A0A3Q0KKH4_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KKH4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 954 aa.

						>A0A3Q0KKH4_SCHMA|A0A3Q0KKH4
MIPLIHIGENLLPFILFIQFYGIIITYGKIETLNTIISQNHHHVNLSSIYTTHNTTHNENLQNKSLILDQSILNSKNDHHSINHEQWYFHFDMFIIMFLAFSSFCTNIGLLYLDRCAKSSIPTNNSSFSNHFITITNTTNNNTTSSNNLNTNLLMHNNINNLQCLSFNYLLKKWSNKRNSYGFNSLLSNQSSIVTIPNETINKTTKSTTTTTRSFSLSNPPLNKYPSSISLIKLNQTNQFYHHHHHGSIQYHTPRGRRQRRYLRGLFGLSISNLSLSLCLLSWCICQMIIYNIDKHKYYILNVWLTIIAFINLWTIDIAQTLEIGAILWIALERTLGIHWPSEIQTLNSNNNNNNSTGNKTTCHHGNNIIINTSIKSNPPQYKFKFFKNIIKKYFNSDDVICNQFKMKKNQSFINSNKKINHEKYKIFLWFLRVLLCLLPFILFILASLYSLNNIIQYIKKHKLLLYNNQYNLIDINIEQLPWQQEQQPQQQPQQQMDMISNFETTYIIHNNSSINDSYIKYFNSLIVYNYYYYTYITNHNNFIKKHISLLHNIHMKYQIYMYYTSSIIPALIIGQFIAPLMILITTNLLIYQKVASRDKRFFSRQSSNTSKSSFISGTSISSVNSPTKRKLTTTTINFPIPLLRVLESSNQDIRMNFDDDHMNTTNNTTNNTSKEHHTLIHKPLNDQLDTNHSISNIQEQKQNTLLVPFIDLNENSFQYSSIKNLSNTTNTTHSLLHNHNNSSIDNKQKYLFNERRNSISVIQPTISSYNEYYENHSNVTLISKTLLTTTTTTTNTTNNDTTINNTIHTSRRTTSTETSSSTMYTIQKRRKSTNDLFNSLFQSRTQDLIQTRSSDESILIQALRRQHRRTLRILIILLLIFVICRGPRSIILIIEWLQYESNLYTWLQYTSIFSYTSAILDTIIYGFWGNRAYRLYMKNLCHQCALYKYCIRQ
					

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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	33	Very low	44.6	Very low	113 Å²	113	79 Å²	79	56%	0.557	42%	0.422	S	S	*	.				0	-46.3	0	-95.6	-156.7	175.2	0	0	114.3	L4	M1-L4 WeakPolarHBondContact O-CA 3.34Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.48Å
2	I	34	Very low	45.6	Very low	103 Å²	103	81.9 Å²	81.9	53%	0.528	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-44.6	175.6	-64.8	172.5	0	0	0	113.5	L4 I5 H6	I2-L4 PolarHBondContact O-N 2.83Å; I2-I5 WeakPolarHBondContact O-CB 3.44Å; I2-I5 PolarHBondContact O-N 3.39Å; I2-H6 PolarHBondContact O-N 3.24Å
3	P	39.9	Very low	46.8	Very low	85 Å²	85	80.8 Å²	80.8	55%	0.552	44%	0.437	S	S	*	.	H	α-helix	trans	-58.4	-26.8	172.2	18.2	-32.4	0	0	0	114.2	I5 H6 I7	P3-I5 PolarHBondContact O-N 2.97Å; P3-H6 PolarHBondContact O-N 3.14Å; P3-I7 WeakPolarHBondContact O-CB 3.41Å; P3-I7 WeakPolarHBondContact O-CD1 3.26Å; P3-I7 WeakPolarHBondContact O-CG1 3.47Å; P3-I7 PolarHBondContact O-N 3.16Å
4	L	40.3	Very low	48	Very low	53 Å²	53	78.4 Å²	78.4	28%	0.277	42%	0.421	S	S	.	.	H	α-helix	trans	-67.3	-17.1	173.8	-124.9	79.6	0	0	0	113	M1 I2 I7 G8 C105 T106	M1-L4 WeakPolarHBondContact O-CA 3.34Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.48Å; I2-L4 PolarHBondContact O-N 2.83Å; L4-I7 HydrophobicContact CD1-CD1 4.37Å; L4-G8 PolarHBondContact O-N 3.38Å; L4-C105 HydrophobicContact CD1-CB 4.28Å; L4-T106 HydrophobicContact CD2-CG2 3.79Å
5	I	44.6	Very low	48.8	Very low	70 Å²	70	74.3 Å²	74.3	36%	0.359	40%	0.399	S	S	.	.	H	α-helix	trans	-87.2	-43.6	177.3	-51.2	175.4	0	0	0	110.3	I2 P3 I7 G8 E9 M938	I2-I5 WeakPolarHBondContact O-CB 3.44Å; I2-I5 PolarHBondContact O-N 3.39Å; P3-I5 PolarHBondContact O-N 2.97Å; I5-I7 VanDerWaalsContact C-N 3.32Å; I5-G8 VanDerWaalsContact O-CA 3.25Å; I5-G8 WeakPolarHBondContact O-CA 3.47Å; I5-G8 PolarHBondContact O-N 3.31Å; I5-E9 PolarHBondContact O-N 3.29Å; I5-E9 VanDerWaalsContact O-N 3.15Å; I5-M938 HydrophobicContact CD1-CE 3.65Å; I5-M938 HydrophobicContact CD1-SD 3.94Å; I5-M938 HydrophobicContact CG1-CE 4.46Å
6	H	42.7	Very low	49.8	Very low	108 Å²	108	74.2 Å²	74.2	50%	0.5	40%	0.397	S	S	.	.	H	α-helix	trans	-66.7	-33.3	169.9	-78.4	-50.5	0	0	0	111.9	I2 P3 G8 E9 N10	I2-H6 PolarHBondContact O-N 3.24Å; P3-H6 PolarHBondContact O-N 3.14Å; H6-G8 PolarHBondContact O-N 3.1Å; H6-E9 IonicContact CE1-OE2 2.62Å; H6-E9 PolarHBondContact CE1-OE2 3.37Å; H6-E9 IonicContact CG-OE2 2.69Å; H6-E9 IonicContact ND1-OE2 3.78Å; H6-E9 PolarHBondContact ND1-OE2 3.38Å; H6-E9 PolarHBondContact O-N 3.27Å; H6-N10 WeakPolarHBondContact O-CB 3.29Å; H6-N10 PolarHBondContact O-N 2.97Å
7	I	45.8	Very low	50.7	Low	59 Å²	59	75.8 Å²	75.8	30%	0.303	40%	0.4	S	S	.	.	H	α-helix	trans	-58.7	-32.5	164.9	-73.6	164.4	0	0	0	110.7	P3 L4 I5 N10 L11	P3-I7 WeakPolarHBondContact O-CB 3.41Å; P3-I7 WeakPolarHBondContact O-CD1 3.26Å; P3-I7 WeakPolarHBondContact O-CG1 3.47Å; P3-I7 PolarHBondContact O-N 3.16Å; L4-I7 HydrophobicContact CD1-CD1 4.37Å; I5-I7 VanDerWaalsContact C-N 3.32Å; I7-N10 CarbonylContact O-C 3.6Å; I7-N10 PolarHBondContact O-N 3.03Å; I7-L11 HydrophobicContact CG2-CD1 4.21Å; I7-L11 WeakPolarHBondContact O-CA 3.4Å; I7-L11 VanDerWaalsContact O-CB 3.23Å; I7-L11 WeakPolarHBondContact O-CB 3.27Å; I7-L11 PolarHBondContact O-N 2.84Å
8	G	44.9	Very low	51.1	Low	34 Å²	34	72.3 Å²	72.3	35%	0.351	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-36.5	174.4	0	0	0	0	0	114.1	L4 I5 H6 L11	L4-G8 PolarHBondContact O-N 3.38Å; I5-G8 VanDerWaalsContact O-CA 3.25Å; I5-G8 WeakPolarHBondContact O-CA 3.47Å; I5-G8 PolarHBondContact O-N 3.31Å; H6-G8 PolarHBondContact O-N 3.1Å; G8-L11 WeakPolarHBondContact O-CB 3.37Å; G8-L11 PolarHBondContact O-N 2.97Å
9	E	52.5	Low	51.4	Low	124 Å²	124	72.5 Å²	72.5	58%	0.579	38%	0.38	S	S	*	.	H	α-helix	trans	-70.6	-41.8	172.3	-67.2	171.5	152.4	0	0	110.7	I5 H6 L11 P13	I5-E9 PolarHBondContact O-N 3.29Å; I5-E9 VanDerWaalsContact O-N 3.15Å; H6-E9 IonicContact CE1-OE2 2.62Å; H6-E9 PolarHBondContact CE1-OE2 3.37Å; H6-E9 IonicContact CG-OE2 2.69Å; H6-E9 IonicContact ND1-OE2 3.78Å; H6-E9 PolarHBondContact ND1-OE2 3.38Å; H6-E9 PolarHBondContact O-N 3.27Å; E9-L11 VanDerWaalsContact C-N 3.27Å; E9-L11 PolarHBondContact O-N 3.3Å; E9-P13 VanDerWaalsContact O-CD 3.27Å; E9-P13 WeakPolarHBondContact O-CD 3.48Å
10	N	55.8	Low	51.9	Low	107 Å²	107	75.3 Å²	75.3	57%	0.572	39%	0.389	S	S	*	.	H	α-helix	trans	-75.6	-9.6	174.6	-67.8	-2.5	0	0	0	113.5	H6 I7 P13 F14	H6-N10 WeakPolarHBondContact O-CB 3.29Å; H6-N10 PolarHBondContact O-N 2.97Å; I7-N10 CarbonylContact O-C 3.6Å; I7-N10 PolarHBondContact O-N 3.03Å; N10-P13 WeakPolarHBondContact O-CD 3.32Å; N10-P13 WeakPolarHBondContact O-CG 3.48Å; N10-F14 WeakPolarHBondContact O-CB 3.32Å; N10-F14 PolarHBondContact O-N 2.94Å
11	L	56.7	Low	52.5	Low	13 Å²	13	72.8 Å²	72.8	7%	0.068	38%	0.375	C	S	.	.	H	α-helix	trans	-69.3	-40.1	-174.7	-156.7	82.2	0	0	0	111.1	I7 G8 E9 F14 I15 I920 L921 I924	I7-L11 HydrophobicContact CG2-CD1 4.21Å; I7-L11 WeakPolarHBondContact O-CA 3.4Å; I7-L11 VanDerWaalsContact O-CB 3.23Å; I7-L11 WeakPolarHBondContact O-CB 3.27Å; I7-L11 PolarHBondContact O-N 2.84Å; G8-L11 WeakPolarHBondContact O-CB 3.37Å; G8-L11 PolarHBondContact O-N 2.97Å; E9-L11 VanDerWaalsContact C-N 3.27Å; E9-L11 PolarHBondContact O-N 3.3Å; L11-F14 PolarHBondContact O-N 2.97Å; L11-I15 HydrophobicContact CD2-CD1 3.95Å; L11-I15 HydrophobicContact CG-CD1 3.86Å; L11-I15 HydrophobicContact CG-CG1 4.49Å; L11-I15 WeakPolarHBondContact O-CB 3.47Å; L11-I15 WeakPolarHBondContact O-CD1 3.48Å; L11-I15 WeakPolarHBondContact O-CG1 3.25Å; L11-I15 PolarHBondContact O-N 2.99Å; L11-I920 HydrophobicContact CD1-CG2 4.1Å; L11-I920 HydrophobicContact CD2-CG2 4.04Å; L11-L921 HydrophobicContact CD2-CD2 3.69Å; L11-L921 HydrophobicContact CD2-CG 4.32Å; L11-I924 HydrophobicContact CD2-CD1 3.97Å
12	L	57.3	Low	53.6	Low	114 Å²	114	67.9 Å²	67.9	60%	0.597	35%	0.353	S	S	*	.	H	α-helix	trans	-64.9	-52	177.9	-175.6	64.4	0	0	0	111.7	F14 I15 L16	L12-F14 VanDerWaalsContact C-N 3.28Å; L12-F14 PolarHBondContact O-N 2.86Å; L12-I15 PolarHBondContact O-N 2.83Å; L12-L16 HydrophobicContact CG-CD1 4.19Å; L12-L16 WeakPolarHBondContact O-CB 3.36Å; L12-L16 VanDerWaalsContact O-CG 3.31Å; L12-L16 WeakPolarHBondContact O-CG 3.5Å; L12-L16 PolarHBondContact O-N 3.31Å
13	P	61.3	Low	54.8	Low	68 Å²	68	66.5 Å²	66.5	44%	0.442	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-28.2	173.5	24.4	-32.3	0	0	0	113	E9 N10 F17	E9-P13 VanDerWaalsContact O-CD 3.27Å; E9-P13 WeakPolarHBondContact O-CD 3.48Å; N10-P13 WeakPolarHBondContact O-CD 3.32Å; N10-P13 WeakPolarHBondContact O-CG 3.48Å; P13-F17 WeakPolarHBondContact O-CB 3.21Å; P13-F17 PolarHBondContact O-N 3.26Å
14	F	63.7	Low	55.4	Low	47 Å²	47	67.4 Å²	67.4	21%	0.206	35%	0.345	C	S	.	.	H	α-helix	trans	-68.6	-39.3	172	-177.6	-105.7	0	0	0	112.7	N10 L11 L12 F17 I18 F98 L99	N10-F14 WeakPolarHBondContact O-CB 3.32Å; N10-F14 PolarHBondContact O-N 2.94Å; L11-F14 PolarHBondContact O-N 2.97Å; L12-F14 VanDerWaalsContact C-N 3.28Å; L12-F14 PolarHBondContact O-N 2.86Å; F14-F17 HydrophobicContact CD2-CD1 4.43Å; F14-F17 PolarHBondContact O-N 3.3Å; F14-I18 HydrophobicContact CD1-CD1 3.95Å; F14-I18 HydrophobicContact CE1-CD1 3.5Å; F14-I18 VanDerWaalsContact CE1-CD1 3.5Å; F14-I18 HydrophobicContact CE1-CG1 4.38Å; F14-I18 HydrophobicContact CZ-CD1 3.91Å; F14-I18 HydrophobicContact CZ-CG1 4.45Å; F14-I18 WeakPolarHBondContact O-CG1 3.28Å; F14-I18 PolarHBondContact O-N 3.42Å; F14-F98 HydrophobicContact CD1-CE1 4.06Å; F14-F98 AromaticContact CE1-CD1 3.57Å; F14-F98 HydrophobicContact CE1-CD1 3.57Å; F14-F98 AromaticContact CE1-CE1 3.48Å; F14-F98 HydrophobicContact CE1-CE1 3.48Å; F14-F98 VanDerWaalsContact CE1-CE1 3.48Å; F14-F98 HydrophobicContact CE2-CD1 4.34Å; F14-F98 HydrophobicContact CE2-CE1 4.28Å; F14-F98 AromaticContact CZ-CD1 3.43Å; F14-F98 HydrophobicContact CZ-CD1 3.43Å; F14-F98 VanDerWaalsContact CZ-CD1 3.43Å; F14-F98 AromaticContact CZ-CE1 3.61Å; F14-F98 HydrophobicContact CZ-CE1 3.61Å; F14-F98 HydrophobicContact CZ-CG 4.37Å; F14-L99 HydrophobicContact CE1-CD2 4.28Å
15	I	60.2	Low	56.1	Low	17 Å²	17	65.1 Å²	65.1	9%	0.087	33%	0.333	C	S	.	.	H	α-helix	trans	-69.2	-41.3	174.8	-71.3	164.1	0	0	0	110.7	L11 L12 F17 I18 Q19 F914 L921	L11-I15 HydrophobicContact CD2-CD1 3.95Å; L11-I15 HydrophobicContact CG-CD1 3.86Å; L11-I15 HydrophobicContact CG-CG1 4.49Å; L11-I15 WeakPolarHBondContact O-CB 3.47Å; L11-I15 WeakPolarHBondContact O-CD1 3.48Å; L11-I15 WeakPolarHBondContact O-CG1 3.25Å; L11-I15 PolarHBondContact O-N 2.99Å; L12-I15 PolarHBondContact O-N 2.83Å; I15-F17 VanDerWaalsContact C-N 3.32Å; I15-I18 PolarHBondContact O-N 3.02Å; I15-Q19 PolarHBondContact O-N 3.47Å; I15-F914 HydrophobicContact CG2-CE2 3.61Å; I15-F914 HydrophobicContact CG2-CZ 3.79Å; I15-L921 HydrophobicContact CD1-CD1 3.94Å; I15-L921 HydrophobicContact CD1-CD2 4.03Å; I15-L921 HydrophobicContact CD1-CG 4.15Å
16	L	64	Low	56.6	Low	72 Å²	72	62.2 Å²	62.2	38%	0.377	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-39.1	171.5	-69.4	169	0	0	0	111.1	L12 Q19 F20	L12-L16 HydrophobicContact CG-CD1 4.19Å; L12-L16 WeakPolarHBondContact O-CB 3.36Å; L12-L16 VanDerWaalsContact O-CG 3.31Å; L12-L16 WeakPolarHBondContact O-CG 3.5Å; L12-L16 PolarHBondContact O-N 3.31Å; L16-Q19 CarbonylContact O-C 3.55Å; L16-Q19 WeakPolarHBondContact O-CA 3.46Å; L16-Q19 WeakPolarHBondContact O-CB 3.31Å; L16-Q19 PolarHBondContact O-N 2.97Å; L16-Q19 VanDerWaalsContact O-N 3.13Å; L16-F20 WeakPolarHBondContact O-CD2 3.31Å; L16-F20 PolarHBondContact O-N 3.5Å
17	F	64.9	Low	56.9	Low	101 Å²	101	65.1 Å²	65.1	44%	0.443	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-37.8	174.8	174	-106.2	0	0	0	112	P13 F14 I15 Q19 F20 Y21 F91	P13-F17 WeakPolarHBondContact O-CB 3.21Å; P13-F17 PolarHBondContact O-N 3.26Å; F14-F17 HydrophobicContact CD2-CD1 4.43Å; F14-F17 PolarHBondContact O-N 3.3Å; I15-F17 VanDerWaalsContact C-N 3.32Å; F17-Q19 VanDerWaalsContact C-N 3.33Å; F17-Q19 PolarHBondContact O-N 3.44Å; F17-F20 PolarHBondContact O-N 3.2Å; F17-Y21 WeakPolarHBondContact O-CB 3.24Å; F17-Y21 PolarHBondContact O-N 2.91Å; F17-F91 HydrophobicContact CE1-CE1 4.29Å; F17-F91 AromaticContact CE1-CZ 3.77Å; F17-F91 HydrophobicContact CE1-CZ 3.77Å; F17-F91 AromaticContact CZ-CZ 3.85Å; F17-F91 HydrophobicContact CZ-CZ 3.85Å
18	I	58.8	Low	57	Low	13 Å²	13	63.3 Å²	63.3	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-39.1	169.2	-71.7	168.7	0	0	0	111.2	F14 I15 G22 I95 I913 F914	F14-I18 HydrophobicContact CD1-CD1 3.95Å; F14-I18 HydrophobicContact CE1-CD1 3.5Å; F14-I18 VanDerWaalsContact CE1-CD1 3.5Å; F14-I18 HydrophobicContact CE1-CG1 4.38Å; F14-I18 HydrophobicContact CZ-CD1 3.91Å; F14-I18 HydrophobicContact CZ-CG1 4.45Å; F14-I18 WeakPolarHBondContact O-CG1 3.28Å; F14-I18 PolarHBondContact O-N 3.42Å; I15-I18 PolarHBondContact O-N 3.02Å; I18-G22 PolarHBondContact O-N 2.88Å; I18-I95 HydrophobicContact CD1-CG2 3.91Å; I18-I95 HydrophobicContact CG1-CG2 4.35Å; I18-I913 HydrophobicContact CG2-CG2 4.5Å; I18-F914 HydrophobicContact CG2-CD2 4.35Å
19	Q	56.7	Low	57.1	Low	76 Å²	76	65 Å²	65	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-50.9	173.9	-69	-177.3	-31.2	0	0	111.5	I15 L16 F17 Y21 G22 I23 F914	I15-Q19 PolarHBondContact O-N 3.47Å; L16-Q19 CarbonylContact O-C 3.55Å; L16-Q19 WeakPolarHBondContact O-CA 3.46Å; L16-Q19 WeakPolarHBondContact O-CB 3.31Å; L16-Q19 PolarHBondContact O-N 2.97Å; L16-Q19 VanDerWaalsContact O-N 3.13Å; F17-Q19 VanDerWaalsContact C-N 3.33Å; F17-Q19 PolarHBondContact O-N 3.44Å; Q19-Y21 PolarHBondContact O-N 3.34Å; Q19-G22 PolarHBondContact O-N 3.38Å; Q19-I23 WeakPolarHBondContact O-CB 3.35Å; Q19-I23 WeakPolarHBondContact O-CD1 3.36Å; Q19-I23 WeakPolarHBondContact O-CG1 3.32Å; Q19-I23 PolarHBondContact O-N 3.23Å; Q19-F914 HydrophobicContact CG-CD2 4.33Å; Q19-F914 HydrophobicContact CG-CE2 3.55Å; Q19-F914 HydrophobicContact CG-CZ 4Å
20	F	60.3	Low	57.1	Low	128 Å²	128	62.7 Å²	62.7	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-60.7	-43	177.1	-77.7	-64.9	0	0	0	112	L16 F17 I23 I24	L16-F20 WeakPolarHBondContact O-CD2 3.31Å; L16-F20 PolarHBondContact O-N 3.5Å; F17-F20 PolarHBondContact O-N 3.2Å; F20-I23 PolarHBondContact O-N 3.18Å; F20-I24 HydrophobicContact CB-CD1 4.43Å; F20-I24 VanDerWaalsContact O-CB 3.3Å; F20-I24 WeakPolarHBondContact O-CB 3.41Å; F20-I24 WeakPolarHBondContact O-CD1 3.41Å; F20-I24 WeakPolarHBondContact O-CG1 3.4Å; F20-I24 PolarHBondContact O-N 3.04Å
21	Y	64.4	Low	56.5	Low	24 Å²	24	63.8 Å²	63.8	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-47.9	177.2	173.8	-108.1	0	0	0	111.8	F17 Q19 I23 I24 I25 Y88 F91 D92 I95 Y910	F17-Y21 WeakPolarHBondContact O-CB 3.24Å; F17-Y21 PolarHBondContact O-N 2.91Å; Q19-Y21 PolarHBondContact O-N 3.34Å; Y21-I23 VanDerWaalsContact C-N 3.32Å; Y21-I23 PolarHBondContact O-N 3Å; Y21-I24 PolarHBondContact O-N 3.43Å; Y21-I25 HydrophobicContact CD1-CD1 3.7Å; Y21-I25 HydrophobicContact CD2-CD1 4.03Å; Y21-I25 HydrophobicContact CD2-CG1 4.29Å; Y21-I25 HydrophobicContact CE1-CD1 3.24Å; Y21-I25 HydrophobicContact CE1-CG1 4.41Å; Y21-I25 HydrophobicContact CE2-CD1 3.6Å; Y21-I25 HydrophobicContact CE2-CG1 3.94Å; Y21-I25 HydrophobicContact CG-CD1 4.05Å; Y21-I25 WeakPolarHBondContact O-CD1 3.21Å; Y21-I25 VanDerWaalsContact O-CG1 3.31Å; Y21-I25 WeakPolarHBondContact O-CG1 3.23Å; Y21-I25 PolarHBondContact O-N 3.38Å; Y21-I25 WeakPolarHBondContact OH-CD1 3.46Å; Y21-Y88 HydrophobicContact CE2-CD1 4.25Å; Y21-F91 HydrophobicContact CD1-CD1 4.17Å; Y21-F91 AromaticContact CD1-CE1 3.94Å; Y21-F91 HydrophobicContact CD1-CE1 3.94Å; Y21-F91 HydrophobicContact CD2-CD1 4.21Å; Y21-F91 AromaticContact CD2-CE1 3.82Å; Y21-F91 HydrophobicContact CD2-CE1 3.82Å; Y21-F91 AromaticContact CE1-CD1 3.49Å; Y21-F91 HydrophobicContact CE1-CD1 3.49Å; Y21-F91 VanDerWaalsContact CE1-CD1 3.49Å; Y21-F91 AromaticContact CE1-CE1 3.75Å; Y21-F91 HydrophobicContact CE1-CE1 3.75Å; Y21-F91 AromaticContact CE2-CD1 3.54Å; Y21-F91 HydrophobicContact CE2-CD1 3.54Å; Y21-F91 AromaticContact CE2-CE1 3.63Å; Y21-F91 HydrophobicContact CE2-CE1 3.63Å; Y21-F91 HydrophobicContact CE2-CG 4.3Å; Y21-F91 HydrophobicContact CG-CD1 4.5Å; Y21-F91 AromaticContact CG-CE1 3.98Å; Y21-F91 HydrophobicContact CG-CE1 3.98Å; Y21-F91 AromaticContact CZ-CD1 3.15Å; Y21-F91 AromaticContact CZ-CE1 3.62Å; Y21-F91 WeakPolarHBondContact OH-CD1 3.14Å; Y21-D92 WeakPolarHBondContact CE1-OD1 3.5Å; Y21-D92 PolarHBondContact OH-OD1 2.81Å; Y21-I95 HydrophobicContact CD1-CD1 3.74Å; Y21-I95 HydrophobicContact CE1-CD1 3.59Å; Y21-Y910 HydrophobicContact CE1-CE1 4.49Å
22	G	55.8	Low	56.2	Low	9 Å²	9	66.6 Å²	66.6	9%	0.093	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-37.3	175	0	0	0	0	0	113.2	I18 Q19 T26	I18-G22 PolarHBondContact O-N 2.88Å; Q19-G22 PolarHBondContact O-N 3.38Å; G22-T26 WeakPolarHBondContact O-CB 3.44Å; G22-T26 PolarHBondContact O-N 2.83Å; G22-T26 VanDerWaalsContact O-N 3.11Å; G22-T26 PolarHBondContact O-OG1 2.8Å
23	I	59.1	Low	55.4	Low	75 Å²	75	64.3 Å²	64.3	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-64.5	-49.9	172.4	-71.8	166.4	0	0	0	110.5	Q19 F20 Y21 T26 Y27	Q19-I23 WeakPolarHBondContact O-CB 3.35Å; Q19-I23 WeakPolarHBondContact O-CD1 3.36Å; Q19-I23 WeakPolarHBondContact O-CG1 3.32Å; Q19-I23 PolarHBondContact O-N 3.23Å; F20-I23 PolarHBondContact O-N 3.18Å; Y21-I23 VanDerWaalsContact C-N 3.32Å; Y21-I23 PolarHBondContact O-N 3Å; I23-T26 PolarHBondContact O-N 3.46Å; I23-T26 VanDerWaalsContact O-N 3.13Å; I23-Y27 HydrophobicContact CG2-CD2 3.66Å; I23-Y27 HydrophobicContact CG2-CE2 3.81Å; I23-Y27 WeakPolarHBondContact O-CD2 3.45Å; I23-Y27 PolarHBondContact O-N 3.37Å
24	I	53.5	Low	54.5	Low	104 Å²	104	65.4 Å²	65.4	53%	0.533	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-44.8	-177.6	-72.9	162.2	0	0	0	111.6	F20 Y21 T26 Y27 G28	F20-I24 HydrophobicContact CB-CD1 4.43Å; F20-I24 VanDerWaalsContact O-CB 3.3Å; F20-I24 WeakPolarHBondContact O-CB 3.41Å; F20-I24 WeakPolarHBondContact O-CD1 3.41Å; F20-I24 WeakPolarHBondContact O-CG1 3.4Å; F20-I24 PolarHBondContact O-N 3.04Å; Y21-I24 PolarHBondContact O-N 3.43Å; I24-T26 VanDerWaalsContact C-N 3.31Å; I24-T26 PolarHBondContact O-N 2.85Å; I24-Y27 PolarHBondContact O-N 2.99Å; I24-G28 PolarHBondContact O-N 3.46Å
25	I	55.3	Low	53.7	Low	4 Å²	4	66.1 Å²	66.1	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-44.8	173.2	-64.1	157	0	0	0	110.1	Y21 G28 K29 Y88 Y910	Y21-I25 HydrophobicContact CD1-CD1 3.7Å; Y21-I25 HydrophobicContact CD2-CD1 4.03Å; Y21-I25 HydrophobicContact CD2-CG1 4.29Å; Y21-I25 HydrophobicContact CE1-CD1 3.24Å; Y21-I25 HydrophobicContact CE1-CG1 4.41Å; Y21-I25 HydrophobicContact CE2-CD1 3.6Å; Y21-I25 HydrophobicContact CE2-CG1 3.94Å; Y21-I25 HydrophobicContact CG-CD1 4.05Å; Y21-I25 WeakPolarHBondContact O-CD1 3.21Å; Y21-I25 VanDerWaalsContact O-CG1 3.31Å; Y21-I25 WeakPolarHBondContact O-CG1 3.23Å; Y21-I25 PolarHBondContact O-N 3.38Å; Y21-I25 WeakPolarHBondContact OH-CD1 3.46Å; I25-G28 PolarHBondContact O-N 3.39Å; I25-K29 WeakPolarHBondContact O-CB 3.36Å; I25-K29 PolarHBondContact O-N 3.49Å; I25-Y88 HydrophobicContact CD1-CD1 4.36Å; I25-Y88 HydrophobicContact CG1-CD1 3.84Å; I25-Y88 HydrophobicContact CG1-CE1 3.82Å; I25-Y910 HydrophobicContact CB-CE2 4.44Å; I25-Y910 HydrophobicContact CD1-CE1 3.86Å; I25-Y910 HydrophobicContact CD1-CE2 4.11Å; I25-Y910 WeakPolarHBondContact CD1-OH 3.46Å; I25-Y910 HydrophobicContact CG2-CE2 4.02Å
26	T	53.9	Low	52.9	Low	10 Å²	10	69.5 Å²	69.5	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-68	-39.7	-175.8	-51.7	0	0	0	0	111.2	G22 I23 I24 K29 I30 W907	G22-T26 WeakPolarHBondContact O-CB 3.44Å; G22-T26 PolarHBondContact O-N 2.83Å; G22-T26 VanDerWaalsContact O-N 3.11Å; G22-T26 PolarHBondContact O-OG1 2.8Å; I23-T26 PolarHBondContact O-N 3.46Å; I23-T26 VanDerWaalsContact O-N 3.13Å; I24-T26 VanDerWaalsContact C-N 3.31Å; I24-T26 PolarHBondContact O-N 2.85Å; T26-K29 PolarHBondContact O-N 3.05Å; T26-I30 HydrophobicContact CG2-CD1 3.69Å; T26-I30 HydrophobicContact CG2-CG1 4.31Å; T26-I30 VanDerWaalsContact O-CB 3.3Å; T26-I30 WeakPolarHBondContact O-CB 3.15Å; T26-I30 WeakPolarHBondContact O-CD1 3.37Å; T26-I30 WeakPolarHBondContact O-CG1 3.21Å; T26-I30 PolarHBondContact O-N 3.27Å; T26-W907 HydrophobicContact CG2-CD2 4.34Å; T26-W907 VanDerWaalsContact CG2-CE2 3.49Å; T26-W907 HydrophobicContact CG2-CH2 4.17Å; T26-W907 HydrophobicContact CG2-CZ2 3.4Å
27	Y	50.2	Low	52.1	Low	168 Å²	168	69.4 Å²	69.4	66%	0.659	35%	0.346	S	S	*	.	H	α-helix	trans	-62	-51.6	170	-87.5	-76.6	0	0	0	111.8	I23 I24 K29 I30 E31	I23-Y27 HydrophobicContact CG2-CD2 3.66Å; I23-Y27 HydrophobicContact CG2-CE2 3.81Å; I23-Y27 WeakPolarHBondContact O-CD2 3.45Å; I23-Y27 PolarHBondContact O-N 3.37Å; I24-Y27 PolarHBondContact O-N 2.99Å; Y27-K29 PolarHBondContact O-N 3.14Å; Y27-I30 CarbonylContact O-C 3.59Å; Y27-I30 PolarHBondContact O-N 2.76Å; Y27-E31 VanDerWaalsContact O-CB 3.22Å; Y27-E31 WeakPolarHBondContact O-CB 3.19Å; Y27-E31 PolarHBondContact O-N 2.94Å
28	G	46.8	Very low	50.9	Low	22 Å²	22	67.2 Å²	67.2	23%	0.227	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-26.5	179.2	0	0	0	0	0	114	I24 I25 T32	I24-G28 PolarHBondContact O-N 3.46Å; I25-G28 PolarHBondContact O-N 3.39Å; G28-T32 WeakPolarHBondContact O-CB 3.39Å; G28-T32 WeakPolarHBondContact O-CG2 3.27Å; G28-T32 PolarHBondContact O-N 3.18Å; G28-T32 PolarHBondContact O-OG1 2.9Å
29	K	48.7	Very low	50.1	Low	69 Å²	69	72.4 Å²	72.4	30%	0.3	37%	0.367	S	S	.	.	H	α-helix	trans	-84	-33	176.2	-164.7	174.8	-170.4	174	0	112.7	I25 T26 Y27 T32 L33 T906	I25-K29 WeakPolarHBondContact O-CB 3.36Å; I25-K29 PolarHBondContact O-N 3.49Å; T26-K29 PolarHBondContact O-N 3.05Å; Y27-K29 PolarHBondContact O-N 3.14Å; K29-T32 WeakPolarHBondContact CA-OG1 3.46Å; K29-T32 PolarHBondContact O-OG1 3.11Å; K29-L33 WeakPolarHBondContact O-CB 3.25Å; K29-L33 PolarHBondContact O-N 3.41Å; K29-T906 HydrophobicContact CD-CG2 4.18Å; K29-T906 PolarHBondContact NZ-OG1 3.48Å
30	I	51.1	Low	49.4	Very low	76 Å²	76	73 Å²	73	39%	0.39	37%	0.373	S	S	.	.	H	α-helix	trans	-70.2	-38	168.2	-71.3	166	0	0	0	109.8	T26 Y27 L33 N34	T26-I30 HydrophobicContact CG2-CD1 3.69Å; T26-I30 HydrophobicContact CG2-CG1 4.31Å; T26-I30 VanDerWaalsContact O-CB 3.3Å; T26-I30 WeakPolarHBondContact O-CB 3.15Å; T26-I30 WeakPolarHBondContact O-CD1 3.37Å; T26-I30 WeakPolarHBondContact O-CG1 3.21Å; T26-I30 PolarHBondContact O-N 3.27Å; Y27-I30 CarbonylContact O-C 3.59Å; Y27-I30 PolarHBondContact O-N 2.76Å; I30-L33 PolarHBondContact O-N 3.29Å; I30-N34 WeakPolarHBondContact O-CB 3.47Å; I30-N34 PolarHBondContact O-N 2.87Å; I30-N34 PolarHBondContact O-ND2 3.29Å; I30-N34 PolarHBondContact O-OD1 2.89Å
31	E	43.8	Very low	48.3	Very low	130 Å²	130	72.5 Å²	72.5	61%	0.607	37%	0.372	S	S	*	.	H	α-helix	trans	-67.1	-47.7	176.8	-174.1	171	-158.1	0	0	111.3	Y27 N34 T35	Y27-E31 VanDerWaalsContact O-CB 3.22Å; Y27-E31 WeakPolarHBondContact O-CB 3.19Å; Y27-E31 PolarHBondContact O-N 2.94Å; E31-N34 PolarHBondContact O-N 3.26Å; E31-T35 WeakPolarHBondContact O-CG2 3.42Å; E31-T35 PolarHBondContact O-N 3.13Å; E31-T35 PolarHBondContact O-OG1 3.29Å
32	T	49.7	Very low	46.9	Very low	71 Å²	71	78.2 Å²	78.2	44%	0.436	40%	0.399	S	S	.	.	H	α-helix	trans	-66.4	-35	172.9	46.3	0	0	0	0	113	G28 K29 T35 I36	G28-T32 WeakPolarHBondContact O-CB 3.39Å; G28-T32 WeakPolarHBondContact O-CG2 3.27Å; G28-T32 PolarHBondContact O-N 3.18Å; G28-T32 PolarHBondContact O-OG1 2.9Å; K29-T32 WeakPolarHBondContact CA-OG1 3.46Å; K29-T32 PolarHBondContact O-OG1 3.11Å; T32-T35 WeakPolarHBondContact CA-OG1 3.45Å; T32-T35 PolarHBondContact O-OG1 2.87Å; T32-I36 WeakPolarHBondContact O-CB 3.39Å; T32-I36 WeakPolarHBondContact O-CD1 3.46Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 2.65Å
33	L	41.6	Very low	45.9	Very low	67 Å²	67	84.1 Å²	84.1	35%	0.351	42%	0.424	S	S	.	.	H	α-helix	trans	-66.2	-40.3	171.5	-172.7	68.2	0	0	0	111.3	K29 I30 I36 I37	K29-L33 WeakPolarHBondContact O-CB 3.25Å; K29-L33 PolarHBondContact O-N 3.41Å; I30-L33 PolarHBondContact O-N 3.29Å; L33-I36 PolarHBondContact O-N 3.06Å; L33-I37 HydrophobicContact CD1-CD1 4.36Å; L33-I37 HydrophobicContact CD2-CD1 4.38Å; L33-I37 HydrophobicContact CG-CD1 3.84Å; L33-I37 HydrophobicContact CG-CG1 4.49Å; L33-I37 VanDerWaalsContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CG1 3.46Å; L33-I37 PolarHBondContact O-N 3.43Å
34	N	42.8	Very low	45	Very low	90 Å²	90	84.5 Å²	84.5	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-70.5	-33.6	178.5	-75	-8	0	0	0	112.5	I30 E31 S38	I30-N34 WeakPolarHBondContact O-CB 3.47Å; I30-N34 PolarHBondContact O-N 2.87Å; I30-N34 PolarHBondContact O-ND2 3.29Å; I30-N34 PolarHBondContact O-OD1 2.89Å; E31-N34 PolarHBondContact O-N 3.26Å; N34-S38 WeakPolarHBondContact O-CB 3.38Å; N34-S38 PolarHBondContact O-N 2.87Å; N34-S38 PolarHBondContact O-OG 3.26Å
35	T	45.4	Very low	43.9	Very low	63 Å²	63	84.4 Å²	84.4	39%	0.387	43%	0.43	S	S	.	.	H	α-helix	trans	-73.2	-36.4	172.4	55.6	0	0	0	0	111.9	E31 T32 S38 Q39	E31-T35 WeakPolarHBondContact O-CG2 3.42Å; E31-T35 PolarHBondContact O-N 3.13Å; E31-T35 PolarHBondContact O-OG1 3.29Å; T32-T35 WeakPolarHBondContact CA-OG1 3.45Å; T32-T35 PolarHBondContact O-OG1 2.87Å; T35-S38 WeakPolarHBondContact CA-OG 3.47Å; T35-S38 PolarHBondContact O-N 3.3Å; T35-S38 PolarHBondContact O-OG 2.88Å; T35-S38 VanDerWaalsContact O-OG 3.13Å; T35-Q39 VanDerWaalsContact O-CB 3.28Å; T35-Q39 WeakPolarHBondContact O-CB 3.33Å; T35-Q39 WeakPolarHBondContact O-CG 3.42Å; T35-Q39 PolarHBondContact O-N 3.38Å
36	I	44.9	Very low	42.6	Very low	87 Å²	87	89.6 Å²	89.6	45%	0.446	46%	0.457	S	S	.	.	H	α-helix	trans	-64.4	-41.5	170.2	-69.6	165.3	0	0	0	110.6	T32 L33 N40	T32-I36 WeakPolarHBondContact O-CB 3.39Å; T32-I36 WeakPolarHBondContact O-CD1 3.46Å; T32-I36 WeakPolarHBondContact O-CG1 3.32Å; T32-I36 PolarHBondContact O-N 2.65Å; L33-I36 PolarHBondContact O-N 3.06Å; I36-N40 VanDerWaalsContact O-CB 3.24Å; I36-N40 WeakPolarHBondContact O-CB 3.5Å; I36-N40 PolarHBondContact O-N 3.09Å; I36-N40 PolarHBondContact O-ND2 3.11Å
37	I	46.4	Very low	41.5	Very low	71 Å²	71	92.5 Å²	92.5	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-67	-39.8	176.3	-74.5	169.5	0	0	0	111.4	L33 N40 H41	L33-I37 HydrophobicContact CD1-CD1 4.36Å; L33-I37 HydrophobicContact CD2-CD1 4.38Å; L33-I37 HydrophobicContact CG-CD1 3.84Å; L33-I37 HydrophobicContact CG-CG1 4.49Å; L33-I37 VanDerWaalsContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CB 3.31Å; L33-I37 WeakPolarHBondContact O-CG1 3.46Å; L33-I37 PolarHBondContact O-N 3.43Å; I37-N40 PolarHBondContact O-N 3.39Å; I37-H41 WeakPolarHBondContact O-CB 3.22Å; I37-H41 PolarHBondContact O-CD2 3.23Å; I37-H41 PolarHBondContact O-N 3.15Å
38	S	40.1	Very low	40.5	Very low	54 Å²	54	87.6 Å²	87.6	38%	0.378	47%	0.468	S	S	.	.	H	α-helix	trans	-71.1	-40.5	177.4	71.2	0	0	0	0	112	N34 T35 N40 H41 H42	N34-S38 WeakPolarHBondContact O-CB 3.38Å; N34-S38 PolarHBondContact O-N 2.87Å; N34-S38 PolarHBondContact O-OG 3.26Å; T35-S38 WeakPolarHBondContact CA-OG 3.47Å; T35-S38 PolarHBondContact O-N 3.3Å; T35-S38 PolarHBondContact O-OG 2.88Å; T35-S38 VanDerWaalsContact O-OG 3.13Å; S38-N40 VanDerWaalsContact C-N 3.35Å; S38-H41 PolarHBondContact O-N 2.82Å; S38-H42 PolarHBondContact O-CD2 2.87Å; S38-H42 PolarHBondContact O-N 2.7Å
