0.671	44%	0.436	S	S	*	.	H	α-helix	trans	-71.2	-39.5	-179.4	-147	-78.8	0	0	0	111.9	D216 G217 S224	D216-F220 PolarHBondContact O-N 2.73Å; G217-F220 PolarHBondContact O-N 3.4Å; F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.26Å; F220-S224 PolarHBondContact O-OG 3.06Å
221	D	45.4	Very low	39.5	Very low	66 Å²	66	77 Å²	77	35%	0.353	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-45.5	171.3	-105.9	16.7	0	0	0	111.3	G217 S224 R225	G217-D221 PolarHBondContact O-N 2.98Å; D221-S224 CarbonylContact O-C 3.49Å; D221-S224 WeakPolarHBondContact O-CA 3.44Å; D221-S224 WeakPolarHBondContact O-CB 3.4Å; D221-S224 PolarHBondContact O-N 3.41Å; D221-S224 VanDerWaalsContact O-N 3.16Å; D221-R225 WeakPolarHBondContact O-CG 3.46Å; D221-R225 PolarHBondContact O-N 3.26Å; D221-R225 IonicContact OD2-NH2 3.86Å
222	E	44.9	Very low	40.5	Very low	21 Å²	21	77 Å²	77	10%	0.098	42%	0.417	C	S	.	.	H	α-helix	trans	-70.4	-37.1	-177.2	-161.4	114.9	-99.7	0	0	112.5	E218 L219 S224 R225 V226 F278 P279 F282	E218-E222 VanDerWaalsContact O-CB 3.28Å; E218-E222 WeakPolarHBondContact O-CB 3.06Å; E218-E222 PolarHBondContact O-N 3.4Å; L219-E222 PolarHBondContact O-N 3.28Å; E222-S224 VanDerWaalsContact C-N 3.32Å; E222-R225 PolarHBondContact O-N 3.38Å; E222-R225 IonicContact OE1-CZ 3.58Å; E222-R225 IonicContact OE1-NH1 3.55Å; E222-R225 PolarHBondContact OE1-NH1 3.08Å; E222-V226 PolarHBondContact O-N 2.91Å; E222-V226 VanDerWaalsContact O-N 3.09Å; E222-F278 HydrophobicContact CG-CD1 4.28Å; E222-F278 HydrophobicContact CG-CE1 4.49Å; E222-F278 WeakPolarHBondContact OE2-CD1 3.47Å; E222-P279 WeakPolarHBondContact OE2-CD 3.15Å; E222-F282 HydrophobicContact CB-CD2 4.07Å; E222-F282 HydrophobicContact CB-CE2 4.08Å; E222-F282 HydrophobicContact CG-CD1 4.28Å; E222-F282 HydrophobicContact CG-CD2 3.62Å; E222-F282 HydrophobicContact CG-CE1 4.08Å; E222-F282 HydrophobicContact CG-CE2 3.41Å; E222-F282 VanDerWaalsContact CG-CE2 3.41Å; E222-F282 HydrophobicContact CG-CG 4.02Å; E222-F282 HydrophobicContact CG-CZ 3.64Å
223	I	43.6	Very low	41.3	Very low	40 Å²	40	73.2 Å²	73.2	21%	0.205	39%	0.391	C	S	.	.	H	α-helix	trans	-62.4	-41.6	168.2	-70.4	168.8	0	0	0	110.4	L219 R225 V226 V227 F282 L314	L219-I223 HydrophobicContact CD1-CD1 4Å; L219-I223 HydrophobicContact CD1-CG1 4.29Å; L219-I223 HydrophobicContact CG-CD1 3.95Å; L219-I223 WeakPolarHBondContact O-CB 3.42Å; L219-I223 VanDerWaalsContact O-CG1 3.27Å; L219-I223 WeakPolarHBondContact O-CG1 3.33Å; L219-I223 PolarHBondContact O-N 3.36Å; I223-R225 PolarHBondContact O-N 3.4Å; I223-V226 WeakPolarHBondContact O-CB 3.42Å; I223-V226 PolarHBondContact O-N 3.03Å; I223-V226 VanDerWaalsContact O-N 3.15Å; I223-V227 WeakPolarHBondContact O-CG2 3.36Å; I223-V227 PolarHBondContact O-N 3.25Å; I223-F282 HydrophobicContact CG1-CD2 4.5Å; I223-L314 HydrophobicContact CD1-CD2 4.38Å
224	S	46.4	Very low	42.1	Very low	39 Å²	39	69.9 Å²	69.9	27%	0.273	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-40.3	177.2	-60.6	0	0	0	0	111.9	F220 D221 E222 V226 V227 L228	F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.26Å; F220-S224 PolarHBondContact O-OG 3.06Å; D221-S224 CarbonylContact O-C 3.49Å; D221-S224 WeakPolarHBondContact O-CA 3.44Å; D221-S224 WeakPolarHBondContact O-CB 3.4Å; D221-S224 PolarHBondContact O-N 3.41Å; D221-S224 VanDerWaalsContact O-N 3.16Å; E222-S224 VanDerWaalsContact C-N 3.32Å; S224-V226 VanDerWaalsContact C-N 3.33Å; S224-V226 PolarHBondContact O-N 3.46Å; S224-V227 PolarHBondContact O-N 3.34Å; S224-L228 WeakPolarHBondContact O-CB 3.13Å; S224-L228 VanDerWaalsContact O-CG 3.27Å; S224-L228 WeakPolarHBondContact O-CG 3.45Å; S224-L228 PolarHBondContact O-N 3.03Å
225	R	48.3	Very low	42.7	Very low	51 Å²	51	68 Å²	68	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-58.5	-41.4	171.1	-69.2	174.1	-160.6	145.7	12.1	111.9	A126 D221 E222 I223 A229 L257	A126-R225 PolarHBondContact O-NE 3.19Å; D221-R225 WeakPolarHBondContact O-CG 3.46Å; D221-R225 PolarHBondContact O-N 3.26Å; D221-R225 IonicContact OD2-NH2 3.86Å; E222-R225 PolarHBondContact O-N 3.38Å; E222-R225 IonicContact OE1-CZ 3.58Å; E222-R225 IonicContact OE1-NH1 3.55Å; E222-R225 PolarHBondContact OE1-NH1 3.08Å; I223-R225 PolarHBondContact O-N 3.4Å; R225-A229 VanDerWaalsContact O-CB 3.28Å; R225-A229 WeakPolarHBondContact O-CB 3.4Å; R225-A229 PolarHBondContact O-N 3.41Å; R225-L257 HydrophobicContact CB-CD2 4.21Å
226	V	47.8	Very low	43.1	Very low	4 Å²	4	63.9 Å²	63.9	2%	0.024	35%	0.351	C	S	.	.	H	α-helix	trans	-65.3	-47.6	176.6	170.7	0	0	0	0	111.9	E222 I223 S224 L228 A229 F230 L257 F282 F285	E222-V226 PolarHBondContact O-N 2.91Å; E222-V226 VanDerWaalsContact O-N 3.09Å; I223-V226 WeakPolarHBondContact O-CB 3.42Å; I223-V226 PolarHBondContact O-N 3.03Å; I223-V226 VanDerWaalsContact O-N 3.15Å; S224-V226 VanDerWaalsContact C-N 3.33Å; S224-V226 PolarHBondContact O-N 3.46Å; V226-L228 VanDerWaalsContact C-N 3.33Å; V226-L228 PolarHBondContact O-N 3.34Å; V226-A229 PolarHBondContact O-N 3.43Å; V226-A229 VanDerWaalsContact O-N 3.17Å; V226-F230 HydrophobicContact CG1-CD2 3.63Å; V226-F230 HydrophobicContact CG1-CE2 3.65Å; V226-F230 WeakPolarHBondContact O-CD2 3.11Å; V226-F230 PolarHBondContact O-N 2.8Å; V226-L257 HydrophobicContact CG2-CD1 3.91Å; V226-L257 HydrophobicContact CG2-CD2 4.03Å; V226-F282 HydrophobicContact CG2-CE2 3.42Å; V226-F282 VanDerWaalsContact CG2-CE2 3.42Å; V226-F282 HydrophobicContact CG2-CZ 3.32Å; V226-F285 HydrophobicContact CG1-CE1 4.36Å
227	V	46.1	Very low	43.3	Very low	76 Å²	76	62.9 Å²	62.9	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-42.4	178.6	173.9	0	0	0	0	110.7	I223 S224 F230 N231	I223-V227 WeakPolarHBondContact O-CG2 3.36Å; I223-V227 PolarHBondContact O-N 3.25Å; S224-V227 PolarHBondContact O-N 3.34Å; V227-F230 PolarHBondContact O-N 2.79Å; V227-N231 WeakPolarHBondContact O-CB 3.1Å; V227-N231 PolarHBondContact O-N 3.24Å; V227-N231 PolarHBondContact O-ND2 3.45Å
228	L	46	Very low	43.7	Very low	67 Å²	67	66.7 Å²	66.7	35%	0.351	37%	0.368	S	S	.	.	H	α-helix	trans	-62.3	-41.3	172.9	-72.5	167.5	0	0	0	112.1	F127 S224 V226 N231 N232	F127-L228 HydrophobicContact CD1-CD1 4.2Å; F127-L228 HydrophobicContact CE1-CD1 3.99Å; S224-L228 WeakPolarHBondContact O-CB 3.13Å; S224-L228 VanDerWaalsContact O-CG 3.27Å; S224-L228 WeakPolarHBondContact O-CG 3.45Å; S224-L228 PolarHBondContact O-N 3.03Å; V226-L228 VanDerWaalsContact C-N 3.33Å; V226-L228 PolarHBondContact O-N 3.34Å; L228-N231 PolarHBondContact O-N 2.89Å; L228-N232 WeakPolarHBondContact O-CB 3.24Å; L228-N232 PolarHBondContact O-N 2.82Å; L228-N232 PolarHBondContact O-ND2 2.96Å
229	A	45.5	Very low	44	Very low	5 Å²	5	61.7 Å²	61.7	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-42.8	176.8	0	0	0	0	0	112.3	R225 V226 N231 N232 A233 V253 L256 L257	R225-A229 VanDerWaalsContact O-CB 3.28Å; R225-A229 WeakPolarHBondContact O-CB 3.4Å; R225-A229 PolarHBondContact O-N 3.41Å; V226-A229 PolarHBondContact O-N 3.43Å; V226-A229 VanDerWaalsContact O-N 3.17Å; A229-N231 VanDerWaalsContact C-N 3.33Å; A229-N231 PolarHBondContact O-N 2.84Å; A229-N232 PolarHBondContact O-N 3.4Å; A229-A233 VanDerWaalsContact O-CB 3.27Å; A229-A233 WeakPolarHBondContact O-CB 3.08Å; A229-A233 PolarHBondContact O-N 3.21Å; A229-V253 HydrophobicContact CB-CG1 4.08Å; A229-L256 HydrophobicContact CB-CB 3.96Å; A229-L256 HydrophobicContact CB-CD1 4.27Å; A229-L257 HydrophobicContact CB-CD1 4.4Å; A229-L257 HydrophobicContact CB-CD2 3.99Å; A229-L257 HydrophobicContact CB-CG 3.89Å
230	F	48.4	Very low	43.8	Very low	70 Å²	70	65.8 Å²	65.8	31%	0.307	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-33.5	174.7	-87	-71.5	0	0	0	113.4	V226 V227 G248 V253	V226-F230 HydrophobicContact CG1-CD2 3.63Å; V226-F230 HydrophobicContact CG1-CE2 3.65Å; V226-F230 WeakPolarHBondContact O-CD2 3.11Å; V226-F230 PolarHBondContact O-N 2.8Å; V227-F230 PolarHBondContact O-N 2.79Å; F230-G248 PolarHBondContact O-N 3.43Å; F230-V253 HydrophobicContact CD1-CG2 3.72Å; F230-V253 HydrophobicContact CD2-CG1 4.24Å; F230-V253 HydrophobicContact CE1-CG1 4.41Å; F230-V253 HydrophobicContact CE1-CG2 4.04Å; F230-V253 HydrophobicContact CE2-CG1 4.11Å; F230-V253 HydrophobicContact CG-CG1 4.45Å; F230-V253 HydrophobicContact CG-CG2 4.05Å; F230-V253 HydrophobicContact CZ-CG1 4.19Å
231	N	43.8	Very low	43.5	Very low	110 Å²	110	62 Å²	62	59%	0.588	36%	0.357	S	S	*	.	H	α-helix	trans	-77.2	-30.8	176.8	-69.5	-22.8	0	0	0	113	V227 L228 A229	V227-N231 WeakPolarHBondContact O-CB 3.1Å; V227-N231 PolarHBondContact O-N 3.24Å; V227-N231 PolarHBondContact O-ND2 3.45Å; L228-N231 PolarHBondContact O-N 2.89Å; A229-N231 VanDerWaalsContact C-N 3.33Å; A229-N231 PolarHBondContact O-N 2.84Å
232	N	44.8	Very low	42.9	Very low	79 Å²	79	64.1 Å²	64.1	42%	0.422	37%	0.374	S	S	.	.	H	α-helix	trans	-96.6	-17.9	-173.5	-68.1	-17.1	0	0	0	114.6	L130 L228 A229 L256	L130-N232 WeakPolarHBondContact CD2-ND2 3.46Å; L228-N232 WeakPolarHBondContact O-CB 3.24Å; L228-N232 PolarHBondContact O-N 2.82Å; L228-N232 PolarHBondContact O-ND2 2.96Å; A229-N232 PolarHBondContact O-N 3.4Å; N232-L256 HydrophobicContact CB-CD1 4.16Å
233	A	43	Very low	42.5	Very low	10 Å²	10	64.5 Å²	64.5	8%	0.083	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-71.9	131.5	-178.9	0	0	0	0	0	112.4	A229 G248 E252 V253 L256	A229-A233 VanDerWaalsContact O-CB 3.27Å; A229-A233 WeakPolarHBondContact O-CB 3.08Å; A229-A233 PolarHBondContact O-N 3.21Å; A233-G248 WeakPolarHBondContact O-CA 3.42Å; A233-E252 HydrophobicContact CB-CB 3.8Å; A233-E252 HydrophobicContact CB-CG 4Å; A233-V253 HydrophobicContact CB-CG2 3.74Å; A233-L256 HydrophobicContact CB-CD1 3.9Å
234	V	44	Very low	42	Very low	78 Å²	78	63.5 Å²	63.5	47%	0.473	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-75.5	145.9	174.6	-177.4	0	0	0	0	110	C236 C249 E252	V234-C236 PolarHBondContact O-N 3.11Å; V234-C249 WeakPolarHBondContact O-CB 3.24Å; V234-C249 PolarHBondContact O-N 3.01Å; V234-E252 VanDerWaalsContact CB-OE1 3.3Å; V234-E252 WeakPolarHBondContact CB-OE1 3.25Å; V234-E252 WeakPolarHBondContact CG2-OE1 3.41Å; V234-E252 PolarHBondContact N-OE1 3.26Å
235	P	45.3	Very low	41.3	Very low	87 Å²	87	65.6 Å²	65.6	57%	0.565	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-69	117.3	172.2	25.9	-34.3	0	0	0	112.1
236	C	44.6	Very low	40.9	Very low	36 Å²	36	70.1 Å²	70.1	24%	0.243	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-81.7	144.1	177.2	124.6	0	0	0	0	112.4	V234 T238 C239 C249	V234-C236 PolarHBondContact O-N 3.11Å; C236-T238 VanDerWaalsContact C-N 3.35Å; C236-T238 PolarHBondContact O-N 3.3Å; C236-T238 PolarHBondContact SG-N 3.33Å; C236-T238 VanDerWaalsContact SG-N 3.38Å; C236-T238 PolarHBondContact SG-OG1 2.87Å; C236-C239 HydrophobicContact CB-CB 3.81Å; C236-C239 WeakPolarHBondContact CB-SG 3.24Å; C236-C239 WeakPolarHBondContact O-CB 3.34Å; C236-C239 PolarHBondContact O-N 3.1Å; C236-C239 WeakPolarHBondContact SG-CB 3.5Å; C236-C239 PolarHBondContact SG-N 3.42Å; C236-C239 CovalentContact SG-SG 2.05Å; C236-C239 PolarHBondContact SG-SG 2.89Å; C236-C249 HydrophobicContact CB-CB 4.14Å
237	S	41	Very low	40.5	Very low	114 Å²	114	72.9 Å²	72.9	80%	0.797	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-25.3	-176.1	55.7	0	0	0	0	115.1	C239 V240	S237-C239 VanDerWaalsContact C-N 3.32Å; S237-V240 WeakPolarHBondContact O-CG2 3.31Å
238	T	41.4	Very low	40.3	Very low	130 Å²	130	69.3 Å²	69.3	80%	0.798	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.2	171.5	45.3	0	0	0	0	113.3	C236	C236-T238 VanDerWaalsContact C-N 3.35Å; C236-T238 PolarHBondContact O-N 3.3Å; C236-T238 PolarHBondContact SG-N 3.33Å; C236-T238 VanDerWaalsContact SG-N 3.38Å; C236-T238 PolarHBondContact SG-OG1 2.87Å
239	C	42.2	Very low	40.3	Very low	25 Å²	25	66.5 Å²	66.5	17%	0.169	40%	0.401	C	S	.	.			trans	-113.9	44.8	-168.2	-52.1	0	0	0	0	112.1	C236 S237 F241 C249 C251	C236-C239 HydrophobicContact CB-CB 3.81Å; C236-C239 WeakPolarHBondContact CB-SG 3.24Å; C236-C239 WeakPolarHBondContact O-CB 3.34Å; C236-C239 PolarHBondContact O-N 3.1Å; C236-C239 WeakPolarHBondContact SG-CB 3.5Å; C236-C239 PolarHBondContact SG-N 3.42Å; C236-C239 CovalentContact SG-SG 2.05Å; C236-C239 PolarHBondContact SG-SG 2.89Å; S237-C239 VanDerWaalsContact C-N 3.32Å; C239-F241 PolarHBondContact O-N 3.45Å; C239-C249 HydrophobicContact CB-CB 4.42Å; C239-C249 VanDerWaalsContact CB-SG 3.54Å; C239-C249 PolarHBondContact SG-SG 3.4Å; C239-C251 VanDerWaalsContact SG-SG 3.68Å
240	V	30.6	Very low	40.3	Very low	120 Å²	120	67.4 Å²	67.4	73%	0.727	41%	0.407	S	S	*	.			trans	-76.9	88.6	-166.6	-172.4	0	0	0	0	112.4	S237	S237-V240 WeakPolarHBondContact O-CG2 3.31Å
241	F	31.4	Very low	40.3	Very low	75 Å²	75	65.5 Å²	65.5	33%	0.329	40%	0.402	S	S	.	.			trans	-83.5	122.9	162.8	-82.3	-84.7	0	0	0	110.8	C239 G243 L244 C250 W293	C239-F241 PolarHBondContact O-N 3.45Å; F241-G243 PolarHBondContact O-N 3.35Å; F241-L244 HydrophobicContact CB-CB 3.7Å; F241-L244 HydrophobicContact CB-CD1 4.22Å; F241-L244 HydrophobicContact CB-CG 4.33Å; F241-L244 HydrophobicContact CD1-CD1 3.88Å; F241-L244 HydrophobicContact CD2-CD1 4Å; F241-L244 HydrophobicContact CE1-CD1 4.16Å; F241-L244 HydrophobicContact CE2-CD1 4.27Å; F241-L244 HydrophobicContact CG-CB 4.18Å; F241-L244 HydrophobicContact CG-CD1 3.79Å; F241-L244 HydrophobicContact CG-CG 4.42Å; F241-L244 HydrophobicContact CZ-CD1 4.34Å; F241-C250 VanDerWaalsContact CE2-SG 3.55Å; F241-W293 AromaticContact CE1-CH2 3.85Å; F241-W293 HydrophobicContact CE1-CH2 3.85Å; F241-W293 AromaticContact CE1-CZ3 3.73Å; F241-W293 HydrophobicContact CE1-CZ3 3.73Å; F241-W293 HydrophobicContact CZ-CH2 4.48Å
242	P	32.7	Very low	40.6	Very low	110 Å²	110	62.6 Å²	62.6	71%	0.714	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.8	176.5	-24.2	35.5	0	0	0	115.8
243	G	34.9	Very low	40.9	Very low	29 Å²	29	58.8 Å²	58.8	30%	0.299	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136	12.6	-176.6	0	0	0	0	0	115.6	F241 V307	F241-G243 PolarHBondContact O-N 3.35Å; G243-V307 WeakPolarHBondContact O-CG1 3.43Å
244	L	33.6	Very low	41.2	Very low	18 Å²	18	58.5 Å²	58.5	9%	0.094	36%	0.362	C	S	.	.			trans	-122.7	25.4	173.9	-75.2	166.6	0	0	0	111.4	F241 K246 T247 F310	F241-L244 HydrophobicContact CB-CB 3.7Å; F241-L244 HydrophobicContact CB-CD1 4.22Å; F241-L244 HydrophobicContact CB-CG 4.33Å; F241-L244 HydrophobicContact CD1-CD1 3.88Å; F241-L244 HydrophobicContact CD2-CD1 4Å; F241-L244 HydrophobicContact CE1-CD1 4.16Å; F241-L244 HydrophobicContact CE2-CD1 4.27Å; F241-L244 HydrophobicContact CG-CB 4.18Å; F241-L244 HydrophobicContact CG-CD1 3.79Å; F241-L244 HydrophobicContact CG-CG 4.42Å; F241-L244 HydrophobicContact CZ-CD1 4.34Å; L244-K246 PolarHBondContact O-N 2.96Å; L244-T247 WeakPolarHBondContact CD2-OG1 3.24Å; L244-T247 PolarHBondContact O-N 3.39Å; L244-F310 HydrophobicContact CD1-CE2 4.27Å; L244-F310 HydrophobicContact CD2-CD2 3.85Å; L244-F310 HydrophobicContact CD2-CE2 3.55Å; L244-F310 HydrophobicContact CD2-CZ 4.44Å; L244-F310 HydrophobicContact CG-CE2 4.14Å
245	A	31.9	Very low	41.7	Very low	84 Å²	84	62.5 Å²	62.5	69%	0.694	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	1.2	-176.8	0	0	0	0	0	115