39	Q	41.5	Very low	39.7	Very low	122 Å²	122	92.2 Å²	92.2	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-60.3	-43.8	170.8	-74.5	174.2	-4.2	0	0	111.4	T35 H42 H43	T35-Q39 VanDerWaalsContact O-CB 3.28Å; T35-Q39 WeakPolarHBondContact O-CB 3.33Å; T35-Q39 WeakPolarHBondContact O-CG 3.42Å; T35-Q39 PolarHBondContact O-N 3.38Å; Q39-H42 PolarHBondContact O-N 3.29Å; Q39-H43 PolarHBondContact O-N 2.99Å
40	N	42.9	Very low	38.6	Very low	90 Å²	90	98.3 Å²	98.3	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-39.9	175	-77	-24.7	0	0	0	112.4	I36 I37 S38 H43 V44	I36-N40 VanDerWaalsContact O-CB 3.24Å; I36-N40 WeakPolarHBondContact O-CB 3.5Å; I36-N40 PolarHBondContact O-N 3.09Å; I36-N40 PolarHBondContact O-ND2 3.11Å; I37-N40 PolarHBondContact O-N 3.39Å; S38-N40 VanDerWaalsContact C-N 3.35Å; N40-H43 PolarHBondContact O-N 3.1Å; N40-V44 WeakPolarHBondContact O-CB 3.37Å; N40-V44 VanDerWaalsContact O-CG2 3.25Å; N40-V44 WeakPolarHBondContact O-CG2 3.41Å; N40-V44 PolarHBondContact O-N 3.4Å
41	H	37	Very low	37.6	Very low	117 Å²	117	100.1 Å²	100.1	54%	0.542	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-38.4	174.1	-90.8	-63.6	0	0	0	112.5	I37 S38 V44 N45	I37-H41 WeakPolarHBondContact O-CB 3.22Å; I37-H41 PolarHBondContact O-CD2 3.23Å; I37-H41 PolarHBondContact O-N 3.15Å; S38-H41 PolarHBondContact O-N 2.82Å; H41-V44 PolarHBondContact O-N 3.18Å; H41-N45 WeakPolarHBondContact O-CB 3.43Å; H41-N45 PolarHBondContact O-N 2.92Å
42	H	33.9	Very low	36.8	Very low	143 Å²	143	99.2 Å²	99.2	66%	0.662	53%	0.527	S	S	*	.	H	α-helix	trans	-64.1	-40.6	171.1	-79.9	-67.2	0	0	0	112	S38 Q39 L46	S38-H42 PolarHBondContact O-CD2 2.87Å; S38-H42 PolarHBondContact O-N 2.7Å; Q39-H42 PolarHBondContact O-N 3.29Å; H42-L46 PolarHBondContact O-N 3.11Å; H42-L46 VanDerWaalsContact O-N 3.1Å
43	H	35.3	Very low	35.7	Very low	133 Å²	133	103.9 Å²	103.9	62%	0.616	54%	0.544	S	S	*	.	H	α-helix	trans	-67.7	-38	175.9	-110.2	-71.3	0	0	0	113.5	Q39 N40 L46 S47	Q39-H43 PolarHBondContact O-N 2.99Å; N40-H43 PolarHBondContact O-N 3.1Å; H43-L46 PolarHBondContact O-N 2.83Å; H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 3.08Å
44	V	40.3	Very low	35	Very low	83 Å²	83	107 Å²	107	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-71.3	-36.1	177.9	168.8	0	0	0	0	111.5	N40 H41 L46 S47 S48	N40-V44 WeakPolarHBondContact O-CB 3.37Å; N40-V44 VanDerWaalsContact O-CG2 3.25Å; N40-V44 WeakPolarHBondContact O-CG2 3.41Å; N40-V44 PolarHBondContact O-N 3.4Å; H41-V44 PolarHBondContact O-N 3.18Å; V44-L46 VanDerWaalsContact C-N 3.3Å; V44-S47 PolarHBondContact O-OG 3.45Å; V44-S48 WeakPolarHBondContact O-CB 3.45Å; V44-S48 PolarHBondContact O-N 3.11Å; V44-S48 VanDerWaalsContact O-N 3.16Å; V44-S48 PolarHBondContact O-OG 3.01Å; V44-S48 VanDerWaalsContact O-OG 3.14Å
45	N	29.8	Very low	34.3	Very low	103 Å²	103	109.2 Å²	109.2	55%	0.551	58%	0.577	S	S	*	*	H	α-helix	trans	-72.7	-20.6	172	-79.8	-0.4	0	0	0	113.3	H41 S48 I49	H41-N45 WeakPolarHBondContact O-CB 3.43Å; H41-N45 PolarHBondContact O-N 2.92Å; N45-S48 PolarHBondContact O-OG 3.29Å; N45-I49 WeakPolarHBondContact O-CD1 3.19Å; N45-I49 WeakPolarHBondContact O-CG1 3.45Å
46	L	29.1	Very low	33.5	Very low	113 Å²	113	112 Å²	112	59%	0.592	59%	0.594	S	S	*	*	H	α-helix	trans	-83.1	-38.2	171.6	-130.9	73.5	0	0	0	112.1	H42 H43 V44	H42-L46 PolarHBondContact O-N 3.11Å; H42-L46 VanDerWaalsContact O-N 3.1Å; H43-L46 PolarHBondContact O-N 2.83Å; V44-L46 VanDerWaalsContact C-N 3.3Å
47	S	31.4	Very low	32.7	Very low	70 Å²	70	115.6 Å²	115.6	49%	0.49	61%	0.609	S	S	.	*	H	α-helix	trans	-75.6	-24.5	-178.4	65.5	0	0	0	0	114	H43 V44 I49	H43-S47 PolarHBondContact O-N 3.47Å; H43-S47 PolarHBondContact O-OG 3.08Å; V44-S47 PolarHBondContact O-OG 3.45Å; S47-I49 VanDerWaalsContact C-N 3.35Å
48	S	29	Very low	32.2	Very low	66 Å²	66	119.6 Å²	119.6	46%	0.462	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-22.1	175.7	60.1	0	0	0	0	114.2	V44 N45	V44-S48 WeakPolarHBondContact O-CB 3.45Å; V44-S48 PolarHBondContact O-N 3.11Å; V44-S48 VanDerWaalsContact O-N 3.16Å; V44-S48 PolarHBondContact O-OG 3.01Å; V44-S48 VanDerWaalsContact O-OG 3.14Å; N45-S48 PolarHBondContact O-OG 3.29Å
49	I	28.5	Very low	31.8	Very low	118 Å²	118	124.8 Å²	124.8	61%	0.605	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-28.2	-179.1	-66.1	174	0	0	0	112	N45 S47	N45-I49 WeakPolarHBondContact O-CD1 3.19Å; N45-I49 WeakPolarHBondContact O-CG1 3.45Å; S47-I49 VanDerWaalsContact C-N 3.35Å
50	Y	26.9	Very low	31.3	Very low	198 Å²	198	124.8 Å²	124.8	78%	0.776	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	3.9	-172.7	-80.7	-75.9	0	0	0	115.7
51	T	29.3	Very low	31	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	7.6	-178.2	47.6	0	0	0	0	114.8
52	T	27.8	Very low	30.7	Very low	110 Å²	110	129.1 Å²	129.1	68%	0.675	68%	0.675	S	S	*	*	S	Bend	trans	-120.7	55	177.6	58.2	0	0	0	0	113.9
53	H	26.8	Very low	30.5	Very low	170 Å²	170	126.4 Å²	126.4	79%	0.787	67%	0.665	S	S	*	*	S	Bend	trans	-158.1	136.7	149	-107.3	-63.8	0	0	0	114.4
54	N	27.2	Very low	30.4	Very low	133 Å²	133	127.7 Å²	127.7	71%	0.711	67%	0.669	S	S	*	*			trans	55.4	108.7	153.1	-62	8.3	0	0	0	120.6	T56	N54-T56 PolarHBondContact O-N 3.5Å
55	T	26.5	Very low	30	Very low	135 Å²	135	126.6 Å²	126.6	83%	0.828	67%	0.665	S	S	*	*			trans	-50.9	120.7	147.2	46.5	0	0	0	0	113.3
56	T	28.4	Very low	30	Very low	121 Å²	121	126.6 Å²	126.6	74%	0.742	67%	0.665	S	S	*	*			trans	-170.7	143.8	138.1	23.3	0	0	0	0	112	N54	N54-T56 PolarHBondContact O-N 3.5Å
57	H	28.9	Very low	30.4	Very low	164 Å²	164	126.7 Å²	126.7	76%	0.759	66%	0.664	S	S	*	*			trans	28.8	108.1	160.1	-69	-80.5	0	0	0	122.6	E59	H57-E59 PolarHBondContact O-N 3.46Å
58	N	35.6	Very low	30.5	Very low	154 Å²	154	128.4 Å²	128.4	82%	0.824	67%	0.668	S	S	*	*	S	Bend	trans	53.1	-19	135.3	-89.8	11.8	0	0	0	124.8	N60	N58-N60 VanDerWaalsContact C-N 3.3Å; N58-N60 PolarHBondContact O-N 3.38Å
59	E	32.3	Very low	30.6	Very low	163 Å²	163	130 Å²	130	76%	0.762	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-16.4	-177.5	-64.5	-167	153.7	0	0	113.8	H57 L61 Q62	H57-E59 PolarHBondContact O-N 3.46Å; E59-L61 PolarHBondContact O-N 2.66Å; E59-Q62 PolarHBondContact O-N 3.2Å
60	N	31.4	Very low	30.7	Very low	123 Å²	123	130.3 Å²	130.3	66%	0.658	67%	0.67	S	S	*	*	H	α-helix	trans	-65.9	-3.1	-174.9	-92.2	-31.4	0	0	0	116.5	N58	N58-N60 VanDerWaalsContact C-N 3.3Å; N58-N60 PolarHBondContact O-N 3.38Å
61	L	35.6	Very low	31	Very low	140 Å²	140	124 Å²	124	73%	0.733	65%	0.654	S	S	*	*	H	α-helix	trans	-77.7	-37	172.3	-94.8	163.3	0	0	0	112.9	E59 K64	E59-L61 PolarHBondContact O-N 2.66Å; L61-K64 PolarHBondContact O-N 3.45Å
62	Q	29.9	Very low	31.2	Very low	157 Å²	157	122.8 Å²	122.8	73%	0.734	64%	0.643	S	S	*	*	H	α-helix	trans	-75.8	-35.9	-179.5	-69	-171.6	-4.7	0	0	112.6	E59 K64 S65 L66	E59-Q62 PolarHBondContact O-N 3.2Å; Q62-K64 PolarHBondContact O-N 2.8Å; Q62-S65 PolarHBondContact O-N 3.41Å; Q62-S65 PolarHBondContact O-OG 3.15Å; Q62-L66 PolarHBondContact O-N 3.23Å
63	N	30.4	Very low	31.3	Very low	86 Å²	86	122.8 Å²	122.8	46%	0.46	64%	0.638	S	S	.	*	H	α-helix	trans	-60.5	-31.5	172.5	-71.8	-23.6	0	0	0	111.9	L66 I67	N63-L66 PolarHBondContact O-N 3.44Å; N63-I67 WeakPolarHBondContact O-CB 3.3Å; N63-I67 WeakPolarHBondContact O-CD1 3.24Å; N63-I67 VanDerWaalsContact O-CG1 3.26Å; N63-I67 WeakPolarHBondContact O-CG1 3.13Å; N63-I67 PolarHBondContact O-N 3.4Å
64	K	32.7	Very low	31.5	Very low	161 Å²	161	120.2 Å²	120.2	70%	0.7	63%	0.63	S	S	*	*	H	α-helix	trans	-72.7	-32.8	-179.4	-147	173	-170.6	177.3	0	113.1	L61 Q62 L68	L61-K64 PolarHBondContact O-N 3.45Å; Q62-K64 PolarHBondContact O-N 2.8Å; K64-L68 PolarHBondContact O-N 3.3Å
65	S	33.6	Very low	31.8	Very low	60 Å²	60	116.1 Å²	116.1	42%	0.42	61%	0.612	S	S	.	*	H	α-helix	trans	-72.3	-41.5	167.8	41.4	0	0	0	0	112	Q62 I67 L68 D69	Q62-S65 PolarHBondContact O-N 3.41Å; Q62-S65 PolarHBondContact O-OG 3.15Å; S65-I67 PolarHBondContact O-N 3.24Å; S65-L68 CarbonylContact O-C 3.56Å; S65-L68 WeakPolarHBondContact O-CA 3.38Å; S65-L68 VanDerWaalsContact O-CB 3.27Å; S65-L68 WeakPolarHBondContact O-CB 3.36Å; S65-L68 PolarHBondContact O-N 3.11Å; S65-D69 PolarHBondContact O-N 3.21Å
66	L	29.5	Very low	32	Very low	103 Å²	103	116.4 Å²	116.4	54%	0.539	60%	0.602	S	S	.	*	H	α-helix	trans	-67.4	-36.6	-176.5	-163	146.6	0	0	0	112.7	Q62 N63 L68 D69 Q70	Q62-L66 PolarHBondContact O-N 3.23Å; N63-L66 PolarHBondContact O-N 3.44Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3Å; L66-D69 PolarHBondContact O-N 2.83Å; L66-Q70 PolarHBondContact O-N 3.2Å
67	I	37.4	Very low	32.2	Very low	114 Å²	114	117.2 Å²	117.2	59%	0.585	60%	0.601	S	S	*	*	H	α-helix	trans	-63.6	-37.2	169.8	-68.9	165.3	0	0	0	111.1	N63 S65 Q70 S71	N63-I67 WeakPolarHBondContact O-CB 3.3Å; N63-I67 WeakPolarHBondContact O-CD1 3.24Å; N63-I67 VanDerWaalsContact O-CG1 3.26Å; N63-I67 WeakPolarHBondContact O-CG1 3.13Å; N63-I67 PolarHBondContact O-N 3.4Å; S65-I67 PolarHBondContact O-N 3.24Å; I67-Q70 PolarHBondContact O-N 3.05Å; I67-S71 PolarHBondContact O-N 2.76Å
68	L	33.5	Very low	32.8	Very low	107 Å²	107	113.1 Å²	113.1	56%	0.56	59%	0.585	S	S	*	*	H	α-helix	trans	-66.2	-45	175.9	-159.7	72.9	0	0	0	110.8	K64 S65 L66 Q70 S71 I72	K64-L68 PolarHBondContact O-N 3.3Å; S65-L68 CarbonylContact O-C 3.56Å; S65-L68 WeakPolarHBondContact O-CA 3.38Å; S65-L68 VanDerWaalsContact O-CB 3.27Å; S65-L68 WeakPolarHBondContact O-CB 3.36Å; S65-L68 PolarHBondContact O-N 3.11Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3Å; L68-Q70 VanDerWaalsContact C-N 3.33Å; L68-Q70 PolarHBondContact O-N 3.38Å; L68-S71 WeakPolarHBondContact O-CB 3.38Å; L68-S71 PolarHBondContact O-N 3.07Å; L68-S71 VanDerWaalsContact O-N 3.11Å; L68-S71 PolarHBondContact O-OG 3.15Å; L68-I72 HydrophobicContact CG-CD1 4.3Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.19Å; L68-I72 PolarHBondContact O-N 3.25Å
69	D	30.2	Very low	32.6	Very low	98 Å²	98	111.4 Å²	111.4	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-63.2	-36	176.5	-72	-36.9	0	0	0	112.6	S65 L66 I72 L73	S65-D69 PolarHBondContact O-N 3.21Å; L66-D69 PolarHBondContact O-N 2.83Å; D69-I72 PolarHBondContact O-N 3.26Å; D69-L73 PolarHBondContact O-N 3.49Å
70	Q	30.1	Very low	32.8	Very low	126 Å²	126	110.2 Å²	110.2	59%	0.589	57%	0.566	S	S	*	*	H	α-helix	trans	-67.6	-36	172.4	-116.7	172.1	-0.8	0	0	112.4	L66 I67 L68 L73 N74	L66-Q70 PolarHBondContact O-N 3.2Å; I67-Q70 PolarHBondContact O-N 3.05Å; L68-Q70 VanDerWaalsContact C-N 3.33Å; L68-Q70 PolarHBondContact O-N 3.38Å; Q70-L73 PolarHBondContact O-N 3.24Å; Q70-N74 PolarHBondContact O-N 2.99Å
71	S	34.5	Very low	33.5	Very low	64 Å²	64	106.6 Å²	106.6	45%	0.448	55%	0.55	S	S	.	*	H	α-helix	trans	-66.3	-38.2	171.1	81.7	0	0	0	0	112.2	I67 L68 N74 S75	I67-S71 PolarHBondContact O-N 2.76Å; L68-S71 WeakPolarHBondContact O-CB 3.38Å; L68-S71 PolarHBondContact O-N 3.07Å; L68-S71 VanDerWaalsContact O-N 3.11Å; L68-S71 PolarHBondContact O-OG 3.15Å; S71-N74 PolarHBondContact O-N 2.81Å; S71-S75 PolarHBondContact O-N 2.93Å
72	I	32.8	Very low	34	Very low	89 Å²	89	101.2 Å²	101.2	46%	0.456	52%	0.522	S	S	.	.	H	α-helix	trans	-64.8	-39.9	175.1	-70.1	162.7	0	0	0	110.6	L68 D69 N74 S75	L68-I72 HydrophobicContact CG-CD1 4.3Å; L68-I72 VanDerWaalsContact O-CG1 3.31Å; L68-I72 WeakPolarHBondContact O-CG1 3.19Å; L68-I72 PolarHBondContact O-N 3.25Å; D69-I72 PolarHBondContact O-N 3.26Å; I72-N74 VanDerWaalsContact C-N 3.35Å; I72-N74 PolarHBondContact O-N 3.45Å; I72-S75 WeakPolarHBondContact O-CB 3.26Å; I72-S75 PolarHBondContact O-N 3.38Å; I72-S75 PolarHBondContact O-OG 3.32Å
73	L	30.1	Very low	34.7	Very low	111 Å²	111	97.9 Å²	97.9	58%	0.581	51%	0.509	S	S	*	.	H	α-helix	trans	-62.5	-42	178.2	-158.3	74.2	0	0	0	111.8	D69 Q70 K76	D69-L73 PolarHBondContact O-N 3.49Å; Q70-L73 PolarHBondContact O-N 3.24Å; L73-K76 PolarHBondContact O-N 3.5Å
74	N	30	Very low	35.7	Very low	116 Å²	116	98 Å²	98	62%	0.62	51%	0.506	S	S	*	.	H	α-helix	trans	-68.6	-31.1	175.5	-75	-16.4	0	0	0	113	Q70 S71 I72 K76 N77	Q70-N74 PolarHBondContact O-N 2.99Å; S71-N74 PolarHBondContact O-N 2.81Å; I72-N74 VanDerWaalsContact C-N 3.35Å; I72-N74 PolarHBondContact O-N 3.45Å; N74-K76 PolarHBondContact O-N 3.34Å; N74-N77 PolarHBondContact O-N 3.42Å; N74-N77 VanDerWaalsContact O-N 3.11Å
75	S	35.2	Very low	36.7	Very low	46 Å²	46	92.9 Å²	92.9	32%	0.322	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-62.7	-9.3	178.3	81.9	0	0	0	0	115	S71 I72 N77 D78	S71-S75 PolarHBondContact O-N 2.93Å; I72-S75 WeakPolarHBondContact O-CB 3.26Å; I72-S75 PolarHBondContact O-N 3.38Å; I72-S75 PolarHBondContact O-OG 3.32Å; S75-N77 PolarHBondContact O-N 2.59Å; S75-D78 PolarHBondContact O-N 2.82Å
76	K	30.6	Very low	37.8	Very low	142 Å²	142	92.7 Å²	92.7	62%	0.617	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.8	170.3	-76.6	-177.3	174.7	175.8	0	113	L73 N74 D78 H79	L73-K76 PolarHBondContact O-N 3.5Å; N74-K76 PolarHBondContact O-N 3.34Å; K76-D78 VanDerWaalsContact C-N 3.33Å; K76-H79 PolarHBondContact O-CD2 3.31Å; K76-H79 VanDerWaalsContact O-CD2 3.3Å
77	N	32.9	Very low	39.3	Very low	138 Å²	138	96.9 Å²	96.9	74%	0.738	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-78.3	-15.5	177.3	-68.2	-17.6	0	0	0	113.2	N74 S75 H79	N74-N77 PolarHBondContact O-N 3.42Å; N74-N77 VanDerWaalsContact O-N 3.11Å; S75-N77 PolarHBondContact O-N 2.59Å; N77-H79 PolarHBondContact O-N 3.4Å
78	D	40.4	Very low	40.5	Very low	78 Å²	78	95.3 Å²	95.3	42%	0.417	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-72.9	11.2	175.6	-75.8	-58.7	0	0	0	115	S75 K76 H80 S81 I82	S75-D78 PolarHBondContact O-N 2.82Å; K76-D78 VanDerWaalsContact C-N 3.33Å; D78-H80 PolarHBondContact O-N 2.86Å; D78-S81 WeakPolarHBondContact CA-OG 3.24Å; D78-S81 PolarHBondContact O-OG 2.84Å; D78-S81 PolarHBondContact OD1-OG 2.87Å; D78-I82 HydrophobicContact CB-CD1 4.42Å
79	H	32.1	Very low	42	Very low	117 Å²	117	91.5 Å²	91.5	54%	0.542	45%	0.453	S	S	.	.	H	α-helix	trans	-67.4	-23.4	168.5	-85	-69.1	0	0	0	112.8	K76 N77 N83	K76-H79 PolarHBondContact O-CD2 3.31Å; K76-H79 VanDerWaalsContact O-CD2 3.3Å; N77-H79 PolarHBondContact O-N 3.4Å; H79-N83 PolarHBondContact O-ND2 3.37Å
80	H	36.5	Very low	43.9	Very low	138 Å²	138	90.5 Å²	90.5	64%	0.639	45%	0.445	S	S	*	.	H	α-helix	trans	-78.9	-51.6	173.8	-100.6	-79.7	0	0	0	113.1	D78 I82 N83 H84	D78-H80 PolarHBondContact O-N 2.86Å; H80-I82 PolarHBondContact O-N 3.46Å; H80-N83 PolarHBondContact O-N 2.95Å; H80-H84 AromaticContact ND1-NE2 3.37Å; H80-H84 PolarHBondContact ND1-NE2 2.8Å; H80-H84 PolarHBondContact O-CD2 3.3Å; H80-H84 PolarHBondContact O-N 3.45Å; H80-H84 VanDerWaalsContact O-N 3.12Å
81	S	44.9	Very low	45.8	Very low	47 Å²	47	87.7 Å²	87.7	33%	0.329	43%	0.431	S	S	.	.	H	α-helix	trans	-56	-48.4	-173.3	49.8	0	0	0	0	112.7	D78 H84 E85	D78-S81 WeakPolarHBondContact CA-OG 3.24Å; D78-S81 PolarHBondContact O-OG 2.84Å; D78-S81 PolarHBondContact OD1-OG 2.87Å; S81-H84 PolarHBondContact O-N 2.94Å; S81-E85 PolarHBondContact O-N 3.46Å
82	I	46.4	Very low	47.7	Very low	27 Å²	27	85 Å²	85	14%	0.138	41%	0.411	C	S	.	.	H	α-helix	trans	-73.2	-32.9	-175.6	-66.2	162.9	0	0	0	112.4	D78 H80 E85 Q86 K546	D78-I82 HydrophobicContact CB-CD1 4.42Å; H80-I82 PolarHBondContact O-N 3.46Å; I82-E85 PolarHBondContact O-N 3.3Å; I82-Q86 PolarHBondContact O-N 2.93Å; I82-K546 HydrophobicContact CD1-CD 3.73Å; I82-K546 VanDerWaalsContact CD1-CE 3.45Å; I82-K546 HydrophobicContact CD1-CG 4.03Å; I82-K546 HydrophobicContact CG2-CG 4.36Å
83	N	45.4	Very low	49.8	Very low	87 Å²	87	81.4 Å²	81.4	47%	0.465	39%	0.393	S	S	.	.	H	α-helix	trans	-64.2	-43.9	172.9	-77.4	-9.3	0	0	0	110.6	H79 H80 E85 Q86 W87	H79-N83 PolarHBondContact O-ND2 3.37Å; H80-N83 PolarHBondContact O-N 2.95Å; N83-E85 PolarHBondContact O-N 2.88Å; N83-Q86 PolarHBondContact O-N 3.46Å; N83-W87 VanDerWaalsContact O-CD1 3.25Å; N83-W87 PolarHBondContact O-N 3.45Å; N83-W87 VanDerWaalsContact O-N 3.12Å
84	H	50.3	Low	52.1	Low	88 Å²	88	81.8 Å²	81.8	41%	0.407	39%	0.39	S	S	.	.	H	α-helix	trans	-60.5	-42.4	177.1	-70.3	-58.3	0	0	0	112.4	H80 S81 Q86 W87 Y88	H80-H84 AromaticContact ND1-NE2 3.37Å; H80-H84 PolarHBondContact ND1-NE2 2.8Å; H80-H84 PolarHBondContact O-CD2 3.3Å; H80-H84 PolarHBondContact O-N 3.45Å; H80-H84 VanDerWaalsContact O-N 3.12Å; S81-H84 PolarHBondContact O-N 2.94Å; H84-Q86 VanDerWaalsContact C-N 3.33Å; H84-Q86 PolarHBondContact O-N 3.03Å; H84-W87 PolarHBondContact O-N 3.31Å; H84-Y88 HydrophobicContact CB-CD2 4.42Å; H84-Y88 HydrophobicContact CB-CE2 3.9Å; H84-Y88 WeakPolarHBondContact O-CD2 3.33Å; H84-Y88 PolarHBondContact O-N 3.4Å
85	E	54.9	Low	54.4	Low	55 Å²	55	76.5 Å²	76.5	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-57.2	-42	175.5	-75.8	-146.2	125	0	0	113.2	S81 I82 N83 F89 N553	S81-E85 PolarHBondContact O-N 3.46Å; I82-E85 PolarHBondContact O-N 3.3Å; N83-E85 PolarHBondContact O-N 2.88Å; E85-F89 PolarHBondContact O-N 3.21Å; E85-F89 VanDerWaalsContact O-N 3.08Å; E85-N553 PolarHBondContact OE1-ND2 3.06Å
86	Q	56.4	Low	56.6	Low	56 Å²	56	75 Å²	75	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-66.8	-42.3	178	-68.1	-177	13.7	0	0	111.9	I82 N83 H84 F89 H90	I82-Q86 PolarHBondContact O-N 2.93Å; N83-Q86 PolarHBondContact O-N 3.46Å; H84-Q86 VanDerWaalsContact C-N 3.33Å; H84-Q86 PolarHBondContact O-N 3.03Å; Q86-F89 PolarHBondContact O-N 3.23Å; Q86-H90 PolarHBondContact O-CD2 3.1Å; Q86-H90 PolarHBondContact O-N 2.74Å
87	W	59.8	Low	59.1	Low	190 Å²	190	72.2 Å²	72.2	72%	0.72	34%	0.34	S	S	*	.	H	α-helix	trans	-61.3	-44.5	175.6	-83	104.2	0	0	0	112.2	N83 H84 H90 F91	N83-W87 VanDerWaalsContact O-CD1 3.25Å; N83-W87 PolarHBondContact O-N 3.45Å; N83-W87 VanDerWaalsContact O-N 3.12Å; H84-W87 PolarHBondContact O-N 3.31Å; W87-H90 PolarHBondContact O-N 2.94Å; W87-F91 VanDerWaalsContact O-CB 3.28Å; W87-F91 WeakPolarHBondContact O-CB 3.12Å; W87-F91 PolarHBondContact O-N 2.73Å
88	Y	64	Low	61.4	Low	82 Å²	82	68.6 Å²	68.6	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-44.4	176.2	-64.4	-49	0	0	0	111.9	Y21 I25 H84 F91 D92	Y21-Y88 HydrophobicContact CE2-CD1 4.25Å; I25-Y88 HydrophobicContact CD1-CD1 4.36Å; I25-Y88 HydrophobicContact CG1-CD1 3.84Å; I25-Y88 HydrophobicContact CG1-CE1 3.82Å; H84-Y88 HydrophobicContact CB-CD2 4.42Å; H84-Y88 HydrophobicContact CB-CE2 3.9Å; H84-Y88 WeakPolarHBondContact O-CD2 3.33Å; H84-Y88 PolarHBondContact O-N 3.4Å; Y88-F91 PolarHBondContact O-N 3.24Å; Y88-D92 WeakPolarHBondContact O-CB 3.09Å; Y88-D92 PolarHBondContact O-N 2.85Å
89	F	63.9	Low	63.4	Low	27 Å²	27	65.2 Å²	65.2	12%	0.118	30%	0.3	C	S	.	.	H	α-helix	trans	-59.7	-49.7	176.8	174.3	-108.7	0	0	0	112.4	E85 Q86 F91 D92 M93 Y291 H552	E85-F89 PolarHBondContact O-N 3.21Å; E85-F89 VanDerWaalsContact O-N 3.08Å; Q86-F89 PolarHBondContact O-N 3.23Å; F89-F91 VanDerWaalsContact C-N 3.29Å; F89-F91 PolarHBondContact O-N 3.32Å; F89-D92 PolarHBondContact O-N 3.39Å; F89-M93 HydrophobicContact CD2-CG 4.17Å; F89-M93 HydrophobicContact CE1-CG 4.33Å; F89-M93 HydrophobicContact CE2-CG 3.78Å; F89-M93 HydrophobicContact CE2-SD 4.16Å; F89-M93 HydrophobicContact CZ-CE 4.28Å; F89-M93 HydrophobicContact CZ-CG 3.87Å; F89-M93 HydrophobicContact CZ-SD 4.28Å; F89-M93 WeakPolarHBondContact O-CB 3.06Å; F89-M93 WeakPolarHBondContact O-CG 3.25Å; F89-M93 PolarHBondContact O-N 2.93Å; F89-M93 VanDerWaalsContact O-N 3.08Å; F89-Y291 HydrophobicContact CD1-CD2 4.27Å; F89-Y291 HydrophobicContact CD1-CE2 4.23Å; F89-Y291 HydrophobicContact CE1-CD1 4.39Å; F89-Y291 AromaticContact CE1-CD2 3.75Å; F89-Y291 HydrophobicContact CE1-CD2 3.75Å; F89-Y291 HydrophobicContact CE1-CE2 4.16Å; F89-Y291 AromaticContact CE1-CG 3.89Å; F89-Y291 HydrophobicContact CE1-CG 3.89Å; F89-Y291 HydrophobicContact CZ-CD2 4.37Å; F89-H552 AromaticContact CE2-CD2 3.44Å; F89-H552 VanDerWaalsContact CE2-CD2 3.44Å; F89-H552 WeakPolarHBondContact CE2-CD2 3.37Å; F89-H552 AromaticContact CE2-NE2 3.28Å; F89-H552 VanDerWaalsContact CE2-NE2 3.28Å; F89-H552 WeakPolarHBondContact CE2-NE2 3.43Å; F89-H552 AromaticContact CZ-CD2 3.73Å; F89-H552 AromaticContact CZ-NE2 3.44Å; F89-H552 WeakPolarHBondContact CZ-NE2 3.22Å
90	H	70.1	Confident	65.9	Low	77 Å²	77	59.8 Å²	59.8	36%	0.356	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-34.5	179.5	-71.3	-51.7	0	0	0	112.6	Q86 W87 F94 Y291	Q86-H90 PolarHBondContact O-CD2 3.1Å; Q86-H90 PolarHBondContact O-N 2.74Å; W87-H90 PolarHBondContact O-N 2.94Å; H90-F94 WeakPolarHBondContact O-CB 3.48Å; H90-F94 PolarHBondContact O-N 2.86Å; H90-Y291 AromaticContact CE1-CE1 3.77Å
91	F	71.4	Confident	68.2	Low	67 Å²	67	59 Å²	59	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-75.5	-40.5	179	-165.7	-88.1	0	0	0	112.9	F17 Y21 W87 Y88 F89 M93 F94 I95	F17-F91 HydrophobicContact CE1-CE1 4.29Å; F17-F91 AromaticContact CE1-CZ 3.77Å; F17-F91 HydrophobicContact CE1-CZ 3.77Å; F17-F91 AromaticContact CZ-CZ 3.85Å; F17-F91 HydrophobicContact CZ-CZ 3.85Å; Y21-F91 HydrophobicContact CD1-CD1 4.17Å; Y21-F91 AromaticContact CD1-CE1 3.94Å; Y21-F91 HydrophobicContact CD1-CE1 3.94Å; Y21-F91 HydrophobicContact CD2-CD1 4.21Å; Y21-F91 AromaticContact CD2-CE1 3.82Å; Y21-F91 HydrophobicContact CD2-CE1 3.82Å; Y21-F91 AromaticContact CE1-CD1 3.49Å; Y21-F91 HydrophobicContact CE1-CD1 3.49Å; Y21-F91 VanDerWaalsContact CE1-CD1 3.49Å; Y21-F91 AromaticContact CE1-CE1 3.75Å; Y21-F91 HydrophobicContact CE1-CE1 3.75Å; Y21-F91 AromaticContact CE2-CD1 3.54Å; Y21-F91 HydrophobicContact CE2-CD1 3.54Å; Y21-F91 AromaticContact CE2-CE1 3.63Å; Y21-F91 HydrophobicContact CE2-CE1 3.63Å; Y21-F91 HydrophobicContact CE2-CG 4.3Å; Y21-F91 HydrophobicContact CG-CD1 4.5Å; Y21-F91 AromaticContact CG-CE1 3.98Å; Y21-F91 HydrophobicContact CG-CE1 3.98Å; Y21-F91 AromaticContact CZ-CD1 3.15Å; Y21-F91 AromaticContact CZ-CE1 3.62Å; Y21-F91 WeakPolarHBondContact OH-CD1 3.14Å; W87-F91 VanDerWaalsContact O-CB 3.28Å; W87-F91 WeakPolarHBondContact O-CB 3.12Å; W87-F91 PolarHBondContact O-N 2.73Å; Y88-F91 PolarHBondContact O-N 3.24Å; F89-F91 VanDerWaalsContact C-N 3.29Å; F89-F91 PolarHBondContact O-N 3.32Å; F91-M93 VanDerWaalsContact C-N 3.31Å; F91-M93 PolarHBondContact O-N 3Å; F91-F94 WeakPolarHBondContact O-CB 3.2Å; F91-F94 PolarHBondContact O-N 3.26Å; F91-F94 VanDerWaalsContact O-N 3.14Å; F91-I95 HydrophobicContact CD1-CD1 3.67Å; F91-I95 HydrophobicContact CD1-CG1 4.05Å; F91-I95 HydrophobicContact CE1-CD1 3.68Å; F91-I95 HydrophobicContact CE1-CG1 4.04Å; F91-I95 WeakPolarHBondContact O-CG1 3.19Å; F91-I95 PolarHBondContact O-N 3.23Å
92	D	73	Confident	70	Confident	7 Å²	7	57.3 Å²	57.3	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-44.3	173.6	-72.6	5.5	0	0	0	110.9	Y21 Y88 F89 I95 I96 Y910	Y21-D92 WeakPolarHBondContact CE1-OD1 3.5Å; Y21-D92 PolarHBondContact OH-OD1 2.81Å; Y88-D92 WeakPolarHBondContact O-CB 3.09Å; Y88-D92 PolarHBondContact O-N 2.85Å; F89-D92 PolarHBondContact O-N 3.39Å; D92-I95 PolarHBondContact O-N 3Å; D92-I96 WeakPolarHBondContact O-CG1 3.39Å; D92-I96 PolarHBondContact O-N 3.02Å; D92-Y910 WeakPolarHBondContact OD2-CE1 3.19Å; D92-Y910 VanDerWaalsContact OD2-CZ 3.29Å; D92-Y910 PolarHBondContact OD2-OH 2.63Å
93	M	77	Confident	71.8	Confident	13 Å²	13	56.2 Å²	56.2	6%	0.064	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-40.9	173.9	-70.1	-72.7	-77.2	0	0	111.8	F89 F91 I96 M97 C284 Q287 M288	F89-M93 HydrophobicContact CD2-CG 4.17Å; F89-M93 HydrophobicContact CE1-CG 4.33Å; F89-M93 HydrophobicContact CE2-CG 3.78Å; F89-M93 HydrophobicContact CE2-SD 4.16Å; F89-M93 HydrophobicContact CZ-CE 4.28Å; F89-M93 HydrophobicContact CZ-CG 3.87Å; F89-M93 HydrophobicContact CZ-SD 4.28Å; F89-M93 WeakPolarHBondContact O-CB 3.06Å; F89-M93 WeakPolarHBondContact O-CG 3.25Å; F89-M93 PolarHBondContact O-N 2.93Å; F89-M93 VanDerWaalsContact O-N 3.08Å; F91-M93 VanDerWaalsContact C-N 3.31Å; F91-M93 PolarHBondContact O-N 3Å; M93-I96 PolarHBondContact O-N 3.45Å; M93-M97 WeakPolarHBondContact O-CB 3.49Å; M93-M97 PolarHBondContact O-N 3.4Å; M93-C284 HydrophobicContact CE-CB 4.14Å; M93-C284 WeakPolarHBondContact CE-O 3.49Å; M93-Q287 HydrophobicContact CE-CB 3.84Å; M93-Q287 HydrophobicContact SD-CB 4.36Å; M93-M288 HydrophobicContact CE-CG 3.59Å; M93-M288 HydrophobicContact CE-SD 3.72Å
94	F	78	Confident	73.7	Confident	120 Å²	120	55.5 Å²	55.5	53%	0.526	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-43.4	174.2	177.1	-96.8	0	0	0	112.6	H90 F91 I96 M97 F98	H90-F94 WeakPolarHBondContact O-CB 3.48Å; H90-F94 PolarHBondContact O-N 2.86Å; F91-F94 WeakPolarHBondContact O-CB 3.2Å; F91-F94 PolarHBondContact O-N 3.26Å; F91-F94 VanDerWaalsContact O-N 3.14Å; F94-I96 PolarHBondContact O-N 3.38Å; F94-M97 PolarHBondContact O-N 2.97Å; F94-F98 WeakPolarHBondContact O-CB 3.42Å; F94-F98 PolarHBondContact O-N 2.83Å
95	I	79.8	Confident	75.2	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-49.4	174.8	-66.4	165.3	0	0	0	110.1	I18 Y21 F91 D92 M97 F98 L99 I913	I18-I95 HydrophobicContact CD1-CG2 3.91Å; I18-I95 HydrophobicContact CG1-CG2 4.35Å; Y21-I95 HydrophobicContact CD1-CD1 3.74Å; Y21-I95 HydrophobicContact CE1-CD1 3.59Å; F91-I95 HydrophobicContact CD1-CD1 3.67Å; F91-I95 HydrophobicContact CD1-CG1 4.05Å; F91-I95 HydrophobicContact CE1-CD1 3.68Å; F91-I95 HydrophobicContact CE1-CG1 4.04Å; F91-I95 WeakPolarHBondContact O-CG1 3.19Å; F91-I95 PolarHBondContact O-N 3.23Å; D92-I95 PolarHBondContact O-N 3Å; I95-M97 VanDerWaalsContact C-N 3.33Å; I95-M97 PolarHBondContact O-N 3.38Å; I95-F98 PolarHBondContact O-N 3.4Å; I95-L99 HydrophobicContact CG2-CD1 3.76Å; I95-L99 HydrophobicContact CG2-CG 4.2Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 VanDerWaalsContact O-CG 3.3Å; I95-L99 WeakPolarHBondContact O-CG 3.38Å; I95-L99 PolarHBondContact O-N 3.34Å; I95-I913 HydrophobicContact CG2-CG2 3.74Å
96	I	81.2	Confident	76.4	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.067	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-42.1	-177.8	-61.8	162.2	0	0	0	110.5	D92 M93 F94 L99 A100 L280 C284 I913	D92-I96 WeakPolarHBondContact O-CG1 3.39Å; D92-I96 PolarHBondContact O-N 3.02Å; M93-I96 PolarHBondContact O-N 3.45Å; F94-I96 PolarHBondContact O-N 3.38Å; I96-L99 PolarHBondContact O-N 3.43Å; I96-A100 VanDerWaalsContact O-CB 3.32Å; I96-A100 WeakPolarHBondContact O-CB 3.31Å; I96-A100 PolarHBondContact O-N 3.48Å; I96-L280 HydrophobicContact CG2-CB 4.19Å; I96-L280 HydrophobicContact CG2-CD2 3.97Å; I96-C284 WeakPolarHBondContact CG2-SG 3.33Å; I96-I913 HydrophobicContact CD1-CD1 4.11Å; I96-I913 HydrophobicContact CD1-CG1 4.29Å; I96-I913 HydrophobicContact CG1-CD1 3.98Å; I96-I913 HydrophobicContact CG1-CG1 3.94Å