246	K	40.5	Very low	42	Very low	146 Å²	146	61.5 Å²	61.5	64%	0.635	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-1.2	-179.1	-64.2	178.1	172.8	-178.4	0	113.8	L244 D308	L244-K246 PolarHBondContact O-N 2.96Å; K246-D308 WeakPolarHBondContact CD-OD1 3.22Å; K246-D308 IonicContact NZ-OD1 2.77Å; K246-D308 PolarHBondContact NZ-OD1 3.05Å; K246-D308 IonicContact NZ-OD2 2.65Å; K246-D308 PolarHBondContact NZ-OD2 3.11Å
247	T	39.9	Very low	42.3	Very low	61 Å²	61	60.4 Å²	60.4	37%	0.374	35%	0.35	S	S	.	.	S	Bend	trans	-142.9	138.6	-172	32.9	0	0	0	0	108.9	L244	L244-T247 WeakPolarHBondContact CD2-OG1 3.24Å; L244-T247 PolarHBondContact O-N 3.39Å
248	G	40.5	Very low	42.8	Very low	2 Å²	2	57.5 Å²	57.5	2%	0.021	34%	0.338	C	S	.	.			trans	-65.2	154.5	-146.4	0	0	0	0	0	117.9	F230 A233 C250	F230-G248 PolarHBondContact O-N 3.43Å; A233-G248 WeakPolarHBondContact O-CA 3.42Å; G248-C250 PolarHBondContact O-N 3.08Å
249	C	45.7	Very low	43.2	Very low	7 Å²	7	52.1 Å²	52.1	5%	0.047	30%	0.304	C	S	.	.			trans	-54.2	131.8	177.5	167.1	0	0	0	0	113.1	V234 C236 C239 C251 E252 V253	V234-C249 WeakPolarHBondContact O-CB 3.24Å; V234-C249 PolarHBondContact O-N 3.01Å; C236-C249 HydrophobicContact CB-CB 4.14Å; C239-C249 HydrophobicContact CB-CB 4.42Å; C239-C249 VanDerWaalsContact CB-SG 3.54Å; C239-C249 PolarHBondContact SG-SG 3.4Å; C249-C251 VanDerWaalsContact C-N 3.3Å; C249-C251 PolarHBondContact O-N 3Å; C249-C251 VanDerWaalsContact SG-CB 3.59Å; C249-C251 PolarHBondContact SG-N 2.86Å; C249-E252 HydrophobicContact CB-CB 3.9Å; C249-E252 CarbonylContact O-C 3.57Å; C249-E252 PolarHBondContact O-N 3.38Å; C249-E252 PolarHBondContact SG-N 3.04Å; C249-E252 VanDerWaalsContact SG-N 3.43Å; C249-V253 WeakPolarHBondContact O-CG2 3.19Å; C249-V253 PolarHBondContact O-N 2.87Å
250	C	46.9	Very low	43.5	Very low	25 Å²	25	53.7 Å²	53.7	17%	0.169	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-33.6	176	-59.6	0	0	0	0	114.8	F241 G248 E252 G254	F241-C250 VanDerWaalsContact CE2-SG 3.55Å; G248-C250 PolarHBondContact O-N 3.08Å; C250-E252 VanDerWaalsContact C-N 3.34Å; C250-G254 PolarHBondContact O-N 3Å
251	C	48.1	Very low	44.4	Very low	29 Å²	29	54.7 Å²	54.7	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-68.1	-35.7	173.7	-55.3	0	0	0	0	111.3	C239 C249 G254 R255 W260	C239-C251 VanDerWaalsContact SG-SG 3.68Å; C249-C251 VanDerWaalsContact C-N 3.3Å; C249-C251 PolarHBondContact O-N 3Å; C249-C251 VanDerWaalsContact SG-CB 3.59Å; C249-C251 PolarHBondContact SG-N 2.86Å; C251-G254 PolarHBondContact O-N 3.25Å; C251-R255 WeakPolarHBondContact O-CB 3.44Å; C251-R255 PolarHBondContact O-N 3.13Å; C251-W260 HydrophobicContact CB-CD2 4.36Å; C251-W260 HydrophobicContact CB-CE3 3.94Å; C251-W260 HydrophobicContact CB-CH2 3.89Å; C251-W260 HydrophobicContact CB-CZ2 4.31Å; C251-W260 HydrophobicContact CB-CZ3 3.7Å
252	E	50.6	Low	44.9	Very low	49 Å²	49	53.5 Å²	53.5	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-81.9	-33.9	179.7	-162.1	163	126.6	0	0	112.6	A233 V234 C249 C250 G254 R255 L256	A233-E252 HydrophobicContact CB-CB 3.8Å; A233-E252 HydrophobicContact CB-CG 4Å; V234-E252 VanDerWaalsContact CB-OE1 3.3Å; V234-E252 WeakPolarHBondContact CB-OE1 3.25Å; V234-E252 WeakPolarHBondContact CG2-OE1 3.41Å; V234-E252 PolarHBondContact N-OE1 3.26Å; C249-E252 HydrophobicContact CB-CB 3.9Å; C249-E252 CarbonylContact O-C 3.57Å; C249-E252 PolarHBondContact O-N 3.38Å; C249-E252 PolarHBondContact SG-N 3.04Å; C249-E252 VanDerWaalsContact SG-N 3.43Å; C250-E252 VanDerWaalsContact C-N 3.34Å; E252-G254 VanDerWaalsContact C-N 3.32Å; E252-R255 WeakPolarHBondContact O-CB 3.29Å; E252-R255 PolarHBondContact O-N 3.31Å; E252-L256 WeakPolarHBondContact O-CB 3.28Å; E252-L256 VanDerWaalsContact O-CG 3.28Å; E252-L256 WeakPolarHBondContact O-CG 3.43Å; E252-L256 PolarHBondContact O-N 2.89Å
253	V	50.7	Low	45.6	Very low	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-57.9	-46.5	163.1	173.7	0	0	0	0	109.9	A229 F230 A233 C249 R255 L256 L257	A229-V253 HydrophobicContact CB-CG1 4.08Å; F230-V253 HydrophobicContact CD1-CG2 3.72Å; F230-V253 HydrophobicContact CD2-CG1 4.24Å; F230-V253 HydrophobicContact CE1-CG1 4.41Å; F230-V253 HydrophobicContact CE1-CG2 4.04Å; F230-V253 HydrophobicContact CE2-CG1 4.11Å; F230-V253 HydrophobicContact CG-CG1 4.45Å; F230-V253 HydrophobicContact CG-CG2 4.05Å; F230-V253 HydrophobicContact CZ-CG1 4.19Å; A233-V253 HydrophobicContact CB-CG2 3.74Å; C249-V253 WeakPolarHBondContact O-CG2 3.19Å; C249-V253 PolarHBondContact O-N 2.87Å; V253-R255 VanDerWaalsContact C-N 3.29Å; V253-R255 PolarHBondContact O-N 3.05Å; V253-L256 PolarHBondContact O-N 2.74Å; V253-L257 HydrophobicContact CG1-CD1 3.73Å; V253-L257 HydrophobicContact CG1-CG 4.43Å; V253-L257 WeakPolarHBondContact O-CB 3.21Å; V253-L257 VanDerWaalsContact O-CG 3.25Å; V253-L257 WeakPolarHBondContact O-CG 3.14Å; V253-L257 PolarHBondContact O-N 3.46Å
254	G	49.1	Very low	46.1	Very low	3 Å²	3	57.3 Å²	57.3	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-33.3	174.4	0	0	0	0	0	113.5	C250 C251 E252 G258 I259 W260	C250-G254 PolarHBondContact O-N 3Å; C251-G254 PolarHBondContact O-N 3.25Å; E252-G254 VanDerWaalsContact C-N 3.32Å; G254-G258 PolarHBondContact O-N 2.81Å; G254-I259 PolarHBondContact O-N 3.41Å; G254-W260 PolarHBondContact O-N 3.47Å
255	R	54.5	Low	46.3	Very low	162 Å²	162	60.4 Å²	60.4	61%	0.611	36%	0.357	S	S	*	.	H	α-helix	trans	-71.7	-47.9	174.5	-169.9	179	179.8	-170.5	-2.7	111.6	C251 E252 V253 L257 G258 W260	C251-R255 WeakPolarHBondContact O-CB 3.44Å; C251-R255 PolarHBondContact O-N 3.13Å; E252-R255 WeakPolarHBondContact O-CB 3.29Å; E252-R255 PolarHBondContact O-N 3.31Å; V253-R255 VanDerWaalsContact C-N 3.29Å; V253-R255 PolarHBondContact O-N 3.05Å; R255-L257 VanDerWaalsContact C-N 3.31Å; R255-L257 PolarHBondContact O-N 2.98Å; R255-G258 PolarHBondContact O-N 2.69Å; R255-W260 HydrophobicContact CB-CE3 4.35Å
256	L	51.2	Low	46.7	Very low	67 Å²	67	61.5 Å²	61.5	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-35.4	177.3	-72.6	170.6	0	0	0	112.4	A229 N232 A233 E252 V253 G258	A229-L256 HydrophobicContact CB-CB 3.96Å; A229-L256 HydrophobicContact CB-CD1 4.27Å; N232-L256 HydrophobicContact CB-CD1 4.16Å; A233-L256 HydrophobicContact CB-CD1 3.9Å; E252-L256 WeakPolarHBondContact O-CB 3.28Å; E252-L256 VanDerWaalsContact O-CG 3.28Å; E252-L256 WeakPolarHBondContact O-CG 3.43Å; E252-L256 PolarHBondContact O-N 2.89Å; V253-L256 PolarHBondContact O-N 2.74Å; L256-G258 VanDerWaalsContact C-N 3.32Å
257	L	51.5	Low	46.5	Very low	12 Å²	12	58.3 Å²	58.3	6%	0.063	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-4	174.5	-63.9	171.7	0	0	0	113.7	R225 V226 A229 V253 R255 I259 W271 R276	R225-L257 HydrophobicContact CB-CD2 4.21Å; V226-L257 HydrophobicContact CG2-CD1 3.91Å; V226-L257 HydrophobicContact CG2-CD2 4.03Å; A229-L257 HydrophobicContact CB-CD1 4.4Å; A229-L257 HydrophobicContact CB-CD2 3.99Å; A229-L257 HydrophobicContact CB-CG 3.89Å; V253-L257 HydrophobicContact CG1-CD1 3.73Å; V253-L257 HydrophobicContact CG1-CG 4.43Å; V253-L257 WeakPolarHBondContact O-CB 3.21Å; V253-L257 VanDerWaalsContact O-CG 3.25Å; V253-L257 WeakPolarHBondContact O-CG 3.14Å; V253-L257 PolarHBondContact O-N 3.46Å; R255-L257 VanDerWaalsContact C-N 3.31Å; R255-L257 PolarHBondContact O-N 2.98Å; L257-I259 HydrophobicContact CB-CD1 3.65Å; L257-I259 HydrophobicContact CB-CG1 3.86Å; L257-I259 HydrophobicContact CD1-CD1 4.02Å; L257-I259 HydrophobicContact CG-CD1 4.48Å; L257-I259 PolarHBondContact O-N 3.48Å; L257-W271 HydrophobicContact CD1-CH2 4.33Å; L257-W271 HydrophobicContact CD1-CZ3 4.32Å; L257-R276 PolarHBondContact O-NH1 2.89Å
258	G	51.4	Low	46.3	Very low	53 Å²	53	60.3 Å²	60.3	55%	0.546	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	20.5	-178.3	0	0	0	0	0	114.8	G254 R255 L256	G254-G258 PolarHBondContact O-N 2.81Å; R255-G258 PolarHBondContact O-N 2.69Å; L256-G258 VanDerWaalsContact C-N 3.32Å
259	I	49.7	Very low	46.1	Very low	17 Å²	17	62.1 Å²	62.1	9%	0.087	38%	0.38	C	S	.	.			trans	-92.5	-25.2	-177	-57.3	170.8	0	0	0	111.4	G254 L257 W271 F278	G254-I259 PolarHBondContact O-N 3.41Å; L257-I259 HydrophobicContact CB-CD1 3.65Å; L257-I259 HydrophobicContact CB-CG1 3.86Å; L257-I259 HydrophobicContact CD1-CD1 4.02Å; L257-I259 HydrophobicContact CG-CD1 4.48Å; L257-I259 PolarHBondContact O-N 3.48Å; I259-W271 HydrophobicContact CD1-CE3 3.73Å; I259-W271 HydrophobicContact CD1-CZ3 3.47Å; I259-W271 VanDerWaalsContact CD1-CZ3 3.47Å; I259-W271 HydrophobicContact CG2-CE3 3.96Å; I259-F278 HydrophobicContact CD1-CE2 3.86Å; I259-F278 HydrophobicContact CD1-CZ 3.53Å; I259-F278 HydrophobicContact CG1-CE2 4Å; I259-F278 HydrophobicContact CG1-CZ 3.67Å
260	W	47.5	Very low	45.8	Very low	59 Å²	59	63.8 Å²	63.8	22%	0.223	39%	0.389	C	S	.	.			trans	-114.5	130.4	179.1	-176.9	64.2	0	0	0	111.3	C251 G254 R255	C251-W260 HydrophobicContact CB-CD2 4.36Å; C251-W260 HydrophobicContact CB-CE3 3.94Å; C251-W260 HydrophobicContact CB-CH2 3.89Å; C251-W260 HydrophobicContact CB-CZ2 4.31Å; C251-W260 HydrophobicContact CB-CZ3 3.7Å; G254-W260 PolarHBondContact O-N 3.47Å; R255-W260 HydrophobicContact CB-CE3 4.35Å
261	K	50.4	Low	45.7	Very low	141 Å²	141	65.7 Å²	65.7	61%	0.613	39%	0.392	S	S	*	.			trans	-95	128.1	163.4	-66.6	-173.9	-180	-177	0	107.8	D263 T264	K261-D263 PolarHBondContact O-N 3.45Å; K261-T264 PolarHBondContact O-N 3.42Å
262	G	42.2	Very low	45.4	Very low	50 Å²	50	67.6 Å²	67.6	52%	0.515	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10	-172.9	0	0	0	0	0	115.7
263	D	46	Very low	45.2	Very low	146 Å²	146	66.1 Å²	66.1	78%	0.781	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-21.3	-174.3	-43.8	-60	0	0	0	113.4	K261	K261-D263 PolarHBondContact O-N 3.45Å
264	T	45.6	Very low	44.6	Very low	73 Å²	73	75 Å²	75	45%	0.448	44%	0.436	S	S	.	.			trans	-98.4	94.3	178.4	55.6	0	0	0	0	111.1	K261 D266 S269	K261-T264 PolarHBondContact O-N 3.42Å; T264-D266 PolarHBondContact O-N 3.49Å; T264-S269 PolarHBondContact O-OG 3.27Å; T264-S269 PolarHBondContact OG1-OG 2.97Å; T264-S269 VanDerWaalsContact OG1-OG 3.08Å
265	G	38.2	Very low	44.2	Very low	83 Å²	83	81 Å²	81	86%	0.856	46%	0.463	S	S	*	.			trans	-67.6	9.8	179.5	0	0	0	0	0	116.3
266	D	40.3	Very low	43.7	Very low	107 Å²	107	77.9 Å²	77.9	57%	0.572	45%	0.451	S	S	*	.			trans	-87.4	116.2	176.1	-104.4	-46.7	0	0	0	110.6	T264 S268 S269	T264-D266 PolarHBondContact O-N 3.49Å; D266-S268 PolarHBondContact O-N 2.56Å; D266-S268 PolarHBondContact OD1-OG 2.81Å; D266-S269 WeakPolarHBondContact O-CB 3.41Å; D266-S269 PolarHBondContact O-N 3.41Å; D266-S269 PolarHBondContact O-OG 3.14Å
267	A	36	Very low	43.3	Very low	79 Å²	79	84.2 Å²	84.2	65%	0.653	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-63.5	-21.3	173.7	0	0	0	0	0	112.8	S269 L270	A267-S269 PolarHBondContact O-N 3Å; A267-L270 HydrophobicContact CB-CD1 4.44Å; A267-L270 WeakPolarHBondContact O-CB 3.33Å; A267-L270 WeakPolarHBondContact O-CD1 3.2Å; A267-L270 VanDerWaalsContact O-CG 3.26Å; A267-L270 WeakPolarHBondContact O-CG 3.48Å; A267-L270 PolarHBondContact O-N 2.83Å
268	S	36.3	Very low	43.1	Very low	103 Å²	103	84.1 Å²	84.1	72%	0.72	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-69.4	-14.4	170	53.9	0	0	0	0	113.6	D266	D266-S268 PolarHBondContact O-N 2.56Å; D266-S268 PolarHBondContact OD1-OG 2.81Å
269	S	37.4	Very low	42.6	Very low	39 Å²	39	83.3 Å²	83.3	27%	0.273	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-90.3	-1.4	174.1	76.3	0	0	0	0	114	T264 D266 A267 W271	T264-S269 PolarHBondContact O-OG 3.27Å; T264-S269 PolarHBondContact OG1-OG 2.97Å; T264-S269 VanDerWaalsContact OG1-OG 3.08Å; D266-S269 WeakPolarHBondContact O-CB 3.41Å; D266-S269 PolarHBondContact O-N 3.41Å; D266-S269 PolarHBondContact O-OG 3.14Å; A267-S269 PolarHBondContact O-N 3Å; S269-W271 PolarHBondContact O-N 3.34Å
270	L	38	Very low	42.1	Very low	43 Å²	43	87.2 Å²	87.2	23%	0.225	49%	0.491	C	S	.	.	S	Bend	trans	-57.2	130.3	170.3	-71.2	171.3	0	0	0	109.6	A267	A267-L270 HydrophobicContact CB-CD1 4.44Å; A267-L270 WeakPolarHBondContact O-CB 3.33Å; A267-L270 WeakPolarHBondContact O-CD1 3.2Å; A267-L270 VanDerWaalsContact O-CG 3.26Å; A267-L270 WeakPolarHBondContact O-CG 3.48Å; A267-L270 PolarHBondContact O-N 2.83Å
271	W	44.6	Very low	41.5	Very low	64 Å²	64	86.9 Å²	86.9	24%	0.242	50%	0.501	C	S	.	.			trans	68.7	64.4	179.3	-43.5	93.8	0	0	0	115.3	L257 I259 S269 L273 L286	L257-W271 HydrophobicContact CD1-CH2 4.33Å; L257-W271 HydrophobicContact CD1-CZ3 4.32Å; I259-W271 HydrophobicContact CD1-CE3 3.73Å; I259-W271 HydrophobicContact CD1-CZ3 3.47Å; I259-W271 VanDerWaalsContact CD1-CZ3 3.47Å; I259-W271 HydrophobicContact CG2-CE3 3.96Å; S269-W271 PolarHBondContact O-N 3.34Å; W271-L273 HydrophobicContact CB-CD2 4.28Å; W271-L273 HydrophobicContact CB-CG 4.1Å; W271-L273 HydrophobicContact CE3-CD2 4.31Å; W271-L273 PolarHBondContact O-N 2.84Å; W271-L286 HydrophobicContact CE3-CD1 3.79Å; W271-L286 HydrophobicContact CE3-CD2 4.35Å; W271-L286 HydrophobicContact CH2-CD2 4.12Å; W271-L286 HydrophobicContact CZ3-CD1 3.73Å; W271-L286 HydrophobicContact CZ3-CD2 3.79Å; W271-L286 HydrophobicContact CZ3-CG 4.4Å
272	N	43.3	Very low	41	Very low	70 Å²	70	80.2 Å²	80.2	37%	0.374	47%	0.472	S	S	.	.			trans	-74.1	72	161.4	-164.9	-22.1	0	0	0	111	Q274 Q275	N272-Q274 PolarHBondContact O-N 3.44Å; N272-Q274 PolarHBondContact OD1-N 3.08Å; N272-Q275 HydrophobicContact CB-CG 4.46Å; N272-Q275 PolarHBondContact ND2-NE2 3.23Å; N272-Q275 PolarHBondContact O-N 3.18Å
273	L	44.6	Very low	40.9	Very low	18 Å²	18	80.5 Å²	80.5	9%	0.094	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-8	-178.8	-62	175.2	0	0	0	113.9	W271 Q275 R276 F278 L286 F287	W271-L273 HydrophobicContact CB-CD2 4.28Å; W271-L273 HydrophobicContact CB-CG 4.1Å; W271-L273 HydrophobicContact CE3-CD2 4.31Å; W271-L273 PolarHBondContact O-N 2.84Å; L273-Q275 VanDerWaalsContact C-N 3.34Å; L273-R276 VanDerWaalsContact O-O 3.09Å; L273-F278 HydrophobicContact CD2-CD2 4.03Å; L273-F278 HydrophobicContact CD2-CE2 4.01Å; L273-L286 HydrophobicContact CD2-CD1 3.69Å; L273-F287 HydrophobicContact CD1-CD1 4.49Å; L273-F287 HydrophobicContact CD1-CD2 4.44Å; L273-F287 HydrophobicContact CD1-CE1 4.01Å; L273-F287 HydrophobicContact CD1-CE2 3.95Å; L273-F287 HydrophobicContact CD1-CZ 3.72Å
274	Q	39.3	Very low	40.5	Very low	187 Å²	187	78.7 Å²	78.7	87%	0.874	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.5	173.6	-61	-175.4	-9.1	0	0	113	N272	N272-Q274 PolarHBondContact O-N 3.44Å; N272-Q274 PolarHBondContact OD1-N 3.08Å
275	Q	41	Very low	40.2	Very low	129 Å²	129	76.7 Å²	76.7	60%	0.603	44%	0.435	S	S	*	.	S	Bend	trans	-87.2	-12.8	-179.7	-64.1	-170.1	25.3	0	0	114.3	N272 L273	N272-Q275 HydrophobicContact CB-CG 4.46Å; N272-Q275 PolarHBondContact ND2-NE2 3.23Å; N272-Q275 PolarHBondContact O-N 3.18Å; L273-Q275 VanDerWaalsContact C-N 3.34Å
276	R	42.8	Very low	40.2	Very low	95 Å²	95	73.5 Å²	73.5	36%	0.358	40%	0.399	S	S	.	.	S	Bend	trans	-131.9	126	172.3	-109.1	-176.9	161.8	-178.1	-12.5	110.2	L257 L273 F278	L257-R276 PolarHBondContact O-NH1 2.89Å; L273-R276 VanDerWaalsContact O-O 3.09Å; R276-F278 HydrophobicContact CB-CD2 4.06Å; R276-F278 HydrophobicContact CB-CE1 4.4Å; R276-F278 HydrophobicContact CB-CE2 3.61Å; R276-F278 HydrophobicContact CB-CZ 3.8Å; R276-F278 HydrophobicContact CG-CZ 4.43Å; R276-F278 WeakPolarHBondContact O-CD2 3.27Å; R276-F278 PolarHBondContact O-N 2.81Å
277	Q	43.8	Very low	40.1	Very low	200 Å²	200	72.5 Å²	72.5	94%	0.935	39%	0.389	S	S	*	.			trans	-75.5	76.9	172.8	-74.8	-172.5	-20.7	0	0	110.2
278	F	45.7	Very low	40	Very low	10 Å²	10	70.1 Å²	70.1	4%	0.044	37%	0.373	C	S	.	.			trans	-67.1	147.1	167.5	-67	-65.4	0	0	0	111.1	E222 I259 L273 R276 F282 Q283	E222-F278 HydrophobicContact CG-CD1 4.28Å; E222-F278 HydrophobicContact CG-CE1 4.49Å; E222-F278 WeakPolarHBondContact OE2-CD1 3.47Å; I259-F278 HydrophobicContact CD1-CE2 3.86Å; I259-F278 HydrophobicContact CD1-CZ 3.53Å; I259-F278 HydrophobicContact CG1-CE2 4Å; I259-F278 HydrophobicContact CG1-CZ 3.67Å; L273-F278 HydrophobicContact CD2-CD2 4.03Å; L273-F278 HydrophobicContact CD2-CE2 4.01Å; R276-F278 HydrophobicContact CB-CD2 4.06Å; R276-F278 HydrophobicContact CB-CE1 4.4Å; R276-F278 HydrophobicContact CB-CE2 3.61Å; R276-F278 HydrophobicContact CB-CZ 3.8Å; R276-F278 HydrophobicContact CG-CZ 4.43Å; R276-F278 WeakPolarHBondContact O-CD2 3.27Å; R276-F278 PolarHBondContact O-N 2.81Å; F278-F282 HydrophobicContact CB-CB 4.45Å; F278-F282 HydrophobicContact CB-CD1 3.68Å; F278-F282 HydrophobicContact CB-CE1 4.38Å; F278-F282 HydrophobicContact CB-CG 4.48Å; F278-F282 AromaticContact CD1-CD1 3.45Å; F278-F282 HydrophobicContact CD1-CD1 3.45Å; F278-F282 VanDerWaalsContact CD1-CD1 3.45Å; F278-F282 AromaticContact CD1-CE1 3.34Å; F278-F282 HydrophobicContact CD1-CE1 3.34Å; F278-F282 HydrophobicContact CD1-CG 4.42Å; F278-F282 HydrophobicContact CD1-CZ 4.29Å; F278-F282 HydrophobicContact CD2-CD1 4.31Å; F278-F282 HydrophobicContact CD2-CE1 4.27Å; F278-F282 HydrophobicContact CE1-CD1 4.16Å; F278-F282 AromaticContact CE1-CE1 3.56Å; F278-F282 HydrophobicContact CE1-CE1 3.56Å; F278-F282 HydrophobicContact CE1-CZ 4.27Å; F278-F282 HydrophobicContact CE2-CE1 4.43Å; F278-F282 AromaticContact CG-CD1 3.55Å; F278-F282 HydrophobicContact CG-CD1 3.55Å; F278-F282 AromaticContact CG-CE1 3.74Å; F278-F282 HydrophobicContact CG-CE1 3.74Å; F278-F282 HydrophobicContact CZ-CE1 4.11Å; F278-Q283 HydrophobicContact CB-CG 3.74Å; F278-Q283 PolarHBondContact O-NE2 2.95Å
279	P	42.7	Very low	40.1	Very low	37 Å²	37	67.5 Å²	67.5	24%	0.24	35%	0.349	C	S	.	.			trans	-52.8	145	170	-26.2	34.6	0	0	0	112	E222 A281 F282 Q283	E222-P279 WeakPolarHBondContact OE2-CD 3.15Å; P279-A281 PolarHBondContact O-N 2.97Å; P279-A281 VanDerWaalsContact O-N 3.13Å; P279-F282 HydrophobicContact CB-CB 4.48Å; P279-F282 WeakPolarHBondContact O-CA 3.23Å; P279-F282 WeakPolarHBondContact O-CB 3.43Å; P279-F282 PolarHBondContact O-N 2.89Å; P279-Q283 PolarHBondContact O-N 3.48Å
280	C	38.6	Very low	39.9	Very low	99 Å²	99	69.3 Å²	69.3	67%	0.669	35%	0.353	S	S	*	.	H	α-helix	trans	-56.9	-33.6	-177.6	-68.8	0	0	0	0	113	N284	C280-N284 WeakPolarHBondContact O-CB 3.17Å; C280-N284 PolarHBondContact O-N 3.44Å; C280-N284 PolarHBondContact O-ND2 3.43Å; C280-N284 VanDerWaalsContact O-ND2 3.16Å
281	A	34.6	Very low	39.6	Very low	52 Å²	52	75 Å²	75	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-42.6	173.4	0	0	0	0	0	112.3	L219 P279 N284 F285	L219-A281 HydrophobicContact CD1-CB 3.96Å; L219-A281 HydrophobicContact CD2-CB 3.83Å; P279-A281 PolarHBondContact O-N 2.97Å; P279-A281 VanDerWaalsContact O-N 3.13Å; A281-N284 PolarHBondContact O-N 2.92Å; A281-F285 PolarHBondContact O-N 2.74Å
282	F	40.2	Very low	39.2	Very low	0 Å²	0	79.3 Å²	79.3	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-73.5	-37.1	178.3	-172.9	-90.2	0	0	0	112.6	L219 E222 I223 V226 F278 P279 N284 F285 L286	L219-F282 HydrophobicContact CD1-CB 4.06Å; E222-F282 HydrophobicContact CB-CD2 4.07Å; E222-F282 HydrophobicContact CB-CE2 4.08Å; E222-F282 HydrophobicContact CG-CD1 4.28Å; E222-F282 HydrophobicContact CG-CD2 3.62Å; E222-F282 HydrophobicContact CG-CE1 4.08Å; E222-F282 HydrophobicContact CG-CE2 3.41Å; E222-F282 VanDerWaalsContact CG-CE2 3.41Å; E222-F282 HydrophobicContact CG-CG 4.02Å; E222-F282 HydrophobicContact CG-CZ 3.64Å; I223-F282 HydrophobicContact CG1-CD2 4.5Å; V226-F282 HydrophobicContact CG2-CE2 3.42Å; V226-F282 VanDerWaalsContact CG2-CE2 3.42Å; V226-F282 HydrophobicContact CG2-CZ 3.32Å; F278-F282 HydrophobicContact CB-CB 4.45Å; F278-F282 HydrophobicContact CB-CD1 3.68Å; F278-F282 HydrophobicContact CB-CE1 4.38Å; F278-F282 HydrophobicContact CB-CG 4.48Å; F278-F282 AromaticContact CD1-CD1 3.45Å; F278-F282 HydrophobicContact CD1-CD1 3.45Å; F278-F282 VanDerWaalsContact CD1-CD1 3.45Å; F278-F282 AromaticContact CD1-CE1 3.34Å; F278-F282 HydrophobicContact CD1-CE1 3.34Å; F278-F282 HydrophobicContact CD1-CG 4.42Å; F278-F282 HydrophobicContact CD1-CZ 4.29Å; F278-F282 HydrophobicContact CD2-CD1 4.31Å; F278-F282 HydrophobicContact CD2-CE1 4.27Å; F278-F282 HydrophobicContact CE1-CD1 4.16Å; F278-F282 AromaticContact CE1-CE1 3.56Å; F278-F282 HydrophobicContact CE1-CE1 3.56Å; F278-F282 HydrophobicContact CE1-CZ 4.27Å; F278-F282 HydrophobicContact CE2-CE1 4.43Å; F278-F282 AromaticContact CG-CD1 3.55Å; F278-F282 HydrophobicContact CG-CD1 3.55Å; F278-F282 AromaticContact CG-CE1 3.74Å; F278-F282 HydrophobicContact CG-CE1 3.74Å; F278-F282 HydrophobicContact CZ-CE1 4.11Å; P279-F282 HydrophobicContact CB-CB 4.48Å; P279-F282 WeakPolarHBondContact O-CA 3.23Å; P279-F282 WeakPolarHBondContact O-CB 3.43Å; P279-F282 PolarHBondContact O-N 2.89Å; F282-N284 VanDerWaalsContact C-N 3.33Å; F282-N284 PolarHBondContact O-N 3.38Å; F282-F285 WeakPolarHBondContact O-CB 3.4Å; F282-F285 PolarHBondContact O-N 2.88Å; F282-L286 HydrophobicContact CD1-CD1 3.9Å; F282-L286 HydrophobicContact CD1-CG 4.21Å; F282-L286 HydrophobicContact CE1-CD1 3.42Å; F282-L286 VanDerWaalsContact CE1-CD1 3.42Å; F282-L286 HydrophobicContact CE1-CG 3.97Å; F282-L286 HydrophobicContact CZ-CD1 4.17Å; F282-L286 HydrophobicContact CZ-CG 4.46Å; F282-L286 PolarHBondContact O-N 3.23Å
283	Q	39.2	Very low	38.8	Very low	56 Å²	56	82.3 Å²	82.3	26%	0.262	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-44.8	169.6	-65	-168.6	14.8	0	0	111.1	F278 P279 F285 L286 F287	F278-Q283 HydrophobicContact CB-CG 3.74Å; F278-Q283 PolarHBondContact O-NE2 2.95Å; P279-Q283 PolarHBondContact O-N 3.48Å; Q283-F285 VanDerWaalsContact C-N 3.33Å; Q283-F285 PolarHBondContact O-N 3.02Å; Q283-L286 PolarHBondContact O-N 3.42Å; Q283-F287 HydrophobicContact CB-CD2 4.39Å; Q283-F287 HydrophobicContact CB-CE2 4.44Å; Q283-F287 WeakPolarHBondContact O-CB 3.21Å; Q283-F287 WeakPolarHBondContact O-CD2 3.41Å; Q283-F287 PolarHBondContact O-N 3.37Å
284	N	39.4	Very low	38.2	Very low	109 Å²	109	88.4 Å²	88.4	58%	0.583	44%	0.437	S	S	*	.	H	α-helix	trans	-63.8	-35.5	176.1	-74.6	-28.9	0	0	0	112.6	C280 A281 F282 G288	C280-N284 WeakPolarHBondContact O-CB 3.17Å; C280-N284 PolarHBondContact O-N 3.44Å; C280-N284 PolarHBondContact O-ND2 3.43Å; C280-N284 VanDerWaalsContact O-ND2 3.16Å; A281-N284 PolarHBondContact O-N 2.92Å; F282-N284 VanDerWaalsContact C-N 3.33Å; F282-N284 PolarHBondContact O-N 3.38Å; N284-G288 PolarHBondContact O-N 3.46Å
285	F	38.9	Very low	37.8	Very low	31 Å²	31	82.8 Å²	82.8	14%	0.136	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-50.4	171.4	169.6	-100.4	0	0	0	111.7	V226 A281 F282 Q283 G288 Q289 C312 L314	V226-F285 HydrophobicContact CG1-CE1 4.36Å; A281-F285 PolarHBondContact O-N 2.74Å; F282-F285 WeakPolarHBondContact O-CB 3.4Å; F282-F285 PolarHBondContact O-N 2.88Å; Q283-F285 VanDerWaalsContact C-N 3.33Å; Q283-F285 PolarHBondContact O-N 3.02Å; F285-G288 PolarHBondContact O-N 3.24Å; F285-Q289 WeakPolarHBondContact O-CG 3.42Å; F285-Q289 PolarHBondContact O-N 2.88Å; F285-C312 HydrophobicContact CE2-CB 4.43Å; F285-L314 HydrophobicContact CD2-CD2 4.42Å
286	L	37.9	Very low	37.2	Very low	16 Å²	16	80.1 Å²	80.1	8%	0.084	43%	0.429	C	S	.	.	H	α-helix	trans	-66.8	-38.6	178.5	-67.2	-177	0	0	0	113.1	W271 L273 F282 Q283 Q289 Q290	W271-L286 HydrophobicContact CE3-CD1 3.79Å; W271-L286 HydrophobicContact CE3-CD2 4.35Å; W271-L286 HydrophobicContact CH2-CD2 4.12Å; W271-L286 HydrophobicContact CZ3-CD1 3.73Å; W271-L286 HydrophobicContact CZ3-CD2 3.79Å; W271-L286 HydrophobicContact CZ3-CG 4.4Å; L273-L286 HydrophobicContact CD2-CD1 3.69Å; F282-L286 HydrophobicContact CD1-CD1 3.9Å; F282-L286 HydrophobicContact CD1-CG 4.21Å; F282-L286 HydrophobicContact CE1-CD1 3.42Å; F282-L286 VanDerWaalsContact CE1-CD1 3.42Å; F282-L286 HydrophobicContact CE1-CG 3.97Å; F282-L286 HydrophobicContact CZ-CD1 4.17Å; F282-L286 HydrophobicContact CZ-CG 4.46Å; F282-L286 PolarHBondContact O-N 3.23Å; Q283-L286 PolarHBondContact O-N 3.42Å; L286-Q289 PolarHBondContact O-N 2.85Å; L286-Q290 WeakPolarHBondContact O-CB 3.45Å; L286-Q290 PolarHBondContact O-N 3.33Å
287	F	37.4	Very low	36.4	Very low	85 Å²	85	83.4 Å²	83.4	37%	0.373	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-33.9	172.5	-78.7	-57.5	0	0	0	112.8	L273 Q283 Q290 K291	L273-F287 HydrophobicContact CD1-CD1 4.49Å; L273-F287 HydrophobicContact CD1-CD2 4.44Å; L273-F287 HydrophobicContact CD1-CE1 4.01Å; L273-F287 HydrophobicContact CD1-CE2 3.95Å; L273-F287 HydrophobicContact CD1-CZ 3.72Å; Q283-F287 HydrophobicContact CB-CD2 4.39Å; Q283-F287 HydrophobicContact CB-CE2 4.44Å; Q283-F287 WeakPolarHBondContact O-CB 3.21Å; Q283-F287 WeakPolarHBondContact O-CD2 3.41Å; Q283-F287 PolarHBondContact O-N 3.37Å; F287-Q290 PolarHBondContact O-N 2.64Å; F287-K291 WeakPolarHBondContact O-CG 3.39Å; F287-K291 PolarHBondContact O-N 2.95Å
288	G	34.4	Very low	35.6	Very low	30 Å²	30	81.8 Å²	81.8	31%	0.309	45%	0.446	S	S	.	.	H	α-helix	trans	-61.7	-46.4	173.5	0	0	0	0	0	111.4	N284 F285 H292	N284-G288 PolarHBondContact O-N 3.46Å; F285-G288 PolarHBondContact O-N 3.24Å; G288-H292 PolarHBondContact O-N 3.03Å
289	Q	38	Very low	34.6	Very low	48 Å²	48	88 Å²	88	22%	0.224	49%	0.489	C	S	.	.	H	α-helix	trans	-57.7	-55.4	169.7	-68.7	-68.3	-15	0	0	110.8	F285 L286 K291 H292 W293	F285-Q289 WeakPolarHBondContact O-CG 3.42Å; F285-Q289 PolarHBondContact O-N 2.88Å; L286-Q289 PolarHBondContact O-N 2.85Å; Q289-K291 VanDerWaalsContact C-N 3.29Å; Q289-K291 PolarHBondContact O-N 3.05Å; Q289-H292 WeakPolarHBondContact O-CA 3.27Å; Q289-H292 VanDerWaalsContact O-CB 3.3Å; Q289-H292 WeakPolarHBondContact O-CB 3.36Å; Q289-H292 PolarHBondContact O-N 3.22Å; Q289-W293 PolarHBondContact O-N 3.41Å
290	Q	33.3	Very low	33.7	Very low	76 Å²	76	91.1 Å²	91.1	36%	0.355	51%	0.511	S	S	.	.	H	α-helix	trans	-55.1	-39.4	-176.3	-166	-178.9	31.8	0	0	113.5	L286 F287 H292 W293 L294	L286-Q290 WeakPolarHBondContact O-CB 3.45Å; L286-Q290 PolarHBondContact O-N 3.33Å; F287-Q290 PolarHBondContact O-N 2.64Å; Q290-H292 VanDerWaalsContact C-N 3.32Å; Q290-H292 PolarHBondContact O-N 3.37Å; Q290-W293 PolarHBondContact O-N 3.41Å; Q290-L294 HydrophobicContact CG-CD1 4.42Å; Q290-L294 PolarHBondContact O-N 2.99Å
291	K	32.7	Very low	33	Very low	164 Å²	164	96.1 Å²	96.1	71%	0.713	52%	0.522	S	S	*	.	H	α-helix	trans	-67.3	-29.4	175.9	-76.4	180	177.2	178.4	0	113.5	F287 Q289 W293	F287-K291 WeakPolarHBondContact O-CG 3.39Å; F287-K291 PolarHBondContact O-N 2.95Å; Q289-K291 VanDerWaalsContact C-N 3.29Å; Q289-K291 PolarHBondContact O-N 3.05Å; K291-W293 VanDerWaalsContact C-N 3.29Å; K291-W293 PolarHBondContact O-N 3.15Å
292	H	35.8	Very low	32.6	Very low	153 Å²	153	97.6 Å²	97.6	71%	0.708	53%	0.534	S	S	*	.	H	α-helix	trans	-70.3	-26	177.3	-136	-76	0	0	0	112.7	G288 Q289 Q290	G288-H292 PolarHBondContact O-N 3.03Å; Q289-H292 WeakPolarHBondContact O-CA 3.27Å; Q289-H292 VanDerWaalsContact O-CB 3.3Å; Q289-H292 WeakPolarHBondContact O-CB 3.36Å; Q289-H292 PolarHBondContact O-N 3.22Å; Q290-H292 VanDerWaalsContact C-N 3.32Å; Q290-H292 PolarHBondContact O-N 3.37Å
293	W	34.2	Very low	31.9	Very low	133 Å²	133	106.9 Å²	106.9	50%	0.504	57%	0.574	S	S	.	*	H	α-helix	trans	-82.5	-32.4	178.6	-65.7	105.3	0	0	0	114	F241 Q289 Q290 K291 G295 F310	F241-W293 AromaticContact CE1-CH2 3.85Å; F241-W293 HydrophobicContact CE1-CH2 3.85Å; F241-W293 AromaticContact CE1-CZ3 3.73Å; F241-W293 HydrophobicContact CE1-CZ3 3.73Å; F241-W293 HydrophobicContact CZ-CH2 4.48Å; Q289-W293 PolarHBondContact O-N 3.41Å; Q290-W293 PolarHBondContact O-N 3.41Å; K291-W293 VanDerWaalsContact C-N 3.29Å; K291-W293 PolarHBondContact O-N 3.15Å; W293-G295 PolarHBondContact O-N 3.47Å; W293-F310 AromaticContact CH2-CZ 3.79Å; W293-F310 HydrophobicContact CH2-CZ 3.79Å; W293-F310 HydrophobicContact CZ2-CE1 4.08Å; W293-F310 AromaticContact CZ2-CZ 3.65Å; W293-F310 HydrophobicContact CZ2-CZ 3.65Å
294	L	32.4	Very low	31.1	Very low	146 Å²	146	110.4 Å²	110.4	76%	0.764	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	3	-177.3	-74.3	163.7	0	0	0	114.3	Q290	Q290-L294 HydrophobicContact CG-CD1 4.42Å; Q290-L294 PolarHBondContact O-N 2.99Å
295	G	30.6	Very low	30.4	Very low	69 Å²	69	107.6 Å²	107.6	71%	0.711	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	7.1	-174.1	0	0	0	0	0	116.5	W293	W293-G295 PolarHBondContact O-N 3.47Å
296	A	29.1	Very low	29.6	Very low	73 Å²	73	113.8 Å²	113.8	60%	0.603	64%	0.637	S	S	*	*			trans	-125.9	70.5	-166.9	0	0	0	0	0	114.1	H298	A296-H298 PolarHBondContact O-N 3.37Å
297	D	25.8	Very low	29	Very low	165 Å²	165	117 Å²	117	88%	0.882	66%	0.657	S	S	*	*			trans	-66.3	26.5	179.5	-94.1	-37.5	0	0	0	115.7
298	H	27.1	Very low	28.3	Very low	165 Å²	165	116.5 Å²	116.5	76%	0.764	66%	0.658	S	S	*	*			trans	-125.2	62.6	-170.5	-68.6	-8.2	0	0	0	112.9	A296 S300	A296-H298 PolarHBondContact O-N 3.37Å; H298-S300 VanDerWaalsContact C-N 3.27Å; H298-S300 PolarHBondContact O-N 3.14Å
299	C	23.8	Very low	27.9	Very low	140 Å²	140	119.6 Å²	119.6	95%	0.946	68%	0.675	S	S	*	*			trans	-70.8	72.8	169.7	-82.4	0	0	0	0	112.9
300	S	25	Very low	27.3	Very low	103 Å²	103	122.8 Å²	122.8	72%	0.72	69%	0.689	S	S	*	*			trans	-108.9	74.7	-178.8	55.6	0	0	0	0	113.7	H298 A302	H298-S300 VanDerWaalsContact C-N 3.27Å; H298-S300 PolarHBondContact O-N 3.14Å; S300-A302 PolarHBondContact O-N 3.04Å
301	K	24.1	Very low	26.9	Very low	204 Å²	204	126.5 Å²	126.5	89%	0.887	71%	0.706	S	S	*	*			trans	29.2	69.9	159.4	-66.2	-177.2	176.9	178.1	0	116.6
302	A	26.1	Very low	26.5	Very low	83 Å²	83	122.4 Å²	122.4	69%	0.686	70%	0.697	S	S	*	*			trans	-60.9	144	161.2	0	0	0	0	0	110.3	S300	S300-A302 PolarHBondContact O-N 3.04Å
303	K	24.4	Very low	25.9	Very low	195 Å²	195	121.3 Å²	121.3	85%	0.848	70%	0.696	S	S	*	*			trans	-88.5	156.6	176.1	-68.7	179.5	-179.9	176	0	110.1	G305	K303-G305 PolarHBondContact O-N 3.35Å
304	S	23.9	Very low	25.4	Very low	130 Å²	130	120.8 Å²	120.8	91%	0.909	70%	0.702	S	S	*	*	S	Bend	trans	-60	113.1	176.5	52.9	0	0	0	0	112
305	G	22.8	Very low	25	Very low	50 Å²	50	121 Å²	121	52%	0.515	70%	0.703	S	S	.	*	S	Bend	trans	156.6	140.3	176.6	0	0	0	0	0	111.3	K303	K303-G305 PolarHBondContact O-N 3.35Å
306	D	23.4	Very low	24.7	Very low	162 Å²	162	124.8 Å²	124.8	87%	0.866	71%	0.707	S	S	*	*			trans	57.4	63.6	152.4	-43.4	-27	0	0	0	118