97	M	82.5	Confident	77.6	Confident	84 Å²	84	48.2 Å²	48.2	41%	0.414	22%	0.216	S	C	.	.	H	α-helix	trans	-65.7	-41.7	177.5	-141.8	-67.6	-74.3	0	0	111.8	M93 F94 I95 A100 F101 L281	M93-M97 WeakPolarHBondContact O-CB 3.49Å; M93-M97 PolarHBondContact O-N 3.4Å; F94-M97 PolarHBondContact O-N 2.97Å; I95-M97 VanDerWaalsContact C-N 3.33Å; I95-M97 PolarHBondContact O-N 3.38Å; M97-A100 PolarHBondContact O-N 2.96Å; M97-F101 WeakPolarHBondContact O-CB 3.33Å; M97-F101 PolarHBondContact O-N 3.3Å; M97-L281 HydrophobicContact CG-CD1 4.04Å; M97-L281 HydrophobicContact SD-CD1 3.76Å
98	F	81.5	Confident	78.7	Confident	62 Å²	62	42.7 Å²	42.7	27%	0.272	20%	0.2	S	C	.	.	H	α-helix	trans	-63.4	-40.5	174.4	177.8	-94.7	0	0	0	112.7	F14 F94 I95 S102	F14-F98 HydrophobicContact CD1-CE1 4.06Å; F14-F98 AromaticContact CE1-CD1 3.57Å; F14-F98 HydrophobicContact CE1-CD1 3.57Å; F14-F98 AromaticContact CE1-CE1 3.48Å; F14-F98 HydrophobicContact CE1-CE1 3.48Å; F14-F98 VanDerWaalsContact CE1-CE1 3.48Å; F14-F98 HydrophobicContact CE2-CD1 4.34Å; F14-F98 HydrophobicContact CE2-CE1 4.28Å; F14-F98 AromaticContact CZ-CD1 3.43Å; F14-F98 HydrophobicContact CZ-CD1 3.43Å; F14-F98 VanDerWaalsContact CZ-CD1 3.43Å; F14-F98 AromaticContact CZ-CE1 3.61Å; F14-F98 HydrophobicContact CZ-CE1 3.61Å; F14-F98 HydrophobicContact CZ-CG 4.37Å; F94-F98 WeakPolarHBondContact O-CB 3.42Å; F94-F98 PolarHBondContact O-N 2.83Å; I95-F98 PolarHBondContact O-N 3.4Å; F98-S102 WeakPolarHBondContact O-CB 3.3Å; F98-S102 PolarHBondContact O-N 2.87Å; F98-S102 PolarHBondContact O-OG 3.18Å
99	L	82.7	Confident	79.3	Confident	8 Å²	8	39.1 Å²	39.1	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-42.3	175	-71.3	174.6	0	0	0	111.5	F14 I95 I96 S102 S103 I913 T917 I920	F14-L99 HydrophobicContact CE1-CD2 4.28Å; I95-L99 HydrophobicContact CG2-CD1 3.76Å; I95-L99 HydrophobicContact CG2-CG 4.2Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 VanDerWaalsContact O-CG 3.3Å; I95-L99 WeakPolarHBondContact O-CG 3.38Å; I95-L99 PolarHBondContact O-N 3.34Å; I96-L99 PolarHBondContact O-N 3.43Å; L99-S102 PolarHBondContact O-N 3.29Å; L99-S103 VanDerWaalsContact O-CB 3.31Å; L99-S103 WeakPolarHBondContact O-CB 3.09Å; L99-S103 PolarHBondContact O-N 3.13Å; L99-I913 HydrophobicContact CD1-CG2 3.69Å; L99-T917 HydrophobicContact CD1-CG2 4.11Å; L99-T917 HydrophobicContact CD2-CG2 4Å; L99-I920 HydrophobicContact CD2-CD1 3.64Å
100	A	84.5	Confident	79.9	Confident	2 Å²	2	38.3 Å²	38.3	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-48.4	175	0	0	0	0	0	111.1	I96 M97 S103 F104 S277 L280 L281	I96-A100 VanDerWaalsContact O-CB 3.32Å; I96-A100 WeakPolarHBondContact O-CB 3.31Å; I96-A100 PolarHBondContact O-N 3.48Å; M97-A100 PolarHBondContact O-N 2.96Å; A100-S103 PolarHBondContact O-N 3.29Å; A100-F104 WeakPolarHBondContact O-CB 3.4Å; A100-F104 PolarHBondContact O-N 3.12Å; A100-S277 WeakPolarHBondContact O-CB 3.27Å; A100-S277 PolarHBondContact O-OG 2.84Å; A100-L280 HydrophobicContact CB-CB 4.01Å; A100-L281 HydrophobicContact CB-CB 4.45Å
101	F	84.7	Confident	80.3	Confident	121 Å²	121	36.8 Å²	36.8	53%	0.531	18%	0.179	S	C	.	.	H	α-helix	trans	-67.2	-41	177.6	-173.6	-99.9	0	0	0	112.9	M97 S103 F104 C105	M97-F101 WeakPolarHBondContact O-CB 3.33Å; M97-F101 PolarHBondContact O-N 3.3Å; F101-S103 VanDerWaalsContact C-N 3.34Å; F101-S103 PolarHBondContact O-N 3.17Å; F101-F104 VanDerWaalsContact O-CB 3.3Å; F101-F104 WeakPolarHBondContact O-CB 3.35Å; F101-F104 PolarHBondContact O-N 3.36Å; F101-C105 PolarHBondContact O-N 2.88Å; F101-C105 PolarHBondContact O-SG 3.35Å
102	S	81.8	Confident	80.5	Confident	12 Å²	12	40.7 Å²	40.7	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-37.7	176.4	-65.4	0	0	0	0	112.1	F98 L99 T106	F98-S102 WeakPolarHBondContact O-CB 3.3Å; F98-S102 PolarHBondContact O-N 2.87Å; F98-S102 PolarHBondContact O-OG 3.18Å; L99-S102 PolarHBondContact O-N 3.29Å; S102-T106 WeakPolarHBondContact O-CB 3.36Å; S102-T106 WeakPolarHBondContact O-CG2 3.29Å; S102-T106 PolarHBondContact O-N 3.48Å; S102-T106 PolarHBondContact O-OG1 3.22Å
103	S	83.9	Confident	80.2	Confident	4 Å²	4	42 Å²	42	3%	0.028	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-43.9	170.2	-175.2	0	0	0	0	111.4	L99 A100 F101 C105 T106 N107 N273	L99-S103 VanDerWaalsContact O-CB 3.31Å; L99-S103 WeakPolarHBondContact O-CB 3.09Å; L99-S103 PolarHBondContact O-N 3.13Å; A100-S103 PolarHBondContact O-N 3.29Å; F101-S103 VanDerWaalsContact C-N 3.34Å; F101-S103 PolarHBondContact O-N 3.17Å; S103-C105 PolarHBondContact O-N 3.11Å; S103-T106 WeakPolarHBondContact CA-OG1 3.47Å; S103-T106 PolarHBondContact O-N 3.37Å; S103-T106 PolarHBondContact O-OG1 3.48Å; S103-T106 VanDerWaalsContact O-OG1 3.08Å; S103-N107 WeakPolarHBondContact O-CB 3.43Å; S103-N107 PolarHBondContact O-N 2.86Å; S103-N107 PolarHBondContact O-ND2 2.92Å; S103-N107 PolarHBondContact OG-ND2 3.37Å; S103-N107 VanDerWaalsContact OG-ND2 3.17Å; S103-N273 PolarHBondContact OG-O 3.02Å
104	F	85.3	Confident	79.8	Confident	73 Å²	73	42.4 Å²	42.4	32%	0.32	20%	0.202	S	C	.	.	H	α-helix	trans	-54.9	-53.8	176.1	-168.9	-105.9	0	0	0	111.5	A100 F101 N107 I108 L274 S277 L278	A100-F104 WeakPolarHBondContact O-CB 3.4Å; A100-F104 PolarHBondContact O-N 3.12Å; F101-F104 VanDerWaalsContact O-CB 3.3Å; F101-F104 WeakPolarHBondContact O-CB 3.35Å; F101-F104 PolarHBondContact O-N 3.36Å; F104-N107 PolarHBondContact O-N 2.84Å; F104-I108 HydrophobicContact CD1-CD1 3.72Å; F104-I108 HydrophobicContact CD2-CD1 4.07Å; F104-I108 HydrophobicContact CE1-CD1 3.38Å; F104-I108 HydrophobicContact CE2-CD1 3.75Å; F104-I108 HydrophobicContact CG-CD1 4.05Å; F104-I108 HydrophobicContact CZ-CD1 3.39Å; F104-I108 WeakPolarHBondContact O-CB 3.4Å; F104-I108 WeakPolarHBondContact O-CG1 3.49Å; F104-I108 PolarHBondContact O-N 3.31Å; F104-L274 HydrophobicContact CD2-CD1 3.5Å; F104-L274 HydrophobicContact CE2-CD1 3.78Å; F104-L274 HydrophobicContact CG-CD1 4.47Å; F104-S277 WeakPolarHBondContact CB-OG 3.47Å; F104-L278 HydrophobicContact CE2-CD2 4.26Å
105	C	82	Confident	79.5	Confident	40 Å²	40	46 Å²	46	27%	0.27	21%	0.212	S	C	.	.	H	α-helix	trans	-66.1	-39.5	-178.1	-68.5	0	0	0	0	113.6	L4 F101 S103 G109	L4-C105 HydrophobicContact CD1-CB 4.28Å; F101-C105 PolarHBondContact O-N 2.88Å; F101-C105 PolarHBondContact O-SG 3.35Å; S103-C105 PolarHBondContact O-N 3.11Å; C105-G109 PolarHBondContact O-N 3.06Å
106	T	80.8	Confident	78.6	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-68	-41.3	177.6	46.2	0	0	0	0	111.9	L4 S102 S103 G109 L110 I920	L4-T106 HydrophobicContact CD2-CG2 3.79Å; S102-T106 WeakPolarHBondContact O-CB 3.36Å; S102-T106 WeakPolarHBondContact O-CG2 3.29Å; S102-T106 PolarHBondContact O-N 3.48Å; S102-T106 PolarHBondContact O-OG1 3.22Å; S103-T106 WeakPolarHBondContact CA-OG1 3.47Å; S103-T106 PolarHBondContact O-N 3.37Å; S103-T106 PolarHBondContact O-OG1 3.48Å; S103-T106 VanDerWaalsContact O-OG1 3.08Å; T106-G109 PolarHBondContact O-N 2.85Å; T106-L110 PolarHBondContact O-N 3.2Å; T106-I920 HydrophobicContact CG2-CG2 4.36Å
107	N	82.6	Confident	77.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-73.3	-39.6	-179.8	-75.7	-69.5	0	0	0	113.5	S103 F104 G109 L110 L111 S270 N273 T923	S103-N107 WeakPolarHBondContact O-CB 3.43Å; S103-N107 PolarHBondContact O-N 2.86Å; S103-N107 PolarHBondContact O-ND2 2.92Å; S103-N107 PolarHBondContact OG-ND2 3.37Å; S103-N107 VanDerWaalsContact OG-ND2 3.17Å; F104-N107 PolarHBondContact O-N 2.84Å; N107-G109 VanDerWaalsContact C-N 3.31Å; N107-G109 PolarHBondContact O-N 3.2Å; N107-L110 WeakPolarHBondContact O-CB 3.49Å; N107-L110 PolarHBondContact O-N 2.78Å; N107-L111 PolarHBondContact O-N 3.46Å; N107-S270 WeakPolarHBondContact OD1-CA 3.36Å; N107-N273 VanDerWaalsContact ND2-CB 3.27Å; N107-N273 WeakPolarHBondContact ND2-CB 3.2Å; N107-T923 WeakPolarHBondContact OD1-CG2 3.43Å
108	I	81.8	Confident	76.3	Confident	74 Å²	74	52.6 Å²	52.6	38%	0.379	26%	0.256	S	S	.	.	H	α-helix	trans	-64.9	-38.3	171.1	-71.2	173.4	0	0	0	110.6	F104 L110 L111 Y112 L274	F104-I108 HydrophobicContact CD1-CD1 3.72Å; F104-I108 HydrophobicContact CD2-CD1 4.07Å; F104-I108 HydrophobicContact CE1-CD1 3.38Å; F104-I108 HydrophobicContact CE2-CD1 3.75Å; F104-I108 HydrophobicContact CG-CD1 4.05Å; F104-I108 HydrophobicContact CZ-CD1 3.39Å; F104-I108 WeakPolarHBondContact O-CB 3.4Å; F104-I108 WeakPolarHBondContact O-CG1 3.49Å; F104-I108 PolarHBondContact O-N 3.31Å; I108-L110 VanDerWaalsContact C-N 3.3Å; I108-L110 PolarHBondContact O-N 3.47Å; I108-L111 PolarHBondContact O-N 3.21Å; I108-Y112 WeakPolarHBondContact O-CB 3.34Å; I108-Y112 PolarHBondContact O-N 2.94Å; I108-L274 HydrophobicContact CG1-CD1 4.4Å
109	G	76.1	Confident	74.6	Confident	6 Å²	6	54.4 Å²	54.4	6%	0.062	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-39	171.3	0	0	0	0	0	113.3	C105 T106 N107 L113	C105-G109 PolarHBondContact O-N 3.06Å; T106-G109 PolarHBondContact O-N 2.85Å; N107-G109 VanDerWaalsContact C-N 3.31Å; N107-G109 PolarHBondContact O-N 3.2Å; G109-L113 WeakPolarHBondContact O-CG 3.34Å; G109-L113 PolarHBondContact O-N 3.36Å; G109-L113 VanDerWaalsContact O-N 3.11Å
110	L	77.4	Confident	72.3	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-69.8	-42.5	176.1	-176	57.5	0	0	0	112.4	T106 N107 I108 L113 D114 L266 T923	T106-L110 PolarHBondContact O-N 3.2Å; N107-L110 WeakPolarHBondContact O-CB 3.49Å; N107-L110 PolarHBondContact O-N 2.78Å; I108-L110 VanDerWaalsContact C-N 3.3Å; I108-L110 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 3.41Å; L110-D114 PolarHBondContact O-N 2.94Å; L110-L266 HydrophobicContact CD1-CD1 4.47Å; L110-L266 HydrophobicContact CD2-CD2 4.46Å; L110-T923 HydrophobicContact CD2-CG2 4.45Å
111	L	79.3	Confident	69.9	Low	46 Å²	46	65.2 Å²	65.2	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-39.5	175.2	-77.9	166	0	0	0	112.6	N107 I108 D114 R115 F267 S270	N107-L111 PolarHBondContact O-N 3.46Å; I108-L111 PolarHBondContact O-N 3.21Å; L111-D114 PolarHBondContact O-N 3.31Å; L111-R115 PolarHBondContact O-N 3.32Å; L111-F267 HydrophobicContact CD2-CD2 3.75Å; L111-F267 HydrophobicContact CD2-CE2 3.83Å; L111-S270 VanDerWaalsContact CD2-OG 3.31Å; L111-S270 WeakPolarHBondContact CD2-OG 3.3Å
112	Y	75.3	Confident	67.3	Low	149 Å²	149	64.7 Å²	64.7	58%	0.584	35%	0.35	S	S	*	.	H	α-helix	trans	-60.9	-45.9	173.1	-178.3	-94.1	0	0	0	110.9	I108 D114 R115 C116	I108-Y112 WeakPolarHBondContact O-CB 3.34Å; I108-Y112 PolarHBondContact O-N 2.94Å; Y112-D114 VanDerWaalsContact C-N 3.34Å; Y112-D114 PolarHBondContact O-N 3Å; Y112-R115 WeakPolarHBondContact O-CB 3.48Å; Y112-R115 PolarHBondContact O-N 3.16Å; Y112-R115 VanDerWaalsContact O-N 3.14Å; Y112-C116 VanDerWaalsContact CE1-SG 3.56Å; Y112-C116 PolarHBondContact O-N 3.15Å; Y112-C116 PolarHBondContact O-SG 2.95Å; Y112-C116 VanDerWaalsContact O-SG 3.35Å
113	L	66.7	Low	64.9	Low	34 Å²	34	69.4 Å²	69.4	18%	0.178	38%	0.379	C	S	.	.	H	α-helix	trans	-64.6	-33.2	174.8	-73.8	176.2	0	0	0	113.5	G109 L110 C116 A117 F928 Y934	G109-L113 WeakPolarHBondContact O-CG 3.34Å; G109-L113 PolarHBondContact O-N 3.36Å; G109-L113 VanDerWaalsContact O-N 3.11Å; L110-L113 PolarHBondContact O-N 3.41Å; L113-C116 PolarHBondContact O-N 3.43Å; L113-A117 VanDerWaalsContact O-CB 3.26Å; L113-A117 WeakPolarHBondContact O-CB 3.38Å; L113-A117 PolarHBondContact O-N 2.99Å; L113-F928 HydrophobicContact CD1-CD1 3.84Å; L113-F928 HydrophobicContact CD1-CE1 3.45Å; L113-F928 VanDerWaalsContact CD1-CE1 3.45Å; L113-Y934 HydrophobicContact CD1-CD2 3.49Å; L113-Y934 VanDerWaalsContact CD1-CD2 3.49Å; L113-Y934 HydrophobicContact CD1-CE2 3.81Å; L113-Y934 HydrophobicContact CD1-CG 4.47Å; L113-Y934 HydrophobicContact CD2-CD2 4.48Å
114	D	68.6	Low	62.3	Low	21 Å²	21	75.6 Å²	75.6	11%	0.112	41%	0.411	C	S	.	.	H	α-helix	trans	-64.9	-39.4	171.3	178.7	53	0	0	0	111.9	L110 L111 Y112 A117 K118 L263	L110-D114 PolarHBondContact O-N 2.94Å; L111-D114 PolarHBondContact O-N 3.31Å; Y112-D114 VanDerWaalsContact C-N 3.34Å; Y112-D114 PolarHBondContact O-N 3Å; D114-A117 PolarHBondContact O-N 3.06Å; D114-K118 WeakPolarHBondContact O-CE 3.41Å; D114-K118 WeakPolarHBondContact O-CG 3.38Å; D114-K118 PolarHBondContact O-N 3.3Å; D114-K118 WeakPolarHBondContact OD2-CE 3.35Å; D114-K118 IonicContact OD2-NZ 2.63Å; D114-K118 PolarHBondContact OD2-NZ 2.8Å; D114-L263 VanDerWaalsContact OD1-CD1 3.25Å; D114-L263 WeakPolarHBondContact OD1-CD1 3.49Å; D114-L263 WeakPolarHBondContact OD1-CD2 3.23Å; D114-L263 WeakPolarHBondContact OD1-CG 3.24Å
115	R	70.5	Confident	59.5	Low	197 Å²	197	80 Å²	80	74%	0.743	44%	0.438	S	S	*	.	H	α-helix	trans	-62	-46	171.9	-172.4	173.2	177.8	152.5	-1.9	111.3	L111 Y112 A117 K118	L111-R115 PolarHBondContact O-N 3.32Å; Y112-R115 WeakPolarHBondContact O-CB 3.48Å; Y112-R115 PolarHBondContact O-N 3.16Å; Y112-R115 VanDerWaalsContact O-N 3.14Å; R115-A117 VanDerWaalsContact C-N 3.27Å; R115-A117 PolarHBondContact O-N 3.37Å; R115-K118 PolarHBondContact O-N 2.95Å
116	C	62.4	Low	56.9	Low	78 Å²	78	83 Å²	83	53%	0.527	46%	0.46	S	S	.	.	H	α-helix	trans	-66.9	-23.6	175.6	-62.9	0	0	0	0	114	Y112 L113 K118	Y112-C116 VanDerWaalsContact CE1-SG 3.56Å; Y112-C116 PolarHBondContact O-N 3.15Å; Y112-C116 PolarHBondContact O-SG 2.95Å; Y112-C116 VanDerWaalsContact O-SG 3.35Å; L113-C116 PolarHBondContact O-N 3.43Å; C116-K118 VanDerWaalsContact C-N 3.34Å
117	A	57.6	Low	54.6	Low	48 Å²	48	87.7 Å²	87.7	40%	0.397	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.9	177.6	0	0	0	0	0	113.9	L113 D114 R115	L113-A117 VanDerWaalsContact O-CB 3.26Å; L113-A117 WeakPolarHBondContact O-CB 3.38Å; L113-A117 PolarHBondContact O-N 2.99Å; D114-A117 PolarHBondContact O-N 3.06Å; R115-A117 VanDerWaalsContact C-N 3.27Å; R115-A117 PolarHBondContact O-N 3.37Å
118	K	57.6	Low	51.9	Low	113 Å²	113	96.4 Å²	96.4	49%	0.491	53%	0.531	S	S	.	.	S	Bend	trans	-83.3	123.4	171.8	-68.9	158.6	-164.6	162.8	0	108.4	D114 R115 C116 S120	D114-K118 WeakPolarHBondContact O-CE 3.41Å; D114-K118 WeakPolarHBondContact O-CG 3.38Å; D114-K118 PolarHBondContact O-N 3.3Å; D114-K118 WeakPolarHBondContact OD2-CE 3.35Å; D114-K118 IonicContact OD2-NZ 2.63Å; D114-K118 PolarHBondContact OD2-NZ 2.8Å; R115-K118 PolarHBondContact O-N 2.95Å; C116-K118 VanDerWaalsContact C-N 3.34Å; K118-S120 PolarHBondContact O-N 3.05Å; K118-S120 VanDerWaalsContact O-N 3.08Å
119	S	44.7	Very low	49.3	Very low	101 Å²	101	97.7 Å²	97.7	71%	0.706	55%	0.547	S	S	*	.			trans	-60.5	112.3	177.6	51.5	0	0	0	0	110.4	I121	S119-I121 PolarHBondContact O-N 2.91Å
120	S	34.5	Very low	46.8	Very low	117 Å²	117	103.9 Å²	103.9	82%	0.818	58%	0.579	S	S	*	*			trans	-71.8	72.5	173.6	55.9	0	0	0	0	110.6	K118 P122	K118-S120 PolarHBondContact O-N 3.05Å; K118-S120 VanDerWaalsContact O-N 3.08Å; S120-P122 WeakPolarHBondContact O-CD 3.48Å
121	I	34	Very low	44.4	Very low	120 Å²	120	112 Å²	112	62%	0.615	62%	0.616	S	S	*	*			trans	-113.5	85	169	-58.5	178.2	0	0	0	106.9	S119 T123	S119-I121 PolarHBondContact O-N 2.91Å; I121-T123 HydrophobicContact CG2-CG2 3.79Å; I121-T123 PolarHBondContact O-N 3.04Å; I121-T123 VanDerWaalsContact O-N 3.09Å
122	P	30.1	Very low	41.9	Very low	109 Å²	109	118.8 Å²	118.8	71%	0.708	64%	0.644	S	S	*	*			trans	-73.7	82.8	157.8	32.7	-30.9	0	0	0	107.5	S120 N124	S120-P122 WeakPolarHBondContact O-CD 3.48Å; P122-N124 PolarHBondContact O-N 3.28Å; P122-N124 VanDerWaalsContact O-N 3.12Å
123	T	32.5	Very low	39.5	Very low	111 Å²	111	119 Å²	119	68%	0.681	65%	0.653	S	S	*	*			trans	-64.2	111.5	162.8	32.5	0	0	0	0	107.6	I121 N125	I121-T123 HydrophobicContact CG2-CG2 3.79Å; I121-T123 PolarHBondContact O-N 3.04Å; I121-T123 VanDerWaalsContact O-N 3.09Å; T123-N125 PolarHBondContact O-N 3.44Å
124	N	28.8	Very low	37.4	Very low	134 Å²	134	122.7 Å²	122.7	72%	0.717	68%	0.677	S	S	*	*			trans	-52.4	138.3	172.2	-71.6	-14	0	0	0	110	P122 S126	P122-N124 PolarHBondContact O-N 3.28Å; P122-N124 VanDerWaalsContact O-N 3.12Å; N124-S126 PolarHBondContact O-N 3.26Å
125	N	26.5	Very low	35.4	Very low	165 Å²	165	128.2 Å²	128.2	88%	0.882	71%	0.706	S	S	*	*	S	Bend	trans	-77.1	63.7	176.4	-71.6	-33.6	0	0	0	110.6	T123	T123-N125 PolarHBondContact O-N 3.44Å
126	S	27.7	Very low	33.3	Very low	103 Å²	103	124.3 Å²	124.3	72%	0.72	70%	0.704	S	S	*	*			trans	-120.8	46	-177.7	64.6	0	0	0	0	112	N124	N124-S126 PolarHBondContact O-N 3.26Å
127	S	31.8	Very low	31.5	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	72%	0.716	S	S	*	*			trans	-144.2	41.2	169.7	67	0	0	0	0	111.3	S129	S127-S129 PolarHBondContact O-N 2.93Å; S127-S129 VanDerWaalsContact O-N 3.11Å
128	F	26.4	Very low	30.2	Very low	183 Å²	183	131.4 Å²	131.4	80%	0.803	74%	0.735	S	S	*	*			trans	-82	50.7	167.3	-145.9	-78	0	0	0	109.9	N130	F128-N130 VanDerWaalsContact C-N 3.3Å; F128-N130 PolarHBondContact O-N 3.41Å
129	S	27.8	Very low	28.7	Very low	101 Å²	101	131.6 Å²	131.6	71%	0.706	75%	0.746	S	S	*	*			trans	-84	73.7	-179.6	59.2	0	0	0	0	110.3	S127 H131	S127-S129 PolarHBondContact O-N 2.93Å; S127-S129 VanDerWaalsContact O-N 3.11Å; S129-H131 VanDerWaalsContact C-N 3.28Å; S129-H131 PolarHBondContact O-N 3.31Å
130	N	22.5	Very low	27.9	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	75%	0.752	S	S	*	*			trans	-67.6	91.4	158.7	-81.7	-5.7	0	0	0	107.9	F128	F128-N130 VanDerWaalsContact C-N 3.3Å; F128-N130 PolarHBondContact O-N 3.41Å
131	H	27.3	Very low	27.6	Very low	179 Å²	179	135.5 Å²	135.5	83%	0.829	75%	0.749	S	S	*	*			trans	-125.5	148	162.4	-103	-69.3	0	0	0	111.7	S129	S129-H131 VanDerWaalsContact C-N 3.28Å; S129-H131 PolarHBondContact O-N 3.31Å
132	F	26.1	Very low	27.3	Very low	189 Å²	189	137 Å²	137	83%	0.829	76%	0.759	S	S	*	*			trans	-61.3	161.9	-166.3	-101.2	-126.1	0	0	0	114.6	T134	F132-T134 PolarHBondContact O-N 2.93Å
133	I	25.7	Very low	26.9	Very low	153 Å²	153	138.5 Å²	138.5	79%	0.785	77%	0.766	S	S	*	*			trans	-65.5	98.2	159.5	-59.1	165.5	0	0	0	107.5	I135	I133-I135 HydrophobicContact CG2-CG1 4.05Å
134	T	23.3	Very low	26.7	Very low	112 Å²	112	139.7 Å²	139.7	69%	0.687	77%	0.773	S	S	*	*			trans	-90.6	113	162.6	-56.2	0	0	0	0	107.7	F132 T136	F132-T134 PolarHBondContact O-N 2.93Å; T134-T136 PolarHBondContact O-N 3.1Å
135	I	26.3	Very low	26.6	Very low	137 Å²	137	138.8 Å²	138.8	70%	0.703	78%	0.777	S	S	*	*			trans	-76.5	101.9	176.9	-57.8	174.9	0	0	0	108.2	I133	I133-I135 HydrophobicContact CG2-CG1 4.05Å
136	T	25.9	Very low	26.4	Very low	116 Å²	116	135.9 Å²	135.9	71%	0.712	77%	0.77	S	S	*	*			trans	-93.1	107.2	168.3	34.1	0	0	0	0	109.9	T134 T138	T134-T136 PolarHBondContact O-N 3.1Å; T136-T138 PolarHBondContact O-N 3Å
137	N	24.7	Very low	26.5	Very low	146 Å²	146	138.6 Å²	138.6	78%	0.781	78%	0.776	S	S	*	*			trans	-66.7	100.9	174.5	-72.9	-16.5	0	0	0	110.3	T139	N137-T139 PolarHBondContact O-N 3.33Å
138	T	29.8	Very low	26.3	Very low	129 Å²	129	141 Å²	141	79%	0.791	78%	0.781	S	S	*	*			trans	-74.5	111.9	166	49.5	0	0	0	0	109.3	T136 N140	T136-T138 PolarHBondContact O-N 3Å; T138-N140 PolarHBondContact O-N 3.07Å
139	T	27.2	Very low	26	Very low	117 Å²	117	139.9 Å²	139.9	72%	0.718	78%	0.782	S	S	*	*			trans	-69	116	-177.5	34.9	0	0	0	0	112.5	N137 N141	N137-T139 PolarHBondContact O-N 3.33Å; T139-N141 PolarHBondContact O-N 3.07Å
140	N	28.2	Very low	25.9	Very low	156 Å²	156	142 Å²	142	83%	0.834	79%	0.786	S	S	*	*			trans	-77.8	102.7	162.2	-84.1	-12.6	0	0	0	108.9	T138 N142	T138-N140 PolarHBondContact O-N 3.07Å; N140-N142 VanDerWaalsContact C-N 3.26Å; N140-N142 PolarHBondContact O-N 2.97Å
141	N	27	Very low	26	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	78%	0.783	S	S	*	*			trans	-75.3	74.6	174.2	-74.5	1.6	0	0	0	111.4	T139	T139-N141 PolarHBondContact O-N 3.07Å
142	N	27.2	Very low	26	Very low	151 Å²	151	139 Å²	139	81%	0.807	78%	0.78	S	S	*	*			trans	-103.1	120.7	160.2	-87.1	4.5	0	0	0	109	N140 T144	N140-N142 VanDerWaalsContact C-N 3.26Å; N140-N142 PolarHBondContact O-N 2.97Å; N142-T144 PolarHBondContact O-N 3.46Å
143	T	23	Very low	25.8	Very low	141 Å²	141	137.7 Å²	137.7	87%	0.865	78%	0.781	S	S	*	*			trans	-82.6	98.7	-175.3	48.5	0	0	0	0	112.3
144	T	28.3	Very low	25.7	Very low	136 Å²	136	136.9 Å²	136.9	83%	0.834	78%	0.778	S	S	*	*			trans	-141.3	140.4	157.6	44.7	0	0	0	0	110.5	N142	N142-T144 PolarHBondContact O-N 3.46Å
145	S	25.8	Very low	25.8	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	78%	0.782	S	S	*	*			trans	-27	143.1	-174.3	-158	0	0	0	0	118.5	N147	S145-N147 PolarHBondContact O-N 2.97Å
146	S	22.9	Very low	25.9	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	79%	0.786	S	S	*	*			trans	-59.9	122.7	171.6	51.7	0	0	0	0	112.8
147	N	29.2	Very low	25.9	Very low	159 Å²	159	143.2 Å²	143.2	85%	0.85	80%	0.795	S	S	*	*			trans	-148.7	146	148	-100.7	-40	0	0	0	109.5	S145	S145-N147 PolarHBondContact O-N 2.97Å
148	N	27.4	Very low	26	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	79%	0.79	S	S	*	*			trans	-71.5	152.4	-155.6	-70.4	-47.6	0	0	0	115.5
149	L	21.4	Very low	26	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	78%	0.784	S	S	*	*			trans	-60.1	148.3	165.5	-71.9	74.6	0	0	0	110.6
150	N	24.4	Very low	26.1	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	79%	0.791	S	S	*	*			trans	-161.2	138.6	131.7	-110.9	-28	0	0	0	116.1
151	T	25.7	Very low	26.3	Very low	107 Å²	107	144 Å²	144	66%	0.656	79%	0.789	S	S	*	*			trans	64.8	139.3	147.6	56.3	0	0	0	0	123.5
152	N	27.5	Very low	26.7	Very low	146 Å²	146	143.7 Å²	143.7	78%	0.781	79%	0.786	S	S	*	*			trans	67.4	111.3	153.4	-53.7	-19.3	0	0	0	117.7
153	L	21.6	Very low	27.1	Very low	161 Å²	161	145.2 Å²	145.2	84%	0.843	79%	0.789	S	S	*	*			cis	79.8	124.9	24.4	-151.9	92.4	0	0	0	116.4
154	L	23.4	Very low	27.6	Very low	136 Å²	136	142.7 Å²	142.7	71%	0.712	78%	0.776	S	S	*	*			trans	77.2	107.4	152.8	-152.1	144.7	0	0	0	119.7
155	M	26	Very low	28.2	Very low	159 Å²	159	142 Å²	142	78%	0.783	77%	0.767	S	S	*	*				-166.6	166.2	127.1	-106	-55.9	166	0	0	112.7
156	H	28.2	Very low	29.2	Very low	167 Å²	167	140.7 Å²	140.7	77%	0.773	76%	0.757	S	S	*	*			trans	62.6	55	170.5	-83.8	-75.3	0	0	0	119.5
157	N	24.6	Very low	30.3	Very low	172 Å²	172	142.7 Å²	142.7	92%	0.92	75%	0.753	S	S	*	*			trans	-102.7	112.7	145.6	-123.1	-27.5	0	0	0	107.6
158	N	26.8	Very low	31	Very low	126 Å²	126	140.2 Å²	140.2	67%	0.674	74%	0.74	S	S	*	*			trans	-149.4	137.9	-178.4	-137.8	-6.5	0	0	0	116.1
159	I	30.4	Very low	32.1	Very low	130 Å²	130	140.1 Å²	140.1	67%	0.667	73%	0.729	S	S	*	*	S	Bend	trans	42.2	95.4	165.5	-57.5	145.7	0	0	0	117.6
160	N	28.8	Very low	33.4	Very low	161 Å²	161	138.2 Å²	138.2	86%	0.861	72%	0.719	S	S	*	*			trans	-151.5	-1.5	146.4	-102.8	-58.1	0	0	0	114.6
161	N	33.3	Very low	34.6	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	71%	0.708	S	S	*	*			trans	-91.5	-5.8	-170.7	-90.8	-19.1	0	0	0	116.6	Q163	N161-Q163 PolarHBondContact O-N 2.88Å
162	L	35	Very low	35.6	Very low	138 Å²	138	138 Å²	138	72%	0.723	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-66.9	-31.3	-169.5	-110.3	72.5	0	0	0	114.9	C164 L165	L162-C164 VanDerWaalsContact C-N 3.28Å; L162-C164 PolarHBondContact O-N 3.02Å; L162-L165 PolarHBondContact O-N 3.41Å
163	Q	34.6	Very low	36.7	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-73.6	-9.3	-173.7	-77	-168	-16.1	0	0	115.3	N161	N161-Q163 PolarHBondContact O-N 2.88Å
164	C	34.9	Very low	37.6	Very low	88 Å²	88	139.1 Å²	139.1	60%	0.595	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-88.4	-10.5	178.2	-78	0	0	0	0	114.8	L162 N168	L162-C164 VanDerWaalsContact C-N 3.28Å; L162-C164 PolarHBondContact O-N 3.02Å; C164-N168 PolarHBondContact O-N 2.93Å
165	L	41.2	Very low	39.2	Very low	123 Å²	123	135.8 Å²	135.8	64%	0.644	68%	0.68	S	S	*	*	H	α-helix	trans	-71.5	-41.9	-172.3	-76.5	163.8	0	0	0	113.5	L162 F167 N168 Y169	L162-L165 PolarHBondContact O-N 3.41Å; L165-F167 PolarHBondContact O-N 2.93Å; L165-N168 PolarHBondContact O-N 3.4Å; L165-Y169 WeakPolarHBondContact O-CB 3.42Å; L165-Y169 PolarHBondContact O-N 3.33Å
166	S	46.3	Very low	39.9	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	67%	0.67	S	S	*	*	H	α-helix	trans	-63.1	-41.9	-178	55.5	0	0	0	0	112.9	Y169 L170	S166-Y169 PolarHBondContact O-N 2.88Å; S166-L170 PolarHBondContact O-N 3.36Å
167	F	44.5	Very low	40.6	Very low	147 Å²	147	134.4 Å²	134.4	65%	0.645	67%	0.673	S	S	*	*	H	α-helix	trans	-70.7	-39.4	-179.3	-151	-90.5	0	0	0	112	L165 L171	L165-F167 PolarHBondContact O-N 2.93Å; F167-L171 HydrophobicContact CE1-CD1 4.29Å; F167-L171 PolarHBondContact O-N 3.46Å; F167-L171 VanDerWaalsContact O-N 3.1Å
168	N	45.3	Very low	41.3	Very low	106 Å²	106	134 Å²	134	57%	0.567	66%	0.658	S	S	*	*	H	α-helix	trans	-68.9	-35.5	174.6	-93.7	-18.7	0	0	0	112.8	C164 L165 L171 K172	C164-N168 PolarHBondContact O-N 2.93Å; L165-N168 PolarHBondContact O-N 3.4Å; N168-L171 PolarHBondContact O-N 3.17Å; N168-K172 WeakPolarHBondContact O-CB 3.33Å; N168-K172 PolarHBondContact O-N 2.81Å
169	Y	50.4	Low	41.6	Very low	155 Å²	155	134.3 Å²	134.3	61%	0.608	66%	0.66	S	S	*	*	H	α-helix	trans	-61.9	-45.9	176	-174.9	-91.2	0	0	0	111.6	L165 S166 K172 K173	L165-Y169 WeakPolarHBondContact O-CB 3.42Å; L165-Y169 PolarHBondContact O-N 3.33Å; S166-Y169 PolarHBondContact O-N 2.88Å; Y169-K172 PolarHBondContact O-N 3.31Å; Y169-K173 HydrophobicContact CE1-CD 4.2Å; Y169-K173 WeakPolarHBondContact O-CB 3.35Å; Y169-K173 PolarHBondContact O-N 2.82Å
170	L	48.4	Very low	41.6	Very low	120 Å²	120	132.9 Å²	132.9	63%	0.628	66%	0.661	S	S	*	*	H	α-helix	trans	-60.6	-45.5	173.7	-83.2	165.8	0	0	0	112.1	S166 K172 K173 W174	S166-L170 PolarHBondContact O-N 3.36Å; L170-K172 PolarHBondContact O-N 3.5Å; L170-K173 PolarHBondContact O-N 2.96Å; L170-W174 PolarHBondContact O-N 2.92Å
171	L	48.7	Very low	41.8	Very low	105 Å²	105	136 Å²	136	55%	0.55	66%	0.663	S	S	.	*	H	α-helix	trans	-61.7	-42.6	178	-130.7	78.1	0	0	0	112.2	F167 N168 W174 S175	F167-L171 HydrophobicContact CE1-CD1 4.29Å; F167-L171 PolarHBondContact O-N 3.46Å; F167-L171 VanDerWaalsContact O-N 3.1Å; N168-L171 PolarHBondContact O-N 3.17Å; L171-W174 PolarHBondContact O-N 3.47Å; L171-S175 WeakPolarHBondContact O-CB 3.33Å; L171-S175 PolarHBondContact O-N 3.38Å
172	K	48.2	Very low	41.4	Very low	144 Å²	144	132.2 Å²	132.2	63%	0.626	66%	0.659	S	S	*	*	H	α-helix	trans	-65	-42.5	177.9	-167	173.3	-176.6	179.7	0	111.4	N168 Y169 L170 W174 S175 N176	N168-K172 WeakPolarHBondContact O-CB 3.33Å; N168-K172 PolarHBondContact O-N 2.81Å; Y169-K172 PolarHBondContact O-N 3.31Å; L170-K172 PolarHBondContact O-N 3.5Å; K172-W174 VanDerWaalsContact C-N 3.3Å; K172-W174 PolarHBondContact O-N 2.9Å; K172-S175 PolarHBondContact O-N 3.32Å; K172-N176 PolarHBondContact O-N 2.88Å; K172-N176 PolarHBondContact O-OD1 2.89Å
173	K	48.9	Very low	41.1	Very low	140 Å²	140	134.7 Å²	134.7	61%	0.609	66%	0.664	S	S	*	*	H	α-helix	trans	-64.7	-33.1	175.9	-157.7	167.4	-173.1	172.6	0	112.3	Y169 L170	Y169-K173 HydrophobicContact CE1-CD 4.2Å; Y169-K173 WeakPolarHBondContact O-CB 3.35Å; Y169-K173 PolarHBondContact O-N 2.82Å; L170-K173 PolarHBondContact O-N 2.96Å
174	W	41.8	Very low	40.6	Very low	190 Å²	190	131.7 Å²	131.7	72%	0.72	65%	0.654	S	S	*	*	H	α-helix	trans	-77.5	-28.6	174.3	-134.1	58.6	0	0	0	113.8	L170 L171 K172	L170-W174 PolarHBondContact O-N 2.92Å; L171-W174 PolarHBondContact O-N 3.47Å; K172-W174 VanDerWaalsContact C-N 3.3Å; K172-W174 PolarHBondContact O-N 2.9Å
175	S	56.1	Low	40	Very low	65 Å²	65	133 Å²	133	46%	0.455	66%	0.664	S	S	.	*	H	α-helix	trans	-73.8	-48.4	175.3	-167	0	0	0	0	111.9	L171 K172 K177 R178	L171-S175 WeakPolarHBondContact O-CB 3.33Å; L171-S175 PolarHBondContact O-N 3.38Å; K172-S175 PolarHBondContact O-N 3.32Å; S175-K177 PolarHBondContact O-N 2.94Å; S175-R178 PolarHBondContact O-N 3.32Å; S175-R178 VanDerWaalsContact O-N 3.11Å
176	N	40.9	Very low	39.2	Very low	107 Å²	107	134.5 Å²	134.5	57%	0.572	67%	0.672	S	S	*	*	H	α-helix	trans	-59	-32.9	-176	-76.9	24.4	0	0	0	112.6	K172 R178 N179	K172-N176 PolarHBondContact O-N 2.88Å; K172-N176 PolarHBondContact O-OD1 2.89Å; N176-R178 PolarHBondContact O-N 3.29Å; N176-R178 VanDerWaalsContact O-N 3.12Å; N176-N179 PolarHBondContact O-N 3.33Å
177	K	44.3	Very low	38.3	Very low	191 Å²	191	139.2 Å²	139.2	83%	0.83	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	1	-179.6	-148.5	178.9	-179.1	-178.7	0	114.7	S175	S175-K177 PolarHBondContact O-N 2.94Å
178	R	38	Very low	37.3	Very low	163 Å²	163	136.8 Å²	136.8	62%	0.615	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-21.1	175.9	-60.9	-167.2	-161.7	177.4	4.3	115	S175 N176 S180	S175-R178 PolarHBondContact O-N 3.32Å; S175-R178 VanDerWaalsContact O-N 3.11Å; N176-R178 PolarHBondContact O-N 3.29Å; N176-R178 VanDerWaalsContact O-N 3.12Å; R178-S180 PolarHBondContact O-N 3.43Å
179	N	33.1	Very low	36.2	Very low	132 Å²	132	138.9 Å²	138.9	71%	0.706	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	22.9	-174.7	-66.8	14.2	0	0	0	112.6	N176	N176-N179 PolarHBondContact O-N 3.33Å
180	S	30.9	Very low	34.9	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-1	-178.3	-165.8	0	0	0	0	114.1	R178	R178-S180 PolarHBondContact O-N 3.43Å
181	Y	32.7	Very low	33.7	Very low	226 Å²	226	140.2 Å²	140.2	89%	0.886	72%	0.723	S	S	*	*	S	Bend	trans	-110.6	100.2	170.5	-71	-78.8	0	0	0	108
182	G	25.2	Very low	32.4	Very low	68 Å²	68	140.1 Å²	140.1	70%	0.701	73%	0.731	S	S	*	*			trans	-89.3	161.4	-178.8	0	0	0	0	0	112.9
183	F	28.2	Very low	31.2	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.833	74%	0.741	S	S	*	*			trans	-151.6	112.5	154	-121.5	-84.6	0	0	0	107.8
184	N	25.4	Very low	30	Very low	119 Å²	119	139.9 Å²	139.9	64%	0.636	75%	0.746	S	S	*	*			trans	31.7	126.3	156.8	-49.2	-6.7	0	0	0	118.3
185	S	21.5	Very low	29	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	75%	0.747	S	S	*	*			cis	57.7	52.9	18.1	88	0	0	0	0	116.2
186	L	24.9	Very low	27.6	Very low	155 Å²	155	140.4 Å²	140.4	81%	0.812	76%	0.761	S	S	*	*			trans	-167.8	96.1	154.7	-110.1	162.3	0	0	0	110.6
187	L	27.8	Very low	27	Very low	184 Å²	184	140.1 Å²	140.1	96%	0.963	77%	0.765	S	S	*	*			trans	168.9	90.7	153.7	-98.1	160.4	0	0	0	109.3
188	S	22.8	Very low	26.1	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	77%	0.77	S	S	*	*			trans	-118.4	143	173.5	52.4	0	0	0	0	109.8
189	N	22.8	Very low	25.5	Very low	150 Å²	150	140.2 Å²	140.2	80%	0.802	78%	0.781	S	S	*	*			trans	67	115	166.8	-48.5	-20	0	0	0	116.6
190	Q	22.5	Very low	25.1	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	79%	0.788	S	S	*	*				-178.9	149.7	104.2	-96	178.2	7.3	0	0	111.9
191	S	23.3	Very low	25	Very low	118 Å²	118	143 Å²	143	83%	0.825	79%	0.792	S	S	*	*			trans	60.9	142.9	171.1	72.5	0	0	0	0	118.6
192	S	22.1	Very low	24.5	Very low	103 Å²	103	140 Å²	140	72%	0.72	79%	0.791	S	S	*	*			cis	-154.4	134	-29.2	42.2	0	0	0	0	108.1
193	I	21.9	Very low	24.5	Very low	161 Å²	161	146.2 Å²	146.2	83%	0.826	80%	0.798	S	S	*	*			trans	-89.3	118.4	174.6	-65.6	172.8	0	0	0	107.8
194	V	24.9	Very low	24.2	Very low	118 Å²	118	143.4 Å²	143.4	72%	0.715	80%	0.797	S	S	*	*			trans	-114.3	113	162.3	-179.5	0	0	0	0	107.1	I196	V194-I196 HydrophobicContact CG1-CD1 4.29Å; V194-I196 HydrophobicContact CG1-CG1 4.34Å
195	T	20.5	Very low	24.4	Very low	121 Å²	121	145 Å²	145	74%	0.742	81%	0.811	S	S	*	*			trans	-138.8	114.4	175.2	-57.9	0	0	0	0	106.5
196	I	26.1	Very low	24.3	Very low	146 Å²	146	149.4 Å²	149.4	75%	0.749	82%	0.816	S	S	*	*			trans	-120.8	130.7	-178.7	-61.8	178.9	0	0	0	106.5	V194	V194-I196 HydrophobicContact CG1-CD1 4.29Å; V194-I196 HydrophobicContact CG1-CG1 4.34Å
197	P	28.1	Very low	24.3	Very low	101 Å²	101	147.9 Å²	147.9	66%	0.656	82%	0.818	S	S	*	*			trans	-87.8	162.7	-164.7	35.4	-37	0	0	0	113.1
198	N	25	Very low	24.1	Very low	174 Å²	174	144.7 Å²	144.7	93%	0.93	81%	0.807	S	S	*	*			trans	-116.1	115.5	158.1	-107.9	4.6	0	0	0	108.1
199	E	26.5	Very low	24.2	Very low	182 Å²	182	145.4 Å²	145.4	85%	0.85	81%	0.807	S	S	*	*			trans	-85.7	160.3	178.4	-64.1	-173.3	133.5	0	0	112.3
200	T	23.2	Very low	24.1	Very low	139 Å²	139	144.7 Å²	144.7	85%	0.853	81%	0.808	S	S	*	*			trans	-78.1	123.6	176.4	46.1	0	0	0	0	112.5
201	I	30.3	Very low	24.3	Very low	151 Å²	151	141.9 Å²	141.9	77%	0.774	80%	0.804	S	S	*	*			trans	-129	117.3	154.8	-76.8	166.2	0	0	0	109.1	K203	I201-K203 HydrophobicContact CG2-CB 4.41Å
202	N	22	Very low	24.2	Very low	163 Å²	163	143 Å²	143	87%	0.872	81%	0.806	S	S	*	*			trans	-82.6	128.7	160.4	-76.3	-32.2	0	0	0	108.4
203	K	25.6	Very low	24.4	Very low	198 Å²	198	148 Å²	148	86%	0.861	81%	0.809	S	S	*	*			trans	-150.2	123.7	160.8	-122.8	170.4	-174.4	176.3	0	112.8	I201	I201-K203 HydrophobicContact CG2-CB 4.41Å
204	T	21.5	Very low	24.3	Very low	132 Å²	132	145.7 Å²	145.7	81%	0.81	81%	0.807	S	S	*	*			trans	-87.8	131.1	174.5	47	0	0	0	0	111.2
205	T	28.3	Very low	24.5	Very low	151 Å²	151	147.8 Å²	147.8	93%	0.926	81%	0.807	S	S	*	*			trans	-162.9	159.4	141.8	14.2	0	0	0	0	111.3
206	K	20.1	Very low	24.6	Very low	210 Å²	210	146.5 Å²	146.5	91%	0.913	80%	0.803	S	S	*	*			trans	-88	143.7	176.6	-56.7	169.8	-178.1	174.5	0	110.1
207	S	25.9	Very low	24.5	Very low	122 Å²	122	147.3 Å²	147.3	85%	0.853	81%	0.808	S	S	*	*			trans	-155	164.3	152.3	-161.2	0	0	0	0	110.9
208	T	22.1	Very low	24.5	Very low	118 Å²	118	147.9 Å²	147.9	72%	0.724	81%	0.814	S	S	*	*			trans	-95.2	167.7	-155.7	47.4	0	0	0	0	116.3
209	T	24.9	Very low	24.5	Very low	111 Å²	111	146.4 Å²	146.4	68%	0.681	81%	0.806	S	S	*	*			trans	61.3	101.7	148.7	43.4	0	0	0	0	119.6
210	T	21.2	Very low	24.6	Very low	134 Å²	134	142.6 Å²	142.6	82%	0.822	80%	0.798	S	S	*	*				28.8	112.5	128.7	50	0	0	0	0	118.9
211	T	26	Very low	24.9	Very low	127 Å²	127	141.8 Å²	141.8	78%	0.779	80%	0.795	S	S	*	*			trans	-143.2	120.8	148.5	-35.3	0	0	0	0	109.5	R213	T211-R213 PolarHBondContact O-N 2.89Å
212	T	23	Very low	24.8	Very low	142 Å²	142	142.3 Å²	142.3	87%	0.871	80%	0.798	S	S	*	*			trans	-72.8	93.4	177.1	44	0	0	0	0	110.5
213	R	24.4	Very low	25	Very low	206 Å²	206	141.5 Å²	141.5	78%	0.777	79%	0.794	S	S	*	*			trans	-97.4	91.7	173.9	-110.5	177.1	172.8	-175.7	-0	111.5	T211 F215	T211-R213 PolarHBondContact O-N 2.89Å; R213-F215 HydrophobicContact CB-CD2 4.49Å; R213-F215 HydrophobicContact CB-CE2 4.48Å; R213-F215 HydrophobicContact CG-CE2 4.25Å; R213-F215 PolarHBondContact O-N 3.47Å
214	S	20.6	Very low	25.1	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	79%	0.794	S	S	*	*			trans	-66.5	109.4	167.7	52.6	0	0	0	0	110.7
215	F	29.2	Very low	25.3	Very low	162 Å²	162	144.9 Å²	144.9	71%	0.711	79%	0.793	S	S	*	*			trans	-110.4	95.4	165.7	-85.9	-71.6	0	0	0	111	R213	R213-F215 HydrophobicContact CB-CD2 4.49Å; R213-F215 HydrophobicContact CB-CE2 4.48Å; R213-F215 HydrophobicContact CG-CE2 4.25Å; R213-F215 PolarHBondContact O-N 3.47Å
216	S	22.7	Very low	25.3	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	78%	0.783	S	S	*	*			trans	17	118.9	143.9	56	0	0	0	0	119
217	L	24.3	Very low	25.9	Very low	163 Å²	163	138.7 Å²	138.7	85%	0.853	78%	0.78	S	S	*	*			trans	20.3	101.9	142.8	-88.7	60.9	0	0	0	117.5
218	S	28	Very low	26	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	77%	0.769	S	S	*	*				-139	113.9	122.8	56.6	0	0	0	0	109.2	P220	S218-P220 VanDerWaalsContact O-CD 3.25Å; S218-P220 WeakPolarHBondContact O-CD 3.5Å
219	N	25.2	Very low	26.4	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	78%	0.775	S	S	*	*			trans	-73.3	116.4	174.8	-75.5	-28.1	0	0	0	108.3
220	P	28.9	Very low	26.6	Very low	103 Å²	103	137.1 Å²	137.1	67%	0.669	76%	0.764	S	S	*	*			trans	-61.2	125.4	165.3	27.3	-32.6	0	0	0	107.3	S218 L222	S218-P220 VanDerWaalsContact O-CD 3.25Å; S218-P220 WeakPolarHBondContact O-CD 3.5Å; P220-L222 PolarHBondContact O-N 2.78Å
221	P	29.8	Very low	27.4	Very low	121 Å²	121	138.9 Å²	138.9	79%	0.786	77%	0.767	S	S	*	*			trans	-67.8	110.8	-164.8	23	-33.3	0	0	0	112	N223	P221-N223 PolarHBondContact O-N 3.23Å
222	L	26.9	Very low	27.8	Very low	163 Å²	163	138.3 Å²	138.3	85%	0.853	76%	0.758	S	S	*	*			trans	-65.5	71.7	159	-80.6	82.1	0	0	0	109.5	P220	P220-L222 PolarHBondContact O-N 2.78Å
223	N	25.6	Very low	28.1	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	75%	0.748	S	S	*	*			trans	-176.2	90.3	154.9	-99.3	-40.3	0	0	0	113	P221	P221-N223 PolarHBondContact O-N 3.23Å
224	K	28.5	Very low	28.7	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.857	74%	0.744	S	S	*	*				172.4	100.3	128.4	-92.7	155.2	-172.6	172.7	0	110.4	P226	K224-P226 WeakPolarHBondContact O-CD 3.2Å
225	Y	25.8	Very low	29.3	Very low	203 Å²	203	136.2 Å²	136.2	80%	0.796	74%	0.74	S	S	*	*			trans	-58.5	125.4	158.1	-75.8	-88.1	0	0	0	108.4	S227	Y225-S227 VanDerWaalsContact C-N 3.34Å; Y225-S227 PolarHBondContact O-N 3.13Å
226	P	28.9	Very low	29.4	Very low	110 Å²	110	134.7 Å²	134.7	71%	0.714	74%	0.735	S	S	*	*			trans	-70.2	91.5	177.5	27.3	-33.2	0	0	0	109.9	K224 S228	K224-P226 WeakPolarHBondContact O-CD 3.2Å; P226-S228 PolarHBondContact O-N 2.96Å
227	S	31	Very low	29.9	Very low	122 Å²	122	135 Å²	135	85%	0.853	73%	0.733	S	S	*	*			trans	-75.8	25.8	-179.1	51.6	0	0	0	0	113.7	Y225	Y225-S227 VanDerWaalsContact C-N 3.34Å; Y225-S227 PolarHBondContact O-N 3.13Å
228	S	28.6	Very low	30.3	Very low	88 Å²	88	133.6 Å²	133.6	62%	0.615	73%	0.727	S	S	*	*			trans	-134.8	94.4	176	47.9	0	0	0	0	109.8	P226 S230	P226-S228 PolarHBondContact O-N 2.96Å; S228-S230 PolarHBondContact O-N 3.46Å
229	I	31.4	Very low	30.4	Very low	165 Å²	165	136.6 Å²	136.6	85%	0.846	73%	0.728	S	S	*	*			trans	-71.9	83.6	163	-61.1	173.4	0	0	0	106.8
230	S	29.4	Very low	30.5	Very low	64 Å²	64	138.5 Å²	138.5	45%	0.448	73%	0.73	S	S	.	*			trans	-63.9	154.6	166	63.1	0	0	0	0	109.6	S228 I232	S228-S230 PolarHBondContact O-N 3.46Å; S230-I232 PolarHBondContact O-N 3.24Å
231	L	37.7	Very low	30.6	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-66.3	1.8	-174.9	-91.7	157.8	0	0	0	114.9
232	I	34.3	Very low	30.4	Very low	115 Å²	115	147.1 Å²	147.1	59%	0.59	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-71.6	-32.8	-177.3	-60.8	172.4	0	0	0	111.8	S230 L234 N235	S230-I232 PolarHBondContact O-N 3.24Å; I232-L234 PolarHBondContact O-N 3.35Å; I232-N235 PolarHBondContact O-N 3.12Å; I232-N235 VanDerWaalsContact O-N 3.09Å
233	K	28.1	Very low	30.4	Very low	151 Å²	151	146.4 Å²	146.4	66%	0.657	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-73.5	9.3	-171.7	-146.1	174.1	-176.1	175.2	0	115.3
234	L	37.6	Very low	30.5	Very low	134 Å²	134	148 Å²	148	70%	0.702	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-92	-13.7	169	-151.3	138.8	0	0	0	112.9	I232	I232-L234 PolarHBondContact O-N 3.35Å
235	N	33.5	Very low	30.5	Very low	134 Å²	134	147.4 Å²	147.4	72%	0.717	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-21.6	173.5	-83.2	9.7	0	0	0	113.7	I232	I232-N235 PolarHBondContact O-N 3.12Å; I232-N235 VanDerWaalsContact O-N 3.09Å
236	Q	31.8	Very low	30.6	Very low	130 Å²	130	146.1 Å²	146.1	61%	0.607	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-82.6	-11.7	-177.6	-77.9	-177.7	-30.2	0	0	114.6	N238	Q236-N238 PolarHBondContact O-N 3.27Å
237	T	33.1	Very low	30.7	Very low	99 Å²	99	143.8 Å²	143.8	61%	0.607	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-73.8	-1.6	173.8	45.2	0	0	0	0	113.8
238	N	31.5	Very low	31	Very low	134 Å²	134	143.7 Å²	143.7	72%	0.717	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-90.1	8.8	180	-75.4	9.1	0	0	0	114.5	Q236	Q236-N238 PolarHBondContact O-N 3.27Å
239	Q	30.5	Very low	31.1	Very low	175 Å²	175	145.7 Å²	145.7	82%	0.818	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-112.8	0.8	176.3	-76.9	-168.5	-33.5	0	0	115
240	F	28.7	Very low	31.2	Very low	183 Å²	183	145.3 Å²	145.3	80%	0.803	73%	0.73	S	S	*	*	S	Bend	trans	-125.2	68.8	171.9	-84.5	-85.9	0	0	0	111.2
241	Y	29.4	Very low	31.4	Very low	233 Å²	233	152 Å²	152	91%	0.914	75%	0.747	S	S	*	*	S	Bend	trans	-167.3	127.1	137.5	-90.5	-60.1	0	0	0	108.4
242	H	26.5	Very low	31.2	Very low	173 Å²	173	149.6 Å²	149.6	80%	0.801	73%	0.731	S	S	*	*			trans	-71.1	154.6	-177.8	-92.9	-107.7	0	0	0	113
243	H	26.4	Very low	31.2	Very low	148 Å²	148	148.3 Å²	148.3	69%	0.685	73%	0.728	S	S	*	*			trans	11.7	103.9	162.9	-63.2	-25.6	0	0	0	118.4
244	H	28.2	Very low	31.9	Very low	178 Å²	178	145.6 Å²	145.6	82%	0.824	73%	0.726	S	S	*	*			trans	-147.9	121.1	133.3	-107.1	40.3	0	0	0	109	H246	H244-H246 VanDerWaalsContact C-N 3.35Å; H244-H246 PolarHBondContact O-N 2.7Å
245	H	27.1	Very low	32.3	Very low	185 Å²	185	148 Å²	148	86%	0.856	73%	0.726	S	S	*	*			trans	-78.6	74.7	-172.2	-83.4	-97.5	0	0	0	112.9
246	H	28.8	Very low	33.5	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.815	71%	0.705	S	S	*	*			trans	-101	115.6	157.8	-83.3	-68.1	0	0	0	110.3	H244	H244-H246 VanDerWaalsContact C-N 3.35Å; H244-H246 PolarHBondContact O-N 2.7Å
247	G	30.6	Very low	35	Very low	62 Å²	62	145.1 Å²	145.1	64%	0.639	71%	0.708	S	S	*	*			trans	-54.5	149.3	-179.7	0	0	0	0	0	112.5	I249	G247-I249 VanDerWaalsContact C-N 3.25Å; G247-I249 PolarHBondContact O-N 3.11Å
248	S	38	Very low	36.5	Very low	120 Å²	120	145.3 Å²	145.3	84%	0.839	70%	0.698	S	S	*	*			trans	-70.6	72.6	-169.9	47.1	0	0	0	0	113.5	Q250	S248-Q250 VanDerWaalsContact C-N 3.31Å; S248-Q250 PolarHBondContact O-N 3.4Å
249	I	31.2	Very low	38.2	Very low	129 Å²	129	143.7 Å²	143.7	66%	0.662	69%	0.686	S	S	*	*			trans	-58	97.4	164.1	-60.2	172.7	0	0	0	106.8	G247 Y251	G247-I249 VanDerWaalsContact C-N 3.25Å; G247-I249 PolarHBondContact O-N 3.11Å; I249-Y251 WeakPolarHBondContact O-CD2 3.48Å; I249-Y251 PolarHBondContact O-N 2.93Å
250	Q	33.3	Very low	40.2	Very low	158 Å²	158	142.3 Å²	142.3	74%	0.738	67%	0.673	S	S	*	*			trans	-58.6	104.1	173.8	-79.5	-168.3	-6.1	0	0	108.3	S248 H252	S248-Q250 VanDerWaalsContact C-N 3.31Å; S248-Q250 PolarHBondContact O-N 3.4Å; Q250-H252 PolarHBondContact O-N 2.68Å
251	Y	32.8	Very low	42.4	Very low	204 Å²	204	138.4 Å²	138.4	80%	0.8	65%	0.653	S	S	*	*			trans	-64.1	85.3	173.8	-72.4	-81.6	0	0	0	109.5	I249 T253	I249-Y251 WeakPolarHBondContact O-CD2 3.48Å; I249-Y251 PolarHBondContact O-N 2.93Å; Y251-T253 PolarHBondContact O-N 3.08Å
252	H	33.3	Very low	44.5	Very low	121 Å²	121	129 Å²	129	56%	0.56	62%	0.616	S	S	*	*			trans	-61.3	82.2	167.8	-100.6	29.1	0	0	0	108.2	Q250 R260	Q250-H252 PolarHBondContact O-N 2.68Å; H252-R260 PolarHBondContact NE2-NH1 3.49Å
253	T	35.7	Very low	46.8	Very low	87 Å²	87	122.6 Å²	122.6	53%	0.534	59%	0.588	S	S	.	*			trans	-51.6	135	-174.2	62.8	0	0	0	0	109.6	Y251 R255 G256	Y251-T253 PolarHBondContact O-N 3.08Å; T253-R255 PolarHBondContact O-N 3.21Å; T253-G256 PolarHBondContact O-N 3.37Å
254	P	41.6	Very low	49.3	Very low	94 Å²	94	124.6 Å²	124.6	61%	0.61	59%	0.589	S	S	*	*	H	α-helix	trans	-59.5	-22.9	-168.8	19.4	-31.7	0	0	0	113.1	G256 R257 R258	P254-G256 PolarHBondContact O-N 2.83Å; P254-R257 PolarHBondContact O-N 3.44Å; P254-R258 PolarHBondContact O-N 3.25Å; P254-R258 VanDerWaalsContact O-N 3.16Å
255	R	46.7	Very low	51.7	Low	184 Å²	184	116.2 Å²	116.2	69%	0.694	55%	0.551	S	S	*	*	H	α-helix	trans	-53.8	-46.3	169.6	-163.9	176.7	-170	123.8	-5	112.8	T253 R258 Q259	T253-R255 PolarHBondContact O-N 3.21Å; R255-R258 PolarHBondContact O-N 3.43Å; R255-Q259 WeakPolarHBondContact O-CB 3.12Å; R255-Q259 PolarHBondContact O-N 3.09Å
256	G	57.7	Low	54.2	Low	28 Å²	28	107.9 Å²	107.9	29%	0.289	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-38.4	178.1	0	0	0	0	0	112.9	T253 P254 Q259 R260	T253-G256 PolarHBondContact O-N 3.37Å; P254-G256 PolarHBondContact O-N 2.83Å; G256-Q259 PolarHBondContact O-N 3.07Å; G256-R260 WeakPolarHBondContact O-CB 3.29Å; G256-R260 WeakPolarHBondContact O-CG 3.5Å; G256-R260 PolarHBondContact O-N 3.25Å
257	R	63.2	Low	56.8	Low	177 Å²	177	104.3 Å²	104.3	67%	0.668	50%	0.495	S	S	*	.	H	α-helix	trans	-65.1	-40.1	176.6	-163.4	175.7	-170.1	-176.4	3	111.8	P254 R261	P254-R257 PolarHBondContact O-N 3.44Å; R257-R261 WeakPolarHBondContact O-CG 3.31Å; R257-R261 PolarHBondContact O-N 2.84Å
258	R	64.4	Low	59.2	Low	103 Å²	103	102.8 Å²	102.8	39%	0.389	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-44	174.1	-170.5	177.5	-175.1	168.7	5.5	111.9	P254 R255 R260 R261 Y262 E333 R334 G337	P254-R258 PolarHBondContact O-N 3.25Å; P254-R258 VanDerWaalsContact O-N 3.16Å; R255-R258 PolarHBondContact O-N 3.43Å; R258-R260 PolarHBondContact O-N 3.37Å; R258-R261 PolarHBondContact O-N 3.02Å; R258-Y262 PolarHBondContact O-N 3.31Å; R258-Y262 VanDerWaalsContact O-N 3.15Å; R258-E333 PolarHBondContact NH2-O 3.12Å; R258-R334 PolarHBondContact NH2-O 3.17Å; R258-G337 VanDerWaalsContact CZ-O 3.31Å; R258-G337 PolarHBondContact NH1-O 2.96Å; R258-G337 VanDerWaalsContact NH2-C 3.31Å; R258-G337 VanDerWaalsContact NH2-CA 3.28Å; R258-G337 PolarHBondContact NH2-O 3.41Å
259	Q	68.3	Low	61.5	Low	100 Å²	100	97 Å²	97	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-58.8	-48.6	177.2	-176	170.4	-24.2	0	0	111.3	R255 G256 R261 Y262 L263	R255-Q259 WeakPolarHBondContact O-CB 3.12Å; R255-Q259 PolarHBondContact O-N 3.09Å; G256-Q259 PolarHBondContact O-N 3.07Å; Q259-R261 VanDerWaalsContact C-N 3.26Å; Q259-R261 PolarHBondContact O-N 3.47Å; Q259-Y262 PolarHBondContact O-N 3.4Å; Q259-L263 WeakPolarHBondContact O-CB 3.35Å; Q259-L263 PolarHBondContact O-N 3.36Å
260	R	71.8	Confident	64.1	Low	146 Å²	146	91 Å²	91	55%	0.551	41%	0.408	S	S	*	.	H	α-helix	trans	-57.4	-30.8	176.7	-74.8	178.1	177.7	167.4	2	113.9	H252 G256 R258 L263 R264	H252-R260 PolarHBondContact NE2-NH1 3.49Å; G256-R260 WeakPolarHBondContact O-CB 3.29Å; G256-R260 WeakPolarHBondContact O-CG 3.5Å; G256-R260 PolarHBondContact O-N 3.25Å; R258-R260 PolarHBondContact O-N 3.37Å; R260-L263 WeakPolarHBondContact O-CB 3.47Å; R260-R264 WeakPolarHBondContact O-CG 3.36Å; R260-R264 PolarHBondContact O-N 3.47Å
261	R	74.5	Confident	66.6	Low	101 Å²	101	87.6 Å²	87.6	38%	0.381	39%	0.394	S	S	.	.	H	α-helix	trans	-78.5	-37.3	176.3	-66.6	-174.4	-165.8	156.7	-6.1	113.6	R257 R258 Q259 L263 R264 G265 W329 E333	R257-R261 WeakPolarHBondContact O-CG 3.31Å; R257-R261 PolarHBondContact O-N 2.84Å; R258-R261 PolarHBondContact O-N 3.02Å; Q259-R261 VanDerWaalsContact C-N 3.26Å; Q259-R261 PolarHBondContact O-N 3.47Å; R261-L263 VanDerWaalsContact C-N 3.28Å; R261-R264 PolarHBondContact O-N 2.88Å; R261-G265 PolarHBondContact O-N 2.98Å; R261-W329 PolarHBondContact O-NE1 3.07Å; R261-E333 VanDerWaalsContact CB-CD 3.47Å; R261-E333 HydrophobicContact CB-CG 3.98Å; R261-E333 WeakPolarHBondContact CD-OE1 3.42Å; R261-E333 WeakPolarHBondContact CD-OE2 3.31Å; R261-E333 IonicContact NH1-OE2 2.89Å
262	Y	74.5	Confident	69.2	Low	36 Å²	36	78 Å²	78	14%	0.141	36%	0.357	C	S	.	.	H	α-helix	trans	-62.2	-41.2	170.7	-176.1	-101.3	0	0	0	110.7	R258 Q259 R264 G265 L266 I330 R334 Y926	R258-Y262 PolarHBondContact O-N 3.31Å; R258-Y262 VanDerWaalsContact O-N 3.15Å; Q259-Y262 PolarHBondContact O-N 3.4Å; Y262-R264 PolarHBondContact O-N 3Å; Y262-G265 PolarHBondContact O-N 3.03Å; Y262-G265 VanDerWaalsContact O-N 3.07Å; Y262-L266 HydrophobicContact CD1-CD1 3.94Å; Y262-L266 HydrophobicContact CD1-CG 4.31Å; Y262-L266 HydrophobicContact CE1-CD1 3.5Å; Y262-L266 VanDerWaalsContact CE1-CD1 3.5Å; Y262-L266 HydrophobicContact CE1-CG 3.97Å; Y262-L266 PolarHBondContact O-N 3.23Å; Y262-I330 HydrophobicContact CD2-CG2 3.9Å; Y262-I330 HydrophobicContact CE2-CG2 3.45Å; Y262-I330 VanDerWaalsContact CE2-CG2 3.45Å; Y262-R334 PolarHBondContact OH-NH2 3.4Å; Y262-Y926 PolarHBondContact OH-O 2.85Å
263	L	74.9	Confident	71.9	Confident	38 Å²	38	72.3 Å²	72.3	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-56.5	-44.4	175.7	-143	69.3	0	0	0	112.6	D114 Q259 R260 R261 G265 L266 F267	D114-L263 VanDerWaalsContact OD1-CD1 3.25Å; D114-L263 WeakPolarHBondContact OD1-CD1 3.49Å; D114-L263 WeakPolarHBondContact OD1-CD2 3.23Å; D114-L263 WeakPolarHBondContact OD1-CG 3.24Å; Q259-L263 WeakPolarHBondContact O-CB 3.35Å; Q259-L263 PolarHBondContact O-N 3.36Å; R260-L263 WeakPolarHBondContact O-CB 3.47Å; R261-L263 VanDerWaalsContact C-N 3.28Å; L263-G265 VanDerWaalsContact C-N 3.29Å; L263-G265 PolarHBondContact O-N 3.3Å; L263-L266 PolarHBondContact O-N 3.09Å; L263-F267 WeakPolarHBondContact O-CB 3.32Å; L263-F267 PolarHBondContact O-N 2.95Å
264	R	77.8	Confident	74.4	Confident	189 Å²	189	70 Å²	70	71%	0.713	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-35.4	174.7	-72.8	176.2	179.4	-165.6	-3.9	113.2	R260 R261 Y262 G268	R260-R264 WeakPolarHBondContact O-CG 3.36Å; R260-R264 PolarHBondContact O-N 3.47Å; R261-R264 PolarHBondContact O-N 2.88Å; Y262-R264 PolarHBondContact O-N 3Å; R264-G268 PolarHBondContact O-N 2.87Å
265	G	78.6	Confident	76.6	Confident	2 Å²	2	67.9 Å²	67.9	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-66.9	-47.1	174.2	0	0	0	0	0	112.2	R261 Y262 L263 F267 G268 L269	R261-G265 PolarHBondContact O-N 2.98Å; Y262-G265 PolarHBondContact O-N 3.03Å; Y262-G265 VanDerWaalsContact O-N 3.07Å; L263-G265 VanDerWaalsContact C-N 3.29Å; L263-G265 PolarHBondContact O-N 3.3Å; G265-F267 VanDerWaalsContact C-N 3.3Å; G265-F267 PolarHBondContact O-N 2.99Å; G265-G268 PolarHBondContact O-N 2.85Å; G265-L269 WeakPolarHBondContact O-CB 3.25Å; G265-L269 PolarHBondContact O-N 3.41Å
266	L	81.3	Confident	78.6	Confident	11 Å²	11	59.2 Å²	59.2	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-35.9	174.6	-71.4	-178.9	0	0	0	112.9	L110 Y262 L263 L269 S270 I330	L110-L266 HydrophobicContact CD1-CD1 4.47Å; L110-L266 HydrophobicContact CD2-CD2 4.46Å; Y262-L266 HydrophobicContact CD1-CD1 3.94Å; Y262-L266 HydrophobicContact CD1-CG 4.31Å; Y262-L266 HydrophobicContact CE1-CD1 3.5Å; Y262-L266 VanDerWaalsContact CE1-CD1 3.5Å; Y262-L266 HydrophobicContact CE1-CG 3.97Å; Y262-L266 PolarHBondContact O-N 3.23Å; L263-L266 PolarHBondContact O-N 3.09Å; L266-L269 HydrophobicContact CD2-CD2 4.35Å; L266-L269 PolarHBondContact O-N 2.88Å; L266-S270 WeakPolarHBondContact O-CB 3.14Å; L266-S270 PolarHBondContact O-N 3.1Å; L266-S270 PolarHBondContact O-OG 3.24Å; L266-I330 HydrophobicContact CD2-CD1 4.18Å
267	F	82.6	Confident	80.1	Confident	101 Å²	101	58 Å²	58	44%	0.443	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-44.9	176.5	-174.5	-108.6	0	0	0	111.4	L111 L263 G265 S270 I271	L111-F267 HydrophobicContact CD2-CD2 3.75Å; L111-F267 HydrophobicContact CD2-CE2 3.83Å; L263-F267 WeakPolarHBondContact O-CB 3.32Å; L263-F267 PolarHBondContact O-N 2.95Å; G265-F267 VanDerWaalsContact C-N 3.3Å; G265-F267 PolarHBondContact O-N 2.99Å; F267-S270 WeakPolarHBondContact CA-OG 3.05Å; F267-S270 PolarHBondContact O-N 3.24Å; F267-S270 PolarHBondContact O-OG 3.06Å; F267-I271 HydrophobicContact CD1-CD1 3.87Å; F267-I271 HydrophobicContact CE1-CD1 3.41Å; F267-I271 VanDerWaalsContact CE1-CD1 3.41Å; F267-I271 HydrophobicContact CE2-CD1 4.17Å; F267-I271 HydrophobicContact CG-CD1 4.43Å; F267-I271 HydrophobicContact CZ-CD1 3.59Å; F267-I271 WeakPolarHBondContact O-CG1 3.27Å; F267-I271 PolarHBondContact O-N 2.97Å
268	G	80.9	Confident	81.4	Confident	29 Å²	29	53.7 Å²	53.7	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-57	-50.3	171.5	0	0	0	0	0	112	R264 G265 S270 I271 S272	R264-G268 PolarHBondContact O-N 2.87Å; G265-G268 PolarHBondContact O-N 2.85Å; G268-S270 VanDerWaalsContact C-N 3.3Å; G268-S270 PolarHBondContact O-N 3.42Å; G268-I271 PolarHBondContact O-N 3.3Å; G268-I271 VanDerWaalsContact O-N 3.08Å; G268-S272 PolarHBondContact O-N 3.34Å; G268-S272 PolarHBondContact O-OG 3.01Å
269	L	85.8	Confident	82.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.7	-43.1	175.8	-174.4	69.7	0	0	0	112.2	G265 L266 I271 S272 N273 E323 A326 I327 T923	G265-L269 WeakPolarHBondContact O-CB 3.25Å; G265-L269 PolarHBondContact O-N 3.41Å; L266-L269 HydrophobicContact CD2-CD2 4.35Å; L266-L269 PolarHBondContact O-N 2.88Å; L269-I271 VanDerWaalsContact C-N 3.31Å; L269-I271 PolarHBondContact O-N 2.93Å; L269-S272 WeakPolarHBondContact CA-OG 3.44Å; L269-S272 PolarHBondContact O-OG 3.18Å; L269-N273 VanDerWaalsContact O-CB 3.26Å; L269-N273 WeakPolarHBondContact O-CB 3.38Å; L269-N273 PolarHBondContact O-N 3.31Å; L269-N273 PolarHBondContact O-OD1 3.17Å; L269-E323 HydrophobicContact CD1-CG 3.82Å; L269-A326 HydrophobicContact CB-CB 4.11Å; L269-I327 HydrophobicContact CD1-CD1 4.48Å; L269-I327 HydrophobicContact CD1-CG1 4Å; L269-T923 HydrophobicContact CD2-CG2 4.26Å; L269-T923 HydrophobicContact CG-CG2 4.31Å
270	S	86.4	Confident	83.4	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-70	-26.5	178.9	60	0	0	0	0	113.9	N107 L111 L266 F267 G268 L274	N107-S270 WeakPolarHBondContact OD1-CA 3.36Å; L111-S270 VanDerWaalsContact CD2-OG 3.31Å; L111-S270 WeakPolarHBondContact CD2-OG 3.3Å; L266-S270 WeakPolarHBondContact O-CB 3.14Å; L266-S270 PolarHBondContact O-N 3.1Å; L266-S270 PolarHBondContact O-OG 3.24Å; F267-S270 WeakPolarHBondContact CA-OG 3.05Å; F267-S270 PolarHBondContact O-N 3.24Å; F267-S270 PolarHBondContact O-OG 3.06Å; G268-S270 VanDerWaalsContact C-N 3.3Å; G268-S270 PolarHBondContact O-N 3.42Å; S270-L274 WeakPolarHBondContact O-CB 3.48Å; S270-L274 PolarHBondContact O-N 3.06Å
271	I	86.4	Confident	84.1	Confident	86 Å²	86	41 Å²	41	44%	0.441	20%	0.201	S	C	.	.	H	α-helix	trans	-80.6	-44.8	176.4	-71.5	171.9	0	0	0	110.6	F267 G268 L269 N273 L274 S275	F267-I271 HydrophobicContact CD1-CD1 3.87Å; F267-I271 HydrophobicContact CE1-CD1 3.41Å; F267-I271 VanDerWaalsContact CE1-CD1 3.41Å; F267-I271 HydrophobicContact CE2-CD1 4.17Å; F267-I271 HydrophobicContact CG-CD1 4.43Å; F267-I271 HydrophobicContact CZ-CD1 3.59Å; F267-I271 WeakPolarHBondContact O-CG1 3.27Å; F267-I271 PolarHBondContact O-N 2.97Å; G268-I271 PolarHBondContact O-N 3.3Å; G268-I271 VanDerWaalsContact O-N 3.08Å; L269-I271 VanDerWaalsContact C-N 3.31Å; L269-I271 PolarHBondContact O-N 2.93Å; I271-N273 VanDerWaalsContact C-N 3.3Å; I271-N273 PolarHBondContact O-N 3.03Å; I271-L274 PolarHBondContact O-N 2.89Å; I271-S275 WeakPolarHBondContact O-CB 3.31Å; I271-S275 PolarHBondContact O-N 2.96Å