307	V	24.9	Very low	24.5	Very low	84 Å²	84	124.8 Å²	124.8	51%	0.509	71%	0.714	S	S	.	*			trans	-137.2	111.1	160.7	-174	0	0	0	0	108.7	G243	G243-V307 WeakPolarHBondContact O-CG1 3.43Å
308	D	23.4	Very low	24.4	Very low	73 Å²	73	125.4 Å²	125.4	39%	0.39	71%	0.712	S	S	.	*			trans	-138.9	16.8	-165.7	-90.1	-79.1	0	0	0	115.4	K246 R424	K246-D308 WeakPolarHBondContact CD-OD1 3.22Å; K246-D308 IonicContact NZ-OD1 2.77Å; K246-D308 PolarHBondContact NZ-OD1 3.05Å; K246-D308 IonicContact NZ-OD2 2.65Å; K246-D308 PolarHBondContact NZ-OD2 3.11Å; D308-R424 PolarHBondContact O-NH1 3.5Å
309	S	25.5	Very low	24.3	Very low	96 Å²	96	123 Å²	123	67%	0.671	71%	0.714	S	S	*	*			trans	-154.6	158.4	173.1	60	0	0	0	0	113.7
310	F	25.1	Very low	24.4	Very low	115 Å²	115	123.1 Å²	123.1	50%	0.504	71%	0.71	S	S	.	*			trans	-124.2	141.8	174.7	-123.1	-107.1	0	0	0	109.5	L244 W293	L244-F310 HydrophobicContact CD1-CE2 4.27Å; L244-F310 HydrophobicContact CD2-CD2 3.85Å; L244-F310 HydrophobicContact CD2-CE2 3.55Å; L244-F310 HydrophobicContact CD2-CZ 4.44Å; L244-F310 HydrophobicContact CG-CE2 4.14Å; W293-F310 AromaticContact CH2-CZ 3.79Å; W293-F310 HydrophobicContact CH2-CZ 3.79Å; W293-F310 HydrophobicContact CZ2-CE1 4.08Å; W293-F310 AromaticContact CZ2-CZ 3.65Å; W293-F310 HydrophobicContact CZ2-CZ 3.65Å
311	E	24.3	Very low	24.3	Very low	153 Å²	153	127.9 Å²	127.9	72%	0.715	72%	0.721	S	S	*	*			trans	-94.3	142.9	170.7	-67.7	-172.4	128.4	0	0	110.7
312	C	24.2	Very low	24.3	Very low	79 Å²	79	121.7 Å²	121.7	53%	0.534	72%	0.715	S	S	.	*			trans	-128.4	106.8	171.2	-87.9	0	0	0	0	109.9	F285	F285-C312 HydrophobicContact CE2-CB 4.43Å
313	L	24	Very low	24	Very low	129 Å²	129	129.5 Å²	129.5	68%	0.675	73%	0.727	S	S	*	*			trans	-90.8	103.4	175.1	-71.3	172.5	0	0	0	110	L315	L313-L315 PolarHBondContact O-N 2.85Å; L313-L315 VanDerWaalsContact O-N 3.1Å
314	L	24.1	Very low	23.9	Very low	123 Å²	123	127.3 Å²	127.3	64%	0.644	73%	0.729	S	S	*	*			trans	-71.2	99.3	167.4	-84.7	163.8	0	0	0	109.4	I223 F285	I223-L314 HydrophobicContact CD1-CD2 4.38Å; F285-L314 HydrophobicContact CD2-CD2 4.42Å
315	L	23.8	Very low	23.8	Very low	150 Å²	150	124.6 Å²	124.6	79%	0.785	72%	0.715	S	S	*	*			trans	-71.4	127.4	177.3	-71.5	173	0	0	0	110.9	L313 G317	L313-L315 PolarHBondContact O-N 2.85Å; L313-L315 VanDerWaalsContact O-N 3.1Å; L315-G317 PolarHBondContact O-N 3.04Å
316	N	24.4	Very low	23.7	Very low	149 Å²	149	129.7 Å²	129.7	80%	0.797	73%	0.73	S	S	*	*			trans	-75.7	92.8	-173.5	-165.7	19.6	0	0	0	110.9	Q318	N316-Q318 PolarHBondContact O-N 2.76Å
317	G	23.6	Very low	23.7	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	72%	0.72	S	S	*	*			trans	-72.2	78.4	-173.9	0	0	0	0	0	114.1	L315	L315-G317 PolarHBondContact O-N 3.04Å
318	Q	25.4	Very low	23.4	Very low	178 Å²	178	131.8 Å²	131.8	83%	0.832	74%	0.736	S	S	*	*			trans	-62.6	138	168.9	-82	-166.5	-21.3	0	0	111.5	N316	N316-Q318 PolarHBondContact O-N 2.76Å
319	S	24.2	Very low	23.3	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	75%	0.751	S	S	*	*			trans	-72.1	140	-179.4	50.6	0	0	0	0	112.3
320	T	26.7	Very low	23	Very low	143 Å²	143	133.8 Å²	133.8	88%	0.877	75%	0.75	S	S	*	*			trans	-157.3	138.9	144.4	3.7	0	0	0	0	109.5	G322	T320-G322 PolarHBondContact O-N 2.85Å
321	Q	23	Very low	22.8	Very low	203 Å²	203	133.7 Å²	133.7	95%	0.949	76%	0.759	S	S	*	*			trans	-75.2	119.1	175.2	-67	173.5	-14.5	0	0	109.1
322	G	23.9	Very low	22.7	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	77%	0.767	S	S	*	*			trans	-161.5	97.2	-179.3	0	0	0	0	0	113.4	T320	T320-G322 PolarHBondContact O-N 2.85Å
323	R	20.1	Very low	22.6	Very low	246 Å²	246	138.6 Å²	138.6	93%	0.928	77%	0.772	S	S	*	*			trans	-78.5	135.4	153	-68.7	-176.5	179.7	-171.8	0.4	107.9
324	V	22.2	Very low	22.6	Very low	149 Å²	149	142.5 Å²	142.5	90%	0.903	78%	0.779	S	S	*	*			trans	177.9	159.2	132	146.4	0	0	0	0	108.7
325	A	20.5	Very low	22.9	Very low	73 Å²	73	141.4 Å²	141.4	60%	0.603	78%	0.779	S	S	*	*			trans	-80.4	160.3	-166.6	0	0	0	0	0	115.7
326	D	21.4	Very low	23	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	79%	0.786	S	S	*	*			trans	68.5	151.6	150.2	-65.1	-30.4	0	0	0	120.8
327	P	23	Very low	23	Very low	101 Å²	101	138.9 Å²	138.9	66%	0.656	78%	0.782	S	S	*	*			trans	-95.8	167.1	-168.1	37.9	-35.8	0	0	0	113.9
328	F	19.8	Very low	23.1	Very low	189 Å²	189	141.8 Å²	141.8	83%	0.829	79%	0.787	S	S	*	*				166.4	114.3	128.1	-104.1	-92.5	0	0	0	113
329	V	19.7	Very low	23	Very low	118 Å²	118	140 Å²	140	72%	0.715	79%	0.789	S	S	*	*				55.9	123.1	127.8	176.7	0	0	0	0	122.6
330	S	20	Very low	22.9	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	79%	0.792	S	S	*	*			trans	113.4	109.2	132.6	67.7	0	0	0	0	125.3
331	T	21.3	Very low	22.7	Very low	113 Å²	113	141 Å²	141	69%	0.693	78%	0.784	S	S	*	*				79.6	157.7	124.7	57.7	0	0	0	0	124.8
332	W	21.5	Very low	22.6	Very low	232 Å²	232	139.8 Å²	139.8	88%	0.879	78%	0.783	S	S	*	*			trans	82.1	137.9	167.2	-53.8	86.6	0	0	0	118.8
333	T	22.8	Very low	22.5	Very low	104 Å²	104	144.7 Å²	144.7	64%	0.638	79%	0.786	S	S	*	*			cis	-173.8	132.5	-41.8	19.7	0	0	0	0	113.7
334	Y	23.1	Very low	22.6	Very low	211 Å²	211	142.9 Å²	142.9	83%	0.827	79%	0.785	S	S	*	*			trans	75.3	165.6	142.7	-90.5	-42.7	0	0	0	123.4
335	P	31.1	Very low	22.6	Very low	99 Å²	99	142 Å²	142	64%	0.643	78%	0.78	S	S	*	*				-136	-171.3	-124.6	48.9	-32.7	0	0	0	117.6
336	L	25.7	Very low	22.6	Very low	177 Å²	177	142 Å²	142	93%	0.927	78%	0.775	S	S	*	*			trans	-178.4	161.2	132	-95.9	159.8	0	0	0	113.1
337	G	23.7	Very low	22.6	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	78%	0.779	S	S	*	*			trans	-90.7	-159.4	-170.5	0	0	0	0	0	117
338	P	26.6	Very low	22.6	Very low	135 Å²	135	146.9 Å²	146.9	88%	0.877	78%	0.778	S	S	*	*			cis	-139.1	-163.5	33.3	43.3	-23.5	0	0	0	117
339	T	22	Very low	22.7	Very low	140 Å²	140	143 Å²	143	86%	0.859	78%	0.781	S	S	*	*			trans	-103.1	159	-166.6	46.1	0	0	0	0	117
340	I	22.4	Very low	23	Very low	167 Å²	167	141.2 Å²	141.2	86%	0.856	76%	0.764	S	S	*	*			trans	-140.9	149.7	179.3	-70.3	-175.1	0	0	0	109.6
341	P	22	Very low	23.2	Very low	110 Å²	110	139.1 Å²	139.1	71%	0.714	75%	0.749	S	S	*	*			trans	-98.4	164.9	-154	37.7	-37.2	0	0	0	118.2
342	L	21.8	Very low	23.5	Very low	178 Å²	178	138.5 Å²	138.5	93%	0.932	75%	0.745	S	S	*	*			trans	-65.9	140.9	177.5	-74.2	143.9	0	0	0	114.1
343	H	22.7	Very low	23.7	Very low	177 Å²	177	135.4 Å²	135.4	82%	0.819	74%	0.738	S	S	*	*			trans	-106.3	157.1	173	-97	-117	0	0	0	113
344	K	20.8	Very low	24.1	Very low	208 Å²	208	134.2 Å²	134.2	90%	0.904	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-78	131	-172.7	-62.9	174.3	-179.4	174.4	0	112.1
345	V	22.3	Very low	24.4	Very low	132 Å²	132	129.6 Å²	129.6	80%	0.8	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-77.4	129.5	170.9	-177.1	0	0	0	0	110.5
346	S	21.5	Very low	24.2	Very low	71 Å²	71	129.6 Å²	129.6	50%	0.497	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-74.3	133.7	173.2	37.1	0	0	0	0	111.1
347	K	21.1	Very low	24.3	Very low	212 Å²	212	124.5 Å²	124.5	92%	0.922	68%	0.683	S	S	*	*			trans	-91.2	108.8	175.3	-77.6	-173.9	175.1	-178.9	0	110.5
348	F	22.4	Very low	24.4	Very low	149 Å²	149	124.5 Å²	124.5	65%	0.654	68%	0.683	S	S	*	*			trans	-103.6	142.3	160.9	-67.9	-81.1	0	0	0	110	E411	F348-E411 VanDerWaalsContact CE2-OE1 3.3Å; F348-E411 WeakPolarHBondContact CE2-OE1 3.34Å
349	A	22.2	Very low	24.5	Very low	108 Å²	108	125.7 Å²	125.7	89%	0.893	67%	0.674	S	S	*	*			trans	-133.5	117.1	171.7	0	0	0	0	0	107.4
350	F	26.1	Very low	24.7	Very low	81 Å²	81	121.5 Å²	121.5	36%	0.355	65%	0.651	S	S	.	*			trans	-115.8	147	174.4	51.2	-98.6	0	0	0	109.7	W355 I414 F495	F350-W355 HydrophobicContact CD2-CE3 4.05Å; F350-W355 HydrophobicContact CD2-CZ3 4.49Å; F350-W355 AromaticContact CE2-CE3 3.57Å; F350-W355 HydrophobicContact CE2-CE3 3.57Å; F350-W355 AromaticContact CE2-CZ3 3.61Å; F350-W355 HydrophobicContact CE2-CZ3 3.61Å; F350-W355 HydrophobicContact CZ-CE3 4.27Å; F350-W355 AromaticContact CZ-CZ3 3.91Å; F350-W355 HydrophobicContact CZ-CZ3 3.91Å; F350-I414 HydrophobicContact CE1-CD1 4.3Å; F350-I414 HydrophobicContact CZ-CD1 4.4Å; F350-F495 HydrophobicContact CE2-CE1 4.49Å; F350-F495 HydrophobicContact CZ-CE1 4.17Å
351	S	23.9	Very low	24.7	Very low	48 Å²	48	119.8 Å²	119.8	34%	0.336	65%	0.65	S	S	.	*			trans	-77.9	125.4	172.6	159.3	0	0	0	0	108.5	K353 D354 W355	S351-K353 PolarHBondContact O-N 3.43Å; S351-K353 VanDerWaalsContact OG-CB 3.23Å; S351-K353 WeakPolarHBondContact OG-CB 3.37Å; S351-K353 PolarHBondContact OG-N 3.37Å; S351-D354 WeakPolarHBondContact CB-OD1 3.07Å; S351-D354 WeakPolarHBondContact CB-OD2 3.41Å; S351-D354 WeakPolarHBondContact O-CB 3.26Å; S351-D354 PolarHBondContact O-N 2.94Å; S351-D354 PolarHBondContact OG-N 3.27Å; S351-D354 PolarHBondContact OG-OD1 2.88Å; S351-W355 PolarHBondContact O-N 2.87Å
352	V	27	Very low	24.8	Very low	101 Å²	101	121.9 Å²	121.9	61%	0.612	65%	0.652	S	S	*	*	H	α-helix	trans	-56.2	-31.8	170.6	178.5	0	0	0	0	110.3	D354 W355 V356	V352-D354 VanDerWaalsContact C-N 3.25Å; V352-D354 PolarHBondContact O-N 2.73Å; V352-W355 PolarHBondContact O-N 2.95Å; V352-V356 HydrophobicContact CG1-CG2 4.15Å; V352-V356 WeakPolarHBondContact O-CG2 3.39Å; V352-V356 PolarHBondContact O-N 2.66Å
353	K	26.7	Very low	24.9	Very low	167 Å²	167	117.8 Å²	117.8	73%	0.726	64%	0.636	S	S	*	*	H	α-helix	trans	-63.9	-26.1	174.4	-128.1	176.2	-174.5	178.3	0	113.4	S351 T357	S351-K353 PolarHBondContact O-N 3.43Å; S351-K353 VanDerWaalsContact OG-CB 3.23Å; S351-K353 WeakPolarHBondContact OG-CB 3.37Å; S351-K353 PolarHBondContact OG-N 3.37Å; K353-T357 WeakPolarHBondContact O-CB 3.39Å; K353-T357 VanDerWaalsContact O-CG2 3.24Å; K353-T357 WeakPolarHBondContact O-CG2 3.44Å; K353-T357 PolarHBondContact O-N 2.69Å; K353-T357 PolarHBondContact O-OG1 2.97Å
354	D	30	Very low	25	Very low	79 Å²	79	115.7 Å²	115.7	42%	0.422	64%	0.636	S	S	.	*	H	α-helix	trans	-87.5	-28	-179.2	-58.6	4.4	0	0	0	111.2	S351 V352 K359 C360	S351-D354 WeakPolarHBondContact CB-OD1 3.07Å; S351-D354 WeakPolarHBondContact CB-OD2 3.41Å; S351-D354 WeakPolarHBondContact O-CB 3.26Å; S351-D354 PolarHBondContact O-N 2.94Å; S351-D354 PolarHBondContact OG-N 3.27Å; S351-D354 PolarHBondContact OG-OD1 2.88Å; V352-D354 VanDerWaalsContact C-N 3.25Å; V352-D354 PolarHBondContact O-N 2.73Å; D354-K359 PolarHBondContact O-N 3.47Å; D354-C360 PolarHBondContact O-N 3.49Å; D354-C360 VanDerWaalsContact O-N 3.17Å
355	W	29.5	Very low	25.1	Very low	114 Å²	114	114.2 Å²	114.2	43%	0.432	63%	0.626	S	S	.	*	H	α-helix	trans	-70.7	-54.8	170.2	-170.1	-18.4	0	0	0	110.4	F350 S351 V352 T357 G358 I414 F420	F350-W355 HydrophobicContact CD2-CE3 4.05Å; F350-W355 HydrophobicContact CD2-CZ3 4.49Å; F350-W355 AromaticContact CE2-CE3 3.57Å; F350-W355 HydrophobicContact CE2-CE3 3.57Å; F350-W355 AromaticContact CE2-CZ3 3.61Å; F350-W355 HydrophobicContact CE2-CZ3 3.61Å; F350-W355 HydrophobicContact CZ-CE3 4.27Å; F350-W355 AromaticContact CZ-CZ3 3.91Å; F350-W355 HydrophobicContact CZ-CZ3 3.91Å; S351-W355 PolarHBondContact O-N 2.87Å; V352-W355 PolarHBondContact O-N 2.95Å; W355-T357 PolarHBondContact O-N 2.92Å; W355-G358 PolarHBondContact O-N 3.47Å; W355-I414 HydrophobicContact CH2-CG2 3.6Å; W355-I414 HydrophobicContact CZ2-CG2 3.83Å; W355-I414 HydrophobicContact CZ3-CG2 4.48Å; W355-F420 AromaticContact CH2-CE2 3.74Å; W355-F420 HydrophobicContact CH2-CE2 3.74Å; W355-F420 AromaticContact CH2-CZ 3.94Å; W355-F420 HydrophobicContact CH2-CZ 3.94Å
356	V	27.2	Very low	25.1	Very low	99 Å²	99	112.7 Å²	112.7	60%	0.6	62%	0.621	S	S	*	*	H	α-helix	trans	-63.3	-26.2	-179.1	175.9	0	0	0	0	112.5	V352	V352-V356 HydrophobicContact CG1-CG2 4.15Å; V352-V356 WeakPolarHBondContact O-CG2 3.39Å; V352-V356 PolarHBondContact O-N 2.66Å
357	T	27.6	Very low	25.3	Very low	69 Å²	69	114.4 Å²	114.4	42%	0.423	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.2	9.8	174.4	60.4	0	0	0	0	114.7	K353 W355 K359	K353-T357 WeakPolarHBondContact O-CB 3.39Å; K353-T357 VanDerWaalsContact O-CG2 3.24Å; K353-T357 WeakPolarHBondContact O-CG2 3.44Å; K353-T357 PolarHBondContact O-N 2.69Å; K353-T357 PolarHBondContact O-OG1 2.97Å; W355-T357 PolarHBondContact O-N 2.92Å; T357-K359 PolarHBondContact O-N 3.2Å
358	G	27.5	Very low	25.6	Very low	69 Å²	69	111.2 Å²	111.2	71%	0.711	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.2	18.9	177.6	0	0	0	0	0	114.8	W355	W355-G358 PolarHBondContact O-N 3.47Å
359	K	27.9	Very low	25.7	Very low	160 Å²	160	112 Å²	112	70%	0.696	64%	0.638	S	S	*	*			trans	-95.5	-5.7	-175	-74.3	169.6	-168.9	161.8	0	113.7	D354 T357	D354-K359 PolarHBondContact O-N 3.47Å; T357-K359 PolarHBondContact O-N 3.2Å
360	C	25.7	Very low	25.9	Very low	53 Å²	53	110 Å²	110	36%	0.358	63%	0.627	S	S	.	*	S	Bend	trans	-56.9	137.1	166	-80.7	0	0	0	0	111	D354 M362	D354-C360 PolarHBondContact O-N 3.49Å; D354-C360 VanDerWaalsContact O-N 3.17Å; C360-M362 PolarHBondContact O-N 3.46Å
361	P	24	Very low	25.9	Very low	130 Å²	130	112.4 Å²	112.4	84%	0.844	65%	0.648	S	S	*	*			trans	-76	86.4	-177.7	31.4	-35.3	0	0	0	111
362	M	23.9	Very low	26	Very low	155 Å²	155	121 Å²	121	76%	0.764	67%	0.673	S	S	*	*			trans	-53.9	133.9	167.4	-105.4	-174.6	72.5	0	0	110.2	C360 T364	C360-M362 PolarHBondContact O-N 3.46Å; M362-T364 PolarHBondContact O-N 2.88Å
363	P	24	Very low	25.9	Very low	91 Å²	91	121.8 Å²	121.8	59%	0.591	68%	0.684	S	S	*	*			trans	-69.6	101.3	171.1	28.8	-32.5	0	0	0	109	Y365	P363-Y365 HydrophobicContact CB-CD2 4.25Å; P363-Y365 HydrophobicContact CB-CE2 4.03Å; P363-Y365 HydrophobicContact CG-CE2 4.26Å; P363-Y365 WeakPolarHBondContact O-CD2 3.48Å; P363-Y365 PolarHBondContact O-N 2.85Å
364	T	22.9	Very low	25.9	Very low	134 Å²	134	118.1 Å²	118.1	82%	0.822	68%	0.684	S	S	*	*			trans	-70.2	89.7	176	52.8	0	0	0	0	110	M362 S366	M362-T364 PolarHBondContact O-N 2.88Å; T364-S366 PolarHBondContact O-N 3.48Å
365	Y	23.8	Very low	25.7	Very low	177 Å²	177	118.4 Å²	118.4	69%	0.694	70%	0.698	S	S	*	*			trans	-68.3	110	169.8	-83.4	-94.4	0	0	0	109.6	P363 S367	P363-Y365 HydrophobicContact CB-CD2 4.25Å; P363-Y365 HydrophobicContact CB-CE2 4.03Å; P363-Y365 HydrophobicContact CG-CE2 4.26Å; P363-Y365 WeakPolarHBondContact O-CD2 3.48Å; P363-Y365 PolarHBondContact O-N 2.85Å; Y365-S367 PolarHBondContact O-N 3.11Å
366	S	23.2	Very low	25.5	Very low	99 Å²	99	121.6 Å²	121.6	69%	0.692	72%	0.721	S	S	*	*			trans	-77.1	107	175.3	55.4	0	0	0	0	110.2	T364 N368	T364-S366 PolarHBondContact O-N 3.48Å; S366-N368 PolarHBondContact O-N 2.84Å
367	S	24	Very low	25.4	Very low	107 Å²	107	120.2 Å²	120.2	75%	0.748	73%	0.727	S	S	*	*			trans	-58.1	117.5	168.4	177.9	0	0	0	0	110.3	Y365	Y365-S367 PolarHBondContact O-N 3.11Å
368	N	27.9	Very low	25.4	Very low	145 Å²	145	124.6 Å²	124.6	78%	0.775	75%	0.748	S	S	*	*			trans	-129.7	93.8	177.5	-101.2	-11.5	0	0	0	109.4	S366 G370	S366-N368 PolarHBondContact O-N 2.84Å; N368-G370 PolarHBondContact O-N 3.31Å
369	N	26	Very low	25.6	Very low	167 Å²	167	126.2 Å²	126.2	89%	0.893	75%	0.745	S	S	*	*			trans	-62.3	119.5	167.4	-76.6	-40.8	0	0	0	109.8
370	G	25	Very low	25.5	Very low	66 Å²	66	126 Å²	126	68%	0.68	75%	0.751	S	S	*	*			trans	-165.9	62.3	-166.4	0	0	0	0	0	119.9	N368	N368-G370 PolarHBondContact O-N 3.31Å
371	V	27.3	Very low	25.4	Very low	131 Å²	131	130.6 Å²	130.6	79%	0.794	77%	0.771	S	S	*	*			trans	63.9	99.9	141.4	-174.3	0	0	0	0	120.3
372	R	24.7	Very low	25.5	Very low	227 Å²	227	130.2 Å²	130.2	86%	0.857	76%	0.759	S	S	*	*			trans	62.6	130.5	133	-65.6	-178.5	172.9	178.6	-3.4	123.8
373	S	25.8	Very low	25.5	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	76%	0.757	S	S	*	*			trans	70.6	148.6	137.6	-62.8	0	0	0	0	119.4
374	A	25.4	Very low	25.5	Very low	90 Å²	90	134.9 Å²	134.9	74%	0.744	77%	0.768	S	S	*	*			cis	-156.5	133.4	-11.4	0	0	0	0	0	107.4
375	A	26.1	Very low	25.5	Very low	85 Å²	85	134.9 Å²	134.9	70%	0.702	76%	0.758	S	S	*	*				84.9	130.1	86.7	0	0	0	0	0	116
376	I	26.4	Very low	25.5	Very low	181 Å²	181	135 Å²	135	93%	0.928	76%	0.758	S	S	*	*			trans	67.3	141.3	172.6	-51.7	154.9	0	0	0	112.9
377	G	25.3	Very low	25.5	Very low	69 Å²	69	140.1 Å²	140.1	71%	0.711	76%	0.763	S	S	*	*			cis	158.2	162.1	8.5	0	0	0	0	0	105.3
378	D	26.1	Very low	25.5	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	76%	0.755	S	S	*	*			cis	-150.1	170.8	3.8	-153.3	35.3	0	0	0	106.7
379	P	32.2	Very low	25.3	Very low	102 Å²	102	136.6 Å²	136.6	66%	0.662	76%	0.757	S	S	*	*			trans	-91	-174.7	-165.2	37.7	-36.9	0	0	0	115.4
380	L	24.8	Very low	25.2	Very low	155 Å²	155	137.4 Å²	137.4	81%	0.812	75%	0.749	S	S	*	*			trans	93.8	134.1	174.4	-57.2	165.3	0	0	0	116.4
381	L	25.1	Very low	25.2	Very low	150 Å²	150	143.1 Å²	143.1	79%	0.785	75%	0.752	S	S	*	*			trans	68.5	148.2	170.5	-49.3	168.3	0	0	0	113.8
382	Q	25.2	Very low	25.1	Very low	123 Å²	123	143.2 Å²	143.2	58%	0.575	74%	0.744	S	S	*	*			cis	-160.8	147.5	-3.3	-130.2	174.9	70.8	0	0	108.6
383	K	25.2	Very low	25	Very low	167 Å²	167	140.4 Å²	140.4	73%	0.726	74%	0.737	S	S	*	*			trans	57.6	112.9	161.3	-60.5	151.5	178.4	162.4	0	115.6
384	Q	23.3	Very low	25	Very low	176 Å²	176	139.3 Å²	139.3	82%	0.822	74%	0.736	S	S	*	*				54	125.2	70.3	-157.1	-176.1	0.7	0	0	114.3
385	E	23.5	Very low	24.9	Very low	134 Å²	134	143 Å²	143	63%	0.626	74%	0.739	S	S	*	*			trans	82.4	146.9	173.5	-50.9	-157.1	154	0	0	120.4
386	R	23.5	Very low	24.8	Very low	179 Å²	179	146.8 Å²	146.8	68%	0.675	74%	0.743	S	S	*	*			trans	86.9	113.1	147.1	-77.8	162.6	-148.2	-118.6	-1.3	122.5
387	Y	23.4	Very low	24.8	Very low	207 Å²	207	148.3 Å²	148.3	81%	0.812	74%	0.743	S	S	*	*			trans	66.5	155.6	148.9	-49	-54	0	0	0	118.5
388	G	22.5	Very low	24.7	Very low	56 Å²	56	148.4 Å²	148.4	58%	0.577	74%	0.743	S	S	*	*			cis	140.5	120	-10.9	0	0	0	0	0	114.4
389	C	24.2	Very low	24.6	Very low	122 Å²	122	150.6 Å²	150.6	82%	0.824	75%	0.745	S	S	*	*			trans	67.2	146.3	176.4	-59.8	0	0	0	0	115.6
390	Y	24.2	Very low	24.2	Very low	185 Å²	185	156.9 Å²	156.9	73%	0.725	76%	0.756	S	S	*	*				-172.6	161	82.1	-99.9	-69.1	0	0	0	114.8
391	Y	24.9	Very low	24.1	Very low	185 Å²	185	161.6 Å²	161.6	73%	0.725	76%	0.763	S	S	*	*			trans	42.3	131.3	163.8	-59.1	-63.4	0	0	0	120.8
392	E	24.2	Very low	24	Very low	134 Å²	134	163 Å²	163	63%	0.626	77%	0.765	S	S	*	*			cis	102.6	137.8	12.1	-147.8	-141.9	-173.4	0	0	116.9
393	K	23.5	Very low	23.9	Very low	167 Å²	167	161.4 Å²	161.4	73%	0.726	77%	0.773	S	S	*	*			trans	64.9	97.9	165	-75.2	169.8	-174	124.5	0	121.8
394	A	25.7	Very low	23.9	Very low	97 Å²	97	163 Å²	163	80%	0.802	78%	0.78	S	S	*	*			trans	-161.9	105.7	132.8	0	0	0	0	0	108.6
395	M	23.7	Very low	24	Very low	166 Å²	166	159.7 Å²	159.7	82%	0.818	77%	0.771	S	S	*	*				84.6	118	82.5	-85.1	-67.8	-174.5	0	0	115.9
396	Q	24.7	Very low	24	Very low	166 Å²	166	164.4 Å²	164.4	78%	0.776	78%	0.783	S	S	*	*			trans	73.2	111.3	150.2	-56.4	-176.7	22.1	0	0	122
397	K	25.5	Very low	24.2	Very low	213 Å²	213	160 Å²	160	93%	0.926	77%	0.773	S	S	*	*			trans	44.3	85.2	133.5	-61.3	-176	178.3	179.5	0	119.1
398	G	23.2	Very low	24.5	Very low	70 Å²	70	153.9 Å²	153.9	72%	0.722	75%	0.754	S	S	*	*			trans	136.8	130.2	134.3	0	0	0	0	0	118
399	K	24.4	Very low	24.9	Very low	208 Å²	208	155.2 Å²	155.2	90%	0.904	75%	0.753	S	S	*	*	S	Bend	trans	67.5	156.5	166.6	-55.8	179.3	-179.8	179.4	0	116
400	R	23.2	Very low	25.1	Very low	234 Å²	234	153.8 Å²	153.8	88%	0.883	74%	0.737	S	S	*	*			trans	51	97.8	175.8	-69.5	-177.7	169.8	169.6	-3.9	117.2	Q402	R400-Q402 PolarHBondContact O-N 2.92Å; R400-Q402 VanDerWaalsContact O-N 3.09Å
401	R	23.3	Very low	25.3	Very low	255 Å²	255	147.4 Å²	147.4	96%	0.962	71%	0.714	S	S	*	*			trans	-70.9	91.7	156.6	-75.5	-177.7	172.9	-179	-2.3	109.8	A403	R401-A403 PolarHBondContact O-N 3.02Å
402	Q	23	Very low	25.7	Very low	180 Å²	180	142.6 Å²	142.6	84%	0.841	70%	0.7	S	S	*	*			trans	-77.7	99.5	159.3	-81.6	-174.8	-25.9	0	0	108.7	R400 K404	R400-Q402 PolarHBondContact O-N 2.92Å; R400-Q402 VanDerWaalsContact O-N 3.09Å; Q402-K404 PolarHBondContact O-N 3.31Å; Q402-K404 VanDerWaalsContact O-N 3.13Å
403	A	23.5	Very low	26	Very low	88 Å²	88	139.9 Å²	139.9	73%	0.727	69%	0.694	S	S	*	*			trans	-72.8	99.7	168	0	0	0	0	0	108.2	R401 V405	R401-A403 PolarHBondContact O-N 3.02Å; A403-V405 PolarHBondContact O-N 3.5Å
404	K	23.5	Very low	26.5	Very low	202 Å²	202	135.6 Å²	135.6	88%	0.878	68%	0.678	S	S	*	*			trans	-74.6	81.6	176.1	-166.3	172.2	-172.7	174.5	0	109.2	Q402 R406	Q402-K404 PolarHBondContact O-N 3.31Å; Q402-K404 VanDerWaalsContact O-N 3.13Å; K404-R406 PolarHBondContact O-N 3.33Å; K404-R406 VanDerWaalsContact O-N 3.16Å
405	V	25.6	Very low	27	Very low	106 Å²	106	134.1 Å²	134.1	64%	0.642	66%	0.659	S	S	*	*			trans	-57.1	117.2	176	-179.6	0	0	0	0	108.2	A403 L407	A403-V405 PolarHBondContact O-N 3.5Å; V405-L407 PolarHBondContact O-N 2.86Å
406	R	24	Very low	27.3	Very low	232 Å²	232	133.5 Å²	133.5	88%	0.875	67%	0.665	S	S	*	*			trans	-79.9	106.7	158.4	-78.4	-177.6	164.6	118.2	-5.2	105.5	K404 D408	K404-R406 PolarHBondContact O-N 3.33Å; K404-R406 VanDerWaalsContact O-N 3.16Å; R406-D408 PolarHBondContact O-N 3.18Å
407	L	27.2	Very low	27.6	Very low	88 Å²	88	128 Å²	128	46%	0.461	65%	0.648	S	S	.	*			trans	-59	123.7	163.4	-78.8	159.2	0	0	0	107.5	V405 E411	V405-L407 PolarHBondContact O-N 2.86Å; L407-E411 WeakPolarHBondContact CA-OE2 3.36Å; L407-E411 HydrophobicContact CD2-CB 4.14Å
408	D	29.9	Very low	28	Very low	77 Å²	77	118.3 Å²	118.3	41%	0.412	61%	0.606	S	S	.	*			trans	-65.1	140.6	163.4	-167.3	-67	0	0	0	107.9	R406 N410 E411	R406-D408 PolarHBondContact O-N 3.18Å; D408-N410 PolarHBondContact O-N 3.3Å; D408-N410 WeakPolarHBondContact OD1-CB 3.38Å; D408-N410 PolarHBondContact OD1-N 2.97Å; D408-N410 PolarHBondContact OD1-ND2 3.46Å; D408-E411 HydrophobicContact CB-CB 4.28Å; D408-E411 HydrophobicContact CB-CG 3.84Å; D408-E411 PolarHBondContact N-OE2 3.37Å; D408-E411 WeakPolarHBondContact O-CB 3.36Å; D408-E411 PolarHBondContact O-N 2.87Å
409	P	30.5	Very low	28.6	Very low	85 Å²	85	120 Å²	120	55%	0.552	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-0.6	174.5	27.2	-36.4	0	0	0	114.4	P481	P409-P481 HydrophobicContact CB-CG 3.96Å
410	N	28.3	Very low	29	Very low	91 Å²	91	113.1 Å²	113.1	49%	0.487	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.6	-2	169	-54.2	-91.1	0	0	0	113.7	D408 R489	D408-N410 PolarHBondContact O-N 3.3Å; D408-N410 WeakPolarHBondContact OD1-CB 3.38Å; D408-N410 PolarHBondContact OD1-N 2.97Å; D408-N410 PolarHBondContact OD1-ND2 3.46Å; N410-R489 PolarHBondContact OD1-NH1 3.17Å
411	E	29.2	Very low	29.5	Very low	52 Å²	52	106.1 Å²	106.1	24%	0.243	55%	0.545	C	S	.	.			trans	-89.1	103.8	174.5	-77.9	168.6	168.9	0	0	110.2	F348 L407 D408	F348-E411 VanDerWaalsContact CE2-OE1 3.3Å; F348-E411 WeakPolarHBondContact CE2-OE1 3.34Å; L407-E411 WeakPolarHBondContact CA-OE2 3.36Å; L407-E411 HydrophobicContact CD2-CB 4.14Å; D408-E411 HydrophobicContact CB-CB 4.28Å; D408-E411 HydrophobicContact CB-CG 3.84Å; D408-E411 PolarHBondContact N-OE2 3.37Å; D408-E411 WeakPolarHBondContact O-CB 3.36Å; D408-E411 PolarHBondContact O-N 2.87Å
412	I	33.3	Very low	29.7	Very low	84 Å²	84	99 Å²	99	43%	0.431	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-78.6	125.2	171.6	-53.4	-176.6	0	0	0	108.6	I414 H465 L491	I412-I414 PolarHBondContact O-N 2.87Å; I412-H465 WeakPolarHBondContact CG2-NE2 3.23Å; I412-L491 HydrophobicContact CB-CD1 3.93Å; I412-L491 HydrophobicContact CD1-CD1 3.74Å; I412-L491 HydrophobicContact CG1-CD1 3.84Å
413	P	30.8	Very low	30.1	Very low	77 Å²	77	92.6 Å²	92.6	50%	0.5	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-69.9	130.7	177.1	28.5	-33.9	0	0	0	110.6	T415	P413-T415 PolarHBondContact O-N 2.69Å
414	I	34.6	Very low	30.4	Very low	76 Å²	76	96.8 Å²	96.8	39%	0.39	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-69.7	122.2	170.6	-61	168.9	0	0	0	108.1	F350 W355 I412 T418 F420	F350-I414 HydrophobicContact CE1-CD1 4.3Å; F350-I414 HydrophobicContact CZ-CD1 4.4Å; W355-I414 HydrophobicContact CH2-CG2 3.6Å; W355-I414 HydrophobicContact CZ2-CG2 3.83Å; W355-I414 HydrophobicContact CZ3-CG2 4.48Å; I412-I414 PolarHBondContact O-N 2.87Å; I414-T418 HydrophobicContact CG2-CG2 4.14Å; I414-F420 HydrophobicContact CD1-CZ 4.17Å; I414-F420 HydrophobicContact CG1-CZ 4.39Å; I414-F420 HydrophobicContact CG2-CE2 4.13Å; I414-F420 HydrophobicContact CG2-CZ 3.94Å
415	T	34.8	Very low	30.6	Very low	66 Å²	66	89.6 Å²	89.6	41%	0.405	48%	0.475	S	S	.	.			trans	-115.1	175	179	65.1	0	0	0	0	111	P413 A417 T418	P413-T415 PolarHBondContact O-N 2.69Å; T415-A417 PolarHBondContact O-N 3.43Å; T415-A417 PolarHBondContact OG1-N 3Å; T415-T418 PolarHBondContact N-OG1 2.9Å; T415-T418 VanDerWaalsContact O-CB 3.28Å; T415-T418 WeakPolarHBondContact O-CB 3.41Å; T415-T418 PolarHBondContact O-N 2.88Å; T415-T418 VanDerWaalsContact O-N 3.12Å; T415-T418 PolarHBondContact O-OG1 3.19Å; T415-T418 PolarHBondContact OG1-OG1 2.62Å; T415-T418 VanDerWaalsContact OG1-OG1 3.07Å
416	T	29.8	Very low	30.9	Very low	154 Å²	154	90.4 Å²	90.4	95%	0.945	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.1	170	44.3	0	0	0	0	113.9
417	A	31.8	Very low	31.4	Very low	50 Å²	50	83 Å²	83	41%	0.413	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	19.2	173.4	0	0	0	0	0	112.9	T415	T415-A417 PolarHBondContact O-N 3.43Å; T415-A417 PolarHBondContact OG1-N 3Å
418	T	34.2	Very low	31.7	Very low	10 Å²	10	81.4 Å²	81.4	6%	0.061	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	106.5	178	-55.5	0	0	0	0	109.6	I414 T415 F420 V463 H465	I414-T418 HydrophobicContact CG2-CG2 4.14Å; T415-T418 PolarHBondContact N-OG1 2.9Å; T415-T418 VanDerWaalsContact O-CB 3.28Å; T415-T418 WeakPolarHBondContact O-CB 3.41Å; T415-T418 PolarHBondContact O-N 2.88Å; T415-T418 VanDerWaalsContact O-N 3.12Å; T415-T418 PolarHBondContact O-OG1 3.19Å; T415-T418 PolarHBondContact OG1-OG1 2.62Å; T415-T418 VanDerWaalsContact OG1-OG1 3.07Å; T418-F420 HydrophobicContact CG2-CE2 3.82Å; T418-F420 HydrophobicContact CG2-CZ 3.91Å; T418-F420 WeakPolarHBondContact O-CD2 3.42Å; T418-F420 WeakPolarHBondContact O-CE2 3.36Å; T418-V463 HydrophobicContact CG2-CG1 3.4Å; T418-V463 VanDerWaalsContact CG2-CG1 3.4Å; T418-H465 PolarHBondContact OG1-CE1 2.88Å
419	H	34.9	Very low	31.6	Very low	104 Å²	104	84.2 Å²	84.2	48%	0.481	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130.7	-175.6	-66.1	-72.7	0	0	0	111.6	Y464 D466	H419-Y464 PolarHBondContact N-O 3.28Å; H419-Y464 PolarHBondContact O-N 3.13Å; H419-D466 IonicContact CD2-OD2 3.35Å
420	F	34.4	Very low	31.7	Very low	65 Å²	65	87.2 Å²	87.2	29%	0.285	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.9	-178.9	-66.9	-93.8	0	0	0	110	W355 I414 T418 V463 F495	W355-F420 AromaticContact CH2-CE2 3.74Å; W355-F420 HydrophobicContact CH2-CE2 3.74Å; W355-F420 AromaticContact CH2-CZ 3.94Å; W355-F420 HydrophobicContact CH2-CZ 3.94Å; I414-F420 HydrophobicContact CD1-CZ 4.17Å; I414-F420 HydrophobicContact CG1-CZ 4.39Å; I414-F420 HydrophobicContact CG2-CE2 4.13Å; I414-F420 HydrophobicContact CG2-CZ 3.94Å; T418-F420 HydrophobicContact CG2-CE2 3.82Å; T418-F420 HydrophobicContact CG2-CZ 3.91Å; T418-F420 WeakPolarHBondContact O-CD2 3.42Å; T418-F420 WeakPolarHBondContact O-CE2 3.36Å; F420-V463 HydrophobicContact CD1-CG2 4.13Å; F420-V463 HydrophobicContact CE1-CG2 3.82Å; F420-F495 HydrophobicContact CD1-CZ 4.29Å; F420-F495 HydrophobicContact CE1-CZ 4.17Å
421	I	32.1	Very low	31.6	Very low	87 Å²	87	85.4 Å²	85.4	45%	0.446	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.3	177.5	-56.5	-179.6	0	0	0	108.8	I423 Y464	I421-I423 PolarHBondContact O-N 3.21Å; I421-Y464 HydrophobicContact CD1-CD2 3.75Å; I421-Y464 HydrophobicContact CD1-CE2 3.89Å; I421-Y464 HydrophobicContact CG1-CD2 4.49Å
422	P	28.9	Very low	31.5	Very low	104 Å²	104	91.5 Å²	91.5	68%	0.675	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-73.1	123.2	180	28.6	-33.5	0	0	0	112	Y461	P422-Y461 HydrophobicContact CB-CE1 4.01Å
423	I	30.6	Very low	31.1	Very low	46 Å²	46	96.1 Å²	96.1	24%	0.236	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-103.1	140.6	171.8	-44.5	176.2	0	0	0	108.3	I421 E460 F462	I421-I423 PolarHBondContact O-N 3.21Å; I423-E460 WeakPolarHBondContact CB-O 3.39Å; I423-F462 HydrophobicContact CD1-CB 4.17Å; I423-F462 HydrophobicContact CD1-CD2 3.31Å; I423-F462 HydrophobicContact CD1-CE2 3.76Å; I423-F462 HydrophobicContact CD1-CG 3.8Å
424	R	29.5	Very low	31	Very low	177 Å²	177	97.7 Å²	97.7	67%	0.668	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-75.2	136.7	174.1	-68	-177	176.8	173.5	-1	110.2	D308 E426 S427	D308-R424 PolarHBondContact O-NH1 3.5Å; R424-E426 PolarHBondContact O-N 2.91Å; R424-S427 PolarHBondContact O-N 2.73Å
425	S	28	Very low	30.6	Very low	51 Å²	51	103.1 Å²	103.1	36%	0.357	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-58.9	-24.8	-170.8	-51.2	0	0	0	0	115.1	S427 L428	S425-S427 PolarHBondContact O-N 3.29Å; S425-L428 WeakPolarHBondContact O-CB 2.99Å; S425-L428 PolarHBondContact O-N 3.12Å
426	E	31.7	Very low	30.2	Very low	122 Å²	122	107.3 Å²	107.3	57%	0.57	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-66.1	-20.1	-176	-67.5	164.9	-144.1	0	0	114.2	R424 L428 E429	R424-E426 PolarHBondContact O-N 2.91Å; E426-L428 PolarHBondContact O-N 3.2Å; E426-E429 PolarHBondContact O-N 2.87Å
427	S	34.9	Very low	30	Very low	77 Å²	77	106.9 Å²	106.9	54%	0.538	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-63.7	-19.6	175.7	-58.8	0	0	0	0	113.3	R424 S425	R424-S427 PolarHBondContact O-N 2.73Å; S425-S427 PolarHBondContact O-N 3.29Å
428	L	32.6	Very low	29.8	Very low	55 Å²	55	110.6 Å²	110.6	29%	0.288	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.7	-37.3	179.6	-77.8	157.5	0	0	0	113.7	S425 E426 K430 G431 L457 D458 E460	S425-L428 WeakPolarHBondContact O-CB 2.99Å; S425-L428 PolarHBondContact O-N 3.12Å; E426-L428 PolarHBondContact O-N 3.2Å; L428-K430 PolarHBondContact O-N 2.66Å; L428-G431 PolarHBondContact O-N 3.14Å; L428-L457 HydrophobicContact CB-CD2 3.82Å; L428-D458 WeakPolarHBondContact CD1-O 3.21Å; L428-E460 HydrophobicContact CD1-CB 4.05Å; L428-E460 HydrophobicContact CD1-CG 4.06Å; L428-E460 HydrophobicContact CD2-CB 4.14Å; L428-E460 VanDerWaalsContact CD2-CD 3.41Å; L428-E460 HydrophobicContact CD2-CG 3.84Å; L428-E460 WeakPolarHBondContact CD2-OE2 3.07Å; L428-E460 HydrophobicContact CG-CB 4.43Å; L428-E460 HydrophobicContact CG-CG 4.49Å