272	S	87.7	Confident	84.7	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-45.6	175.3	50.5	0	0	0	0	111.2	G268 L269 S275 L276 A319 E323	G268-S272 PolarHBondContact O-N 3.34Å; G268-S272 PolarHBondContact O-OG 3.01Å; L269-S272 WeakPolarHBondContact CA-OG 3.44Å; L269-S272 PolarHBondContact O-OG 3.18Å; S272-S275 WeakPolarHBondContact O-CB 3.46Å; S272-S275 PolarHBondContact O-N 3.47Å; S272-L276 PolarHBondContact O-N 3.12Å; S272-A319 WeakPolarHBondContact CB-O 3.43Å; S272-E323 VanDerWaalsContact OG-CA 3.32Å; S272-E323 WeakPolarHBondContact OG-CA 3.42Å
273	N	88.3	Confident	85.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-80.4	-25.2	-171.6	-61.8	26.3	0	0	0	111.8	S103 N107 L269 I271 S277 E323 A919	S103-N273 PolarHBondContact OG-O 3.02Å; N107-N273 VanDerWaalsContact ND2-CB 3.27Å; N107-N273 WeakPolarHBondContact ND2-CB 3.2Å; L269-N273 VanDerWaalsContact O-CB 3.26Å; L269-N273 WeakPolarHBondContact O-CB 3.38Å; L269-N273 PolarHBondContact O-N 3.31Å; L269-N273 PolarHBondContact O-OD1 3.17Å; I271-N273 VanDerWaalsContact C-N 3.3Å; I271-N273 PolarHBondContact O-N 3.03Å; N273-S277 WeakPolarHBondContact O-CB 3.48Å; N273-S277 PolarHBondContact O-N 3.35Å; N273-S277 VanDerWaalsContact O-N 3.09Å; N273-E323 PolarHBondContact ND2-OE1 3.08Å; N273-E323 WeakPolarHBondContact OD1-CB 3.31Å; N273-E323 VanDerWaalsContact OD1-CG 3.29Å; N273-E323 WeakPolarHBondContact OD1-CG 3.41Å; N273-E323 PolarHBondContact OD1-OE1 3.31Å; N273-A919 HydrophobicContact CB-CB 4.09Å; N273-A919 VanDerWaalsContact ND2-CA 3.26Å; N273-A919 WeakPolarHBondContact ND2-CA 3.38Å; N273-A919 PolarHBondContact ND2-O 2.74Å; N273-A919 VanDerWaalsContact ND2-O 3.16Å
274	L	88.6	Confident	85.7	Confident	39 Å²	39	36 Å²	36	20%	0.204	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-40.5	165.7	-176.4	67.8	0	0	0	111.8	F104 I108 S270 I271 S277 L278	F104-L274 HydrophobicContact CD2-CD1 3.5Å; F104-L274 HydrophobicContact CE2-CD1 3.78Å; F104-L274 HydrophobicContact CG-CD1 4.47Å; I108-L274 HydrophobicContact CG1-CD1 4.4Å; S270-L274 WeakPolarHBondContact O-CB 3.48Å; S270-L274 PolarHBondContact O-N 3.06Å; I271-L274 PolarHBondContact O-N 2.89Å; L274-S277 WeakPolarHBondContact O-CB 3.17Å; L274-S277 PolarHBondContact O-N 2.98Å; L274-L278 HydrophobicContact CG-CD1 4.28Å; L274-L278 WeakPolarHBondContact O-CG 3.28Å; L274-L278 PolarHBondContact O-N 3.31Å
275	S	88	Confident	85.9	Confident	50 Å²	50	31.1 Å²	31.1	35%	0.35	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-47.6	174.1	-163.3	0	0	0	0	110.8	I271 S272 S277 L278 C279	I271-S275 WeakPolarHBondContact O-CB 3.31Å; I271-S275 PolarHBondContact O-N 2.96Å; S272-S275 WeakPolarHBondContact O-CB 3.46Å; S272-S275 PolarHBondContact O-N 3.47Å; S275-S277 VanDerWaalsContact C-N 3.32Å; S275-S277 PolarHBondContact O-N 2.88Å; S275-L278 PolarHBondContact O-N 2.83Å; S275-C279 WeakPolarHBondContact O-CB 3.49Å; S275-C279 PolarHBondContact O-N 3.48Å; S275-C279 PolarHBondContact O-SG 3.32Å
276	L	89.6	Confident	86.1	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-55.3	-47	175	-177.6	67.9	0	0	0	111.5	S272 L278 C279 L280 I316 A319 Q320 Y916 A919	S272-L276 PolarHBondContact O-N 3.12Å; L276-L278 PolarHBondContact O-N 3.07Å; L276-C279 PolarHBondContact O-N 3.41Å; L276-L280 HydrophobicContact CD1-CD1 4.16Å; L276-L280 HydrophobicContact CD1-CG 4.33Å; L276-L280 HydrophobicContact CG-CD1 3.88Å; L276-L280 HydrophobicContact CG-CG 4.43Å; L276-L280 WeakPolarHBondContact O-CB 3.44Å; L276-L280 VanDerWaalsContact O-CG 3.24Å; L276-L280 WeakPolarHBondContact O-CG 3.37Å; L276-L280 PolarHBondContact O-N 3.31Å; L276-I316 HydrophobicContact CD1-CB 4.1Å; L276-I316 HydrophobicContact CD1-CG1 4.07Å; L276-I316 HydrophobicContact CD1-CG2 3.6Å; L276-A319 HydrophobicContact CB-CB 3.86Å; L276-A319 HydrophobicContact CD1-CB 4.35Å; L276-Q320 HydrophobicContact CD1-CG 4.1Å; L276-Q320 HydrophobicContact CD2-CG 4.38Å; L276-Y916 HydrophobicContact CD1-CD1 4.03Å; L276-Y916 HydrophobicContact CD1-CE1 4.29Å; L276-Y916 HydrophobicContact CD2-CD1 4.33Å; L276-A919 HydrophobicContact CD2-CB 3.67Å
277	S	89.4	Confident	86	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-56.7	-47.6	176.4	167.9	0	0	0	0	112.5	A100 F104 N273 L274 S275 L281	A100-S277 WeakPolarHBondContact O-CB 3.27Å; A100-S277 PolarHBondContact O-OG 2.84Å; F104-S277 WeakPolarHBondContact CB-OG 3.47Å; N273-S277 WeakPolarHBondContact O-CB 3.48Å; N273-S277 PolarHBondContact O-N 3.35Å; N273-S277 VanDerWaalsContact O-N 3.09Å; L274-S277 WeakPolarHBondContact O-CB 3.17Å; L274-S277 PolarHBondContact O-N 2.98Å; S275-S277 VanDerWaalsContact C-N 3.32Å; S275-S277 PolarHBondContact O-N 2.88Å; S277-L281 WeakPolarHBondContact O-CB 3.43Å; S277-L281 PolarHBondContact O-N 3.13Å
278	L	88.9	Confident	85.7	Confident	87 Å²	87	29.2 Å²	29.2	46%	0.455	17%	0.167	S	C	.	.	H	α-helix	trans	-68.7	-39.4	-180	-68.8	170.1	0	0	0	112.5	F104 L274 S275 L276 L281 S282	F104-L278 HydrophobicContact CE2-CD2 4.26Å; L274-L278 HydrophobicContact CG-CD1 4.28Å; L274-L278 WeakPolarHBondContact O-CG 3.28Å; L274-L278 PolarHBondContact O-N 3.31Å; S275-L278 PolarHBondContact O-N 2.83Å; L276-L278 PolarHBondContact O-N 3.07Å; L278-L281 PolarHBondContact O-N 3.03Å; L278-S282 WeakPolarHBondContact O-CB 3.44Å; L278-S282 PolarHBondContact O-N 2.88Å
279	C	88.4	Confident	85.5	Confident	15 Å²	15	31 Å²	31	10%	0.101	17%	0.169	C	C	.	.	H	α-helix	trans	-70.3	-37.2	177.5	-61.9	0	0	0	0	112.2	S275 L276 S282 W283 T315 I316	S275-C279 WeakPolarHBondContact O-CB 3.49Å; S275-C279 PolarHBondContact O-N 3.48Å; S275-C279 PolarHBondContact O-SG 3.32Å; L276-C279 PolarHBondContact O-N 3.41Å; C279-S282 PolarHBondContact O-N 2.78Å; C279-W283 WeakPolarHBondContact O-CB 3.38Å; C279-W283 PolarHBondContact O-N 3.47Å; C279-T315 PolarHBondContact SG-OG1 2.92Å; C279-I316 HydrophobicContact CB-CD1 4.43Å; C279-I316 HydrophobicContact CB-CG1 3.75Å
280	L	87.4	Confident	85	Confident	7 Å²	7	31.5 Å²	31.5	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-41.9	171.8	-72.7	170.2	0	0	0	112	I96 A100 L276 W283 C284 I316 Y916	I96-L280 HydrophobicContact CG2-CB 4.19Å; I96-L280 HydrophobicContact CG2-CD2 3.97Å; A100-L280 HydrophobicContact CB-CB 4.01Å; L276-L280 HydrophobicContact CD1-CD1 4.16Å; L276-L280 HydrophobicContact CD1-CG 4.33Å; L276-L280 HydrophobicContact CG-CD1 3.88Å; L276-L280 HydrophobicContact CG-CG 4.43Å; L276-L280 WeakPolarHBondContact O-CB 3.44Å; L276-L280 VanDerWaalsContact O-CG 3.24Å; L276-L280 WeakPolarHBondContact O-CG 3.37Å; L276-L280 PolarHBondContact O-N 3.31Å; L280-W283 PolarHBondContact O-N 2.98Å; L280-C284 PolarHBondContact O-N 3.44Å; L280-C284 PolarHBondContact O-SG 2.95Å; L280-I316 HydrophobicContact CD2-CD1 3.62Å; L280-I316 HydrophobicContact CD2-CG1 4.24Å; L280-I316 HydrophobicContact CG-CD1 4.12Å; L280-I316 HydrophobicContact CG-CG1 4.32Å; L280-Y916 HydrophobicContact CD1-CD1 4.38Å; L280-Y916 HydrophobicContact CD1-CD2 4.1Å; L280-Y916 HydrophobicContact CD1-CG 3.92Å; L280-Y916 HydrophobicContact CD2-CD2 3.73Å; L280-Y916 HydrophobicContact CD2-CE1 4.46Å; L280-Y916 HydrophobicContact CD2-CE2 3.65Å; L280-Y916 HydrophobicContact CD2-CG 4.22Å
281	L	87.2	Confident	84.1	Confident	61 Å²	61	33 Å²	33	32%	0.319	18%	0.177	S	C	.	.	H	α-helix	trans	-64.2	-43.9	175.1	-179.1	61.6	0	0	0	111.2	M97 A100 S277 L278 C284 I285	M97-L281 HydrophobicContact CG-CD1 4.04Å; M97-L281 HydrophobicContact SD-CD1 3.76Å; A100-L281 HydrophobicContact CB-CB 4.45Å; S277-L281 WeakPolarHBondContact O-CB 3.43Å; S277-L281 PolarHBondContact O-N 3.13Å; L278-L281 PolarHBondContact O-N 3.03Å; L281-C284 PolarHBondContact O-N 3.4Å; L281-I285 HydrophobicContact CD1-CD1 4.19Å; L281-I285 HydrophobicContact CG-CD1 3.99Å; L281-I285 VanDerWaalsContact O-CG1 3.3Å; L281-I285 WeakPolarHBondContact O-CG1 3.34Å; L281-I285 PolarHBondContact O-N 2.73Å
282	S	86.4	Confident	83.4	Confident	42 Å²	42	34.4 Å²	34.4	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-42.8	176.4	-175.7	0	0	0	0	112	L278 C279 C284 I285 C286 N312	L278-S282 WeakPolarHBondContact O-CB 3.44Å; L278-S282 PolarHBondContact O-N 2.88Å; C279-S282 PolarHBondContact O-N 2.78Å; S282-C284 PolarHBondContact O-N 3.13Å; S282-I285 PolarHBondContact O-N 3.46Å; S282-C286 PolarHBondContact O-N 3.37Å; S282-C286 PolarHBondContact O-SG 3.36Å; S282-N312 WeakPolarHBondContact CB-ND2 3.37Å; S282-N312 PolarHBondContact OG-ND2 2.9Å
283	W	84.9	Confident	82.5	Confident	20 Å²	20	35.6 Å²	35.6	8%	0.076	19%	0.191	C	C	.	.	H	α-helix	trans	-56.8	-49.2	171.9	174.6	-81.4	0	0	0	111.5	C279 L280 I285 C286 Q287 A309 N312 L313 M556 Q559	C279-W283 WeakPolarHBondContact O-CB 3.38Å; C279-W283 PolarHBondContact O-N 3.47Å; L280-W283 PolarHBondContact O-N 2.98Å; W283-I285 VanDerWaalsContact C-N 3.34Å; W283-I285 PolarHBondContact O-N 2.89Å; W283-C286 PolarHBondContact O-N 2.82Å; W283-Q287 HydrophobicContact CZ2-CG 4.32Å; W283-Q287 WeakPolarHBondContact O-CG 3.43Å; W283-Q287 PolarHBondContact O-N 3.08Å; W283-A309 HydrophobicContact CE3-CB 3.89Å; W283-A309 HydrophobicContact CH2-CB 4.31Å; W283-A309 VanDerWaalsContact CZ3-C 3.46Å; W283-A309 HydrophobicContact CZ3-CB 3.71Å; W283-A309 WeakPolarHBondContact CZ3-O 3.29Å; W283-N312 HydrophobicContact CB-CB 4.16Å; W283-N312 HydrophobicContact CE3-CB 4.23Å; W283-L313 HydrophobicContact CE3-CB 4.2Å; W283-L313 HydrophobicContact CH2-CD2 4.47Å; W283-L313 HydrophobicContact CZ3-CB 3.75Å; W283-L313 HydrophobicContact CZ3-CD2 4.43Å; W283-M556 HydrophobicContact CZ2-CE 3.87Å; W283-M556 HydrophobicContact CZ2-SD 3.76Å; W283-Q559 VanDerWaalsContact CH2-OE1 3.24Å
284	C	84.1	Confident	81.1	Confident	6 Å²	6	41.8 Å²	41.8	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-42.5	178.6	-68.2	0	0	0	0	112	M93 I96 L280 L281 S282 C286 Q287 M288	M93-C284 HydrophobicContact CE-CB 4.14Å; M93-C284 WeakPolarHBondContact CE-O 3.49Å; I96-C284 WeakPolarHBondContact CG2-SG 3.33Å; L280-C284 PolarHBondContact O-N 3.44Å; L280-C284 PolarHBondContact O-SG 2.95Å; L281-C284 PolarHBondContact O-N 3.4Å; S282-C284 PolarHBondContact O-N 3.13Å; C284-C286 PolarHBondContact O-N 3.01Å; C284-Q287 PolarHBondContact O-N 3.07Å; C284-M288 WeakPolarHBondContact O-CB 3.48Å; C284-M288 VanDerWaalsContact O-CG 3.31Å; C284-M288 WeakPolarHBondContact O-CG 3.22Å; C284-M288 PolarHBondContact O-N 3.32Å
285	I	82.8	Confident	79.8	Confident	88 Å²	88	41.6 Å²	41.6	45%	0.451	22%	0.222	S	C	.	.	H	α-helix	trans	-61.2	-45	175.7	-69.7	165.1	0	0	0	110.5	L281 S282 W283 Q287 M288 I289	L281-I285 HydrophobicContact CD1-CD1 4.19Å; L281-I285 HydrophobicContact CG-CD1 3.99Å; L281-I285 VanDerWaalsContact O-CG1 3.3Å; L281-I285 WeakPolarHBondContact O-CG1 3.34Å; L281-I285 PolarHBondContact O-N 2.73Å; S282-I285 PolarHBondContact O-N 3.46Å; W283-I285 VanDerWaalsContact C-N 3.34Å; W283-I285 PolarHBondContact O-N 2.89Å; I285-Q287 PolarHBondContact O-N 3.37Å; I285-M288 PolarHBondContact O-N 3.08Å; I285-I289 HydrophobicContact CG2-CD1 3.7Å; I285-I289 HydrophobicContact CG2-CG1 4.49Å; I285-I289 WeakPolarHBondContact O-CD1 3.15Å; I285-I289 VanDerWaalsContact O-CG1 3.23Å; I285-I289 WeakPolarHBondContact O-CG1 3.4Å; I285-I289 PolarHBondContact O-N 2.93Å
286	C	82.3	Confident	78.3	Confident	7 Å²	7	44.5 Å²	44.5	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-48.3	176.2	-68.7	0	0	0	0	112.3	S282 W283 C284 I289 I290 L305 I308	S282-C286 PolarHBondContact O-N 3.37Å; S282-C286 PolarHBondContact O-SG 3.36Å; W283-C286 PolarHBondContact O-N 2.82Å; C284-C286 PolarHBondContact O-N 3.01Å; C286-I289 PolarHBondContact O-N 3.32Å; C286-I290 WeakPolarHBondContact O-CD1 3.49Å; C286-I290 VanDerWaalsContact O-CG1 3.26Å; C286-I290 WeakPolarHBondContact O-CG1 3.3Å; C286-I290 PolarHBondContact O-N 3.49Å; C286-L305 HydrophobicContact CB-CD2 4.45Å; C286-I308 VanDerWaalsContact SG-CG2 3.58Å
287	Q	79.2	Confident	76.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.5	-34.9	-179	-57.1	-59.5	-5.3	0	0	112.7	M93 W283 C284 I285 I289 I290 Y291 H552 M556	M93-Q287 HydrophobicContact CE-CB 3.84Å; M93-Q287 HydrophobicContact SD-CB 4.36Å; W283-Q287 HydrophobicContact CZ2-CG 4.32Å; W283-Q287 WeakPolarHBondContact O-CG 3.43Å; W283-Q287 PolarHBondContact O-N 3.08Å; C284-Q287 PolarHBondContact O-N 3.07Å; I285-Q287 PolarHBondContact O-N 3.37Å; Q287-I289 VanDerWaalsContact C-N 3.34Å; Q287-I289 PolarHBondContact O-N 3.46Å; Q287-I290 PolarHBondContact O-N 2.9Å; Q287-Y291 WeakPolarHBondContact O-CB 3.36Å; Q287-Y291 PolarHBondContact O-N 3.38Å; Q287-H552 PolarHBondContact OE1-CE1 2.97Å; Q287-M556 HydrophobicContact CG-SD 3.88Å; Q287-M556 PolarHBondContact NE2-SD 3.41Å; Q287-M556 VanDerWaalsContact NE2-SD 3.4Å
288	M	76	Confident	75.9	Confident	66 Å²	66	57 Å²	57	33%	0.325	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-39	171.8	-73.5	-56.9	-59	0	0	112.3	M93 C284 I285 Y291 N292	M93-M288 HydrophobicContact CE-CG 3.59Å; M93-M288 HydrophobicContact CE-SD 3.72Å; C284-M288 WeakPolarHBondContact O-CB 3.48Å; C284-M288 VanDerWaalsContact O-CG 3.31Å; C284-M288 WeakPolarHBondContact O-CG 3.22Å; C284-M288 PolarHBondContact O-N 3.32Å; I285-M288 PolarHBondContact O-N 3.08Å; M288-Y291 PolarHBondContact O-N 3.09Å; M288-N292 WeakPolarHBondContact O-CB 3.37Å; M288-N292 PolarHBondContact O-N 3.43Å; M288-N292 VanDerWaalsContact O-N 3.08Å
289	I	77.7	Confident	74.9	Confident	66 Å²	66	56.7 Å²	56.7	34%	0.338	28%	0.275	S	S	.	.	H	α-helix	trans	-69.3	-43.9	176.1	-65.2	166.4	0	0	0	110.4	I285 C286 Q287 Y291 N292 I293 L305	I285-I289 HydrophobicContact CG2-CD1 3.7Å; I285-I289 HydrophobicContact CG2-CG1 4.49Å; I285-I289 WeakPolarHBondContact O-CD1 3.15Å; I285-I289 VanDerWaalsContact O-CG1 3.23Å; I285-I289 WeakPolarHBondContact O-CG1 3.4Å; I285-I289 PolarHBondContact O-N 2.93Å; C286-I289 PolarHBondContact O-N 3.32Å; Q287-I289 VanDerWaalsContact C-N 3.34Å; Q287-I289 PolarHBondContact O-N 3.46Å; I289-Y291 VanDerWaalsContact C-N 3.25Å; I289-Y291 PolarHBondContact O-N 3.25Å; I289-N292 PolarHBondContact O-N 3.49Å; I289-I293 HydrophobicContact CG2-CD1 3.47Å; I289-I293 VanDerWaalsContact CG2-CD1 3.47Å; I289-I293 HydrophobicContact CG2-CG1 4.11Å; I289-I293 WeakPolarHBondContact O-CB 3.49Å; I289-I293 VanDerWaalsContact O-CG1 3.31Å; I289-I293 WeakPolarHBondContact O-CG1 3.25Å; I289-I293 PolarHBondContact O-N 2.87Å; I289-I293 VanDerWaalsContact O-N 3.09Å; I289-L305 HydrophobicContact CB-CD1 4.22Å; I289-L305 HydrophobicContact CG2-CD1 3.5Å; I289-L305 VanDerWaalsContact CG2-CD1 3.5Å
290	I	74.5	Confident	74.2	Confident	11 Å²	11	62 Å²	62	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-33.2	175.2	-68.8	162.7	0	0	0	111.9	C286 Q287 L305	C286-I290 WeakPolarHBondContact O-CD1 3.49Å; C286-I290 VanDerWaalsContact O-CG1 3.26Å; C286-I290 WeakPolarHBondContact O-CG1 3.3Å; C286-I290 PolarHBondContact O-N 3.49Å; Q287-I290 PolarHBondContact O-N 2.9Å; I290-L305 HydrophobicContact CD1-CB 3.8Å; I290-L305 HydrophobicContact CG1-CB 3.73Å; I290-L305 HydrophobicContact CG1-CD1 4.07Å
291	Y	69.2	Low	73.6	Confident	34 Å²	34	65.3 Å²	65.3	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-73.7	-39.9	176.6	-175.5	-99.1	0	0	0	112.7	F89 H90 Q287 M288 I289 I548 H552	F89-Y291 HydrophobicContact CD1-CD2 4.27Å; F89-Y291 HydrophobicContact CD1-CE2 4.23Å; F89-Y291 HydrophobicContact CE1-CD1 4.39Å; F89-Y291 AromaticContact CE1-CD2 3.75Å; F89-Y291 HydrophobicContact CE1-CD2 3.75Å; F89-Y291 HydrophobicContact CE1-CE2 4.16Å; F89-Y291 AromaticContact CE1-CG 3.89Å; F89-Y291 HydrophobicContact CE1-CG 3.89Å; F89-Y291 HydrophobicContact CZ-CD2 4.37Å; H90-Y291 AromaticContact CE1-CE1 3.77Å; Q287-Y291 WeakPolarHBondContact O-CB 3.36Å; Q287-Y291 PolarHBondContact O-N 3.38Å; M288-Y291 PolarHBondContact O-N 3.09Å; I289-Y291 VanDerWaalsContact C-N 3.25Å; I289-Y291 PolarHBondContact O-N 3.25Å; Y291-I548 HydrophobicContact CD2-CG2 4.23Å; Y291-I548 HydrophobicContact CE2-CG2 4.1Å; Y291-H552 HydrophobicContact CD2-CB 4.45Å
292	N	71.2	Confident	72.8	Confident	115 Å²	115	63.1 Å²	63.1	62%	0.615	31%	0.307	S	S	*	.	H	α-helix	trans	-84.7	-13.8	-175.2	-72.9	-10.4	0	0	0	114.9	M288 I289	M288-N292 WeakPolarHBondContact O-CB 3.37Å; M288-N292 PolarHBondContact O-N 3.43Å; M288-N292 VanDerWaalsContact O-N 3.08Å; I289-N292 PolarHBondContact O-N 3.49Å
293	I	68.4	Low	72.2	Confident	29 Å²	29	63.2 Å²	63.2	15%	0.149	31%	0.306	C	S	.	.	S	Bend	trans	-83.4	130.3	-177	-80.1	178.3	0	0	0	112.2	I289 K295 Y298 L301 L305	I289-I293 HydrophobicContact CG2-CD1 3.47Å; I289-I293 VanDerWaalsContact CG2-CD1 3.47Å; I289-I293 HydrophobicContact CG2-CG1 4.11Å; I289-I293 WeakPolarHBondContact O-CB 3.49Å; I289-I293 VanDerWaalsContact O-CG1 3.31Å; I289-I293 WeakPolarHBondContact O-CG1 3.25Å; I289-I293 PolarHBondContact O-N 2.87Å; I289-I293 VanDerWaalsContact O-N 3.09Å; I293-K295 PolarHBondContact O-N 3.37Å; I293-Y298 HydrophobicContact CG2-CD2 4.13Å; I293-Y298 HydrophobicContact CG2-CG 4.31Å; I293-L301 HydrophobicContact CD1-CD2 3.73Å; I293-L301 HydrophobicContact CD1-CG 4.24Å; I293-L305 HydrophobicContact CD1-CD1 4.27Å
294	D	59.6	Low	71.8	Confident	130 Å²	130	69.6 Å²	69.6	70%	0.695	33%	0.33	S	S	*	.			trans	-61.4	105.3	167.1	-73.8	-46.7	0	0	0	110.9	H296 K297	D294-H296 PolarHBondContact O-N 3.44Å; D294-H296 VanDerWaalsContact O-N 3.09Å; D294-K297 PolarHBondContact O-N 3.07Å; D294-K297 VanDerWaalsContact O-N 3.12Å
295	K	60.2	Low	71.4	Confident	35 Å²	35	70 Å²	70	15%	0.152	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.2	-166.1	-63.5	-179.6	-178	177	0	114	I293 K297 L551	I293-K295 PolarHBondContact O-N 3.37Å; K295-K297 PolarHBondContact O-N 2.94Å; K295-L551 HydrophobicContact CD-CD2 4.42Å
296	H	55.8	Low	70.9	Confident	111 Å²	111	67.8 Å²	67.8	51%	0.514	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-32.5	-179.2	-61.9	-87.8	0	0	0	114	D294	D294-H296 PolarHBondContact O-N 3.44Å; D294-H296 VanDerWaalsContact O-N 3.09Å
297	K	60.2	Low	70.6	Confident	157 Å²	157	71 Å²	71	68%	0.683	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-23.1	-170.4	-172.2	169.7	179	178.7	0	114.1	D294 K295	D294-K297 PolarHBondContact O-N 3.07Å; D294-K297 VanDerWaalsContact O-N 3.12Å; K295-K297 PolarHBondContact O-N 2.94Å
298	Y	69	Low	70.6	Confident	110 Å²	110	74.3 Å²	74.3	43%	0.431	36%	0.355	S	S	.	.			trans	-128.7	35.7	-167	-66.5	-74	0	0	0	113.8	I293 I300 L301 N302	I293-Y298 HydrophobicContact CG2-CD2 4.13Å; I293-Y298 HydrophobicContact CG2-CG 4.31Å; Y298-I300 VanDerWaalsContact C-N 3.32Å; Y298-I300 PolarHBondContact O-N 2.72Å; Y298-L301 PolarHBondContact O-N 3.03Å; Y298-N302 PolarHBondContact O-N 3.18Å
299	Y	68.4	Low	70.7	Confident	81 Å²	81	71.2 Å²	71.2	32%	0.318	34%	0.34	S	S	.	.	H	α-helix	trans	-48.6	-47.5	179.4	178.9	-96.4	0	0	0	113.6	L301 N302 V303 N530	Y299-L301 PolarHBondContact O-N 2.97Å; Y299-N302 PolarHBondContact O-N 3.35Å; Y299-V303 HydrophobicContact CD1-CG2 4.37Å; Y299-V303 HydrophobicContact CE1-CG2 3.91Å; Y299-V303 HydrophobicContact CE2-CG2 4.4Å; Y299-V303 WeakPolarHBondContact O-CG2 3.41Å; Y299-V303 PolarHBondContact O-N 2.72Å; Y299-N530 PolarHBondContact OH-OD1 3.06Å
300	I	73.3	Confident	70.8	Confident	125 Å²	125	71.8 Å²	71.8	64%	0.641	34%	0.34	S	S	*	.	H	α-helix	trans	-61.1	-43.2	179.6	-63.1	171.6	0	0	0	111.5	Y298 V303 W304	Y298-I300 VanDerWaalsContact C-N 3.32Å; Y298-I300 PolarHBondContact O-N 2.72Å; I300-V303 PolarHBondContact O-N 2.8Å; I300-W304 VanDerWaalsContact O-CD1 3.29Å; I300-W304 PolarHBondContact O-N 3.38Å
301	L	74.5	Confident	71.1	Confident	77 Å²	77	75.3 Å²	75.3	40%	0.403	36%	0.358	S	S	.	.	H	α-helix	trans	-67.3	-39.1	178.5	177.2	57.6	0	0	0	111.1	I293 Y298 Y299 W304 L305	I293-L301 HydrophobicContact CD1-CD2 3.73Å; I293-L301 HydrophobicContact CD1-CG 4.24Å; Y298-L301 PolarHBondContact O-N 3.03Å; Y299-L301 PolarHBondContact O-N 2.97Å; L301-W304 PolarHBondContact O-N 2.96Å; L301-L305 HydrophobicContact CD1-CD1 4.16Å; L301-L305 HydrophobicContact CD1-CG 4.2Å; L301-L305 HydrophobicContact CG-CD1 3.95Å; L301-L305 HydrophobicContact CG-CG 4.47Å; L301-L305 WeakPolarHBondContact O-CB 3.4Å; L301-L305 VanDerWaalsContact O-CG 3.27Å; L301-L305 WeakPolarHBondContact O-CG 3.31Å; L301-L305 PolarHBondContact O-N 2.84Å
302	N	71.6	Confident	71.9	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.08	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-46.5	173.1	-75.5	-22.3	0	0	0	111.3	Y298 Y299 W304 L305 T306	Y298-N302 PolarHBondContact O-N 3.18Å; Y299-N302 PolarHBondContact O-N 3.35Å; N302-W304 VanDerWaalsContact C-N 3.35Å; N302-W304 PolarHBondContact O-N 3.5Å; N302-L305 CarbonylContact O-C 3.51Å; N302-L305 PolarHBondContact O-N 2.91Å; N302-L305 VanDerWaalsContact O-N 3.1Å; N302-T306 VanDerWaalsContact O-CG2 3.3Å; N302-T306 WeakPolarHBondContact O-CG2 3.49Å; N302-T306 PolarHBondContact O-N 3.27Å
303	V	72.4	Confident	72.5	Confident	44 Å²	44	69.4 Å²	69.4	27%	0.267	33%	0.329	S	S	.	.	H	α-helix	trans	-59.3	-41.7	175.5	173.8	0	0	0	0	112.1	Y299 I300 L305 T306 I307	Y299-V303 HydrophobicContact CD1-CG2 4.37Å; Y299-V303 HydrophobicContact CE1-CG2 3.91Å; Y299-V303 HydrophobicContact CE2-CG2 4.4Å; Y299-V303 WeakPolarHBondContact O-CG2 3.41Å; Y299-V303 PolarHBondContact O-N 2.72Å; I300-V303 PolarHBondContact O-N 2.8Å; V303-L305 PolarHBondContact O-N 2.96Å; V303-T306 PolarHBondContact O-N 2.94Å; V303-T306 PolarHBondContact O-OG1 3.48Å; V303-I307 HydrophobicContact CG1-CD1 4.09Å; V303-I307 WeakPolarHBondContact O-CG1 3.25Å; V303-I307 PolarHBondContact O-N 3.23Å
304	W	76.9	Confident	73.2	Confident	155 Å²	155	72.7 Å²	72.7	59%	0.587	34%	0.339	S	S	*	.	H	α-helix	trans	-64.2	-39.4	173.6	-82.2	105.6	0	0	0	112.7	I300 L301 N302 I307 I308	I300-W304 VanDerWaalsContact O-CD1 3.29Å; I300-W304 PolarHBondContact O-N 3.38Å; L301-W304 PolarHBondContact O-N 2.96Å; N302-W304 VanDerWaalsContact C-N 3.35Å; N302-W304 PolarHBondContact O-N 3.5Å; W304-I307 PolarHBondContact O-N 3.4Å; W304-I308 WeakPolarHBondContact O-CD1 3.49Å; W304-I308 VanDerWaalsContact O-CG1 3.25Å; W304-I308 WeakPolarHBondContact O-CG1 3.43Å; W304-I308 PolarHBondContact O-N 2.89Å
305	L	76.8	Confident	74.4	Confident	14 Å²	14	68 Å²	68	7%	0.073	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-33.2	176.9	-69.2	165.3	0	0	0	112.6	C286 I289 I290 I293 L301 N302 V303 I308 A309	C286-L305 HydrophobicContact CB-CD2 4.45Å; I289-L305 HydrophobicContact CB-CD1 4.22Å; I289-L305 HydrophobicContact CG2-CD1 3.5Å; I289-L305 VanDerWaalsContact CG2-CD1 3.5Å; I290-L305 HydrophobicContact CD1-CB 3.8Å; I290-L305 HydrophobicContact CG1-CB 3.73Å; I290-L305 HydrophobicContact CG1-CD1 4.07Å; I293-L305 HydrophobicContact CD1-CD1 4.27Å; L301-L305 HydrophobicContact CD1-CD1 4.16Å; L301-L305 HydrophobicContact CD1-CG 4.2Å; L301-L305 HydrophobicContact CG-CD1 3.95Å; L301-L305 HydrophobicContact CG-CG 4.47Å; L301-L305 WeakPolarHBondContact O-CB 3.4Å; L301-L305 VanDerWaalsContact O-CG 3.27Å; L301-L305 WeakPolarHBondContact O-CG 3.31Å; L301-L305 PolarHBondContact O-N 2.84Å; N302-L305 CarbonylContact O-C 3.51Å; N302-L305 PolarHBondContact O-N 2.91Å; N302-L305 VanDerWaalsContact O-N 3.1Å; V303-L305 PolarHBondContact O-N 2.96Å; L305-I308 PolarHBondContact O-N 3.28Å; L305-A309 VanDerWaalsContact O-CB 3.31Å; L305-A309 WeakPolarHBondContact O-CB 3.34Å; L305-A309 PolarHBondContact O-N 3.49Å
306	T	71.8	Confident	75.7	Confident	42 Å²	42	66.5 Å²	66.5	26%	0.258	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-38.7	173.1	70.2	0	0	0	0	112	N302 V303 A309 F310 H555	N302-T306 VanDerWaalsContact O-CG2 3.3Å; N302-T306 WeakPolarHBondContact O-CG2 3.49Å; N302-T306 PolarHBondContact O-N 3.27Å; V303-T306 PolarHBondContact O-N 2.94Å; V303-T306 PolarHBondContact O-OG1 3.48Å; T306-A309 PolarHBondContact O-N 3.5Å; T306-F310 WeakPolarHBondContact O-CB 3.26Å; T306-F310 PolarHBondContact O-N 2.87Å; T306-H555 WeakPolarHBondContact CG2-NE2 3.34Å
307	I	76.4	Confident	77.2	Confident	75 Å²	75	61.2 Å²	61.2	39%	0.385	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-44.9	175	-66.3	165	0	0	0	110.6	V303 W304 A309 F310 I311	V303-I307 HydrophobicContact CG1-CD1 4.09Å; V303-I307 WeakPolarHBondContact O-CG1 3.25Å; V303-I307 PolarHBondContact O-N 3.23Å; W304-I307 PolarHBondContact O-N 3.4Å; I307-A309 VanDerWaalsContact C-N 3.34Å; I307-A309 PolarHBondContact O-N 2.9Å; I307-F310 PolarHBondContact O-N 2.82Å; I307-I311 HydrophobicContact CG2-CD1 3.9Å; I307-I311 VanDerWaalsContact O-CG1 3.3Å; I307-I311 WeakPolarHBondContact O-CG1 3.33Å; I307-I311 PolarHBondContact O-N 3.46Å
308	I	79.5	Confident	78.4	Confident	69 Å²	69	55.1 Å²	55.1	35%	0.354	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-39.1	176.8	-65.7	162.7	0	0	0	110.9	C286 W304 L305 I311 N312	C286-I308 VanDerWaalsContact SG-CG2 3.58Å; W304-I308 WeakPolarHBondContact O-CD1 3.49Å; W304-I308 VanDerWaalsContact O-CG1 3.25Å; W304-I308 WeakPolarHBondContact O-CG1 3.43Å; W304-I308 PolarHBondContact O-N 2.89Å; L305-I308 PolarHBondContact O-N 3.28Å; I308-I311 PolarHBondContact O-N 2.85Å; I308-N312 PolarHBondContact O-N 3.39Å; I308-N312 PolarHBondContact O-ND2 3.34Å
309	A	78	Confident	79.4	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-52.2	172.1	0	0	0	0	0	111.1	W283 L305 T306 I307 I311 N312 L313	W283-A309 HydrophobicContact CE3-CB 3.89Å; W283-A309 HydrophobicContact CH2-CB 4.31Å; W283-A309 VanDerWaalsContact CZ3-C 3.46Å; W283-A309 HydrophobicContact CZ3-CB 3.71Å; W283-A309 WeakPolarHBondContact CZ3-O 3.29Å; L305-A309 VanDerWaalsContact O-CB 3.31Å; L305-A309 WeakPolarHBondContact O-CB 3.34Å; L305-A309 PolarHBondContact O-N 3.49Å; T306-A309 PolarHBondContact O-N 3.5Å; I307-A309 VanDerWaalsContact C-N 3.34Å; I307-A309 PolarHBondContact O-N 2.9Å; A309-I311 VanDerWaalsContact C-N 3.29Å; A309-I311 PolarHBondContact O-N 3.27Å; A309-N312 WeakPolarHBondContact O-CA 3.43Å; A309-N312 WeakPolarHBondContact O-CB 3.44Å; A309-N312 PolarHBondContact O-N 2.88Å; A309-L313 PolarHBondContact O-N 3.43Å
310	F	78.5	Confident	80.3	Confident	78 Å²	78	46.2 Å²	46.2	34%	0.342	23%	0.225	S	C	.	.	H	α-helix	trans	-56.2	-41.3	177.9	-173.2	-88.6	0	0	0	112.7	T306 I307 L313 W314 Y563	T306-F310 WeakPolarHBondContact O-CB 3.26Å; T306-F310 PolarHBondContact O-N 2.87Å; I307-F310 PolarHBondContact O-N 2.82Å; F310-L313 PolarHBondContact O-N 3.38Å; F310-W314 PolarHBondContact O-N 3.32Å; F310-Y563 HydrophobicContact CD2-CD2 4.43Å; F310-Y563 AromaticContact CE2-CD2 3.9Å; F310-Y563 HydrophobicContact CE2-CD2 3.9Å; F310-Y563 HydrophobicContact CE2-CG 4.37Å; F310-Y563 AromaticContact CZ-CD2 3.95Å; F310-Y563 HydrophobicContact CZ-CD2 3.95Å
311	I	82.5	Confident	80.9	Confident	86 Å²	86	40.3 Å²	40.3	44%	0.441	20%	0.195	S	C	.	.	H	α-helix	trans	-63.9	-38.8	173.9	-68.3	165.6	0	0	0	111.6	I307 I308 A309 W314 T315	I307-I311 HydrophobicContact CG2-CD1 3.9Å; I307-I311 VanDerWaalsContact O-CG1 3.3Å; I307-I311 WeakPolarHBondContact O-CG1 3.33Å; I307-I311 PolarHBondContact O-N 3.46Å; I308-I311 PolarHBondContact O-N 2.85Å; A309-I311 VanDerWaalsContact C-N 3.29Å; A309-I311 PolarHBondContact O-N 3.27Å; I311-W314 PolarHBondContact O-N 3.43Å; I311-T315 HydrophobicContact CG2-CG2 4.49Å; I311-T315 WeakPolarHBondContact O-CG2 3.17Å; I311-T315 PolarHBondContact O-N 2.96Å; I311-T315 PolarHBondContact O-OG1 2.94Å
312	N	85.7	Confident	81.5	Confident	14 Å²	14	40 Å²	40	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-64.8	-40.1	174.4	-83.2	-43.7	0	0	0	112.3	S282 W283 I308 A309 T315 I316	S282-N312 WeakPolarHBondContact CB-ND2 3.37Å; S282-N312 PolarHBondContact OG-ND2 2.9Å; W283-N312 HydrophobicContact CB-CB 4.16Å; W283-N312 HydrophobicContact CE3-CB 4.23Å; I308-N312 PolarHBondContact O-N 3.39Å; I308-N312 PolarHBondContact O-ND2 3.34Å; A309-N312 WeakPolarHBondContact O-CA 3.43Å; A309-N312 WeakPolarHBondContact O-CB 3.44Å; A309-N312 PolarHBondContact O-N 2.88Å; N312-T315 WeakPolarHBondContact CA-OG1 3.38Å; N312-T315 PolarHBondContact O-N 3.3Å; N312-T315 PolarHBondContact O-OG1 2.95Å; N312-I316 WeakPolarHBondContact O-CB 3.49Å; N312-I316 WeakPolarHBondContact O-CD1 3.33Å; N312-I316 WeakPolarHBondContact O-CG1 3.21Å; N312-I316 PolarHBondContact O-N 3.36Å
313	L	82.9	Confident	82.2	Confident	11 Å²	11	39.3 Å²	39.3	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-41.4	175.7	-174.9	56.5	0	0	0	111.8	W283 A309 F310 I316 D317 Y563	W283-L313 HydrophobicContact CE3-CB 4.2Å; W283-L313 HydrophobicContact CH2-CD2 4.47Å; W283-L313 HydrophobicContact CZ3-CB 3.75Å; W283-L313 HydrophobicContact CZ3-CD2 4.43Å; A309-L313 PolarHBondContact O-N 3.43Å; F310-L313 PolarHBondContact O-N 3.38Å; L313-I316 PolarHBondContact O-N 3.07Å; L313-D317 PolarHBondContact O-N 3.44Å; L313-Y563 HydrophobicContact CD2-CD1 3.57Å; L313-Y563 HydrophobicContact CD2-CD2 4.14Å; L313-Y563 HydrophobicContact CD2-CE1 4.23Å; L313-Y563 HydrophobicContact CD2-CG 3.51Å; L313-Y563 HydrophobicContact CG-CD1 3.78Å; L313-Y563 HydrophobicContact CG-CD2 4.15Å; L313-Y563 HydrophobicContact CG-CE1 3.91Å; L313-Y563 HydrophobicContact CG-CE2 4.29Å; L313-Y563 HydrophobicContact CG-CG 3.9Å
314	W	83.7	Confident	82.9	Confident	97 Å²	97	37.3 Å²	37.3	37%	0.367	18%	0.177	S	C	.	.	H	α-helix	trans	-63.9	-41.5	174.1	-175.1	71.3	0	0	0	112.9	F310 I311 D317 I318 F444 Y563	F310-W314 PolarHBondContact O-N 3.32Å; I311-W314 PolarHBondContact O-N 3.43Å; W314-D317 PolarHBondContact O-N 2.9Å; W314-I318 HydrophobicContact CD2-CD1 3.75Å; W314-I318 HydrophobicContact CE3-CD1 3.71Å; W314-I318 HydrophobicContact CH2-CD1 3.6Å; W314-I318 HydrophobicContact CZ2-CD1 3.63Å; W314-I318 HydrophobicContact CZ3-CD1 3.63Å; W314-I318 WeakPolarHBondContact O-CG1 3.12Å; W314-I318 PolarHBondContact O-N 3.1Å; W314-F444 AromaticContact CD1-CE1 3.91Å; W314-F444 AromaticContact CD1-CZ 3.7Å; W314-F444 AromaticContact NE1-CE1 3.61Å; W314-F444 AromaticContact NE1-CZ 3.86Å; W314-Y563 HydrophobicContact CB-CE2 3.87Å; W314-Y563 HydrophobicContact CG-CE2 4.44Å
315	T	85	Confident	83.3	Confident	33 Å²	33	30.3 Å²	30.3	20%	0.202	15%	0.154	C	C	.	.	H	α-helix	trans	-73.8	-25.1	177.7	53.6	0	0	0	0	113.4	C279 I311 N312 I318 A319	C279-T315 PolarHBondContact SG-OG1 2.92Å; I311-T315 HydrophobicContact CG2-CG2 4.49Å; I311-T315 WeakPolarHBondContact O-CG2 3.17Å; I311-T315 PolarHBondContact O-N 2.96Å; I311-T315 PolarHBondContact O-OG1 2.94Å; N312-T315 WeakPolarHBondContact CA-OG1 3.38Å; N312-T315 PolarHBondContact O-N 3.3Å; N312-T315 PolarHBondContact O-OG1 2.95Å; T315-I318 PolarHBondContact O-N 3.44Å; T315-A319 WeakPolarHBondContact O-CB 3.28Å; T315-A319 PolarHBondContact O-N 3.48Å
316	I	87.3	Confident	83.8	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-49.1	170.1	-76.6	160.7	0	0	0	111	L276 C279 L280 N312 L313 I318 A319 Q320 Y916	L276-I316 HydrophobicContact CD1-CB 4.1Å; L276-I316 HydrophobicContact CD1-CG1 4.07Å; L276-I316 HydrophobicContact CD1-CG2 3.6Å; C279-I316 HydrophobicContact CB-CD1 4.43Å; C279-I316 HydrophobicContact CB-CG1 3.75Å; L280-I316 HydrophobicContact CD2-CD1 3.62Å; L280-I316 HydrophobicContact CD2-CG1 4.24Å; L280-I316 HydrophobicContact CG-CD1 4.12Å; L280-I316 HydrophobicContact CG-CG1 4.32Å; N312-I316 WeakPolarHBondContact O-CB 3.49Å; N312-I316 WeakPolarHBondContact O-CD1 3.33Å; N312-I316 WeakPolarHBondContact O-CG1 3.21Å; N312-I316 PolarHBondContact O-N 3.36Å; L313-I316 PolarHBondContact O-N 3.07Å; I316-I318 VanDerWaalsContact C-N 3.34Å; I316-I318 PolarHBondContact O-N 3.39Å; I316-A319 WeakPolarHBondContact O-CB 3.16Å; I316-A319 PolarHBondContact O-N 3.02Å; I316-Q320 PolarHBondContact O-N 3.41Å; I316-Y916 HydrophobicContact CG2-CD1 4.35Å; I316-Y916 HydrophobicContact CG2-CE1 3.4Å; I316-Y916 VanDerWaalsContact CG2-CE1 3.4Å
317	D	86.6	Confident	84.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69.1	-30.5	177.4	-87.1	-41	0	0	0	113.2	L313 W314 Q320 T321 F444 Y563 L572 Q576 R889	L313-D317 PolarHBondContact O-N 3.44Å; W314-D317 PolarHBondContact O-N 2.9Å; D317-Q320 PolarHBondContact O-N 2.92Å; D317-Q320 PolarHBondContact OD1-OE1 2.93Å; D317-T321 WeakPolarHBondContact O-CG2 3.4Å; D317-T321 PolarHBondContact O-N 3.15Å; D317-T321 PolarHBondContact O-OG1 2.84Å; D317-F444 HydrophobicContact CB-CD2 4.39Å; D317-F444 HydrophobicContact CB-CE2 3.63Å; D317-F444 HydrophobicContact CB-CZ 3.75Å; D317-Y563 WeakPolarHBondContact OD2-CE1 3.43Å; D317-Y563 PolarHBondContact OD2-OH 3.03Å; D317-L572 HydrophobicContact CB-CD2 4.12Å; D317-Q576 PolarHBondContact OD1-NE2 2.88Å; D317-R889 IonicContact OD1-CZ 3.29Å; D317-R889 VanDerWaalsContact OD1-CZ 3.29Å; D317-R889 IonicContact OD1-NH1 2.84Å; D317-R889 PolarHBondContact OD1-NH1 3Å; D317-R889 IonicContact OD1-NH2 2.8Å; D317-R889 PolarHBondContact OD1-NH2 3.07Å; D317-R889 IonicContact OD2-NH2 3.23Å; D317-R889 PolarHBondContact OD2-NH2 3.41Å
318	I	86.7	Confident	84.8	Confident	30 Å²	30	25 Å²	25	15%	0.154	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-47.3	168.4	-71.1	172	0	0	0	110.5	W314 T315 I316 Q320 T321 L322 F441 F444	W314-I318 HydrophobicContact CD2-CD1 3.75Å; W314-I318 HydrophobicContact CE3-CD1 3.71Å; W314-I318 HydrophobicContact CH2-CD1 3.6Å; W314-I318 HydrophobicContact CZ2-CD1 3.63Å; W314-I318 HydrophobicContact CZ3-CD1 3.63Å; W314-I318 WeakPolarHBondContact O-CG1 3.12Å; W314-I318 PolarHBondContact O-N 3.1Å; T315-I318 PolarHBondContact O-N 3.44Å; I316-I318 VanDerWaalsContact C-N 3.34Å; I316-I318 PolarHBondContact O-N 3.39Å; I318-Q320 VanDerWaalsContact C-N 3.29Å; I318-Q320 PolarHBondContact O-N 3.5Å; I318-T321 PolarHBondContact O-N 3.26Å; I318-T321 PolarHBondContact O-OG1 3.26Å; I318-L322 HydrophobicContact CG2-CD1 3.86Å; I318-L322 HydrophobicContact CG2-CG 4.42Å; I318-L322 WeakPolarHBondContact O-CB 3.17Å; I318-L322 VanDerWaalsContact O-CG 3.3Å; I318-L322 WeakPolarHBondContact O-CG 3.39Å; I318-L322 PolarHBondContact O-N 3.02Å; I318-F441 HydrophobicContact CG2-CE2 4.07Å; I318-F444 HydrophobicContact CD1-CE1 4.24Å; I318-F444 HydrophobicContact CG1-CD1 4.03Å; I318-F444 HydrophobicContact CG1-CE1 3.55Å; I318-F444 HydrophobicContact CG1-CZ 4.46Å
319	A	88.5	Confident	85	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.025	12%	0.117	C	C	.	.	H	α-helix	trans	-59.6	-41.1	177.9	0	0	0	0	0	111.4	S272 L276 T315 I316 L322 E323	S272-A319 WeakPolarHBondContact CB-O 3.43Å; L276-A319 HydrophobicContact CB-CB 3.86Å; L276-A319 HydrophobicContact CD1-CB 4.35Å; T315-A319 WeakPolarHBondContact O-CB 3.28Å; T315-A319 PolarHBondContact O-N 3.48Å; I316-A319 WeakPolarHBondContact O-CB 3.16Å; I316-A319 PolarHBondContact O-N 3.02Å; A319-L322 PolarHBondContact O-N 3.47Å; A319-E323 WeakPolarHBondContact O-CB 3.46Å; A319-E323 PolarHBondContact O-N 3.47Å
320	Q	87.4	Confident	85.2	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-69.2	-41	176.4	-70.4	-179.6	-55.7	0	0	113.4	L276 I316 D317 I318 L322 E323 I324 S915 Y916	L276-Q320 HydrophobicContact CD1-CG 4.1Å; L276-Q320 HydrophobicContact CD2-CG 4.38Å; I316-Q320 PolarHBondContact O-N 3.41Å; D317-Q320 PolarHBondContact O-N 2.92Å; D317-Q320 PolarHBondContact OD1-OE1 2.93Å; I318-Q320 VanDerWaalsContact C-N 3.29Å; I318-Q320 PolarHBondContact O-N 3.5Å; Q320-L322 VanDerWaalsContact C-N 3.29Å; Q320-L322 PolarHBondContact O-N 3.09Å; Q320-E323 WeakPolarHBondContact O-CB 3.49Å; Q320-E323 PolarHBondContact O-N 3.28Å; Q320-I324 WeakPolarHBondContact O-CB 3.27Å; Q320-I324 VanDerWaalsContact O-CD1 3.3Å; Q320-I324 WeakPolarHBondContact O-CD1 3.23Å; Q320-I324 WeakPolarHBondContact O-CG1 3.41Å; Q320-I324 PolarHBondContact O-N 3.5Å; Q320-S915 PolarHBondContact NE2-OG 3.19Å; Q320-S915 VanDerWaalsContact NE2-OG 3.12Å; Q320-Y916 VanDerWaalsContact NE2-CD1 3.32Å
321	T	86.8	Confident	85.2	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-63.8	-34.9	174.5	52.8	0	0	0	0	112.2	D317 I318 G325 P440 F444 Q576	D317-T321 WeakPolarHBondContact O-CG2 3.4Å; D317-T321 PolarHBondContact O-N 3.15Å; D317-T321 PolarHBondContact O-OG1 2.84Å; I318-T321 PolarHBondContact O-N 3.26Å; I318-T321 PolarHBondContact O-OG1 3.26Å; T321-G325 PolarHBondContact O-N 3.37Å; T321-P440 HydrophobicContact CG2-CB 4.27Å; T321-F444 HydrophobicContact CG2-CB 4.01Å; T321-F444 HydrophobicContact CG2-CG 4.37Å; T321-Q576 HydrophobicContact CG2-CG 3.77Å
322	L	86.8	Confident	85.1	Confident	70 Å²	70	16.8 Å²	16.8	37%	0.366	8%	0.084	S	C	.	.	H	α-helix	trans	-71.8	-39.5	174.2	-68.3	173.7	0	0	0	112.8	I318 A319 Q320 G325 A326 F441	I318-L322 HydrophobicContact CG2-CD1 3.86Å; I318-L322 HydrophobicContact CG2-CG 4.42Å; I318-L322 WeakPolarHBondContact O-CB 3.17Å; I318-L322 VanDerWaalsContact O-CG 3.3Å; I318-L322 WeakPolarHBondContact O-CG 3.39Å; I318-L322 PolarHBondContact O-N 3.02Å; A319-L322 PolarHBondContact O-N 3.47Å; Q320-L322 VanDerWaalsContact C-N 3.29Å; Q320-L322 PolarHBondContact O-N 3.09Å; L322-G325 PolarHBondContact O-N 2.65Å; L322-A326 WeakPolarHBondContact O-CB 3.36Å; L322-A326 PolarHBondContact O-N 3.49Å; L322-F441 HydrophobicContact CD2-CD2 3.9Å; L322-F441 HydrophobicContact CD2-CE2 4.13Å; L322-F441 HydrophobicContact CD2-CG 4.21Å; L322-F441 HydrophobicContact CG-CD2 4.17Å; L322-F441 HydrophobicContact CG-CE2 4.38Å
323	E	87	Confident	84.8	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-56.4	-51.5	171.2	171.4	179.7	-143.4	0	0	110.6	L269 S272 N273 A319 Q320 G325 A326 I327 R886 A919	L269-E323 HydrophobicContact CD1-CG 3.82Å; S272-E323 VanDerWaalsContact OG-CA 3.32Å; S272-E323 WeakPolarHBondContact OG-CA 3.42Å; N273-E323 PolarHBondContact ND2-OE1 3.08Å; N273-E323 WeakPolarHBondContact OD1-CB 3.31Å; N273-E323 VanDerWaalsContact OD1-CG 3.29Å; N273-E323 WeakPolarHBondContact OD1-CG 3.41Å; N273-E323 PolarHBondContact OD1-OE1 3.31Å; A319-E323 WeakPolarHBondContact O-CB 3.46Å; A319-E323 PolarHBondContact O-N 3.47Å; Q320-E323 WeakPolarHBondContact O-CB 3.49Å; Q320-E323 PolarHBondContact O-N 3.28Å; E323-G325 VanDerWaalsContact C-N 3.31Å; E323-G325 PolarHBondContact O-N 3.49Å; E323-A326 WeakPolarHBondContact O-CA 3.03Å; E323-A326 WeakPolarHBondContact O-CB 3.2Å; E323-A326 PolarHBondContact O-N 3.42Å; E323-I327 HydrophobicContact CG-CD1 3.81Å; E323-I327 HydrophobicContact CG-CG1 4.48Å; E323-I327 WeakPolarHBondContact O-CG1 3.49Å; E323-I327 PolarHBondContact O-N 3.47Å; E323-R886 IonicContact OE1-NH2 3.27Å; E323-R886 PolarHBondContact OE1-NH2 2.89Å; E323-R886 IonicContact OE2-CZ 3.55Å; E323-R886 IonicContact OE2-NH2 3.92Å; E323-R886 PolarHBondContact OE2-NH2 3.49Å; E323-A919 VanDerWaalsContact OE1-CA 3.31Å; E323-A919 WeakPolarHBondContact OE1-CA 3.45Å
324	I	86.2	Confident	84.3	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-40.1	179.4	-69.3	163.2	0	0	0	110.6	Q320 A326 I327 L328 P440 Q576 P580	Q320-I324 WeakPolarHBondContact O-CB 3.27Å; Q320-I324 VanDerWaalsContact O-CD1 3.3Å; Q320-I324 WeakPolarHBondContact O-CD1 3.23Å; Q320-I324 WeakPolarHBondContact O-CG1 3.41Å; Q320-I324 PolarHBondContact O-N 3.5Å; I324-A326 PolarHBondContact O-N 3.35Å; I324-I327 PolarHBondContact O-N 2.88Å; I324-L328 WeakPolarHBondContact O-CB 3.32Å; I324-L328 PolarHBondContact O-N 2.87Å; I324-P440 HydrophobicContact CG2-CG 4.12Å; I324-Q576 HydrophobicContact CD1-CB 3.67Å; I324-Q576 HydrophobicContact CD1-CG 3.92Å; I324-P580 HydrophobicContact CG2-CB 3.82Å; I324-P580 HydrophobicContact CG2-CG 3.37Å
325	G	86.2	Confident	83.6	Confident	9 Å²	9	13.9 Å²	13.9	9%	0.093	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-38.1	171.5	0	0	0	0	0	113.6	T321 L322 E323 L328 W329 C437	T321-G325 PolarHBondContact O-N 3.37Å; L322-G325 PolarHBondContact O-N 2.65Å; E323-G325 VanDerWaalsContact C-N 3.31Å; E323-G325 PolarHBondContact O-N 3.49Å; G325-L328 PolarHBondContact O-N 3.32Å; G325-W329 WeakPolarHBondContact O-CB 3.48Å; G325-W329 PolarHBondContact O-N 3.41Å; G325-C437 VanDerWaalsContact CA-O 3.23Å; G325-C437 WeakPolarHBondContact CA-O 3.5Å
326	A	86	Confident	82.8	Confident	10 Å²	10	15.8 Å²	15.8	8%	0.083	8%	0.082	C	C	.	.	H	α-helix	trans	-70.5	-43.4	175.9	0	0	0	0	0	112.4	L269 L322 E323 I324 L328 W329 I330	L269-A326 HydrophobicContact CB-CB 4.11Å; L322-A326 WeakPolarHBondContact O-CB 3.36Å; L322-A326 PolarHBondContact O-N 3.49Å; E323-A326 WeakPolarHBondContact O-CA 3.03Å; E323-A326 WeakPolarHBondContact O-CB 3.2Å; E323-A326 PolarHBondContact O-N 3.42Å; I324-A326 PolarHBondContact O-N 3.35Å; A326-L328 VanDerWaalsContact C-N 3.3Å; A326-L328 PolarHBondContact O-N 3.14Å; A326-W329 PolarHBondContact O-N 2.98Å; A326-I330 VanDerWaalsContact O-CG1 3.25Å; A326-I330 WeakPolarHBondContact O-CG1 3.38Å; A326-I330 PolarHBondContact O-N 3.4Å
327	I	84.6	Confident	81.7	Confident	5 Å²	5	16.8 Å²	16.8	3%	0.026	9%	0.092	C	C	.	.	H	α-helix	trans	-53.9	-48.3	171	-72.7	169	0	0	0	110	L269 E323 I324 I330 A331 D922 Y926	L269-I327 HydrophobicContact CD1-CD1 4.48Å; L269-I327 HydrophobicContact CD1-CG1 4Å; E323-I327 HydrophobicContact CG-CD1 3.81Å; E323-I327 HydrophobicContact CG-CG1 4.48Å; E323-I327 WeakPolarHBondContact O-CG1 3.49Å; E323-I327 PolarHBondContact O-N 3.47Å; I324-I327 PolarHBondContact O-N 2.88Å; I327-I330 PolarHBondContact O-N 3.31Å; I327-A331 PolarHBondContact O-N 2.88Å; I327-D922 HydrophobicContact CD1-CB 4.16Å; I327-D922 WeakPolarHBondContact CD1-OD2 3.45Å; I327-Y926 HydrophobicContact CB-CE2 4.49Å; I327-Y926 HydrophobicContact CG1-CE2 4.07Å; I327-Y926 HydrophobicContact CG2-CE2 4.08Å; I327-Y926 WeakPolarHBondContact CG2-OH 3.26Å
328	L	84.2	Confident	80.5	Confident	3 Å²	3	18.4 Å²	18.4	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-66.2	-41.6	179.3	-156.8	68.9	0	0	0	112.3	I324 G325 A326 I330 A331 L332 L436 I583	I324-L328 WeakPolarHBondContact O-CB 3.32Å; I324-L328 PolarHBondContact O-N 2.87Å; G325-L328 PolarHBondContact O-N 3.32Å; A326-L328 VanDerWaalsContact C-N 3.3Å; A326-L328 PolarHBondContact O-N 3.14Å; L328-I330 VanDerWaalsContact C-N 3.3Å; L328-I330 PolarHBondContact O-N 3.05Å; L328-A331 PolarHBondContact O-N 3.38Å; L328-L332 HydrophobicContact CG-CD1 4.15Å; L328-L332 WeakPolarHBondContact O-CB 3.27Å; L328-L332 VanDerWaalsContact O-CG 3.3Å; L328-L332 WeakPolarHBondContact O-CG 3.17Å; L328-L332 PolarHBondContact O-N 3.42Å; L328-L436 VanDerWaalsContact CD2-O 3.25Å; L328-L436 WeakPolarHBondContact CD2-O 3.11Å; L328-I583 HydrophobicContact CD1-CB 3.94Å; L328-I583 HydrophobicContact CD1-CG2 3.63Å; L328-I583 HydrophobicContact CD2-CD1 3.87Å; L328-I583 HydrophobicContact CD2-CG2 4.38Å; L328-I583 HydrophobicContact CG-CG2 4.29Å
329	W	85.2	Confident	79	Confident	44 Å²	44	21 Å²	21	17%	0.167	11%	0.112	C	C	.	.	H	α-helix	trans	-58.6	-41	174.1	176.6	-89.6	0	0	0	112.2	R261 G325 A326 L332 E333 R433 V434	R261-W329 PolarHBondContact O-NE1 3.07Å; G325-W329 WeakPolarHBondContact O-CB 3.48Å; G325-W329 PolarHBondContact O-N 3.41Å; A326-W329 PolarHBondContact O-N 2.98Å; W329-L332 PolarHBondContact O-N 2.91Å; W329-E333 PolarHBondContact O-N 3.47Å; W329-R433 VanDerWaalsContact CD2-NH2 3.33Å; W329-R433 HydrophobicContact CZ3-CG 4.28Å; W329-R433 PolarHBondContact O-NH2 3.44Å; W329-R433 VanDerWaalsContact O-NH2 3.11Å; W329-V434 HydrophobicContact CZ3-CG2 4.12Å
330	I	80.7	Confident	77.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.4	-43.9	176.7	-64.4	162	0	0	0	111.1	Y262 L266 A326 I327 L328 L332 E333 R334 Y926	Y262-I330 HydrophobicContact CD2-CG2 3.9Å; Y262-I330 HydrophobicContact CE2-CG2 3.45Å; Y262-I330 VanDerWaalsContact CE2-CG2 3.45Å; L266-I330 HydrophobicContact CD2-CD1 4.18Å; A326-I330 VanDerWaalsContact O-CG1 3.25Å; A326-I330 WeakPolarHBondContact O-CG1 3.38Å; A326-I330 PolarHBondContact O-N 3.4Å; I327-I330 PolarHBondContact O-N 3.31Å; L328-I330 VanDerWaalsContact C-N 3.3Å; L328-I330 PolarHBondContact O-N 3.05Å; I330-L332 VanDerWaalsContact C-N 3.29Å; I330-L332 PolarHBondContact O-N 2.93Å; I330-E333 PolarHBondContact O-N 3.46Å; I330-R334 WeakPolarHBondContact O-CG 3.27Å; I330-R334 PolarHBondContact O-N 2.98Å; I330-Y926 HydrophobicContact CB-CD1 4.28Å; I330-Y926 HydrophobicContact CB-CE1 4.14Å; I330-Y926 HydrophobicContact CD1-CD1 4.19Å; I330-Y926 HydrophobicContact CD1-CG 4.34Å; I330-Y926 HydrophobicContact CG2-CD1 3.53Å; I330-Y926 HydrophobicContact CG2-CE1 3.59Å
331	A	79.6	Confident	75.6	Confident	1 Å²	1	32 Å²	32	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-44.5	174.7	0	0	0	0	0	110.9	I327 L328 R334 T335 L584	I327-A331 PolarHBondContact O-N 2.88Å; L328-A331 PolarHBondContact O-N 3.38Å; A331-R334 WeakPolarHBondContact O-CB 3.49Å; A331-R334 PolarHBondContact O-N 2.9Å; A331-R334 VanDerWaalsContact O-N 3.15Å; A331-T335 VanDerWaalsContact O-CG2 3.22Å; A331-T335 WeakPolarHBondContact O-CG2 3.41Å; A331-T335 PolarHBondContact O-N 3.04Å; A331-T335 PolarHBondContact O-OG1 3.42Å; A331-L584 HydrophobicContact CB-CD2 4.09Å
332	L	81	Confident	73.6	Confident	17 Å²	17	35.8 Å²	35.8	9%	0.089	19%	0.192	C	C	.	.	H	α-helix	trans	-69.4	-34.8	178.6	-68.3	167.4	0	0	0	113.5	L328 W329 I330 R334 T335 L336 R433 T587	L328-L332 HydrophobicContact CG-CD1 4.15Å; L328-L332 WeakPolarHBondContact O-CB 3.27Å; L328-L332 VanDerWaalsContact O-CG 3.3Å; L328-L332 WeakPolarHBondContact O-CG 3.17Å; L328-L332 PolarHBondContact O-N 3.42Å; W329-L332 PolarHBondContact O-N 2.91Å; I330-L332 VanDerWaalsContact C-N 3.29Å; I330-L332 PolarHBondContact O-N 2.93Å; L332-R334 VanDerWaalsContact C-N 3.3Å; L332-R334 PolarHBondContact O-N 2.68Å; L332-T335 WeakPolarHBondContact CA-OG1 3.27Å; L332-T335 PolarHBondContact O-OG1 3.21Å; L332-L336 WeakPolarHBondContact O-CB 3.43Å; L332-L336 VanDerWaalsContact O-CG 3.25Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 3.48Å; L332-R433 HydrophobicContact CD1-CG 4.27Å; L332-T587 HydrophobicContact CD2-CG2 4.06Å
333	E	77.8	Confident	71.4	Confident	7 Å²	7	40.2 Å²	40.2	3%	0.033	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-37.1	167.6	-87	-49.5	136.5	0	0	112.2	R258 R261 W329 I330 G337 R433	R258-E333 PolarHBondContact NH2-O 3.12Å; R261-E333 VanDerWaalsContact CB-CD 3.47Å; R261-E333 HydrophobicContact CB-CG 3.98Å; R261-E333 WeakPolarHBondContact CD-OE1 3.42Å; R261-E333 WeakPolarHBondContact CD-OE2 3.31Å; R261-E333 IonicContact NH1-OE2 2.89Å; W329-E333 PolarHBondContact O-N 3.47Å; I330-E333 PolarHBondContact O-N 3.46Å; E333-G337 PolarHBondContact O-N 3.1Å; E333-G337 VanDerWaalsContact O-N 3.16Å; E333-R433 VanDerWaalsContact CG-NH2 3.31Å; E333-R433 IonicContact OE1-CZ 3.28Å; E333-R433 VanDerWaalsContact OE1-CZ 3.23Å; E333-R433 IonicContact OE1-NH1 2.88Å; E333-R433 PolarHBondContact OE1-NH1 3.32Å; E333-R433 IonicContact OE1-NH2 2.73Å; E333-R433 PolarHBondContact OE1-NH2 3.2Å
334	R	72.3	Confident	69.1	Low	39 Å²	39	47.3 Å²	47.3	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-69.9	-46.4	180	-75	-176.8	174.9	-172.2	6.6	110.8	R258 Y262 I330 A331 L332 I338	R258-R334 PolarHBondContact NH2-O 3.17Å; Y262-R334 PolarHBondContact OH-NH2 3.4Å; I330-R334 WeakPolarHBondContact O-CG 3.27Å; I330-R334 PolarHBondContact O-N 2.98Å; A331-R334 WeakPolarHBondContact O-CB 3.49Å; A331-R334 PolarHBondContact O-N 2.9Å; A331-R334 VanDerWaalsContact O-N 3.15Å; L332-R334 VanDerWaalsContact C-N 3.3Å; L332-R334 PolarHBondContact O-N 2.68Å; R334-I338 WeakPolarHBondContact O-CG1 3.3Å; R334-I338 PolarHBondContact O-N 2.95Å
335	T	69.8	Low	66.6	Low	14 Å²	14	54.7 Å²	54.7	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-70.9	-49.4	-178.6	64.1	0	0	0	0	111.8	A331 L332 G337 I338 H339 T587 I591	A331-T335 VanDerWaalsContact O-CG2 3.22Å; A331-T335 WeakPolarHBondContact O-CG2 3.41Å; A331-T335 PolarHBondContact O-N 3.04Å; A331-T335 PolarHBondContact O-OG1 3.42Å; L332-T335 WeakPolarHBondContact CA-OG1 3.27Å; L332-T335 PolarHBondContact O-OG1 3.21Å; T335-G337 VanDerWaalsContact C-N 3.33Å; T335-G337 PolarHBondContact O-N 3.22Å; T335-I338 PolarHBondContact O-N 3.47Å; T335-H339 WeakPolarHBondContact O-CB 3.09Å; T335-H339 PolarHBondContact O-N 3.09Å; T335-T587 HydrophobicContact CG2-CG2 3.88Å; T335-I591 HydrophobicContact CG2-CD1 3.51Å; T335-I591 HydrophobicContact CG2-CG1 4.24Å
336	L	68.7	Low	64.2	Low	74 Å²	74	60.2 Å²	60.2	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-40.1	179.2	-69.2	171.1	0	0	0	111.5	L332 I338 H339 W340	L332-L336 WeakPolarHBondContact O-CB 3.43Å; L332-L336 VanDerWaalsContact O-CG 3.25Å; L332-L336 WeakPolarHBondContact O-CG 3.44Å; L332-L336 PolarHBondContact O-N 3.48Å; L336-I338 PolarHBondContact O-N 3.3Å; L336-I338 VanDerWaalsContact O-N 3.13Å; L336-H339 PolarHBondContact O-N 3.5Å; L336-W340 WeakPolarHBondContact O-CA 3.47Å; L336-W340 PolarHBondContact O-N 3.32Å
337	G	63.4	Low	61.8	Low	22 Å²	22	66.7 Å²	66.7	23%	0.227	35%	0.346	C	S	.	.	H	α-helix	trans	-75.1	8.4	174.8	0	0	0	0	0	115.4	R258 E333 T335	R258-G337 VanDerWaalsContact CZ-O 3.31Å; R258-G337 PolarHBondContact NH1-O 2.96Å; R258-G337 VanDerWaalsContact NH2-C 3.31Å; R258-G337 VanDerWaalsContact NH2-CA 3.28Å; R258-G337 PolarHBondContact NH2-O 3.41Å; E333-G337 PolarHBondContact O-N 3.1Å; E333-G337 VanDerWaalsContact O-N 3.16Å; T335-G337 VanDerWaalsContact C-N 3.33Å; T335-G337 PolarHBondContact O-N 3.22Å
338	I	62.1	Low	59.3	Low	34 Å²	34	72.8 Å²	72.8	17%	0.174	38%	0.379	C	S	.	.	H	α-helix	trans	-113.1	-34.9	163.6	-66.6	168.9	0	0	0	110.1	R334 T335 L336 T871	R334-I338 WeakPolarHBondContact O-CG1 3.3Å; R334-I338 PolarHBondContact O-N 2.95Å; T335-I338 PolarHBondContact O-N 3.47Å; L336-I338 PolarHBondContact O-N 3.3Å; L336-I338 VanDerWaalsContact O-N 3.13Å; I338-T871 HydrophobicContact CD1-CG2 3.94Å
339	H	54.9	Low	57	Low	86 Å²	86	77.3 Å²	77.3	40%	0.398	41%	0.41	S	S	.	.	H	α-helix	trans	-72.1	-43.5	179.7	-165.8	-87.4	0	0	0	112.4	T335 L336 K594	T335-H339 WeakPolarHBondContact O-CB 3.09Å; T335-H339 PolarHBondContact O-N 3.09Å; L336-H339 PolarHBondContact O-N 3.5Å; H339-K594 VanDerWaalsContact CD2-CD 3.43Å; H339-K594 WeakPolarHBondContact CD2-CD 3.37Å; H339-K594 PolarHBondContact CD2-NZ 3.36Å; H339-K594 PolarHBondContact CE1-NZ 3.47Å; H339-K594 PolarHBondContact NE2-NZ 3.13Å; H339-K594 PolarHBondContact O-NZ 3.26Å
340	W	55.2	Low	54.8	Low	137 Å²	137	81.6 Å²	81.6	52%	0.519	44%	0.437	S	S	.	.			trans	-124.3	84.7	-175.7	-147.1	-72.6	0	0	0	109.5	L336 S342	L336-W340 WeakPolarHBondContact O-CA 3.47Å; L336-W340 PolarHBondContact O-N 3.32Å; W340-S342 PolarHBondContact O-N 3.49Å
341	P	49.9	Very low	52.6	Low	95 Å²	95	88 Å²	88	62%	0.617	47%	0.471	S	S	*	.			trans	-55.2	135	160.2	26.9	-33.4	0	0	0	107.8	E343	P341-E343 PolarHBondContact O-N 3.19Å
342	S	44.7	Very low	50.4	Low	83 Å²	83	94.9 Å²	94.9	58%	0.58	51%	0.507	S	S	*	.			trans	-60.3	115.7	172.3	50	0	0	0	0	108.1	W340 I344	W340-S342 PolarHBondContact O-N 3.49Å; S342-I344 PolarHBondContact O-N 3.02Å
343	E	39.2	Very low	48.4	Very low	162 Å²	162	100.5 Å²	100.5	76%	0.757	54%	0.538	S	S	*	.			trans	-49.9	112.6	-179.9	-166.6	162.7	-127.5	0	0	109.2	P341 Q345	P341-E343 PolarHBondContact O-N 3.19Å; E343-Q345 PolarHBondContact O-N 2.92Å; E343-Q345 VanDerWaalsContact O-N 3.13Å
344	I	38.3	Very low	46.3	Very low	149 Å²	149	107 Å²	107	76%	0.764	57%	0.572	S	S	*	*			trans	-68.4	113.6	175.4	-62.4	176.1	0	0	0	104.9	S342 T346	S342-I344 PolarHBondContact O-N 3.02Å; I344-T346 PolarHBondContact O-N 2.96Å
345	Q	35.2	Very low	44.3	Very low	157 Å²	157	112 Å²	112	73%	0.734	60%	0.602	S	S	*	*			trans	-64.1	103.5	176.8	-71.9	178.3	-23.2	0	0	108.4	E343 L347	E343-Q345 PolarHBondContact O-N 2.92Å; E343-Q345 VanDerWaalsContact O-N 3.13Å; Q345-L347 HydrophobicContact CB-CB 4.37Å; Q345-L347 HydrophobicContact CB-CD1 4.25Å; Q345-L347 HydrophobicContact CB-CG 4.48Å; Q345-L347 PolarHBondContact O-N 2.89Å
346	T	35.1	Very low	42.6	Very low	126 Å²	126	116.9 Å²	116.9	77%	0.773	64%	0.637	S	S	*	*			trans	-74.4	46.8	167.1	53.2	0	0	0	0	110.4	I344 N348	I344-T346 PolarHBondContact O-N 2.96Å; T346-N348 PolarHBondContact O-N 3.44Å
347	L	34.9	Very low	40.8	Very low	145 Å²	145	119.5 Å²	119.5	76%	0.759	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	58.8	171.7	-93.9	168	0	0	0	109.4	Q345	Q345-L347 HydrophobicContact CB-CB 4.37Å; Q345-L347 HydrophobicContact CB-CD1 4.25Å; Q345-L347 HydrophobicContact CB-CG 4.48Å; Q345-L347 PolarHBondContact O-N 2.89Å
348	N	34	Very low	39.1	Very low	134 Å²	134	122.1 Å²	122.1	72%	0.717	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.9	20.8	167.5	-150.9	33	0	0	0	113.2	T346	T346-N348 PolarHBondContact O-N 3.44Å
349	S	35.7	Very low	37.5	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	71%	0.712	S	S	*	*	S	Bend	trans	-104.2	1.5	-179.6	-166	0	0	0	0	114.2
350	N	37.3	Very low	36.1	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	74%	0.736	S	S	*	*	S	Bend	trans	-127.3	-1.1	-170.5	-89.5	74.2	0	0	0	115.2
351	N	34.8	Very low	34.9	Very low	135 Å²	135	132.6 Å²	132.6	72%	0.722	75%	0.747	S	S	*	*	S	Bend	trans	-88.5	-8.9	-179	-87.8	32.5	0	0	0	114.5
352	N	33.1	Very low	33.8	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-2.8	-176.1	-75.5	30	0	0	0	114.7