429	E	29.7	Very low	29.3	Very low	135 Å²	135	118.8 Å²	118.8	63%	0.631	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-19.9	-168.6	-142	166	-129.8	0	0	112.6	E426 L457	E426-E429 PolarHBondContact O-N 2.87Å; E429-L457 HydrophobicContact CB-CD1 4.13Å; E429-L457 HydrophobicContact CB-CD2 4.04Å; E429-L457 HydrophobicContact CG-CD1 4.23Å; E429-L457 HydrophobicContact CG-CD2 4.09Å; E429-L457 HydrophobicContact CG-CG 4.4Å; E429-L457 WeakPolarHBondContact OE1-CD1 3.41Å
430	K	31	Very low	28.8	Very low	148 Å²	148	119.9 Å²	119.9	64%	0.643	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-2.3	-176.2	-63.7	175.8	179.8	167.4	0	114.2	L428 Y432	L428-K430 PolarHBondContact O-N 2.66Å; K430-Y432 VanDerWaalsContact C-N 3.3Å; K430-Y432 HydrophobicContact CB-CD2 3.63Å; K430-Y432 HydrophobicContact CB-CE2 3.85Å; K430-Y432 VanDerWaalsContact O-CD2 3.23Å; K430-Y432 WeakPolarHBondContact O-CD2 3.35Å; K430-Y432 PolarHBondContact O-N 2.78Å
431	G	26.8	Very low	28.5	Very low	53 Å²	53	123.4 Å²	123.4	55%	0.546	65%	0.646	S	S	.	*			trans	68.8	14.7	170.4	0	0	0	0	0	116.9	L428 Y433	L428-G431 PolarHBondContact O-N 3.14Å; G431-Y433 PolarHBondContact O-N 3.22Å
432	Y	26.7	Very low	28.2	Very low	181 Å²	181	130 Å²	130	71%	0.71	67%	0.666	S	S	*	*			trans	-75.1	86.4	-176.9	-78.1	-91.6	0	0	0	112.6	K430 P434	K430-Y432 VanDerWaalsContact C-N 3.3Å; K430-Y432 HydrophobicContact CB-CD2 3.63Å; K430-Y432 HydrophobicContact CB-CE2 3.85Å; K430-Y432 VanDerWaalsContact O-CD2 3.23Å; K430-Y432 WeakPolarHBondContact O-CD2 3.35Å; K430-Y432 PolarHBondContact O-N 2.78Å; Y432-P434 VanDerWaalsContact O-CD 3.3Å; Y432-P434 WeakPolarHBondContact O-CD 3.4Å
433	Y	25.6	Very low	28.1	Very low	181 Å²	181	131.4 Å²	131.4	71%	0.71	67%	0.667	S	S	*	*			trans	-83.5	112.6	158.6	-74.6	-89.5	0	0	0	109.5	G431 F435	G431-Y433 PolarHBondContact O-N 3.22Å; Y433-F435 VanDerWaalsContact C-N 3.34Å; Y433-F435 PolarHBondContact O-N 3.3Å
434	P	28.1	Very low	27.9	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	69%	0.69	S	S	*	*			trans	-70.5	93	168.2	29	-33	0	0	0	109	Y432 L436	Y432-P434 VanDerWaalsContact O-CD 3.3Å; Y432-P434 WeakPolarHBondContact O-CD 3.4Å; P434-L436 PolarHBondContact O-N 2.96Å; P434-L436 VanDerWaalsContact O-N 3.08Å
435	F	27.3	Very low	27.7	Very low	189 Å²	189	135.1 Å²	135.1	83%	0.829	70%	0.699	S	S	*	*			trans	-60.2	111.3	173.1	-95.2	-98.5	0	0	0	109.7	Y433 N437	Y433-F435 VanDerWaalsContact C-N 3.34Å; Y433-F435 PolarHBondContact O-N 3.3Å; F435-N437 PolarHBondContact O-N 3.49Å
436	L	26.7	Very low	27.6	Very low	154 Å²	154	136.1 Å²	136.1	81%	0.806	72%	0.717	S	S	*	*			trans	-72.5	123.7	172.5	-71	169.5	0	0	0	109.7	P434	P434-L436 PolarHBondContact O-N 2.96Å; P434-L436 VanDerWaalsContact O-N 3.08Å
437	N	24.8	Very low	27.2	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	74%	0.735	S	S	*	*	S	Bend	trans	89.8	143.1	176.5	-47.1	-52.6	0	0	0	117.2	F435	F435-N437 PolarHBondContact O-N 3.49Å
438	S	26.5	Very low	26.8	Very low	128 Å²	128	143.4 Å²	143.4	90%	0.895	74%	0.744	S	S	*	*			trans	79.5	150.2	177.3	72.4	0	0	0	0	117.8
439	E	23.8	Very low	26.5	Very low	181 Å²	181	150 Å²	150	85%	0.846	77%	0.773	S	S	*	*			trans	-90	154.9	-157	-63.6	176.4	118.7	0	0	114.5
440	P	26	Very low	26.3	Very low	127 Å²	127	151.9 Å²	151.9	83%	0.825	78%	0.782	S	S	*	*			trans	-77.1	129.6	179.3	31.4	-34.6	0	0	0	112.4
441	T	28.2	Very low	26	Very low	139 Å²	139	151.9 Å²	151.9	85%	0.853	79%	0.789	S	S	*	*			trans	-131.7	153.4	156.8	29.6	0	0	0	0	111.1
442	R	25.6	Very low	26	Very low	227 Å²	227	155.6 Å²	155.6	86%	0.857	80%	0.8	S	S	*	*			trans	-108.8	163.6	-162	-165.1	-176.6	179	163	-1	110.5
443	N	25.6	Very low	25.9	Very low	133 Å²	133	153.6 Å²	153.6	71%	0.711	80%	0.802	S	S	*	*			trans	83	141.4	179.4	-43.8	-11.6	0	0	0	112.2
444	D	26.6	Very low	25.8	Very low	134 Å²	134	154.4 Å²	154.4	72%	0.717	81%	0.812	S	S	*	*			cis	-138	161.4	13	-117.6	-42.1	0	0	0	116.4
445	I	26	Very low	25.7	Very low	166 Å²	166	155.5 Å²	155.5	85%	0.851	81%	0.811	S	S	*	*			trans	-38.1	126.5	171.8	-59.7	156.3	0	0	0	114
446	G	25.2	Very low	25.6	Very low	72 Å²	72	155 Å²	155	74%	0.742	81%	0.811	S	S	*	*			trans	-167.3	116.8	173.8	0	0	0	0	0	116.4
447	R	24.2	Very low	25.6	Very low	250 Å²	250	150.3 Å²	150.3	94%	0.943	79%	0.786	S	S	*	*			trans	-50.2	159.2	169.2	-59.6	165.1	172.5	170.5	-4	112.5
448	S	25.8	Very low	25.7	Very low	103 Å²	103	146.7 Å²	146.7	72%	0.72	77%	0.767	S	S	*	*			cis	-156.8	152.9	28.7	41.2	0	0	0	0	114.7
449	Q	25.3	Very low	25.7	Very low	193 Å²	193	141 Å²	141	90%	0.902	73%	0.729	S	S	*	*			trans	-62.5	128.4	162.2	176.5	-178.3	6.5	0	0	111.4
450	Q	26.6	Very low	26	Very low	174 Å²	174	134 Å²	134	81%	0.813	70%	0.696	S	S	*	*			trans	-157.3	148.8	165.9	-132.5	170.7	1.5	0	0	111.3
451	D	23.9	Very low	26.3	Very low	148 Å²	148	131.5 Å²	131.5	79%	0.791	67%	0.671	S	S	*	*			trans	-78.4	139.5	-161.9	-41.4	-88.5	0	0	0	114.6
452	V	26.9	Very low	26.4	Very low	131 Å²	131	129.4 Å²	129.4	79%	0.794	65%	0.65	S	S	*	*			trans	-145.2	138.5	151.1	-174.3	0	0	0	0	108.9
453	D	24.7	Very low	26.7	Very low	139 Å²	139	119.4 Å²	119.4	74%	0.743	61%	0.614	S	S	*	*			trans	-72.3	164.5	-168.3	-47.1	-88.5	0	0	0	116.8	I455	D453-I455 PolarHBondContact O-N 3.45Å; D453-I455 VanDerWaalsContact O-N 3.14Å
454	E	24.5	Very low	26.9	Very low	198 Å²	198	120.1 Å²	120.1	93%	0.925	61%	0.608	S	S	*	*			trans	3.7	84.4	161.4	-60.8	-172.6	118	0	0	117.9	Q456	E454-Q456 PolarHBondContact O-N 3.01Å
455	I	25.1	Very low	26.9	Very low	134 Å²	134	116.4 Å²	116.4	69%	0.687	59%	0.586	S	S	*	*			trans	-88.7	104.3	170.6	-58.3	-174.5	0	0	0	110.4	D453 L457	D453-I455 PolarHBondContact O-N 3.45Å; D453-I455 VanDerWaalsContact O-N 3.14Å; I455-L457 PolarHBondContact O-N 2.88Å
456	Q	25.5	Very low	27.1	Very low	179 Å²	179	114.2 Å²	114.2	84%	0.836	58%	0.576	S	S	*	*			trans	-71.4	110.7	176.7	-163.8	162.8	90.9	0	0	110.6	E454 D458	E454-Q456 PolarHBondContact O-N 3.01Å; Q456-D458 PolarHBondContact O-N 2.78Å
457	L	26	Very low	27.3	Very low	54 Å²	54	115.9 Å²	115.9	28%	0.283	58%	0.577	S	S	.	*			trans	-66.6	92.3	-175.8	-73.7	177.5	0	0	0	114.2	L428 E429 I455 G459	L428-L457 HydrophobicContact CB-CD2 3.82Å; E429-L457 HydrophobicContact CB-CD1 4.13Å; E429-L457 HydrophobicContact CB-CD2 4.04Å; E429-L457 HydrophobicContact CG-CD1 4.23Å; E429-L457 HydrophobicContact CG-CD2 4.09Å; E429-L457 HydrophobicContact CG-CG 4.4Å; E429-L457 WeakPolarHBondContact OE1-CD1 3.41Å; I455-L457 PolarHBondContact O-N 2.88Å; L457-G459 PolarHBondContact O-N 3.15Å
458	D	28	Very low	27.5	Very low	70 Å²	70	109.8 Å²	109.8	37%	0.374	57%	0.57	S	S	.	*			trans	-66.7	114	159.1	-87.6	-32.3	0	0	0	109.3	L428 Q456 E460	L428-D458 WeakPolarHBondContact CD1-O 3.21Å; Q456-D458 PolarHBondContact O-N 2.78Å; D458-E460 PolarHBondContact O-N 3.07Å
459	G	27	Very low	27.6	Very low	10 Å²	10	109.3 Å²	109.3	10%	0.103	57%	0.572	C	S	.	*			trans	-65.4	130.1	-178.9	0	0	0	0	0	113.5	L457	L457-G459 PolarHBondContact O-N 3.15Å
460	E	29.6	Very low	28	Very low	32 Å²	32	107.7 Å²	107.7	15%	0.15	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	147.2	174	-77.5	-175.5	-177.2	0	0	111.3	I423 L428 D458 T492 K494	I423-E460 WeakPolarHBondContact CB-O 3.39Å; L428-E460 HydrophobicContact CD1-CB 4.05Å; L428-E460 HydrophobicContact CD1-CG 4.06Å; L428-E460 HydrophobicContact CD2-CB 4.14Å; L428-E460 VanDerWaalsContact CD2-CD 3.41Å; L428-E460 HydrophobicContact CD2-CG 3.84Å; L428-E460 WeakPolarHBondContact CD2-OE2 3.07Å; L428-E460 HydrophobicContact CG-CB 4.43Å; L428-E460 HydrophobicContact CG-CG 4.49Å; D458-E460 PolarHBondContact O-N 3.07Å; E460-T492 HydrophobicContact CB-CG2 4.07Å; E460-T492 HydrophobicContact CG-CG2 3.76Å; E460-T492 WeakPolarHBondContact OE2-CG2 3.29Å; E460-K494 HydrophobicContact CG-CG 3.9Å; E460-K494 WeakPolarHBondContact OE1-CE 3.41Å; E460-K494 IonicContact OE1-NZ 2.73Å; E460-K494 PolarHBondContact OE1-NZ 2.92Å
461	Y	31.1	Very low	28.3	Very low	76 Å²	76	108.5 Å²	108.5	30%	0.298	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.7	139.7	-179.2	-67.6	-115.1	0	0	0	108.7	P422 V493 F495	P422-Y461 HydrophobicContact CB-CE1 4.01Å; Y461-V493 PolarHBondContact N-O 2.92Å; Y461-V493 VanDerWaalsContact N-O 3.14Å; Y461-V493 PolarHBondContact O-N 3.14Å; Y461-F495 AromaticContact CD2-CD2 3.51Å; Y461-F495 HydrophobicContact CD2-CD2 3.51Å; Y461-F495 HydrophobicContact CD2-CE2 4.08Å; Y461-F495 HydrophobicContact CD2-CG 4.45Å; Y461-F495 HydrophobicContact CE2-CB 4.49Å; Y461-F495 HydrophobicContact CE2-CD2 4.03Å; Y461-F495 AromaticContact CG-CD2 3.99Å; Y461-F495 HydrophobicContact CG-CD2 3.99Å; Y461-F495 HydrophobicContact CG-CE2 4.07Å
462	F	32.1	Very low	28.6	Very low	95 Å²	95	109.3 Å²	109.3	42%	0.417	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.9	137.6	170.5	-69.2	-49.3	0	0	0	110.2	I423	I423-F462 HydrophobicContact CD1-CB 4.17Å; I423-F462 HydrophobicContact CD1-CD2 3.31Å; I423-F462 HydrophobicContact CD1-CE2 3.76Å; I423-F462 HydrophobicContact CD1-CG 3.8Å
463	V	30.7	Very low	28.7	Very low	16 Å²	16	111.2 Å²	111.2	10%	0.097	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.4	127.4	173.2	179.4	0	0	0	0	109.3	T418 F420 L491 V493	T418-V463 HydrophobicContact CG2-CG1 3.4Å; T418-V463 VanDerWaalsContact CG2-CG1 3.4Å; F420-V463 HydrophobicContact CD1-CG2 4.13Å; F420-V463 HydrophobicContact CE1-CG2 3.82Å; V463-L491 PolarHBondContact N-O 3.13Å; V463-V493 HydrophobicContact CG2-CG2 3.61Å
464	Y	29.9	Very low	28.8	Very low	148 Å²	148	112.4 Å²	112.4	58%	0.58	57%	0.568	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.4	138.8	165.7	-80.2	-104.1	0	0	0	109.3	H419 I421	H419-Y464 PolarHBondContact N-O 3.28Å; H419-Y464 PolarHBondContact O-N 3.13Å; I421-Y464 HydrophobicContact CD1-CD2 3.75Å; I421-Y464 HydrophobicContact CD1-CE2 3.89Å; I421-Y464 HydrophobicContact CG1-CD2 4.49Å
465	H	27.5	Very low	29	Very low	57 Å²	57	109.1 Å²	109.1	26%	0.264	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.5	116.5	169.4	-80.3	-84.4	0	0	0	108.3	I412 T418 S467	I412-H465 WeakPolarHBondContact CG2-NE2 3.23Å; T418-H465 PolarHBondContact OG1-CE1 2.88Å; H465-S467 PolarHBondContact O-N 3.31Å; H465-S467 VanDerWaalsContact O-N 3.15Å
466	D	30.4	Very low	29.2	Very low	119 Å²	119	108.6 Å²	108.6	64%	0.636	57%	0.57	S	S	*	*			trans	-67.6	112.4	167.4	-59.6	-39.9	0	0	0	107.7	H419	H419-D466 IonicContact CD2-OD2 3.35Å
467	S	27.8	Very low	29.2	Very low	108 Å²	108	110.4 Å²	110.4	76%	0.755	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-79.3	123.2	171.4	-58.9	0	0	0	0	106.9	H465 A469	H465-S467 PolarHBondContact O-N 3.31Å; H465-S467 VanDerWaalsContact O-N 3.15Å; S467-A469 PolarHBondContact O-N 3.3Å
468	P	28.2	Very low	29.2	Very low	122 Å²	122	115.9 Å²	115.9	79%	0.792	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.7	178.6	25.6	-33.8	0	0	0	109.6
469	A	29.6	Very low	29	Very low	93 Å²	93	122 Å²	122	77%	0.769	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-60.6	148.1	175.3	0	0	0	0	0	110.5	S467 E471	S467-A469 PolarHBondContact O-N 3.3Å; A469-E471 VanDerWaalsContact C-N 3.31Å; A469-E471 PolarHBondContact O-N 2.95Å
470	E	32.2	Very low	29	Very low	158 Å²	158	130.5 Å²	130.5	74%	0.738	66%	0.655	S	S	*	*			trans	-74.7	78.4	-178.3	-63.2	-176.3	151.2	0	0	110.4	K485	E470-K485 VanDerWaalsContact CD-NZ 3.26Å; E470-K485 IonicContact OE1-NZ 3.62Å; E470-K485 PolarHBondContact OE1-NZ 2.69Å; E470-K485 IonicContact OE2-NZ 2.95Å; E470-K485 PolarHBondContact OE2-NZ 2.74Å
471	E	33	Very low	28.7	Very low	191 Å²	191	132.5 Å²	132.5	89%	0.893	67%	0.67	S	S	*	*			trans	-67.5	149.1	159.1	-78.6	-159.9	148.2	0	0	110.5	A469	A469-E471 VanDerWaalsContact C-N 3.31Å; A469-E471 PolarHBondContact O-N 2.95Å
472	E	30.6	Very low	28.3	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	70%	0.698	S	S	*	*			trans	-83.8	142.8	-155.7	-65.1	-176.8	128.5	0	0	115.7
473	E	28.4	Very low	28	Very low	170 Å²	170	136.2 Å²	136.2	79%	0.794	70%	0.704	S	S	*	*			trans	74.9	122	149.3	-76.3	-165.8	151.8	0	0	123.7
474	E	28.1	Very low	27.7	Very low	164 Å²	164	138 Å²	138	77%	0.766	72%	0.717	S	S	*	*			trans	82.4	137.3	134.1	-71.1	-146.1	132.9	0	0	123.9
475	T	27.6	Very low	27.7	Very low	129 Å²	129	139.6 Å²	139.6	79%	0.791	73%	0.727	S	S	*	*			trans	74.4	56.7	159.8	65.6	0	0	0	0	121.9
476	S	29	Very low	27.6	Very low	123 Å²	123	142.7 Å²	142.7	86%	0.86	75%	0.75	S	S	*	*				-157.7	146.3	128.2	44	0	0	0	0	113.5
477	K	27.1	Very low	27.4	Very low	218 Å²	218	140.6 Å²	140.6	95%	0.948	74%	0.739	S	S	*	*			trans	-108.5	90.1	-179.5	-69.2	-177.1	179.1	-178.9	0	110.8
478	E	26.2	Very low	27.5	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	75%	0.748	S	S	*	*			trans	-116.6	132.2	154.6	-83.9	-161.2	137.4	0	0	110.6	W480	E478-W480 PolarHBondContact O-N 3.23Å; E478-W480 VanDerWaalsContact O-N 3.1Å
479	Q	24	Very low	27.4	Very low	198 Å²	198	147 Å²	147	93%	0.925	74%	0.737	S	S	*	*			trans	-92.1	74.5	-156.9	-167.7	176.2	11	0	0	111.9
480	W	25.1	Very low	27.4	Very low	190 Å²	190	146.8 Å²	146.8	72%	0.72	73%	0.729	S	S	*	*			trans	-61.6	139.9	167.3	-71.4	89.3	0	0	0	110.5	E478 T482	E478-W480 PolarHBondContact O-N 3.23Å; E478-W480 VanDerWaalsContact O-N 3.1Å; W480-T482 PolarHBondContact O-N 3.16Å
481	P	23.6	Very low	27.2	Very low	73 Å²	73	142.2 Å²	142.2	47%	0.474	71%	0.71	S	S	.	*			trans	-65	137.4	179.8	27.7	-34.1	0	0	0	110.2	P409 I483	P409-P481 HydrophobicContact CB-CG 3.96Å; P481-I483 VanDerWaalsContact C-N 3.25Å; P481-I483 PolarHBondContact O-N 3.36Å
482	T	23.9	Very low	26.9	Very low	142 Å²	142	136.3 Å²	136.3	87%	0.871	69%	0.687	S	S	*	*			trans	-72.8	76.4	-176.7	-44.3	0	0	0	0	111.5	W480 S484	W480-T482 PolarHBondContact O-N 3.16Å; T482-S484 PolarHBondContact O-N 2.96Å
483	I	25.4	Very low	26.9	Very low	107 Å²	107	130.2 Å²	130.2	55%	0.549	66%	0.661	S	S	.	*			trans	-61.4	122.2	165.5	-59.3	172.1	0	0	0	106.5	P481 L487	P481-I483 VanDerWaalsContact C-N 3.25Å; P481-I483 PolarHBondContact O-N 3.36Å; I483-L487 HydrophobicContact CG2-CB 4.37Å; I483-L487 HydrophobicContact CG2-CD1 4.39Å
484	S	24.2	Very low	26.9	Very low	54 Å²	54	128.5 Å²	128.5	38%	0.378	65%	0.651	S	S	.	*			trans	-67.6	144.5	-168.1	56.3	0	0	0	0	112.2	T482 T486 L487	T482-S484 PolarHBondContact O-N 2.96Å; S484-T486 WeakPolarHBondContact CB-OG1 3.34Å; S484-T486 PolarHBondContact O-N 3.25Å; S484-T486 PolarHBondContact OG-OG1 2.99Å; S484-L487 PolarHBondContact O-N 2.94Å
485	K	29	Very low	26.9	Very low	182 Å²	182	123.9 Å²	123.9	79%	0.791	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	7.7	173.6	-66.8	-159.1	170.3	-160	0	114.5	E470	E470-K485 VanDerWaalsContact CD-NZ 3.26Å; E470-K485 IonicContact OE1-NZ 3.62Å; E470-K485 PolarHBondContact OE1-NZ 2.69Å; E470-K485 IonicContact OE2-NZ 2.95Å; E470-K485 PolarHBondContact OE2-NZ 2.74Å
486	T	26.1	Very low	26.8	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-3.6	175.1	50.5	0	0	0	0	114.2	S484	S484-T486 WeakPolarHBondContact CB-OG1 3.34Å; S484-T486 PolarHBondContact O-N 3.25Å; S484-T486 PolarHBondContact OG-OG1 2.99Å
487	L	27.1	Very low	26.7	Very low	75 Å²	75	131.4 Å²	131.4	39%	0.393	63%	0.628	S	S	.	*			trans	-109.5	68.7	-172.7	-74.5	174.6	0	0	0	113.5	I483 S484 R489	I483-L487 HydrophobicContact CG2-CB 4.37Å; I483-L487 HydrophobicContact CG2-CD1 4.39Å; S484-L487 PolarHBondContact O-N 2.94Å; L487-R489 HydrophobicContact CB-CG 4.21Å; L487-R489 HydrophobicContact CD2-CG 4.17Å; L487-R489 PolarHBondContact O-N 3.41Å
488	K	28.5	Very low	26.6	Very low	219 Å²	219	124.7 Å²	124.7	95%	0.952	61%	0.613	S	S	*	*			trans	-66.5	78.6	156.3	-75.4	-166.8	174.6	-169.7	0	109.1
489	R	26.5	Very low	26.6	Very low	145 Å²	145	125 Å²	125	55%	0.547	61%	0.612	S	S	.	*			trans	-85.8	114.9	179.7	-78.4	177.6	172.8	179.1	-1.4	110.6	N410 L487	N410-R489 PolarHBondContact OD1-NH1 3.17Å; L487-R489 HydrophobicContact CB-CG 4.21Å; L487-R489 HydrophobicContact CD2-CG 4.17Å; L487-R489 PolarHBondContact O-N 3.41Å
490	S	29.1	Very low	26.7	Very low	88 Å²	88	121.3 Å²	121.3	62%	0.615	60%	0.596	S	S	*	*			trans	-65.6	135.8	161	46.4	0	0	0	0	110.2
491	L	28	Very low	26.8	Very low	63 Å²	63	118.4 Å²	118.4	33%	0.33	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	128.2	168.7	-80.7	172.7	0	0	0	109.8	I412 V463	I412-L491 HydrophobicContact CB-CD1 3.93Å; I412-L491 HydrophobicContact CD1-CD1 3.74Å; I412-L491 HydrophobicContact CG1-CD1 3.84Å; V463-L491 PolarHBondContact N-O 3.13Å
492	T	28.5	Very low	27.1	Very low	66 Å²	66	124 Å²	124	41%	0.405	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	115.9	171.9	-58.9	0	0	0	0	109.5	E460	E460-T492 HydrophobicContact CB-CG2 4.07Å; E460-T492 HydrophobicContact CG-CG2 3.76Å; E460-T492 WeakPolarHBondContact OE2-CG2 3.29Å
493	V	29.8	Very low	27.2	Very low	38 Å²	38	125.7 Å²	125.7	23%	0.23	61%	0.607	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	124.8	174.8	-175.9	0	0	0	0	109.6	Y461 V463 F495	Y461-V493 PolarHBondContact N-O 2.92Å; Y461-V493 VanDerWaalsContact N-O 3.14Å; Y461-V493 PolarHBondContact O-N 3.14Å; V463-V493 HydrophobicContact CG2-CG2 3.61Å; V493-F495 HydrophobicContact CB-CD2 4.46Å; V493-F495 HydrophobicContact CB-CE2 3.89Å; V493-F495 HydrophobicContact CB-CZ 4.49Å; V493-F495 HydrophobicContact CG1-CD2 3.95Å; V493-F495 HydrophobicContact CG1-CE1 4.41Å; V493-F495 HydrophobicContact CG1-CE2 3.42Å; V493-F495 VanDerWaalsContact CG1-CE2 3.42Å; V493-F495 HydrophobicContact CG1-CZ 3.7Å
494	K	28.3	Very low	27.3	Very low	135 Å²	135	125.7 Å²	125.7	59%	0.587	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.5	114.4	176.8	-73.8	-179.8	177.3	-73.4	0	110.5	E460	E460-K494 HydrophobicContact CG-CG 3.9Å; E460-K494 WeakPolarHBondContact OE1-CE 3.41Å; E460-K494 IonicContact OE1-NZ 2.73Å; E460-K494 PolarHBondContact OE1-NZ 2.92Å
495	F	28.8	Very low	27.2	Very low	67 Å²	67	132 Å²	132	29%	0.294	64%	0.639	S	S	.	*			trans	-100.6	120.5	175.5	-70	-89.6	0	0	0	110.7	F350 F420 Y461 V493 R497	F350-F495 HydrophobicContact CE2-CE1 4.49Å; F350-F495 HydrophobicContact CZ-CE1 4.17Å; F420-F495 HydrophobicContact CD1-CZ 4.29Å; F420-F495 HydrophobicContact CE1-CZ 4.17Å; Y461-F495 AromaticContact CD2-CD2 3.51Å; Y461-F495 HydrophobicContact CD2-CD2 3.51Å; Y461-F495 HydrophobicContact CD2-CE2 4.08Å; Y461-F495 HydrophobicContact CD2-CG 4.45Å; Y461-F495 HydrophobicContact CE2-CB 4.49Å; Y461-F495 HydrophobicContact CE2-CD2 4.03Å; Y461-F495 AromaticContact CG-CD2 3.99Å; Y461-F495 HydrophobicContact CG-CD2 3.99Å; Y461-F495 HydrophobicContact CG-CE2 4.07Å; V493-F495 HydrophobicContact CB-CD2 4.46Å; V493-F495 HydrophobicContact CB-CE2 3.89Å; V493-F495 HydrophobicContact CB-CZ 4.49Å; V493-F495 HydrophobicContact CG1-CD2 3.95Å; V493-F495 HydrophobicContact CG1-CE1 4.41Å; V493-F495 HydrophobicContact CG1-CE2 3.42Å; V493-F495 VanDerWaalsContact CG1-CE2 3.42Å; V493-F495 HydrophobicContact CG1-CZ 3.7Å; F495-R497 PolarHBondContact O-N 2.89Å
496	K	25.3	Very low	27.2	Very low	176 Å²	176	129.6 Å²	129.6	77%	0.765	64%	0.64	S	S	*	*			trans	-83.4	114.5	175.5	-177	167.6	-175.4	167.2	0	110.9	A498	K496-A498 PolarHBondContact O-N 2.99Å
497	R	25.9	Very low	27.2	Very low	234 Å²	234	130.9 Å²	130.9	88%	0.883	64%	0.642	S	S	*	*			trans	-69	113.8	178.1	-164	175.9	-171.4	178.4	3.5	110.5	F495	F495-R497 PolarHBondContact O-N 2.89Å
498	A	25.2	Very low	27.3	Very low	77 Å²	77	138.4 Å²	138.4	64%	0.636	67%	0.665	S	S	*	*			trans	-71.4	137.4	172	0	0	0	0	0	110.4	K496 M500	K496-A498 PolarHBondContact O-N 2.99Å; A498-M500 PolarHBondContact O-N 2.88Å
499	K	26.7	Very low	27.3	Very low	175 Å²	175	135.7 Å²	135.7	76%	0.761	66%	0.66	S	S	*	*			trans	-65.9	115.1	173.8	-72.2	-167.2	171.2	-160.6	0	110	D501	K499-D501 VanDerWaalsContact C-N 3.35Å
500	M	26.4	Very low	27.3	Very low	119 Å²	119	134.7 Å²	134.7	59%	0.586	67%	0.67	S	S	*	*			trans	-90	4.1	-179.3	-73.6	-119.8	59.1	0	0	114	A498 K502 F503	A498-M500 PolarHBondContact O-N 2.88Å; M500-K502 PolarHBondContact O-N 3.46Å; M500-F503 HydrophobicContact CE-CB 3.81Å; M500-F503 PolarHBondContact O-N 3.49Å
501	D	26.1	Very low	27.4	Very low	129 Å²	129	136 Å²	136	69%	0.69	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-2.5	-171.7	-54.9	-28.5	0	0	0	117.3	K499	K499-D501 VanDerWaalsContact C-N 3.35Å
502	K	30.3	Very low	27.5	Very low	192 Å²	192	141.9 Å²	141.9	84%	0.835	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.4	10	-174.3	-64.9	-162	175.1	-165.6	0	116.7	M500	M500-K502 PolarHBondContact O-N 3.46Å
503	F	26.1	Very low	27.5	Very low	177 Å²	177	149.5 Å²	149.5	78%	0.776	72%	0.723	S	S	*	*	S	Bend	trans	-119.3	7.7	-174.6	-91	-78.2	0	0	0	116.1	M500	M500-F503 HydrophobicContact CE-CB 3.81Å; M500-F503 PolarHBondContact O-N 3.49Å
504	C	26.8	Very low	27.6	Very low	106 Å²	106	157.1 Å²	157.1	72%	0.716	76%	0.757	S	S	*	*			trans	-124.2	44.7	178.4	-61.7	0	0	0	0	112.3
505	Q	23.6	Very low	27.7	Very low	186 Å²	186	154.1 Å²	154.1	87%	0.869	76%	0.764	S	S	*	*			trans	-91.4	105.6	154.2	-77.3	-174.8	-33	0	0	107.1	D507	Q505-D507 PolarHBondContact O-N 3.26Å
506	T	27.7	Very low	27.5	Very low	132 Å²	132	156.3 Å²	156.3	81%	0.81	79%	0.794	S	S	*	*			trans	-71.6	120.3	166.3	31.7	0	0	0	0	108.4	R508	T506-R508 PolarHBondContact O-N 3.07Å
507	D	27.4	Very low	27.8	Very low	149 Å²	149	152.3 Å²	152.3	80%	0.797	79%	0.794	S	S	*	*			trans	-59.7	108.9	173.5	-78.1	-51.7	0	0	0	109.3	Q505 L509	Q505-D507 PolarHBondContact O-N 3.26Å; D507-L509 VanDerWaalsContact C-N 3.27Å; D507-L509 PolarHBondContact O-N 3.27Å
508	R	27.5	Very low	28.1	Very low	233 Å²	233	150.3 Å²	150.3	88%	0.879	80%	0.795	S	S	*	*			trans	-69	89.6	169.3	-83.9	-175	167.4	-177.9	-3.3	108.3	T506 V510	T506-R508 PolarHBondContact O-N 3.07Å; R508-V510 VanDerWaalsContact C-N 3.28Å; R508-V510 PolarHBondContact O-N 3.21Å
509	L	28.5	Very low	28.4	Very low	162 Å²	162	154.3 Å²	154.3	85%	0.848	80%	0.804	S	S	*	*			trans	-62.7	90.7	166	-68.4	173.8	0	0	0	108.8	D507	D507-L509 VanDerWaalsContact C-N 3.27Å; D507-L509 PolarHBondContact O-N 3.27Å
510	V	27.8	Very low	28.5	Very low	125 Å²	125	150 Å²	150	76%	0.758	80%	0.801	S	S	*	*			trans	-64.3	127.2	172.5	178.3	0	0	0	0	108.2	R508 E512	R508-V510 VanDerWaalsContact C-N 3.28Å; R508-V510 PolarHBondContact O-N 3.21Å; V510-E512 PolarHBondContact O-N 3.37Å
511	P	31.3	Very low	29.1	Very low	116 Å²	116	149.7 Å²	149.7	75%	0.753	81%	0.81	S	S	*	*			trans	-65.1	130.2	177.1	-21	33.1	0	0	0	111.7	R513	P511-R513 PolarHBondContact O-N 3.48Å
512	E	28.6	Very low	29.4	Very low	186 Å²	186	155 Å²	155	87%	0.869	82%	0.821	S	S	*	*			trans	-70.9	114.2	162.2	-75.3	-167	126.6	0	0	110	V510	V510-E512 PolarHBondContact O-N 3.37Å
513	R	29.5	Very low	29.8	Very low	225 Å²	225	151.2 Å²	151.2	85%	0.849	82%	0.818	S	S	*	*			trans	173.6	157.2	133.2	-95.6	156.7	-168.3	-141.3	2.2	112.1	P511	P511-R513 PolarHBondContact O-N 3.48Å
514	E	32.8	Very low	30.2	Very low	198 Å²	198	147.7 Å²	147.7	93%	0.925	82%	0.816	S	S	*	*			trans	64.6	146.3	173.8	-63.8	161.5	-148.9	0	0	114.4
515	G	29.1	Very low	30.8	Very low	73 Å²	73	149.2 Å²	149.2	75%	0.753	82%	0.817	S	S	*	*			cis	-162.3	163.7	-6.6	0	0	0	0	0	109.4	A517	G515-A517 PolarHBondContact O-N 2.86Å
516	A	25.9	Very low	31.4	Very low	112 Å²	112	148.6 Å²	148.6	93%	0.926	81%	0.814	S	S	*	*			trans	-86.8	111.5	-169.1	0	0	0	0	0	114.4
517	A	31	Very low	32	Very low	92 Å²	92	149.9 Å²	149.9	76%	0.76	82%	0.815	S	S	*	*			trans	-169.8	152.3	161.8	0	0	0	0	0	108.4	G515	G515-A517 PolarHBondContact O-N 2.86Å
518	E	32.6	Very low	32.5	Very low	192 Å²	192	150.1 Å²	150.1	90%	0.897	82%	0.816	S	S	*	*			cis	-147.8	-177.6	-7.2	-140.7	177.9	147.9	0	0	110.1
519	I	31.4	Very low	32.9	Very low	162 Å²	162	142.4 Å²	142.4	83%	0.831	81%	0.81	S	S	*	*			trans	-117.7	155.3	-172.2	-69.3	170	0	0	0	111.6
520	A	29.4	Very low	33.3	Very low	83 Å²	83	145.1 Å²	145.1	69%	0.686	81%	0.808	S	S	*	*			trans	83.2	152.4	176.4	0	0	0	0	0	115.3
521	S	37	Very low	33.6	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	81%	0.807	S	S	*	*			cis	-133	148.4	13.5	-57.8	0	0	0	0	111.5
522	R	34.1	Very low	33.8	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.909	81%	0.808	S	S	*	*			cis	81.2	93.4	41.9	-93.6	-163.9	170.4	-156.9	-1	117
523	S	37	Very low	34.1	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	81%	0.806	S	S	*	*			trans	-176.7	119.5	144.5	48.5	0	0	0	0	108.4
524	S	35.8	Very low	34.3	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	81%	0.807	S	S	*	*				71.7	130	80.1	-88.3	0	0	0	0	113.7
525	D	39.3	Very low	34.5	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	80%	0.803	S	S	*	*			cis	-143.7	144.9	1.4	-67.5	-52.4	0	0	0	108.4
526	Q	36.4	Very low	34.8	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	81%	0.806	S	S	*	*				67	102.2	64	-165.9	177.5	107.7	0	0	116.6
527	L	39.9	Very low	35.2	Very low	160 Å²	160	138.5 Å²	138.5	84%	0.838	80%	0.795	S	S	*	*			trans	171.9	94.7	140	-94.6	167.4	0	0	0	107.8
528	D	38.6	Very low	35.4	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	80%	0.795	S	S	*	*				63.9	131.8	91.7	-111.1	-40.4	0	0	0	116.6
529	G	35.4	Very low	35.3	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	78%	0.781	S	S	*	*			trans	176.6	-18.6	-174.1	0	0	0	0	0	119
530	R	35.4	Very low	35.3	Very low	218 Å²	218	137.4 Å²	137.4	82%	0.823	78%	0.776	S	S	*	*			trans	56.2	112	157	-163.8	178.6	-173	173.7	4.3	120.6
531	T	34.6	Very low	35.5	Very low	119 Å²	119	139.5 Å²	139.5	73%	0.73	78%	0.78	S	S	*	*			trans	70	145.9	156.2	55	0	0	0	0	118.7
532	K	36.3	Very low	35.2	Very low	179 Å²	179	140.3 Å²	140.3	78%	0.778	78%	0.775	S	S	*	*			cis	-152.2	157.1	15.6	-133.9	165.7	-175.7	177.1	0	111.9
533	N	35.1	Very low	35.3	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	78%	0.775	S	S	*	*			trans	73.1	108.5	166.5	-56.7	0.5	0	0	0	118.4
534	T	33.8	Very low	35.1	Very low	143 Å²	143	139.4 Å²	139.4	88%	0.877	78%	0.78	S	S	*	*			trans	-92.1	159.3	168.7	50.4	0	0	0	0	111.5
535	S	35.7	Very low	34.9	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	79%	0.786	S	S	*	*			cis	-140.9	153.1	3.9	44.2	0	0	0	0	111.5
536	S	36.4	Very low	34.5	Very low	117 Å²	117	139.9 Å²	139.9	82%	0.818	79%	0.793	S	S	*	*			trans	-105.2	167	-179.9	51.8	0	0	0	0	112.2
537	G	34	Very low	34.4	Very low	67 Å²	67	138.6 Å²	138.6	69%	0.691	79%	0.791	S	S	*	*			cis	113.9	103.1	-9.9	0	0	0	0	0	115.9
538	K	35.3	Very low	34.2	Very low	176 Å²	176	139.1 Å²	139.1	77%	0.765	79%	0.786	S	S	*	*			trans	62.9	169	164.2	-79.5	-172.7	171.6	-83.4	0	116.9
539	E	31	Very low	34	Very low	127 Å²	127	142.7 Å²	142.7	59%	0.593	79%	0.788	S	S	*	*			cis	170.9	170.7	-27.8	-171.1	178.3	-103.5	0	0	106.8
540	T	30.7	Very low	33.9	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	78%	0.782	S	S	*	*			trans	69.9	156.7	165.2	77.6	0	0	0	0	118.5
541	V	33.5	Very low	33.9	Very low	126 Å²	126	139.4 Å²	139.4	76%	0.764	78%	0.782	S	S	*	*			cis	-157.6	165.3	-21.5	126.5	0	0	0	0	108.9
542	D	30.5	Very low	33.9	Very low	130 Å²	130	137.5 Å²	137.5	70%	0.695	78%	0.778	S	S	*	*			trans	-42.4	155.3	172.9	-66.4	-100.1	0	0	0	118.3
543	S	36.4	Very low	33.9	Very low	128 Å²	128	136 Å²	136	90%	0.895	78%	0.779	S	S	*	*			trans	-154.8	131.9	138.3	-83	0	0	0	0	112.5
544	K	32.3	Very low	33.8	Very low	207 Å²	207	134.4 Å²	134.4	90%	0.9	78%	0.779	S	S	*	*			trans	-89.6	143.2	175.5	-70	172.5	177.8	169.5	0	110.9
545	G	33.2	Very low	33.8	Very low	82 Å²	82	131.3 Å²	131.3	85%	0.845	78%	0.776	S	S	*	*			trans	-154.7	100.6	175.7	0	0	0	0	0	114.1
546	L	30.8	Very low	33.7	Very low	169 Å²	169	131.6 Å²	131.6	89%	0.885	78%	0.778	S	S	*	*			trans	-88.9	136.7	170.1	-88.1	153.8	0	0	0	110.3
547	L	33.5	Very low	33.6	Very low	145 Å²	145	131 Å²	131	76%	0.759	77%	0.774	S	S	*	*				162.3	116.3	123.6	-86.8	160.5	0	0	0	116
548	K	35.9	Very low	33.8	Very low	172 Å²	172	132.4 Å²	132.4	75%	0.748	77%	0.773	S	S	*	*				45.4	139.8	129.2	-75.8	-178.1	-178.1	170.3	0	123.5
549	R	34.5	Very low	33.8	Very low	228 Å²	228	132.8 Å²	132.8	86%	0.86	78%	0.778	S	S	*	*			trans	77.7	152.6	150.4	-73.4	168.9	175.2	170.6	-4.6	118
550	S	33.7	Very low	33.9	Very low	86 Å²	86	131.4 Å²	131.4	60%	0.601	78%	0.781	S	S	*	*			cis	-176.9	158.2	-30	52.5	0	0	0	0	110.1
551	T	34.1	Very low	34.1	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	79%	0.785	S	S	*	*			trans	61.4	154.1	158.6	48.8	0	0	0	0	118.8
552	A	35.4	Very low	34.3	Very low	78 Å²	78	134.1 Å²	134.1	65%	0.645	79%	0.787	S	S	*	*			cis	-171.5	163.8	-24.9	0	0	0	0	0	111
553	N	35.4	Very low	34.4	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	79%	0.787	S	S	*	*			trans	71	118.1	148.9	-72.5	11.3	0	0	0	124.7
554	S	33.7	Very low	34.2	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	78%	0.781	S	S	*	*				86.6	136.9	115.9	72.1	0	0	0	0	124.6
555	G	33.8	Very low	34.2	Very low	78 Å²	78	131.5 Å²	131.5	80%	0.804	78%	0.78	S	S	*	*			trans	102.2	144.8	156.5	0	0	0	0	0	116.2
556	S	33.4	Very low	33.9	Very low	126 Å²	126	135.5 Å²	135.5	88%	0.881	78%	0.781	S	S	*	*			cis	-159.4	-180	-12.9	-156.3	0	0	0	0	112.3
557	S	34.3	Very low	33.9	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	77%	0.774	S	S	*	*			trans	-86.2	153.6	-165.8	55.3	0	0	0	0	119.1
558	S	37.8	Very low	33.7	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	78%	0.779	S	S	*	*			trans	-178.2	125	136.1	47.2	0	0	0	0	109.4
559	E	35.6	Very low	33.5	Very low	184 Å²	184	131.2 Å²	131.2	86%	0.86	78%	0.782	S	S	*	*				63.1	137.3	92.6	-62.8	-180	123.3	0	0	114.6
560	C	32.7	Very low	33.3	Very low	98 Å²	98	128.1 Å²	128.1	66%	0.662	78%	0.781	S	S	*	*			cis	-159.7	132.6	12.6	-138.2	0	0	0	0	115.2
561	H	35.8	Very low	33.2	Very low	179 Å²	179	129 Å²	129	83%	0.829	79%	0.786	S	S	*	*			trans	57.8	162.8	143.7	-82.8	-50.5	0	0	0	123.2
562	P	37.9	Very low	33.2	Very low	123 Å²	123	132.9 Å²	132.9	80%	0.799	79%	0.785	S	S	*	*			trans	-120.3	167.8	-131.8	43.8	-34.8	0	0	0	117.2
563	G	32.2	Very low	33.2	Very low	68 Å²	68	134.4 Å²	134.4	70%	0.701	78%	0.779	S	S	*	*			trans	-164.6	95.9	171.2	0	0	0	0	0	116.6
564	S	32.2	Very low	33	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	78%	0.776	S	S	*	*			trans	74.5	153.2	159.5	83.4	0	0	0	0	120.8
565	R	32.5	Very low	33	Very low	234 Å²	234	136.4 Å²	136.4	88%	0.883	77%	0.767	S	S	*	*			trans	69.3	97.1	164.5	-56.7	-175.2	-169.8	-134.1	-0.5	118.7
566	L	26.9	Very low	33.2	Very low	165 Å²	165	137.5 Å²	137.5	86%	0.864	75%	0.751	S	S	*	*			trans	-60.2	153.7	141.5	-74.1	162.2	0	0	0	110.1