353	N	39.2	Very low	32.8	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	3.1	-174.8	-81.4	56.2	0	0	0	115.1
354	N	33.9	Very low	32.2	Very low	142 Å²	142	137 Å²	137	76%	0.759	77%	0.772	S	S	*	*	S	Bend	trans	-100	0.2	-176.7	-80.5	28.8	0	0	0	114.8
355	N	31.7	Very low	31.6	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	78%	0.78	S	S	*	*			trans	-107.5	16.9	-177.6	-79.2	28.6	0	0	0	114.5	T357	N355-T357 VanDerWaalsContact C-N 3.32Å; N355-T357 PolarHBondContact O-N 3.12Å; N355-T357 VanDerWaalsContact O-N 3.16Å
356	S	33.7	Very low	31.2	Very low	115 Å²	115	135.3 Å²	135.3	80%	0.804	78%	0.778	S	S	*	*			trans	-79.5	87.4	158.2	-67.5	0	0	0	0	108.8
357	T	31.4	Very low	30.9	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	78%	0.781	S	S	*	*			trans	-54.7	144.8	167	35.9	0	0	0	0	110.4	N355 N359	N355-T357 VanDerWaalsContact C-N 3.32Å; N355-T357 PolarHBondContact O-N 3.12Å; N355-T357 VanDerWaalsContact O-N 3.16Å; T357-N359 PolarHBondContact O-N 2.6Å
358	G	27.3	Very low	30.5	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	78%	0.784	S	S	*	*			trans	-74.6	99.4	-160.8	0	0	0	0	0	115	K360	G358-K360 PolarHBondContact O-N 3.35Å
359	N	27.8	Very low	30.3	Very low	148 Å²	148	137.4 Å²	137.4	79%	0.791	78%	0.784	S	S	*	*			trans	-74.3	106.3	155.4	-79.2	-3	0	0	0	109.2	T357 T361	T357-N359 PolarHBondContact O-N 2.6Å; N359-T361 PolarHBondContact O-N 3.46Å
360	K	26.2	Very low	30.1	Very low	207 Å²	207	138.8 Å²	138.8	90%	0.9	78%	0.782	S	S	*	*			trans	-71.6	74.7	163	-75.7	179.8	173.7	177.6	0	109.4	G358 T362	G358-K360 PolarHBondContact O-N 3.35Å; K360-T362 PolarHBondContact O-N 2.85Å
361	T	30.4	Very low	29.7	Very low	123 Å²	123	138.4 Å²	138.4	76%	0.755	78%	0.779	S	S	*	*			trans	-69.2	117.1	163.4	36.6	0	0	0	0	108.6	N359	N359-T361 PolarHBondContact O-N 3.46Å
362	T	26.7	Very low	29.4	Very low	122 Å²	122	138.1 Å²	138.1	75%	0.748	78%	0.777	S	S	*	*			trans	-62.5	147.3	177	33.9	0	0	0	0	111	K360 H364	K360-T362 PolarHBondContact O-N 2.85Å; T362-H364 PolarHBondContact O-N 2.91Å; T362-H364 VanDerWaalsContact O-N 3.15Å
363	C	22.2	Very low	29.1	Very low	132 Å²	132	136.7 Å²	136.7	89%	0.892	77%	0.774	S	S	*	*			trans	-70	109.3	179.4	-60.4	0	0	0	0	110.7
364	H	27.5	Very low	28.7	Very low	179 Å²	179	134.3 Å²	134.3	83%	0.829	77%	0.768	S	S	*	*			trans	-104.9	139	156.9	-92.8	-86.5	0	0	0	110.7	T362	T362-H364 PolarHBondContact O-N 2.91Å; T362-H364 VanDerWaalsContact O-N 3.15Å
365	H	25	Very low	28.6	Very low	202 Å²	202	134.9 Å²	134.9	94%	0.935	77%	0.77	S	S	*	*			trans	-55.3	140.1	175.6	-103.3	1.5	0	0	0	112.1
366	G	26.9	Very low	28.4	Very low	67 Å²	67	136.1 Å²	136.1	69%	0.691	77%	0.768	S	S	*	*			trans	160.7	97	168	0	0	0	0	0	115.3
367	N	29.9	Very low	28.3	Very low	157 Å²	157	136 Å²	136	84%	0.84	77%	0.767	S	S	*	*			trans	51	106.5	156	-62.2	-13.9	0	0	0	119.7	I369	N367-I369 PolarHBondContact O-N 3.27Å; N367-I369 VanDerWaalsContact O-N 3.07Å
368	N	26	Very low	28.2	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	76%	0.76	S	S	*	*			trans	-64.1	100.6	170.7	-69.1	-59.3	0	0	0	112.9	I370	N368-I370 HydrophobicContact CB-CG1 4.39Å
369	I	30.2	Very low	28.4	Very low	140 Å²	140	136.4 Å²	136.4	72%	0.718	75%	0.751	S	S	*	*			trans	-107.4	87.6	164	-67.3	-179.9	0	0	0	109.1	N367 I371	N367-I369 PolarHBondContact O-N 3.27Å; N367-I369 VanDerWaalsContact O-N 3.07Å; I369-I371 VanDerWaalsContact C-N 3.35Å; I369-I371 HydrophobicContact CG2-CD1 3.84Å; I369-I371 HydrophobicContact CG2-CG1 3.81Å; I369-I371 PolarHBondContact O-N 3.27Å
370	I	31	Very low	28.7	Very low	125 Å²	125	134.9 Å²	134.9	64%	0.641	75%	0.75	S	S	*	*			trans	-81.2	77.8	-175.6	-55.3	174.1	0	0	0	110	N368 N372	N368-I370 HydrophobicContact CB-CG1 4.39Å; I370-N372 HydrophobicContact CG2-CB 3.97Å; I370-N372 VanDerWaalsContact CG2-ND2 3.26Å; I370-N372 WeakPolarHBondContact CG2-ND2 3.3Å; I370-N372 PolarHBondContact O-N 3.14Å
371	I	28.9	Very low	29.2	Very low	128 Å²	128	131.8 Å²	131.8	66%	0.656	74%	0.739	S	S	*	*			trans	-77.6	72.2	170.5	-61	169.4	0	0	0	108.8	I369 T373	I369-I371 VanDerWaalsContact C-N 3.35Å; I369-I371 HydrophobicContact CG2-CD1 3.84Å; I369-I371 HydrophobicContact CG2-CG1 3.81Å; I369-I371 PolarHBondContact O-N 3.27Å; I371-T373 HydrophobicContact CG2-CG2 3.88Å; I371-T373 WeakPolarHBondContact CG2-OG1 3.25Å; I371-T373 PolarHBondContact O-N 3.31Å
372	N	28.7	Very low	29.5	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	75%	0.745	S	S	*	*			trans	-80	46.5	177.6	-111.6	-38.9	0	0	0	112.1	I370 S374	I370-N372 HydrophobicContact CG2-CB 3.97Å; I370-N372 VanDerWaalsContact CG2-ND2 3.26Å; I370-N372 WeakPolarHBondContact CG2-ND2 3.3Å; I370-N372 PolarHBondContact O-N 3.14Å; N372-S374 PolarHBondContact O-N 2.87Å
373	T	27.1	Very low	30.2	Very low	114 Å²	114	138.2 Å²	138.2	70%	0.699	74%	0.741	S	S	*	*			trans	-78.6	35	178.1	52.5	0	0	0	0	113	I371 I375	I371-T373 HydrophobicContact CG2-CG2 3.88Å; I371-T373 WeakPolarHBondContact CG2-OG1 3.25Å; I371-T373 PolarHBondContact O-N 3.31Å; T373-I375 VanDerWaalsContact C-N 3.32Å; T373-I375 PolarHBondContact O-N 2.83Å
374	S	30.2	Very low	31.1	Very low	86 Å²	86	138 Å²	138	60%	0.601	73%	0.725	S	S	*	*			trans	-72.9	89.6	164.3	55.6	0	0	0	0	109.2	N372 K376	N372-S374 PolarHBondContact O-N 2.87Å; S374-K376 PolarHBondContact O-N 3.19Å
375	I	31.3	Very low	31.7	Very low	155 Å²	155	137.4 Å²	137.4	80%	0.795	72%	0.72	S	S	*	*			trans	-57.4	102.3	176.9	-62.2	175.1	0	0	0	108.4	T373 S377	T373-I375 VanDerWaalsContact C-N 3.32Å; T373-I375 PolarHBondContact O-N 2.83Å; I375-S377 VanDerWaalsContact C-N 3.34Å; I375-S377 PolarHBondContact O-N 2.84Å
376	K	28.9	Very low	32.6	Very low	172 Å²	172	135.6 Å²	135.6	75%	0.748	71%	0.71	S	S	*	*			trans	-62.7	97.1	173	-75.3	175.2	-178.3	165	0	108.4	S374 N378	S374-K376 PolarHBondContact O-N 3.19Å; K376-N378 PolarHBondContact O-N 3.37Å
377	S	30.3	Very low	33.2	Very low	112 Å²	112	138 Å²	138	78%	0.783	70%	0.701	S	S	*	*			trans	-68.8	63.8	172.4	47.6	0	0	0	0	110.5	I375 P379	I375-S377 VanDerWaalsContact C-N 3.34Å; I375-S377 PolarHBondContact O-N 2.84Å; S377-P379 WeakPolarHBondContact O-CD 3.38Å
378	N	29.4	Very low	34	Very low	120 Å²	120	137.3 Å²	137.3	64%	0.642	69%	0.691	S	S	*	*			trans	-51.8	114.5	178	-79.3	-35	0	0	0	108.9	K376	K376-N378 PolarHBondContact O-N 3.37Å
379	P	32.3	Very low	34.7	Very low	94 Å²	94	135.2 Å²	135.2	61%	0.61	68%	0.68	S	S	*	*			trans	-59.6	147.2	177.7	24.9	-33.6	0	0	0	109	S377 Q381	S377-P379 WeakPolarHBondContact O-CD 3.38Å; P379-Q381 VanDerWaalsContact O-CG 3.27Å; P379-Q381 WeakPolarHBondContact O-CG 3.33Å; P379-Q381 PolarHBondContact O-N 3.3Å
380	P	33	Very low	35.8	Very low	117 Å²	117	132 Å²	132	76%	0.76	66%	0.664	S	S	*	*			trans	-70	82.1	-155.8	26.1	-36.4	0	0	0	114.4	Y382	P380-Y382 PolarHBondContact O-N 3.49Å; P380-Y382 VanDerWaalsContact O-N 3.15Å
381	Q	36.9	Very low	36.7	Very low	142 Å²	142	130.5 Å²	130.5	66%	0.664	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-63.7	-21.4	-177.4	-56.6	-165.4	8.6	0	0	113.4	P379 K383 F384	P379-Q381 VanDerWaalsContact O-CG 3.27Å; P379-Q381 WeakPolarHBondContact O-CG 3.33Å; P379-Q381 PolarHBondContact O-N 3.3Å; Q381-K383 PolarHBondContact O-N 3.36Å; Q381-F384 PolarHBondContact O-N 2.89Å
382	Y	37.1	Very low	37.3	Very low	225 Å²	225	129.1 Å²	129.1	88%	0.882	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-63.9	4.7	-174.9	-71.7	-71.6	0	0	0	116.8	P380	P380-Y382 PolarHBondContact O-N 3.49Å; P380-Y382 VanDerWaalsContact O-N 3.15Å
383	K	41	Very low	38.2	Very low	155 Å²	155	131.6 Å²	131.6	67%	0.674	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-119.1	-2.2	168	-71.1	-150.8	169.9	-158.2	0	115.7	Q381	Q381-K383 PolarHBondContact O-N 3.36Å
384	F	41.1	Very low	38.9	Very low	128 Å²	128	135.6 Å²	135.6	56%	0.561	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-10.9	173.8	-97.7	-81.3	0	0	0	114.2	Q381 F386 F387 K388	Q381-F384 PolarHBondContact O-N 2.89Å; F384-F386 VanDerWaalsContact C-N 3.32Å; F384-F386 PolarHBondContact O-N 3.43Å; F384-F387 HydrophobicContact CD1-CB 4.47Å; F384-F387 PolarHBondContact O-N 3.15Å; F384-K388 VanDerWaalsContact O-CB 3.27Å; F384-K388 WeakPolarHBondContact O-CB 3.38Å; F384-K388 PolarHBondContact O-N 3.31Å
385	K	41	Very low	39.3	Very low	165 Å²	165	138.5 Å²	138.5	72%	0.717	66%	0.655	S	S	*	*	H	α-helix	trans	-54.1	-41.8	-179.4	-112.7	-172.3	177.9	-173.5	0	113.4	K388 N389	K385-K388 PolarHBondContact O-N 3.32Å; K385-N389 WeakPolarHBondContact O-CB 3.24Å; K385-N389 VanDerWaalsContact O-CG 3.31Å; K385-N389 PolarHBondContact O-N 3.4Å; K385-N389 PolarHBondContact O-OD1 2.93Å; K385-N389 VanDerWaalsContact O-OD1 3.13Å
386	F	44.5	Very low	39.3	Very low	164 Å²	164	137.2 Å²	137.2	72%	0.719	65%	0.65	S	S	*	*	H	α-helix	trans	-67.9	-48.8	-178	-153.6	-92.8	0	0	0	112.4	F384 N389 I390	F384-F386 VanDerWaalsContact C-N 3.32Å; F384-F386 PolarHBondContact O-N 3.43Å; F386-N389 PolarHBondContact O-N 3.37Å; F386-I390 HydrophobicContact CD1-CD1 3.87Å; F386-I390 HydrophobicContact CE1-CD1 3.89Å; F386-I390 WeakPolarHBondContact O-CG1 3.19Å; F386-I390 PolarHBondContact O-N 2.95Å
387	F	38.4	Very low	39.4	Very low	117 Å²	117	133.9 Å²	133.9	51%	0.513	65%	0.649	S	S	.	*	H	α-helix	trans	-67.1	-35.4	175	-108	-83.1	0	0	0	112.5	F384 N389 I390 I391	F384-F387 HydrophobicContact CD1-CB 4.47Å; F384-F387 PolarHBondContact O-N 3.15Å; F387-N389 VanDerWaalsContact C-N 3.34Å; F387-I390 PolarHBondContact O-N 3.45Å; F387-I391 HydrophobicContact CD1-CD1 4.24Å; F387-I391 WeakPolarHBondContact O-CB 3.29Å; F387-I391 VanDerWaalsContact O-CG1 3.24Å; F387-I391 WeakPolarHBondContact O-CG1 3.3Å; F387-I391 PolarHBondContact O-N 3.49Å
388	K	46.3	Very low	39.5	Very low	143 Å²	143	133.4 Å²	133.4	62%	0.622	64%	0.637	S	S	*	*	H	α-helix	trans	-64.8	-37.3	173.5	-171.7	179	179	-174.4	0	111.4	F384 K385 K392	F384-K388 VanDerWaalsContact O-CB 3.27Å; F384-K388 WeakPolarHBondContact O-CB 3.38Å; F384-K388 PolarHBondContact O-N 3.31Å; K385-K388 PolarHBondContact O-N 3.32Å; K388-K392 WeakPolarHBondContact O-CB 3.22Å; K388-K392 PolarHBondContact O-N 3.17Å
389	N	42.1	Very low	39.6	Very low	110 Å²	110	135.1 Å²	135.1	59%	0.588	65%	0.646	S	S	*	*	H	α-helix	trans	-68.2	-42	175.7	-78.4	23.9	0	0	0	111.9	K385 F386 F387 K392 K393	K385-N389 WeakPolarHBondContact O-CB 3.24Å; K385-N389 VanDerWaalsContact O-CG 3.31Å; K385-N389 PolarHBondContact O-N 3.4Å; K385-N389 PolarHBondContact O-OD1 2.93Å; K385-N389 VanDerWaalsContact O-OD1 3.13Å; F386-N389 PolarHBondContact O-N 3.37Å; F387-N389 VanDerWaalsContact C-N 3.34Å; N389-K392 PolarHBondContact O-N 2.88Å; N389-K393 WeakPolarHBondContact O-CB 3.27Å; N389-K393 PolarHBondContact O-N 3.46Å
390	I	53.6	Low	39.6	Very low	73 Å²	73	137 Å²	137	37%	0.374	66%	0.655	S	S	.	*	H	α-helix	trans	-61.3	-49.6	173.8	-65.6	168.3	0	0	0	110.2	F386 F387 K392 K393 Y394	F386-I390 HydrophobicContact CD1-CD1 3.87Å; F386-I390 HydrophobicContact CE1-CD1 3.89Å; F386-I390 WeakPolarHBondContact O-CG1 3.19Å; F386-I390 PolarHBondContact O-N 2.95Å; F387-I390 PolarHBondContact O-N 3.45Å; I390-K392 PolarHBondContact O-N 3.2Å; I390-K393 PolarHBondContact O-N 3.15Å; I390-Y394 HydrophobicContact CG2-CD2 4.2Å; I390-Y394 HydrophobicContact CG2-CE2 4.41Å; I390-Y394 WeakPolarHBondContact O-CD2 3.46Å; I390-Y394 PolarHBondContact O-N 3.27Å; I390-Y394 VanDerWaalsContact O-N 3.15Å
391	I	48.3	Very low	39.4	Very low	92 Å²	92	139.5 Å²	139.5	47%	0.472	66%	0.661	S	S	.	*	H	α-helix	trans	-63.7	-42.7	-180	-67.5	166.8	0	0	0	111.1	F387 K393 Y394 F395	F387-I391 HydrophobicContact CD1-CD1 4.24Å; F387-I391 WeakPolarHBondContact O-CB 3.29Å; F387-I391 VanDerWaalsContact O-CG1 3.24Å; F387-I391 WeakPolarHBondContact O-CG1 3.3Å; F387-I391 PolarHBondContact O-N 3.49Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 3.03Å; I391-Y394 PolarHBondContact O-N 3.33Å; I391-F395 HydrophobicContact CG2-CD2 4.02Å; I391-F395 WeakPolarHBondContact O-CD2 3.45Å; I391-F395 PolarHBondContact O-N 2.9Å
392	K	42.4	Very low	39	Very low	100 Å²	100	138.2 Å²	138.2	44%	0.435	67%	0.666	S	S	.	*	H	α-helix	trans	-67	-34.8	176.9	-150.4	-162.7	-178.9	-152.3	0	111.9	K388 N389 I390 Y394 F395 N396 D398	K388-K392 WeakPolarHBondContact O-CB 3.22Å; K388-K392 PolarHBondContact O-N 3.17Å; N389-K392 PolarHBondContact O-N 2.88Å; I390-K392 PolarHBondContact O-N 3.2Å; K392-Y394 VanDerWaalsContact C-N 3.27Å; K392-Y394 PolarHBondContact O-N 2.93Å; K392-F395 CarbonylContact O-C 3.42Å; K392-F395 VanDerWaalsContact O-C 3.29Å; K392-F395 PolarHBondContact O-N 2.71Å; K392-N396 PolarHBondContact O-N 2.7Å; K392-N396 PolarHBondContact O-OD1 2.86Å; K392-D398 WeakPolarHBondContact CE-OD2 3.47Å; K392-D398 IonicContact NZ-OD1 2.65Å; K392-D398 IonicContact NZ-OD2 3.47Å; K392-D398 PolarHBondContact NZ-OD2 3.02Å
393	K	48.2	Very low	38.7	Very low	180 Å²	180	135 Å²	135	78%	0.783	66%	0.664	S	S	*	*	H	α-helix	trans	-66.5	-27.5	176	-163.9	176.9	-177.1	-174.9	0	112.9	N389 I390 I391	N389-K393 WeakPolarHBondContact O-CB 3.27Å; N389-K393 PolarHBondContact O-N 3.46Å; I390-K393 PolarHBondContact O-N 3.15Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 3.03Å
394	Y	40.7	Very low	38.1	Very low	197 Å²	197	136.3 Å²	136.3	77%	0.773	67%	0.673	S	S	*	*	H	α-helix	trans	-88.4	-24.3	173.5	-85.3	-76.4	0	0	0	114.2	I390 I391 K392	I390-Y394 HydrophobicContact CG2-CD2 4.2Å; I390-Y394 HydrophobicContact CG2-CE2 4.41Å; I390-Y394 WeakPolarHBondContact O-CD2 3.46Å; I390-Y394 PolarHBondContact O-N 3.27Å; I390-Y394 VanDerWaalsContact O-N 3.15Å; I391-Y394 PolarHBondContact O-N 3.33Å; K392-Y394 VanDerWaalsContact C-N 3.27Å; K392-Y394 PolarHBondContact O-N 2.93Å
395	F	39.5	Very low	37.6	Very low	148 Å²	148	139.6 Å²	139.6	65%	0.649	69%	0.687	S	S	*	*			trans	-110.5	62.8	175.2	-71.3	-82.3	0	0	0	111	I391 K392 S397	I391-F395 HydrophobicContact CG2-CD2 4.02Å; I391-F395 WeakPolarHBondContact O-CD2 3.45Å; I391-F395 PolarHBondContact O-N 2.9Å; K392-F395 CarbonylContact O-C 3.42Å; K392-F395 VanDerWaalsContact O-C 3.29Å; K392-F395 PolarHBondContact O-N 2.71Å; F395-S397 VanDerWaalsContact C-N 3.26Å; F395-S397 PolarHBondContact O-N 2.87Å; F395-S397 VanDerWaalsContact O-N 3.08Å
396	N	30.1	Very low	36.8	Very low	128 Å²	128	141.8 Å²	141.8	68%	0.684	70%	0.697	S	S	*	*			trans	-75.4	83.7	160.9	-96.4	14.3	0	0	0	108.7	K392	K392-N396 PolarHBondContact O-N 2.7Å; K392-N396 PolarHBondContact O-OD1 2.86Å
397	S	31	Very low	36.1	Very low	102 Å²	102	141.5 Å²	141.5	71%	0.713	70%	0.7	S	S	*	*			trans	-149	59.7	168.5	-50.9	0	0	0	0	107.9	F395	F395-S397 VanDerWaalsContact C-N 3.26Å; F395-S397 PolarHBondContact O-N 2.87Å; F395-S397 VanDerWaalsContact O-N 3.08Å
398	D	32	Very low	35.6	Very low	101 Å²	101	144.7 Å²	144.7	54%	0.54	71%	0.713	S	S	.	*			trans	-71.5	161	158.4	-66.4	-48	0	0	0	108.1	K392	K392-D398 WeakPolarHBondContact CE-OD2 3.47Å; K392-D398 IonicContact NZ-OD1 2.65Å; K392-D398 IonicContact NZ-OD2 3.47Å; K392-D398 PolarHBondContact NZ-OD2 3.02Å
399	D	31.8	Very low	34.9	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	73%	0.725	S	S	*	*			trans	64.8	122.2	-174.3	-48.4	-38.2	0	0	0	114.3
400	V	32.9	Very low	34.4	Very low	132 Å²	132	148 Å²	148	80%	0.8	73%	0.728	S	S	*	*	S	Bend		-141.2	-19.5	60.7	151	0	0	0	0	114.3	C402	V400-C402 PolarHBondContact O-N 2.97Å
401	I	29	Very low	33.6	Very low	170 Å²	170	151.7 Å²	151.7	87%	0.872	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	46.6	-158.9	-34.8	-179.4	0	0	0	114.2
402	C	28.6	Very low	33.1	Very low	115 Å²	115	151.1 Å²	151.1	78%	0.777	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-22.9	-177.7	-143.6	0	0	0	0	115.6	V400	V400-C402 PolarHBondContact O-N 2.97Å
403	N	29.3	Very low	32.7	Very low	158 Å²	158	153 Å²	153	85%	0.845	76%	0.757	S	S	*	*	S	Bend	trans	-103.5	3.4	-158.7	-83.9	-3.7	0	0	0	118.5
404	Q	30.1	Very low	32.5	Very low	183 Å²	183	149.1 Å²	149.1	86%	0.855	74%	0.743	S	S	*	*	S	Bend	trans	-124.4	6	-174	-77.3	-162.4	-9.2	0	0	118.7
405	F	29.1	Very low	32.7	Very low	197 Å²	197	144.7 Å²	144.7	86%	0.864	73%	0.733	S	S	*	*			trans	-112.2	62.7	175.9	-86.6	-81.2	0	0	0	115	M407	F405-M407 PolarHBondContact O-N 2.96Å
406	K	25.1	Very low	32.9	Very low	210 Å²	210	139.8 Å²	139.8	91%	0.913	72%	0.717	S	S	*	*			trans	-75	66.6	162.2	-96.4	-174.9	174.3	176.6	0	111.2
407	M	28.8	Very low	33.9	Very low	159 Å²	159	137.6 Å²	137.6	78%	0.783	71%	0.705	S	S	*	*			trans	-139.4	152.7	169	-92.7	-59.9	165	0	0	114.4	F405	F405-M407 PolarHBondContact O-N 2.96Å
408	K	28.9	Very low	34.8	Very low	183 Å²	183	139.3 Å²	139.3	80%	0.796	70%	0.7	S	S	*	*			trans	-26.4	140.2	-168.2	-68.7	171.4	176.5	173.6	0	118.6	N410	K408-N410 PolarHBondContact O-N 3Å
409	K	32.2	Very low	36.1	Very low	201 Å²	201	141.9 Å²	141.9	87%	0.874	71%	0.707	S	S	*	*			trans	-58.9	80.2	178.7	-66.3	174.7	177.7	169.7	0	114.8	Q411	K409-Q411 PolarHBondContact O-N 2.85Å; K409-Q411 VanDerWaalsContact O-N 3.1Å
410	N	30.8	Very low	37.5	Very low	121 Å²	121	138.3 Å²	138.3	65%	0.647	69%	0.687	S	S	*	*			trans	-83.6	79.3	167.3	-87	-16.4	0	0	0	112	K408 S412 F413	K408-N410 PolarHBondContact O-N 3Å; N410-S412 PolarHBondContact O-N 2.85Å; N410-S412 VanDerWaalsContact O-N 3.11Å; N410-F413 PolarHBondContact O-N 3.01Å
411	Q	37.9	Very low	39.3	Very low	151 Å²	151	136.8 Å²	136.8	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-12.4	-173.8	-157.1	163.1	-7.2	0	0	114.2	K409	K409-Q411 PolarHBondContact O-N 2.85Å; K409-Q411 VanDerWaalsContact O-N 3.1Å
412	S	36	Very low	40.8	Very low	81 Å²	81	132.4 Å²	132.4	57%	0.566	65%	0.65	S	S	*	*	H	α-helix	trans	-64	-40.3	172.7	49.9	0	0	0	0	113.5	N410 I414 N415 S416	N410-S412 PolarHBondContact O-N 2.85Å; N410-S412 VanDerWaalsContact O-N 3.11Å; S412-I414 VanDerWaalsContact C-N 3.3Å; S412-I414 PolarHBondContact O-N 3.15Å; S412-N415 PolarHBondContact O-N 3.31Å; S412-S416 PolarHBondContact O-N 3.37Å
413	F	34.6	Very low	42.9	Very low	139 Å²	139	130.8 Å²	130.8	61%	0.61	63%	0.631	S	S	*	*	H	α-helix	trans	-69.4	-24.1	-172.7	-120.3	-84.6	0	0	0	114	N410 S416 N417	N410-F413 PolarHBondContact O-N 3.01Å; F413-S416 PolarHBondContact O-OG 3.27Å; F413-N417 PolarHBondContact O-N 3.07Å
414	I	45.4	Very low	45.1	Very low	98 Å²	98	129.7 Å²	129.7	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-73.9	-30.7	177.4	-66.8	164.9	0	0	0	111	S412 K418	S412-I414 VanDerWaalsContact C-N 3.3Å; S412-I414 PolarHBondContact O-N 3.15Å; I414-K418 HydrophobicContact CG2-CD 4.4Å; I414-K418 WeakPolarHBondContact O-CG 3.36Å; I414-K418 PolarHBondContact O-N 3.25Å
415	N	43.6	Very low	47.2	Very low	104 Å²	104	124.8 Å²	124.8	56%	0.556	59%	0.593	S	S	*	*	H	α-helix	trans	-83.3	-34.3	-178.6	-76.4	-14.6	0	0	0	112.7	S412 K419	S412-N415 PolarHBondContact O-N 3.31Å; N415-K419 PolarHBondContact O-N 3.13Å; N415-K419 VanDerWaalsContact O-N 3.14Å
416	S	44.9	Very low	49.4	Very low	46 Å²	46	119.7 Å²	119.7	32%	0.322	57%	0.57	S	S	.	*	H	α-helix	trans	-61.2	-50.4	171.1	53.9	0	0	0	0	111.1	S412 F413 K418 K419 I420	S412-S416 PolarHBondContact O-N 3.37Å; F413-S416 PolarHBondContact O-OG 3.27Å; S416-K418 VanDerWaalsContact C-N 3.35Å; S416-K418 PolarHBondContact O-N 3.47Å; S416-K419 PolarHBondContact O-N 2.87Å; S416-K419 VanDerWaalsContact O-N 3.1Å; S416-I420 WeakPolarHBondContact O-CG1 3.28Å; S416-I420 PolarHBondContact O-N 3.41Å
417	N	49.6	Very low	51.9	Low	81 Å²	81	115 Å²	115	43%	0.433	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-39	179.2	-79.8	-13	0	0	0	113.2	F413 I420 N421	F413-N417 PolarHBondContact O-N 3.07Å; N417-I420 PolarHBondContact O-N 2.79Å; N417-N421 WeakPolarHBondContact O-CB 3.45Å; N417-N421 VanDerWaalsContact O-CG 3.3Å; N417-N421 PolarHBondContact O-N 2.92Å
418	K	51.4	Low	54.2	Low	138 Å²	138	113 Å²	113	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-63.3	-41.6	173.6	-76	173.4	-177.1	172.7	0	112.7	I414 S416 H422	I414-K418 HydrophobicContact CG2-CD 4.4Å; I414-K418 WeakPolarHBondContact O-CG 3.36Å; I414-K418 PolarHBondContact O-N 3.25Å; S416-K418 VanDerWaalsContact C-N 3.35Å; S416-K418 PolarHBondContact O-N 3.47Å; K418-H422 PolarHBondContact O-N 3.05Å; K418-H422 VanDerWaalsContact O-N 3.11Å
419	K	57.7	Low	56.3	Low	156 Å²	156	107.6 Å²	107.6	68%	0.678	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-45	177.3	-169.1	178.9	-179.9	-176.3	0	111.4	N415 S416 H422 E423	N415-K419 PolarHBondContact O-N 3.13Å; N415-K419 VanDerWaalsContact O-N 3.14Å; S416-K419 PolarHBondContact O-N 2.87Å; S416-K419 VanDerWaalsContact O-N 3.1Å; K419-H422 PolarHBondContact O-N 2.77Å; K419-E423 PolarHBondContact O-N 2.84Å; K419-E423 VanDerWaalsContact O-N 3.08Å
420	I	61.9	Low	58.5	Low	82 Å²	82	105.5 Å²	105.5	42%	0.421	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-47.9	177.3	-68.5	163.8	0	0	0	110.8	S416 N417 H422 E423 K424	S416-I420 WeakPolarHBondContact O-CG1 3.28Å; S416-I420 PolarHBondContact O-N 3.41Å; N417-I420 PolarHBondContact O-N 2.79Å; I420-H422 VanDerWaalsContact C-N 3.29Å; I420-H422 PolarHBondContact O-N 3.25Å; I420-E423 PolarHBondContact O-N 3.39Å; I420-K424 HydrophobicContact CG2-CD 4.17Å; I420-K424 HydrophobicContact CG2-CG 4.42Å; I420-K424 WeakPolarHBondContact O-CG 3.46Å; I420-K424 PolarHBondContact O-N 3.38Å
421	N	69.9	Low	60.8	Low	99 Å²	99	105.4 Å²	105.4	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-32.5	179.4	-73	-6.4	0	0	0	112.4	N417 Y425	N417-N421 WeakPolarHBondContact O-CB 3.45Å; N417-N421 VanDerWaalsContact O-CG 3.3Å; N417-N421 PolarHBondContact O-N 2.92Å; N421-Y425 VanDerWaalsContact O-CB 3.27Å; N421-Y425 WeakPolarHBondContact O-CB 3.08Å; N421-Y425 PolarHBondContact O-N 2.89Å
422	H	62.4	Low	62.6	Low	79 Å²	79	101.4 Å²	101.4	37%	0.366	48%	0.484	S	S	.	.	H	α-helix	trans	-70.1	-39.6	174.8	-172.1	-133.9	0	0	0	113	K418 K419 I420 Y425 K426	K418-H422 PolarHBondContact O-N 3.05Å; K418-H422 VanDerWaalsContact O-N 3.11Å; K419-H422 PolarHBondContact O-N 2.77Å; I420-H422 VanDerWaalsContact C-N 3.29Å; I420-H422 PolarHBondContact O-N 3.25Å; H422-Y425 PolarHBondContact O-N 2.89Å; H422-K426 VanDerWaalsContact CE1-CE 3.42Å; H422-K426 WeakPolarHBondContact CE1-CE 3.42Å; H422-K426 WeakPolarHBondContact O-CG 3.48Å; H422-K426 PolarHBondContact O-N 3.36Å
423	E	71.9	Confident	64.5	Low	81 Å²	81	98.6 Å²	98.6	38%	0.379	46%	0.461	S	S	.	.	H	α-helix	trans	-69.6	-41.1	173.2	-59.6	-48.5	135.4	0	0	111.8	K419 I420 Y425 K426 I427	K419-E423 PolarHBondContact O-N 2.84Å; K419-E423 VanDerWaalsContact O-N 3.08Å; I420-E423 PolarHBondContact O-N 3.39Å; E423-Y425 VanDerWaalsContact C-N 3.29Å; E423-Y425 PolarHBondContact O-N 2.87Å; E423-K426 PolarHBondContact O-N 3.48Å; E423-K426 VanDerWaalsContact O-N 3.14Å; E423-K426 IonicContact OE1-NZ 3.83Å; E423-K426 PolarHBondContact OE1-NZ 2.87Å; E423-K426 WeakPolarHBondContact OE2-CD 3.42Å; E423-K426 IonicContact OE2-NZ 2.73Å; E423-K426 PolarHBondContact OE2-NZ 3.37Å; E423-I427 WeakPolarHBondContact O-CG1 3.35Å; E423-I427 PolarHBondContact O-N 2.83Å
424	K	75.3	Confident	66.7	Low	135 Å²	135	93.9 Å²	93.9	59%	0.587	44%	0.444	S	S	*	.	H	α-helix	trans	-55	-44.3	170.8	-75.4	-177.3	176.1	-176.1	0	111.4	I420 I427 F428	I420-K424 HydrophobicContact CG2-CD 4.17Å; I420-K424 HydrophobicContact CG2-CG 4.42Å; I420-K424 WeakPolarHBondContact O-CG 3.46Å; I420-K424 PolarHBondContact O-N 3.38Å; K424-I427 PolarHBondContact O-N 2.86Å; K424-F428 WeakPolarHBondContact O-CB 3.44Å; K424-F428 PolarHBondContact O-N 3.3Å
425	Y	75.1	Confident	68.4	Low	80 Å²	80	92.8 Å²	92.8	31%	0.314	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-37.8	176.9	-178.4	-109.7	0	0	0	113.1	N421 H422 E423 F428 L429	N421-Y425 VanDerWaalsContact O-CB 3.27Å; N421-Y425 WeakPolarHBondContact O-CB 3.08Å; N421-Y425 PolarHBondContact O-N 2.89Å; H422-Y425 PolarHBondContact O-N 2.89Å; E423-Y425 VanDerWaalsContact C-N 3.29Å; E423-Y425 PolarHBondContact O-N 2.87Å; Y425-F428 PolarHBondContact O-N 3.43Å; Y425-L429 HydrophobicContact CD1-CD1 3.97Å; Y425-L429 HydrophobicContact CD1-CG 4.45Å; Y425-L429 HydrophobicContact CE1-CD1 3.41Å; Y425-L429 VanDerWaalsContact CE1-CD1 3.41Å; Y425-L429 HydrophobicContact CE1-CG 4.08Å; Y425-L429 HydrophobicContact CE2-CD1 4.38Å; Y425-L429 HydrophobicContact CE2-CD2 4.43Å; Y425-L429 HydrophobicContact CE2-CG 4.19Å; Y425-L429 WeakPolarHBondContact O-CB 3.42Å; Y425-L429 WeakPolarHBondContact O-CG 3.33Å; Y425-L429 PolarHBondContact O-N 2.97Å
426	K	73.8	Confident	70.1	Confident	90 Å²	90	90.8 Å²	90.8	39%	0.391	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-40.7	172.2	-70.1	175.8	-159.6	163.8	0	112.5	H422 E423 L429 W430	H422-K426 VanDerWaalsContact CE1-CE 3.42Å; H422-K426 WeakPolarHBondContact CE1-CE 3.42Å; H422-K426 WeakPolarHBondContact O-CG 3.48Å; H422-K426 PolarHBondContact O-N 3.36Å; E423-K426 PolarHBondContact O-N 3.48Å; E423-K426 VanDerWaalsContact O-N 3.14Å; E423-K426 IonicContact OE1-NZ 3.83Å; E423-K426 PolarHBondContact OE1-NZ 2.87Å; E423-K426 WeakPolarHBondContact OE2-CD 3.42Å; E423-K426 IonicContact OE2-NZ 2.73Å; E423-K426 PolarHBondContact OE2-NZ 3.37Å; K426-L429 PolarHBondContact O-N 3.49Å; K426-W430 WeakPolarHBondContact O-CB 3.31Å; K426-W430 PolarHBondContact O-N 3.16Å
427	I	78.7	Confident	71.8	Confident	110 Å²	110	89.1 Å²	89.1	56%	0.564	42%	0.416	S	S	*	.	H	α-helix	trans	-64.5	-45.6	176.9	-66.5	164.1	0	0	0	109.5	E423 K424 W430 F431	E423-I427 WeakPolarHBondContact O-CG1 3.35Å; E423-I427 PolarHBondContact O-N 2.83Å; K424-I427 PolarHBondContact O-N 2.86Å; I427-W430 PolarHBondContact O-N 3.39Å; I427-F431 WeakPolarHBondContact O-CB 3.31Å; I427-F431 PolarHBondContact O-N 2.93Å
428	F	76.3	Confident	73.5	Confident	117 Å²	117	88.6 Å²	88.6	51%	0.513	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-46.9	174.8	-180	-98.2	0	0	0	112.6	K424 Y425 W430 F431 L432	K424-F428 WeakPolarHBondContact O-CB 3.44Å; K424-F428 PolarHBondContact O-N 3.3Å; Y425-F428 PolarHBondContact O-N 3.43Å; F428-W430 VanDerWaalsContact C-N 3.28Å; F428-W430 PolarHBondContact O-N 2.91Å; F428-F431 PolarHBondContact O-N 3.35Å; F428-L432 HydrophobicContact CE1-CD2 4.23Å; F428-L432 VanDerWaalsContact O-CB 3.29Å; F428-L432 WeakPolarHBondContact O-CB 3.32Å; F428-L432 PolarHBondContact O-N 2.85Å
429	L	73.8	Confident	75.1	Confident	71 Å²	71	84.7 Å²	84.7	37%	0.372	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-32.6	175	-77.2	-178.1	0	0	0	113	Y425 K426 R433	Y425-L429 HydrophobicContact CD1-CD1 3.97Å; Y425-L429 HydrophobicContact CD1-CG 4.45Å; Y425-L429 HydrophobicContact CE1-CD1 3.41Å; Y425-L429 VanDerWaalsContact CE1-CD1 3.41Å; Y425-L429 HydrophobicContact CE1-CG 4.08Å; Y425-L429 HydrophobicContact CE2-CD1 4.38Å; Y425-L429 HydrophobicContact CE2-CD2 4.43Å; Y425-L429 HydrophobicContact CE2-CG 4.19Å; Y425-L429 WeakPolarHBondContact O-CB 3.42Å; Y425-L429 WeakPolarHBondContact O-CG 3.33Å; Y425-L429 PolarHBondContact O-N 2.97Å; K426-L429 PolarHBondContact O-N 3.49Å; L429-R433 WeakPolarHBondContact O-CB 3.25Å; L429-R433 PolarHBondContact O-N 3.5Å; L429-R433 VanDerWaalsContact O-N 3.15Å