567	P	30.4	Very low	33.2	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	74%	0.741	S	S	*	*				-123.4	153.2	119.8	35.6	-32.6	0	0	0	112.1
568	E	29	Very low	33.3	Very low	185 Å²	185	139.7 Å²	139.7	86%	0.864	73%	0.73	S	S	*	*			trans	-70.8	135.9	173.7	-68.8	137.3	109	0	0	111.8
569	A	32.7	Very low	33.3	Very low	98 Å²	98	139.8 Å²	139.8	81%	0.81	72%	0.723	S	S	*	*			trans	-149.5	64.2	168.8	0	0	0	0	0	109.3
570	L	29.3	Very low	33.6	Very low	162 Å²	162	137.1 Å²	137.1	85%	0.848	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-61	147.3	165	-79.2	169.4	0	0	0	109.2	R572	L570-R572 PolarHBondContact O-N 3.5Å
571	P	32.9	Very low	34	Very low	106 Å²	106	138.1 Å²	138.1	69%	0.688	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-63.7	134.9	-171.3	26.4	-34.6	0	0	0	110.4	E573	P571-E573 PolarHBondContact O-N 2.93Å; P571-E573 VanDerWaalsContact O-N 3.08Å
572	R	32.5	Very low	34.3	Very low	215 Å²	215	133.3 Å²	133.3	81%	0.811	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-50.1	120	171.3	-88.3	-173.9	174.3	-126	14.1	109	L570	L570-R572 PolarHBondContact O-N 3.5Å
573	E	37	Very low	34.3	Very low	111 Å²	111	132.1 Å²	132.1	52%	0.519	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-69.8	144.8	-168.9	-66.2	163.6	133.4	0	0	110.1	P571 W575 Q576	P571-E573 PolarHBondContact O-N 2.93Å; P571-E573 VanDerWaalsContact O-N 3.08Å; E573-W575 HydrophobicContact CB-CD2 3.79Å; E573-W575 HydrophobicContact CB-CE3 4.02Å; E573-W575 HydrophobicContact CB-CG 4.23Å; E573-W575 HydrophobicContact CB-CH2 4.35Å; E573-W575 HydrophobicContact CB-CZ2 4.15Å; E573-W575 HydrophobicContact CB-CZ3 4.29Å; E573-W575 HydrophobicContact CG-CH2 4.21Å; E573-W575 HydrophobicContact CG-CZ2 4.24Å; E573-W575 HydrophobicContact CG-CZ3 4.43Å; E573-W575 PolarHBondContact O-N 2.78Å; E573-W575 WeakPolarHBondContact OE1-CH2 3.35Å; E573-W575 WeakPolarHBondContact OE2-CZ3 3.42Å; E573-Q576 PolarHBondContact O-N 2.91Å
574	L	31.3	Very low	34.5	Very low	143 Å²	143	133.5 Å²	133.5	75%	0.749	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-18.1	-173.2	-83.9	88.1	0	0	0	113.7	Q576 Y577 Q578	L574-Q576 PolarHBondContact O-N 2.95Å; L574-Y577 WeakPolarHBondContact O-CB 3.37Å; L574-Y577 PolarHBondContact O-N 2.69Å; L574-Y577 VanDerWaalsContact O-N 3.07Å; L574-Q578 PolarHBondContact O-N 3.46Å
575	W	31.9	Very low	34.8	Very low	165 Å²	165	132.8 Å²	132.8	63%	0.625	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-38.5	-174	-33.6	-30.6	0	0	0	111.2	E573 Y577 Q578 D579	E573-W575 HydrophobicContact CB-CD2 3.79Å; E573-W575 HydrophobicContact CB-CE3 4.02Å; E573-W575 HydrophobicContact CB-CG 4.23Å; E573-W575 HydrophobicContact CB-CH2 4.35Å; E573-W575 HydrophobicContact CB-CZ2 4.15Å; E573-W575 HydrophobicContact CB-CZ3 4.29Å; E573-W575 HydrophobicContact CG-CH2 4.21Å; E573-W575 HydrophobicContact CG-CZ2 4.24Å; E573-W575 HydrophobicContact CG-CZ3 4.43Å; E573-W575 PolarHBondContact O-N 2.78Å; E573-W575 WeakPolarHBondContact OE1-CH2 3.35Å; E573-W575 WeakPolarHBondContact OE2-CZ3 3.42Å; W575-Y577 PolarHBondContact O-N 3.42Å; W575-Q578 WeakPolarHBondContact O-CA 3.28Å; W575-Q578 WeakPolarHBondContact O-CB 3.3Å; W575-Q578 PolarHBondContact O-N 3.05Å; W575-D579 PolarHBondContact O-N 3.33Å
576	Q	38.6	Very low	35	Very low	100 Å²	100	127 Å²	127	47%	0.467	63%	0.632	S	S	.	*	H	α-helix	trans	-62.8	-25.8	174.1	-68.4	-173.2	-18.2	0	0	113	E573 L574 Q578	E573-Q576 PolarHBondContact O-N 2.91Å; L574-Q576 PolarHBondContact O-N 2.95Å; Q576-Q578 VanDerWaalsContact C-N 3.31Å
577	Y	33.2	Very low	35.5	Very low	169 Å²	169	124.8 Å²	124.8	66%	0.663	62%	0.62	S	S	*	*	H	α-helix	trans	-86.5	-4.3	175.3	-119.1	-58	0	0	0	113.3	L574 W575	L574-Y577 WeakPolarHBondContact O-CB 3.37Å; L574-Y577 PolarHBondContact O-N 2.69Å; L574-Y577 VanDerWaalsContact O-N 3.07Å; W575-Y577 PolarHBondContact O-N 3.42Å
578	Q	36.1	Very low	35.8	Very low	108 Å²	108	125.4 Å²	125.4	51%	0.505	61%	0.607	S	S	.	*	H	α-helix	trans	-93.8	-49.5	173.4	-150.3	75.4	38.2	0	0	108.9	L574 W575 Q576 E580 K581 D582	L574-Q578 PolarHBondContact O-N 3.46Å; W575-Q578 WeakPolarHBondContact O-CA 3.28Å; W575-Q578 WeakPolarHBondContact O-CB 3.3Å; W575-Q578 PolarHBondContact O-N 3.05Å; Q576-Q578 VanDerWaalsContact C-N 3.31Å; Q578-E580 PolarHBondContact O-N 3.22Å; Q578-K581 WeakPolarHBondContact O-CA 3.47Å; Q578-K581 WeakPolarHBondContact O-CB 3.35Å; Q578-K581 PolarHBondContact O-N 3.19Å; Q578-D582 PolarHBondContact O-N 2.87Å
579	D	39.2	Very low	36	Very low	99 Å²	99	125 Å²	125	53%	0.529	60%	0.599	S	S	.	*	H	α-helix	trans	-55.2	-47.4	178.1	-59.3	-25.4	0	0	0	112.1	W575 K581 D582 D583	W575-D579 PolarHBondContact O-N 3.33Å; D579-K581 PolarHBondContact O-N 3.1Å; D579-K581 VanDerWaalsContact O-N 3.08Å; D579-D582 PolarHBondContact O-N 3.27Å; D579-D582 VanDerWaalsContact O-N 3.1Å; D579-D583 PolarHBondContact O-N 2.99Å
580	E	42.1	Very low	36.1	Very low	128 Å²	128	125 Å²	125	60%	0.598	59%	0.589	S	S	*	*	H	α-helix	trans	-59.3	-23.1	176.9	-74.6	-175	166.5	0	0	113.8	Q578 E584	Q578-E580 PolarHBondContact O-N 3.22Å; E580-E584 PolarHBondContact O-N 2.66Å
581	K	41	Very low	36.4	Very low	119 Å²	119	120.2 Å²	120.2	52%	0.517	57%	0.569	S	S	.	*	H	α-helix	trans	-88.1	-36.4	175.2	-74.7	178	176.8	170.3	0	112.8	Q578 D579 D583 E584 L585	Q578-K581 WeakPolarHBondContact O-CA 3.47Å; Q578-K581 WeakPolarHBondContact O-CB 3.35Å; Q578-K581 PolarHBondContact O-N 3.19Å; D579-K581 PolarHBondContact O-N 3.1Å; D579-K581 VanDerWaalsContact O-N 3.08Å; K581-D583 VanDerWaalsContact C-N 3.3Å; K581-E584 WeakPolarHBondContact O-CB 3.48Å; K581-E584 PolarHBondContact O-N 3.32Å; K581-L585 WeakPolarHBondContact O-CG 3.33Å; K581-L585 PolarHBondContact O-N 3.33Å
582	D	41	Very low	36.4	Very low	78 Å²	78	121.8 Å²	121.8	42%	0.417	57%	0.572	S	S	.	*	H	α-helix	trans	-72.5	-29.7	177.6	-68.4	-21.9	0	0	0	110.3	Q578 D579 L585 L586	Q578-D582 PolarHBondContact O-N 2.87Å; D579-D582 PolarHBondContact O-N 3.27Å; D579-D582 VanDerWaalsContact O-N 3.1Å; D582-L585 PolarHBondContact O-N 3.27Å; D582-L586 WeakPolarHBondContact O-CB 3.36Å; D582-L586 PolarHBondContact O-N 2.96Å
583	D	39.1	Very low	36.5	Very low	98 Å²	98	117.6 Å²	117.6	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-47.1	163.6	-84.5	-18	0	0	0	112.4	D579 K581 L585 L586 I587	D579-D583 PolarHBondContact O-N 2.99Å; K581-D583 VanDerWaalsContact C-N 3.3Å; D583-L585 PolarHBondContact O-N 2.91Å; D583-L586 PolarHBondContact O-N 2.9Å; D583-I587 WeakPolarHBondContact O-CB 3.47Å; D583-I587 WeakPolarHBondContact O-CD1 3.5Å; D583-I587 VanDerWaalsContact O-CG1 3.23Å; D583-I587 WeakPolarHBondContact O-CG1 3.39Å; D583-I587 PolarHBondContact O-N 3.17Å
584	E	36.3	Very low	36.2	Very low	98 Å²	98	116.5 Å²	116.5	46%	0.458	57%	0.569	S	S	.	*	H	α-helix	trans	-58.2	-35.4	172.6	-92.1	-152.9	166.6	0	0	112.2	E580 K581 R588	E580-E584 PolarHBondContact O-N 2.66Å; K581-E584 WeakPolarHBondContact O-CB 3.48Å; K581-E584 PolarHBondContact O-N 3.32Å; E584-R588 VanDerWaalsContact CD-NH2 3.33Å; E584-R588 WeakPolarHBondContact O-CB 3.23Å; E584-R588 VanDerWaalsContact O-CG 3.24Å; E584-R588 WeakPolarHBondContact O-CG 3.24Å; E584-R588 PolarHBondContact O-N 2.93Å; E584-R588 IonicContact OE1-NH2 3.25Å; E584-R588 IonicContact OE2-CZ 2.73Å; E584-R588 IonicContact OE2-NH1 2.65Å; E584-R588 PolarHBondContact OE2-NH1 3.18Å; E584-R588 IonicContact OE2-NH2 3.99Å; E584-R588 PolarHBondContact OE2-NH2 2.91Å
585	L	37.4	Very low	36.1	Very low	94 Å²	94	117.5 Å²	117.5	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-74.1	-39.8	177.5	-74.5	167	0	0	0	111.9	K581 D582 D583 R588 Y589	K581-L585 WeakPolarHBondContact O-CG 3.33Å; K581-L585 PolarHBondContact O-N 3.33Å; D582-L585 PolarHBondContact O-N 3.27Å; D583-L585 PolarHBondContact O-N 2.91Å; L585-R588 CarbonylContact O-C 3.53Å; L585-R588 PolarHBondContact O-N 3.45Å; L585-Y589 PolarHBondContact O-N 3.19Å
586	L	36.7	Very low	36	Very low	112 Å²	112	117 Å²	117	59%	0.586	58%	0.582	S	S	*	*	H	α-helix	trans	-61.2	-46.9	171.9	-114.7	71.4	0	0	0	111.2	D582 D583 R588 Y589 V590	D582-L586 WeakPolarHBondContact O-CB 3.36Å; D582-L586 PolarHBondContact O-N 2.96Å; D583-L586 PolarHBondContact O-N 2.9Å; L586-R588 VanDerWaalsContact C-N 3.28Å; L586-R588 PolarHBondContact O-N 3.31Å; L586-Y589 PolarHBondContact O-N 3.19Å; L586-V590 WeakPolarHBondContact O-CG2 3.47Å; L586-V590 PolarHBondContact O-N 3.3Å
587	I	38.5	Very low	35.5	Very low	118 Å²	118	115.4 Å²	115.4	61%	0.605	59%	0.586	S	S	*	*	H	α-helix	trans	-60.3	-39.5	175.9	-68.5	164.8	0	0	0	110.4	D583 S591	D583-I587 WeakPolarHBondContact O-CB 3.47Å; D583-I587 WeakPolarHBondContact O-CD1 3.5Å; D583-I587 VanDerWaalsContact O-CG1 3.23Å; D583-I587 WeakPolarHBondContact O-CG1 3.39Å; D583-I587 PolarHBondContact O-N 3.17Å; I587-S591 VanDerWaalsContact O-CB 3.29Å; I587-S591 WeakPolarHBondContact O-CB 3.44Å; I587-S591 PolarHBondContact O-N 3.1Å; I587-S591 PolarHBondContact O-OG 2.9Å
588	R	35.7	Very low	35.3	Very low	127 Å²	127	112.4 Å²	112.4	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-69.7	-28	172.3	-75.8	174.9	-171.7	129	14.1	113.5	E584 L585 L586 S591 N592	E584-R588 VanDerWaalsContact CD-NH2 3.33Å; E584-R588 WeakPolarHBondContact O-CB 3.23Å; E584-R588 VanDerWaalsContact O-CG 3.24Å; E584-R588 WeakPolarHBondContact O-CG 3.24Å; E584-R588 PolarHBondContact O-N 2.93Å; E584-R588 IonicContact OE1-NH2 3.25Å; E584-R588 IonicContact OE2-CZ 2.73Å; E584-R588 IonicContact OE2-NH1 2.65Å; E584-R588 PolarHBondContact OE2-NH1 3.18Å; E584-R588 IonicContact OE2-NH2 3.99Å; E584-R588 PolarHBondContact OE2-NH2 2.91Å; L585-R588 CarbonylContact O-C 3.53Å; L585-R588 PolarHBondContact O-N 3.45Å; L586-R588 VanDerWaalsContact C-N 3.28Å; L586-R588 PolarHBondContact O-N 3.31Å; R588-S591 WeakPolarHBondContact CA-OG 3.46Å; R588-S591 PolarHBondContact O-OG 3.37Å; R588-N592 PolarHBondContact O-N 2.88Å; R588-N592 PolarHBondContact O-ND2 3.3Å
589	Y	33.4	Very low	35	Very low	177 Å²	177	115.4 Å²	115.4	69%	0.694	61%	0.606	S	S	*	*	H	α-helix	trans	-76.4	-48	176.5	-126.4	-97.9	0	0	0	111.4	L585 L586 S591 N592 I593	L585-Y589 PolarHBondContact O-N 3.19Å; L586-Y589 PolarHBondContact O-N 3.19Å; Y589-S591 PolarHBondContact O-N 3Å; Y589-N592 PolarHBondContact O-N 2.91Å; Y589-N592 VanDerWaalsContact O-N 3.13Å; Y589-I593 HydrophobicContact CD1-CD1 4.11Å; Y589-I593 PolarHBondContact O-N 3.16Å
590	V	35.7	Very low	34.7	Very low	97 Å²	97	117.9 Å²	117.9	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-62	-43.3	177.6	175.9	0	0	0	0	111.1	L586 N592 I593 S594	L586-V590 WeakPolarHBondContact O-CG2 3.47Å; L586-V590 PolarHBondContact O-N 3.3Å; V590-N592 PolarHBondContact O-N 2.89Å; V590-I593 PolarHBondContact O-N 3.21Å; V590-S594 PolarHBondContact O-N 2.85Å
591	S	33.8	Very low	34.1	Very low	62 Å²	62	117.1 Å²	117.1	43%	0.434	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-11.1	176.8	57.4	0	0	0	0	115	I587 R588 Y589	I587-S591 VanDerWaalsContact O-CB 3.29Å; I587-S591 WeakPolarHBondContact O-CB 3.44Å; I587-S591 PolarHBondContact O-N 3.1Å; I587-S591 PolarHBondContact O-OG 2.9Å; R588-S591 WeakPolarHBondContact CA-OG 3.46Å; R588-S591 PolarHBondContact O-OG 3.37Å; Y589-S591 PolarHBondContact O-N 3Å
592	N	34.6	Very low	33.6	Very low	139 Å²	139	119.8 Å²	119.8	74%	0.743	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-6	169.4	-83.5	-65.4	0	0	0	113.7	R588 Y589 V590	R588-N592 PolarHBondContact O-N 2.88Å; R588-N592 PolarHBondContact O-ND2 3.3Å; Y589-N592 PolarHBondContact O-N 2.91Å; Y589-N592 VanDerWaalsContact O-N 3.13Å; V590-N592 PolarHBondContact O-N 2.89Å
593	I	34.6	Very low	33.1	Very low	127 Å²	127	119.7 Å²	119.7	65%	0.651	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-14.5	-178.8	-66.6	171.7	0	0	0	112.1	Y589 V590	Y589-I593 HydrophobicContact CD1-CD1 4.11Å; Y589-I593 PolarHBondContact O-N 3.16Å; V590-I593 PolarHBondContact O-N 3.21Å
594	S	30.2	Very low	32.8	Very low	88 Å²	88	120.4 Å²	120.4	62%	0.615	67%	0.667	S	S	*	*			trans	-133.6	74	-178.7	-58	0	0	0	0	113.7	V590	V590-S594 PolarHBondContact O-N 2.85Å
595	L	28.9	Very low	32.6	Very low	164 Å²	164	121.3 Å²	121.3	86%	0.859	68%	0.684	S	S	*	*			trans	-114.3	48.4	161.9	-89	174.4	0	0	0	111.7
596	I	30.9	Very low	32.4	Very low	155 Å²	155	123.6 Å²	123.6	80%	0.795	70%	0.702	S	S	*	*			trans	-106	114.1	159	-57.7	179.2	0	0	0	105.6
597	A	27.6	Very low	32.1	Very low	66 Å²	66	121.4 Å²	121.4	55%	0.545	71%	0.706	S	S	.	*			trans	-74.5	153.1	-175.3	0	0	0	0	0	111.5	L599	A597-L599 PolarHBondContact O-N 3.19Å
598	P	27.6	Very low	31.9	Very low	107 Å²	107	119.4 Å²	119.4	70%	0.695	71%	0.714	S	S	*	*			trans	-58.6	138.8	173.9	25.5	-34.8	0	0	0	110.9	D600	P598-D600 PolarHBondContact O-N 3.32Å; P598-D600 VanDerWaalsContact O-N 3.1Å
599	L	31.6	Very low	31.7	Very low	171 Å²	171	126.2 Å²	126.2	90%	0.895	76%	0.755	S	S	*	*			trans	-80.3	89.5	174.8	-78.9	170.5	0	0	0	109.6	A597 S601	A597-L599 PolarHBondContact O-N 3.19Å; L599-S601 PolarHBondContact O-N 3.13Å
600	D	32.3	Very low	31.7	Very low	151 Å²	151	123.7 Å²	123.7	81%	0.807	76%	0.758	S	S	*	*			trans	-43.7	131.1	172.7	-103.5	-39.4	0	0	0	111.8	P598 L602	P598-D600 PolarHBondContact O-N 3.32Å; P598-D600 VanDerWaalsContact O-N 3.1Å; D600-L602 PolarHBondContact O-N 3.28Å
601	S	28.5	Very low	31.4	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	77%	0.767	S	S	*	*			trans	-65.9	92.3	-166.7	50.1	0	0	0	0	113.7	L599 A603	L599-S601 PolarHBondContact O-N 3.13Å; S601-A603 PolarHBondContact O-N 3.13Å
602	L	31.5	Very low	31.3	Very low	175 Å²	175	128.6 Å²	128.6	92%	0.916	79%	0.785	S	S	*	*			trans	-74.7	59.5	166.6	-79.5	172.7	0	0	0	111.9	D600	D600-L602 PolarHBondContact O-N 3.28Å
603	A	30.4	Very low	31.1	Very low	77 Å²	77	127.9 Å²	127.9	64%	0.636	79%	0.787	S	S	*	*			trans	-59.6	135.5	166.6	0	0	0	0	0	109.8	S601 S605	S601-A603 PolarHBondContact O-N 3.13Å; A603-S605 PolarHBondContact O-N 3.09Å; A603-S605 VanDerWaalsContact O-N 3.13Å
604	P	31.6	Very low	30.9	Very low	113 Å²	113	128 Å²	128	73%	0.734	80%	0.796	S	S	*	*			trans	-66.9	116.2	177.1	26.8	-33	0	0	0	109.7	V606	P604-V606 PolarHBondContact O-N 2.78Å
605	S	34	Very low	30.9	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	81%	0.808	S	S	*	*			trans	-67.2	76.7	177	175.7	0	0	0	0	111.9	A603 G607	A603-S605 PolarHBondContact O-N 3.09Å; A603-S605 VanDerWaalsContact O-N 3.13Å; S605-G607 PolarHBondContact O-N 3.14Å; S605-G607 VanDerWaalsContact O-N 3.14Å
606	V	32.4	Very low	31.1	Very low	143 Å²	143	128.3 Å²	128.3	87%	0.867	80%	0.804	S	S	*	*			trans	-77	93.6	171.5	-178.4	0	0	0	0	109.2	P604	P604-V606 PolarHBondContact O-N 2.78Å
607	G	30.1	Very low	31.1	Very low	66 Å²	66	126.2 Å²	126.2	68%	0.68	81%	0.805	S	S	*	*			trans	162.1	136.8	167.8	0	0	0	0	0	114.5	S605	S605-G607 PolarHBondContact O-N 3.14Å; S605-G607 VanDerWaalsContact O-N 3.14Å
608	G	34.2	Very low	31.4	Very low	75 Å²	75	131.3 Å²	131.3	77%	0.773	83%	0.827	S	S	*	*			trans	123.4	12.9	144.8	0	0	0	0	0	120.7
609	M	32.5	Very low	31.7	Very low	270 Å²	270	133.5 Å²	133.5	100%	1.33	84%	0.839	S	S	*	*			trans	-175.4	0	145.4	-106.3	174	-177.7	0	0	113.3

Retrieved 609 of 609 residues in 75.5 ms (Link to these results)

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