430	W	77.4	Confident	76.4	Confident	156 Å²	156	77.4 Å²	77.4	59%	0.591	37%	0.366	S	S	*	.	H	α-helix	trans	-71	-43.7	173.9	176.6	74.7	0	0	0	111.6	K426 I427 F428 R433 V434	K426-W430 WeakPolarHBondContact O-CB 3.31Å; K426-W430 PolarHBondContact O-N 3.16Å; I427-W430 PolarHBondContact O-N 3.39Å; F428-W430 VanDerWaalsContact C-N 3.28Å; F428-W430 PolarHBondContact O-N 2.91Å; W430-R433 PolarHBondContact O-N 2.77Å; W430-V434 HydrophobicContact CD2-CG2 4.34Å; W430-V434 HydrophobicContact CH2-CG2 4.47Å; W430-V434 HydrophobicContact CZ2-CG2 3.92Å; W430-V434 WeakPolarHBondContact O-CG2 3.43Å; W430-V434 PolarHBondContact O-N 3.16Å
431	F	79.2	Confident	77.5	Confident	119 Å²	119	76.2 Å²	76.2	52%	0.522	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-52.8	175.4	177.6	-96	0	0	0	111.9	I427 F428 R433 V434 L435	I427-F431 WeakPolarHBondContact O-CB 3.31Å; I427-F431 PolarHBondContact O-N 2.93Å; F428-F431 PolarHBondContact O-N 3.35Å; F431-R433 PolarHBondContact O-N 3.14Å; F431-V434 PolarHBondContact O-N 3.11Å; F431-L435 HydrophobicContact CE1-CD2 4.31Å; F431-L435 WeakPolarHBondContact O-CB 3.44Å; F431-L435 PolarHBondContact O-N 3.21Å
432	L	76.6	Confident	78.2	Confident	67 Å²	67	74.4 Å²	74.4	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-54.4	-37.3	175.8	177.5	62.8	0	0	0	111.7	F428 L436	F428-L432 HydrophobicContact CE1-CD2 4.23Å; F428-L432 VanDerWaalsContact O-CB 3.29Å; F428-L432 WeakPolarHBondContact O-CB 3.32Å; F428-L432 PolarHBondContact O-N 2.85Å; L432-L436 HydrophobicContact CD1-CD1 4.5Å; L432-L436 HydrophobicContact CG-CD1 4.24Å; L432-L436 WeakPolarHBondContact O-CB 3.34Å; L432-L436 WeakPolarHBondContact O-CD1 3.46Å; L432-L436 VanDerWaalsContact O-CG 3.29Å; L432-L436 WeakPolarHBondContact O-CG 3.44Å; L432-L436 PolarHBondContact O-N 3.44Å
433	R	75.8	Confident	79.2	Confident	23 Å²	23	73.1 Å²	73.1	9%	0.087	34%	0.343	C	S	.	.	H	α-helix	trans	-70.4	-41.7	175.6	177	176.3	172.8	-147.6	-9.2	113.1	W329 L332 E333 L429 W430 F431 L435 L436 C437	W329-R433 VanDerWaalsContact CD2-NH2 3.33Å; W329-R433 HydrophobicContact CZ3-CG 4.28Å; W329-R433 PolarHBondContact O-NH2 3.44Å; W329-R433 VanDerWaalsContact O-NH2 3.11Å; L332-R433 HydrophobicContact CD1-CG 4.27Å; E333-R433 VanDerWaalsContact CG-NH2 3.31Å; E333-R433 IonicContact OE1-CZ 3.28Å; E333-R433 VanDerWaalsContact OE1-CZ 3.23Å; E333-R433 IonicContact OE1-NH1 2.88Å; E333-R433 PolarHBondContact OE1-NH1 3.32Å; E333-R433 IonicContact OE1-NH2 2.73Å; E333-R433 PolarHBondContact OE1-NH2 3.2Å; L429-R433 WeakPolarHBondContact O-CB 3.25Å; L429-R433 PolarHBondContact O-N 3.5Å; L429-R433 VanDerWaalsContact O-N 3.15Å; W430-R433 PolarHBondContact O-N 2.77Å; F431-R433 PolarHBondContact O-N 3.14Å; R433-L435 VanDerWaalsContact C-N 3.33Å; R433-L436 PolarHBondContact O-N 3.17Å; R433-C437 PolarHBondContact O-N 2.93Å; R433-C437 VanDerWaalsContact O-N 3.14Å; R433-C437 PolarHBondContact O-SG 2.93Å
434	V	79.4	Confident	79.9	Confident	40 Å²	40	69.3 Å²	69.3	24%	0.242	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-45.5	174.4	169.4	0	0	0	0	109.5	W329 W430 F431 L436 C437 L438	W329-V434 HydrophobicContact CZ3-CG2 4.12Å; W430-V434 HydrophobicContact CD2-CG2 4.34Å; W430-V434 HydrophobicContact CH2-CG2 4.47Å; W430-V434 HydrophobicContact CZ2-CG2 3.92Å; W430-V434 WeakPolarHBondContact O-CG2 3.43Å; W430-V434 PolarHBondContact O-N 3.16Å; F431-V434 PolarHBondContact O-N 3.11Å; V434-L436 PolarHBondContact O-N 2.99Å; V434-C437 PolarHBondContact O-N 3.06Å; V434-C437 VanDerWaalsContact O-N 3.08Å; V434-L438 HydrophobicContact CG1-CD1 3.73Å; V434-L438 HydrophobicContact CG1-CG 4.31Å; V434-L438 WeakPolarHBondContact O-CG 3.42Å; V434-L438 PolarHBondContact O-N 3.27Å
435	L	81.7	Confident	80.3	Confident	75 Å²	75	65.5 Å²	65.5	39%	0.393	31%	0.311	S	S	.	.	H	α-helix	trans	-56.7	-47.4	175.2	-176.2	64	0	0	0	112.1	F431 R433 C437 L438 L439 I442	F431-L435 HydrophobicContact CE1-CD2 4.31Å; F431-L435 WeakPolarHBondContact O-CB 3.44Å; F431-L435 PolarHBondContact O-N 3.21Å; R433-L435 VanDerWaalsContact C-N 3.33Å; L435-C437 VanDerWaalsContact C-N 3.27Å; L435-C437 PolarHBondContact O-N 3.16Å; L435-L438 CarbonylContact O-C 3.6Å; L435-L438 PolarHBondContact O-N 2.86Å; L435-L438 VanDerWaalsContact O-N 3.15Å; L435-L439 PolarHBondContact O-N 2.77Å; L435-I442 HydrophobicContact CD1-CD1 3.86Å
436	L	80	Confident	80.8	Confident	61 Å²	61	66.9 Å²	66.9	32%	0.319	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-34.1	175	-78.9	163.5	0	0	0	113.3	L328 L432 R433 V434 I583	L328-L436 VanDerWaalsContact CD2-O 3.25Å; L328-L436 WeakPolarHBondContact CD2-O 3.11Å; L432-L436 HydrophobicContact CD1-CD1 4.5Å; L432-L436 HydrophobicContact CG-CD1 4.24Å; L432-L436 WeakPolarHBondContact O-CB 3.34Å; L432-L436 WeakPolarHBondContact O-CD1 3.46Å; L432-L436 VanDerWaalsContact O-CG 3.29Å; L432-L436 WeakPolarHBondContact O-CG 3.44Å; L432-L436 PolarHBondContact O-N 3.44Å; R433-L436 PolarHBondContact O-N 3.17Å; V434-L436 PolarHBondContact O-N 2.99Å; L436-I583 HydrophobicContact CD2-CD1 3.95Å
437	C	80.7	Confident	81.3	Confident	11 Å²	11	63.1 Å²	63.1	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-80.3	-24.3	177.4	-57.3	0	0	0	0	113.1	G325 R433 V434 L435	G325-C437 VanDerWaalsContact CA-O 3.23Å; G325-C437 WeakPolarHBondContact CA-O 3.5Å; R433-C437 PolarHBondContact O-N 2.93Å; R433-C437 VanDerWaalsContact O-N 3.14Å; R433-C437 PolarHBondContact O-SG 2.93Å; V434-C437 PolarHBondContact O-N 3.06Å; V434-C437 VanDerWaalsContact O-N 3.08Å; L435-C437 VanDerWaalsContact C-N 3.27Å; L435-C437 PolarHBondContact O-N 3.16Å
438	L	85.3	Confident	81.5	Confident	70 Å²	70	58.5 Å²	58.5	37%	0.366	29%	0.287	S	S	.	.	H	α-helix	trans	-93.5	-10.1	176.6	-66.4	177.6	0	0	0	113.2	V434 L435 P440 F441 I442	V434-L438 HydrophobicContact CG1-CD1 3.73Å; V434-L438 HydrophobicContact CG1-CG 4.31Å; V434-L438 WeakPolarHBondContact O-CG 3.42Å; V434-L438 PolarHBondContact O-N 3.27Å; L435-L438 CarbonylContact O-C 3.6Å; L435-L438 PolarHBondContact O-N 2.86Å; L435-L438 VanDerWaalsContact O-N 3.15Å; L438-P440 VanDerWaalsContact C-CD 3.49Å; L438-F441 HydrophobicContact CD2-CD1 4.49Å; L438-F441 WeakPolarHBondContact O-CB 3.45Å; L438-F441 PolarHBondContact O-N 2.83Å; L438-I442 HydrophobicContact CB-CD1 3.82Å; L438-I442 HydrophobicContact CB-CG1 4.26Å; L438-I442 WeakPolarHBondContact O-CG1 3.46Å; L438-I442 PolarHBondContact O-N 2.95Å
439	L	84.6	Confident	81.9	Confident	56 Å²	56	57.7 Å²	57.7	29%	0.293	29%	0.287	S	S	.	.	H	α-helix	trans	-51	-44.5	-179.3	-179.7	65.7	0	0	0	113.7	L435 F441 I442 L443 A579	L435-L439 PolarHBondContact O-N 2.77Å; L439-F441 VanDerWaalsContact C-N 3.33Å; L439-F441 PolarHBondContact O-N 3.28Å; L439-I442 PolarHBondContact O-N 2.8Å; L439-L443 HydrophobicContact CD1-CD1 3.99Å; L439-L443 HydrophobicContact CD1-CG 4.05Å; L439-L443 HydrophobicContact CG-CD1 4.01Å; L439-L443 HydrophobicContact CG-CG 4.48Å; L439-L443 WeakPolarHBondContact O-CB 3.4Å; L439-L443 VanDerWaalsContact O-CG 3.29Å; L439-L443 WeakPolarHBondContact O-CG 3.36Å; L439-L443 PolarHBondContact O-N 3.37Å; L439-A579 HydrophobicContact CD2-CB 4.23Å
440	P	84.3	Confident	82.3	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.019	29%	0.294	C	S	.	.	H	α-helix	trans	-56.6	-44.4	174.3	-27.4	37.3	0	0	0	113.4	T321 I324 L438 F444 G575 P580	T321-P440 HydrophobicContact CG2-CB 4.27Å; I324-P440 HydrophobicContact CG2-CG 4.12Å; L438-P440 VanDerWaalsContact C-CD 3.49Å; P440-F444 WeakPolarHBondContact O-CB 3.49Å; P440-F444 PolarHBondContact O-N 3.09Å; P440-F444 VanDerWaalsContact O-N 3.1Å; P440-G575 VanDerWaalsContact CB-O 3.24Å; P440-G575 WeakPolarHBondContact CB-O 3.27Å; P440-G575 WeakPolarHBondContact CG-O 3.48Å; P440-P580 HydrophobicContact CG-CG 4.3Å
441	F	85	Confident	82.5	Confident	57 Å²	57	53.5 Å²	53.5	25%	0.25	27%	0.268	C	S	.	.	H	α-helix	trans	-73.5	-38.1	-176.9	176.1	-106.8	0	0	0	112	I318 L322 L438 L439 F444 I445	I318-F441 HydrophobicContact CG2-CE2 4.07Å; L322-F441 HydrophobicContact CD2-CD2 3.9Å; L322-F441 HydrophobicContact CD2-CE2 4.13Å; L322-F441 HydrophobicContact CD2-CG 4.21Å; L322-F441 HydrophobicContact CG-CD2 4.17Å; L322-F441 HydrophobicContact CG-CE2 4.38Å; L438-F441 HydrophobicContact CD2-CD1 4.49Å; L438-F441 WeakPolarHBondContact O-CB 3.45Å; L438-F441 PolarHBondContact O-N 2.83Å; L439-F441 VanDerWaalsContact C-N 3.33Å; L439-F441 PolarHBondContact O-N 3.28Å; F441-F444 PolarHBondContact O-N 3.34Å; F441-I445 HydrophobicContact CD1-CD1 3.99Å; F441-I445 HydrophobicContact CD2-CD1 4.29Å; F441-I445 HydrophobicContact CE1-CD1 3.48Å; F441-I445 VanDerWaalsContact CE1-CD1 3.48Å; F441-I445 HydrophobicContact CE2-CD1 3.82Å; F441-I445 HydrophobicContact CE2-CG1 4.46Å; F441-I445 HydrophobicContact CG-CD1 4.37Å; F441-I445 HydrophobicContact CZ-CD1 3.4Å; F441-I445 VanDerWaalsContact CZ-CD1 3.4Å; F441-I445 HydrophobicContact CZ-CG1 4.48Å; F441-I445 WeakPolarHBondContact O-CB 3.23Å; F441-I445 WeakPolarHBondContact O-CG1 3.39Å; F441-I445 PolarHBondContact O-N 3.38Å
442	I	85.7	Confident	82.4	Confident	61 Å²	61	52.4 Å²	52.4	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-45.2	175.5	-66.9	164.5	0	0	0	110.7	L435 L438 L439 I445 L446	L435-I442 HydrophobicContact CD1-CD1 3.86Å; L438-I442 HydrophobicContact CB-CD1 3.82Å; L438-I442 HydrophobicContact CB-CG1 4.26Å; L438-I442 WeakPolarHBondContact O-CG1 3.46Å; L438-I442 PolarHBondContact O-N 2.95Å; L439-I442 PolarHBondContact O-N 2.8Å; I442-I445 PolarHBondContact O-N 2.9Å; I442-L446 HydrophobicContact CG2-CD1 3.94Å; I442-L446 VanDerWaalsContact O-CG 3.3Å; I442-L446 WeakPolarHBondContact O-CG 3.24Å; I442-L446 PolarHBondContact O-N 3.41Å
443	L	83.5	Confident	82.6	Confident	52 Å²	52	52.5 Å²	52.5	27%	0.272	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-45.5	176.5	-72.1	170.2	0	0	0	111.5	L439 L446 A447 I574	L439-L443 HydrophobicContact CD1-CD1 3.99Å; L439-L443 HydrophobicContact CD1-CG 4.05Å; L439-L443 HydrophobicContact CG-CD1 4.01Å; L439-L443 HydrophobicContact CG-CG 4.48Å; L439-L443 WeakPolarHBondContact O-CB 3.4Å; L439-L443 VanDerWaalsContact O-CG 3.29Å; L439-L443 WeakPolarHBondContact O-CG 3.36Å; L439-L443 PolarHBondContact O-N 3.37Å; L443-L446 PolarHBondContact O-N 3.48Å; L443-A447 WeakPolarHBondContact O-CB 3.23Å; L443-A447 PolarHBondContact O-N 2.91Å; L443-A447 VanDerWaalsContact O-N 3.07Å; L443-I574 HydrophobicContact CD1-CG2 4.02Å
444	F	85.1	Confident	82.6	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-45.4	176.8	-179.7	-94.2	0	0	0	112.5	W314 D317 I318 T321 P440 F441 L446 A447 S448 Y563 I568 L572	W314-F444 AromaticContact CD1-CE1 3.91Å; W314-F444 AromaticContact CD1-CZ 3.7Å; W314-F444 AromaticContact NE1-CE1 3.61Å; W314-F444 AromaticContact NE1-CZ 3.86Å; D317-F444 HydrophobicContact CB-CD2 4.39Å; D317-F444 HydrophobicContact CB-CE2 3.63Å; D317-F444 HydrophobicContact CB-CZ 3.75Å; I318-F444 HydrophobicContact CD1-CE1 4.24Å; I318-F444 HydrophobicContact CG1-CD1 4.03Å; I318-F444 HydrophobicContact CG1-CE1 3.55Å; I318-F444 HydrophobicContact CG1-CZ 4.46Å; T321-F444 HydrophobicContact CG2-CB 4.01Å; T321-F444 HydrophobicContact CG2-CG 4.37Å; P440-F444 WeakPolarHBondContact O-CB 3.49Å; P440-F444 PolarHBondContact O-N 3.09Å; P440-F444 VanDerWaalsContact O-N 3.1Å; F441-F444 PolarHBondContact O-N 3.34Å; F444-L446 PolarHBondContact O-N 2.87Å; F444-A447 PolarHBondContact O-N 2.87Å; F444-S448 WeakPolarHBondContact O-CB 3.37Å; F444-S448 PolarHBondContact O-N 3.2Å; F444-S448 PolarHBondContact O-OG 2.9Å; F444-Y563 WeakPolarHBondContact CZ-OH 3.33Å; F444-I568 HydrophobicContact CE2-CG2 4.49Å; F444-L572 HydrophobicContact CD2-CD2 3.77Å; F444-L572 HydrophobicContact CE2-CD2 3.89Å
445	I	85.3	Confident	82.2	Confident	56 Å²	56	54.5 Å²	54.5	29%	0.287	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-47	177.4	-78.6	177.4	0	0	0	111.5	F441 I442 A447 S448 L449	F441-I445 HydrophobicContact CD1-CD1 3.99Å; F441-I445 HydrophobicContact CD2-CD1 4.29Å; F441-I445 HydrophobicContact CE1-CD1 3.48Å; F441-I445 VanDerWaalsContact CE1-CD1 3.48Å; F441-I445 HydrophobicContact CE2-CD1 3.82Å; F441-I445 HydrophobicContact CE2-CG1 4.46Å; F441-I445 HydrophobicContact CG-CD1 4.37Å; F441-I445 HydrophobicContact CZ-CD1 3.4Å; F441-I445 VanDerWaalsContact CZ-CD1 3.4Å; F441-I445 HydrophobicContact CZ-CG1 4.48Å; F441-I445 WeakPolarHBondContact O-CB 3.23Å; F441-I445 WeakPolarHBondContact O-CG1 3.39Å; F441-I445 PolarHBondContact O-N 3.38Å; I442-I445 PolarHBondContact O-N 2.9Å; I445-A447 VanDerWaalsContact C-N 3.31Å; I445-A447 PolarHBondContact O-N 3Å; I445-S448 PolarHBondContact O-N 3.02Å; I445-S448 PolarHBondContact O-OG 3.21Å; I445-S448 VanDerWaalsContact O-OG 3.09Å; I445-L449 HydrophobicContact CG2-CD1 3.69Å; I445-L449 HydrophobicContact CG2-CG 4.26Å; I445-L449 WeakPolarHBondContact O-CB 3.5Å; I445-L449 VanDerWaalsContact O-CG 3.28Å; I445-L449 WeakPolarHBondContact O-CG 3.48Å; I445-L449 PolarHBondContact O-N 2.88Å
446	L	85.3	Confident	81.9	Confident	108 Å²	108	54.4 Å²	54.4	57%	0.565	28%	0.278	S	S	*	.	H	α-helix	trans	-60.3	-42.8	179.4	-71.6	169.5	0	0	0	111.3	I442 L443 F444 Y450	I442-L446 HydrophobicContact CG2-CD1 3.94Å; I442-L446 VanDerWaalsContact O-CG 3.3Å; I442-L446 WeakPolarHBondContact O-CG 3.24Å; I442-L446 PolarHBondContact O-N 3.41Å; L443-L446 PolarHBondContact O-N 3.48Å; F444-L446 PolarHBondContact O-N 2.87Å; L446-Y450 WeakPolarHBondContact O-CB 3.43Å; L446-Y450 PolarHBondContact O-N 3.18Å
447	A	83.7	Confident	81.5	Confident	11 Å²	11	56.6 Å²	56.6	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-41.9	176.4	0	0	0	0	0	113.3	L443 F444 I445 Y450 S451 S567 A571	L443-A447 WeakPolarHBondContact O-CB 3.23Å; L443-A447 PolarHBondContact O-N 2.91Å; L443-A447 VanDerWaalsContact O-N 3.07Å; F444-A447 PolarHBondContact O-N 2.87Å; I445-A447 VanDerWaalsContact C-N 3.31Å; I445-A447 PolarHBondContact O-N 3Å; A447-Y450 PolarHBondContact O-N 3.37Å; A447-S451 WeakPolarHBondContact O-CB 3.17Å; A447-S451 PolarHBondContact O-N 3.03Å; A447-S567 WeakPolarHBondContact CB-O 3.35Å; A447-A571 HydrophobicContact CB-CB 3.27Å
448	S	83.3	Confident	80.9	Confident	13 Å²	13	64.1 Å²	64.1	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-68.1	-37.5	178.2	67.4	0	0	0	0	112.1	F444 I445 S451 L452	F444-S448 WeakPolarHBondContact O-CB 3.37Å; F444-S448 PolarHBondContact O-N 3.2Å; F444-S448 PolarHBondContact O-OG 2.9Å; I445-S448 PolarHBondContact O-N 3.02Å; I445-S448 PolarHBondContact O-OG 3.21Å; I445-S448 VanDerWaalsContact O-OG 3.09Å; S448-S451 PolarHBondContact O-N 3.13Å; S448-L452 VanDerWaalsContact O-CB 3.26Å; S448-L452 WeakPolarHBondContact O-CB 3.33Å; S448-L452 PolarHBondContact O-N 2.85Å
449	L	83.6	Confident	80.1	Confident	101 Å²	101	65.3 Å²	65.3	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-41	173.5	-72.5	173	0	0	0	111.6	I445 L452 N453	I445-L449 HydrophobicContact CG2-CD1 3.69Å; I445-L449 HydrophobicContact CG2-CG 4.26Å; I445-L449 WeakPolarHBondContact O-CB 3.5Å; I445-L449 VanDerWaalsContact O-CG 3.28Å; I445-L449 WeakPolarHBondContact O-CG 3.48Å; I445-L449 PolarHBondContact O-N 2.88Å; L449-L452 PolarHBondContact O-N 3.05Å; L449-N453 VanDerWaalsContact O-CB 3.25Å; L449-N453 WeakPolarHBondContact O-CB 3.33Å; L449-N453 PolarHBondContact O-N 2.88Å
450	Y	83.5	Confident	79.4	Confident	132 Å²	132	69.6 Å²	69.6	52%	0.518	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-43.7	174.7	179.2	-102.2	0	0	0	111.8	L446 A447 N453 N454	L446-Y450 WeakPolarHBondContact O-CB 3.43Å; L446-Y450 PolarHBondContact O-N 3.18Å; A447-Y450 PolarHBondContact O-N 3.37Å; Y450-N453 PolarHBondContact O-N 3.23Å; Y450-N454 WeakPolarHBondContact CE1-ND2 3.41Å; Y450-N454 VanDerWaalsContact CZ-ND2 3.27Å; Y450-N454 WeakPolarHBondContact O-CB 3.35Å; Y450-N454 VanDerWaalsContact O-CG 3.29Å; Y450-N454 PolarHBondContact O-N 2.88Å; Y450-N454 PolarHBondContact O-OD1 2.81Å; Y450-N454 PolarHBondContact OH-ND2 2.97Å
451	S	81.5	Confident	78.7	Confident	7 Å²	7	76 Å²	76	5%	0.049	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-46.5	174.3	-164.3	0	0	0	0	112	A447 S448 N454 I455 T565 S567	A447-S451 WeakPolarHBondContact O-CB 3.17Å; A447-S451 PolarHBondContact O-N 3.03Å; S448-S451 PolarHBondContact O-N 3.13Å; S451-N454 PolarHBondContact O-N 3.43Å; S451-I455 VanDerWaalsContact O-CG1 3.31Å; S451-I455 WeakPolarHBondContact O-CG1 3.49Å; S451-I455 PolarHBondContact O-N 3.38Å; S451-T565 WeakPolarHBondContact OG-CG2 3.37Å; S451-T565 PolarHBondContact OG-OG1 3.36Å; S451-S567 WeakPolarHBondContact CB-OG 3.42Å
452	L	77.3	Confident	77.4	Confident	96 Å²	96	75.6 Å²	75.6	50%	0.503	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-42.8	177.6	-179.6	62	0	0	0	111.9	S448 L449 I455 I456	S448-L452 VanDerWaalsContact O-CB 3.26Å; S448-L452 WeakPolarHBondContact O-CB 3.33Å; S448-L452 PolarHBondContact O-N 2.85Å; L449-L452 PolarHBondContact O-N 3.05Å; L452-I455 PolarHBondContact O-N 3.16Å; L452-I456 HydrophobicContact CD1-CD1 4.19Å; L452-I456 HydrophobicContact CD1-CG1 4.48Å; L452-I456 HydrophobicContact CG-CD1 3.95Å; L452-I456 WeakPolarHBondContact O-CB 3.4Å; L452-I456 VanDerWaalsContact O-CG1 3.27Å; L452-I456 WeakPolarHBondContact O-CG1 3.39Å; L452-I456 PolarHBondContact O-N 3.41Å
453	N	79.9	Confident	76.4	Confident	69 Å²	69	80.2 Å²	80.2	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-43.1	174.6	174.2	55.5	0	0	0	111.6	L449 Y450 I456 Q457	L449-N453 VanDerWaalsContact O-CB 3.25Å; L449-N453 WeakPolarHBondContact O-CB 3.33Å; L449-N453 PolarHBondContact O-N 2.88Å; Y450-N453 PolarHBondContact O-N 3.23Å; N453-I456 PolarHBondContact O-N 2.9Å; N453-Q457 PolarHBondContact ND2-NE2 3.48Å; N453-Q457 VanDerWaalsContact ND2-NE2 3.11Å; N453-Q457 WeakPolarHBondContact O-CG 3.4Å; N453-Q457 PolarHBondContact O-N 3.5Å; N453-Q457 PolarHBondContact OD1-NE2 2.9Å
454	N	74.9	Confident	75.3	Confident	39 Å²	39	82.6 Å²	82.6	21%	0.209	39%	0.393	C	S	.	.	H	α-helix	trans	-61.3	-46	175	-72.7	5.5	0	0	0	111.3	Y450 S451 I456 Q457 Y458	Y450-N454 WeakPolarHBondContact CE1-ND2 3.41Å; Y450-N454 VanDerWaalsContact CZ-ND2 3.27Å; Y450-N454 WeakPolarHBondContact O-CB 3.35Å; Y450-N454 VanDerWaalsContact O-CG 3.29Å; Y450-N454 PolarHBondContact O-N 2.88Å; Y450-N454 PolarHBondContact O-OD1 2.81Å; Y450-N454 PolarHBondContact OH-ND2 2.97Å; S451-N454 PolarHBondContact O-N 3.43Å; N454-I456 VanDerWaalsContact C-N 3.34Å; N454-I456 PolarHBondContact O-N 3.23Å; N454-Q457 PolarHBondContact O-N 3.2Å; N454-Q457 VanDerWaalsContact O-N 3.13Å; N454-Y458 WeakPolarHBondContact O-CD2 3.29Å; N454-Y458 PolarHBondContact O-N 2.7Å
455	I	72.6	Confident	74	Confident	66 Å²	66	87 Å²	87	34%	0.338	42%	0.416	S	S	.	.	H	α-helix	trans	-58.9	-44.5	175.5	-69	163.3	0	0	0	110.9	S451 L452 Q457 Y458 I459	S451-I455 VanDerWaalsContact O-CG1 3.31Å; S451-I455 WeakPolarHBondContact O-CG1 3.49Å; S451-I455 PolarHBondContact O-N 3.38Å; L452-I455 PolarHBondContact O-N 3.16Å; I455-Q457 VanDerWaalsContact C-N 3.32Å; I455-Q457 PolarHBondContact O-N 3.24Å; I455-Y458 PolarHBondContact O-N 2.9Å; I455-I459 HydrophobicContact CG2-CD1 3.81Å; I455-I459 HydrophobicContact CG2-CG1 4.49Å; I455-I459 VanDerWaalsContact O-CG1 3.31Å; I455-I459 WeakPolarHBondContact O-CG1 3.17Å; I455-I459 PolarHBondContact O-N 3.14Å
456	I	73.8	Confident	72.7	Confident	72 Å²	72	88.2 Å²	88.2	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-62.4	-38.5	175.5	-69.9	165.1	0	0	0	111.4	L452 N453 N454 K460	L452-I456 HydrophobicContact CD1-CD1 4.19Å; L452-I456 HydrophobicContact CD1-CG1 4.48Å; L452-I456 HydrophobicContact CG-CD1 3.95Å; L452-I456 WeakPolarHBondContact O-CB 3.4Å; L452-I456 VanDerWaalsContact O-CG1 3.27Å; L452-I456 WeakPolarHBondContact O-CG1 3.39Å; L452-I456 PolarHBondContact O-N 3.41Å; N453-I456 PolarHBondContact O-N 2.9Å; N454-I456 VanDerWaalsContact C-N 3.34Å; N454-I456 PolarHBondContact O-N 3.23Å; I456-K460 HydrophobicContact CG2-CD 4.27Å; I456-K460 WeakPolarHBondContact O-CB 3.36Å; I456-K460 VanDerWaalsContact O-CG 3.3Å; I456-K460 WeakPolarHBondContact O-CG 3.4Å; I456-K460 PolarHBondContact O-N 3.43Å
457	Q	72	Confident	71.2	Confident	108 Å²	108	89 Å²	89	51%	0.505	42%	0.419	S	S	.	.	H	α-helix	trans	-68.9	-39.9	175.7	-72	-178.3	24.2	0	0	112.2	N453 N454 I455 K460 K461	N453-Q457 PolarHBondContact ND2-NE2 3.48Å; N453-Q457 VanDerWaalsContact ND2-NE2 3.11Å; N453-Q457 WeakPolarHBondContact O-CG 3.4Å; N453-Q457 PolarHBondContact O-N 3.5Å; N453-Q457 PolarHBondContact OD1-NE2 2.9Å; N454-Q457 PolarHBondContact O-N 3.2Å; N454-Q457 VanDerWaalsContact O-N 3.13Å; I455-Q457 VanDerWaalsContact C-N 3.32Å; I455-Q457 PolarHBondContact O-N 3.24Å; Q457-K460 PolarHBondContact O-N 2.92Å; Q457-K461 WeakPolarHBondContact O-CB 3.47Å; Q457-K461 PolarHBondContact O-N 3.08Å
458	Y	68.5	Low	69.7	Low	168 Å²	168	92.1 Å²	92.1	66%	0.659	43%	0.434	S	S	*	.	H	α-helix	trans	-62.8	-44.3	172.2	-81.8	-67.9	0	0	0	111.8	N454 I455 K460 K461 H462	N454-Y458 WeakPolarHBondContact O-CD2 3.29Å; N454-Y458 PolarHBondContact O-N 2.7Å; I455-Y458 PolarHBondContact O-N 2.9Å; Y458-K460 PolarHBondContact O-N 3.33Å; Y458-K461 PolarHBondContact O-N 3.1Å; Y458-H462 VanDerWaalsContact O-CB 3.31Å; Y458-H462 WeakPolarHBondContact O-CB 3.44Å; Y458-H462 PolarHBondContact O-N 3.45Å
459	I	68.9	Low	68.2	Low	95 Å²	95	96.3 Å²	96.3	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-42.7	175.4	-68.2	166.3	0	0	0	110.9	I455 H462 K463	I455-I459 HydrophobicContact CG2-CD1 3.81Å; I455-I459 HydrophobicContact CG2-CG1 4.49Å; I455-I459 VanDerWaalsContact O-CG1 3.31Å; I455-I459 WeakPolarHBondContact O-CG1 3.17Å; I455-I459 PolarHBondContact O-N 3.14Å; I459-H462 PolarHBondContact O-N 2.93Å; I459-K463 WeakPolarHBondContact O-CB 3.3Å; I459-K463 PolarHBondContact O-N 2.83Å
460	K	70.7	Confident	66.5	Low	147 Å²	147	97.5 Å²	97.5	64%	0.639	46%	0.458	S	S	*	.	H	α-helix	trans	-62	-45.9	174.3	-76.9	177.2	178.2	-174.6	0	112.1	I456 Q457 Y458 K463 L464	I456-K460 HydrophobicContact CG2-CD 4.27Å; I456-K460 WeakPolarHBondContact O-CB 3.36Å; I456-K460 VanDerWaalsContact O-CG 3.3Å; I456-K460 WeakPolarHBondContact O-CG 3.4Å; I456-K460 PolarHBondContact O-N 3.43Å; Q457-K460 PolarHBondContact O-N 2.92Å; Y458-K460 PolarHBondContact O-N 3.33Å; K460-K463 PolarHBondContact O-N 3.01Å; K460-L464 PolarHBondContact O-N 2.94Å
461	K	69.5	Low	64.6	Low	136 Å²	136	96.9 Å²	96.9	59%	0.591	46%	0.456	S	S	*	.	H	α-helix	trans	-64.4	-40.7	177.6	-173.3	177.7	179.6	-178.5	0	111.7	Q457 Y458 L464 L465	Q457-K461 WeakPolarHBondContact O-CB 3.47Å; Q457-K461 PolarHBondContact O-N 3.08Å; Y458-K461 PolarHBondContact O-N 3.1Å; K461-L464 WeakPolarHBondContact O-CB 3.42Å; K461-L464 PolarHBondContact O-N 3.18Å; K461-L465 HydrophobicContact CG-CD1 4.28Å; K461-L465 WeakPolarHBondContact O-CG 3.19Å; K461-L465 PolarHBondContact O-N 3.02Å
462	H	57.8	Low	62.6	Low	49 Å²	49	101.5 Å²	101.5	23%	0.227	48%	0.48	C	S	.	.	H	α-helix	trans	-71.5	-33.7	177.9	-161.6	-40.7	0	0	0	112	Y458 I459 L465 L466	Y458-H462 VanDerWaalsContact O-CB 3.31Å; Y458-H462 WeakPolarHBondContact O-CB 3.44Å; Y458-H462 PolarHBondContact O-N 3.45Å; I459-H462 PolarHBondContact O-N 2.93Å; H462-L465 PolarHBondContact O-N 2.92Å; H462-L466 WeakPolarHBondContact ND1-CD1 3.45Å; H462-L466 WeakPolarHBondContact O-CB 3.44Å; H462-L466 VanDerWaalsContact O-CG 3.32Å; H462-L466 WeakPolarHBondContact O-CG 3.38Å; H462-L466 PolarHBondContact O-N 3.45Å
463	K	64.2	Low	60.8	Low	158 Å²	158	101.5 Å²	101.5	69%	0.687	48%	0.48	S	S	*	.	H	α-helix	trans	-65	-40.7	169.4	-172.3	176.6	-179.5	-178.9	0	111.3	I459 K460 L466 Y467	I459-K463 WeakPolarHBondContact O-CB 3.3Å; I459-K463 PolarHBondContact O-N 2.83Å; K460-K463 PolarHBondContact O-N 3.01Å; K463-L466 PolarHBondContact O-N 3.25Å; K463-Y467 WeakPolarHBondContact O-CB 3.24Å; K463-Y467 PolarHBondContact O-N 2.82Å
464	L	59.6	Low	58.9	Low	103 Å²	103	102.3 Å²	102.3	54%	0.539	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-43.9	174.6	-166.6	79.8	0	0	0	111.6	K460 K461 Y467 N468	K460-L464 PolarHBondContact O-N 2.94Å; K461-L464 WeakPolarHBondContact O-CB 3.42Å; K461-L464 PolarHBondContact O-N 3.18Å; L464-Y467 PolarHBondContact O-N 3.32Å; L464-N468 WeakPolarHBondContact O-CB 3.41Å; L464-N468 PolarHBondContact O-N 3.15Å; L464-N468 PolarHBondContact O-OD1 2.81Å; L464-N468 VanDerWaalsContact O-OD1 3.11Å
465	L	58.6	Low	56.8	Low	92 Å²	92	106.1 Å²	106.1	48%	0.482	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-41.3	176.6	-73.7	167.7	0	0	0	112.4	K461 H462 N469	K461-L465 HydrophobicContact CG-CD1 4.28Å; K461-L465 WeakPolarHBondContact O-CG 3.19Å; K461-L465 PolarHBondContact O-N 3.02Å; H462-L465 PolarHBondContact O-N 2.92Å; L465-N469 WeakPolarHBondContact O-CB 3.3Å; L465-N469 PolarHBondContact O-N 3.36Å; L465-N469 PolarHBondContact O-OD1 3.41Å
466	L	58	Low	55.2	Low	83 Å²	83	109.1 Å²	109.1	44%	0.435	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-43.1	173.8	-74.6	167	0	0	0	111.6	H462 K463 Q470	H462-L466 WeakPolarHBondContact ND1-CD1 3.45Å; H462-L466 WeakPolarHBondContact O-CB 3.44Å; H462-L466 VanDerWaalsContact O-CG 3.32Å; H462-L466 WeakPolarHBondContact O-CG 3.38Å; H462-L466 PolarHBondContact O-N 3.45Å; K463-L466 PolarHBondContact O-N 3.25Å; L466-Q470 WeakPolarHBondContact O-CB 3.47Å; L466-Q470 PolarHBondContact O-N 3.45Å
467	Y	52.6	Low	53.3	Low	124 Å²	124	111.6 Å²	111.6	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-48.5	178	-163.4	-115.5	0	0	0	111.4	K463 L464 N469 Q470 Y471	K463-Y467 WeakPolarHBondContact O-CB 3.24Å; K463-Y467 PolarHBondContact O-N 2.82Å; L464-Y467 PolarHBondContact O-N 3.32Å; Y467-N469 PolarHBondContact O-N 2.74Å; Y467-Q470 WeakPolarHBondContact O-CB 3.3Å; Y467-Q470 PolarHBondContact O-N 3.42Å; Y467-Q470 VanDerWaalsContact O-N 3.1Å; Y467-Y471 HydrophobicContact CD1-CD2 4.35Å; Y467-Y471 HydrophobicContact CD1-CE2 4.19Å; Y467-Y471 HydrophobicContact CD2-CE2 4.29Å; Y467-Y471 HydrophobicContact CE1-CD2 4.28Å; Y467-Y471 AromaticContact CE1-CE2 3.71Å; Y467-Y471 HydrophobicContact CE1-CE2 3.71Å; Y467-Y471 AromaticContact CE2-CE2 3.81Å; Y467-Y471 HydrophobicContact CE2-CE2 3.81Å; Y467-Y471 HydrophobicContact CG-CE2 4.47Å; Y467-Y471 AromaticContact CZ-CE2 3.5Å; Y467-Y471 WeakPolarHBondContact O-CD2 3.29Å; Y467-Y471 PolarHBondContact O-N 2.73Å; Y467-Y471 VanDerWaalsContact O-N 3.08Å; Y467-Y471 PolarHBondContact OH-OH 2.84Å
468	N	52.9	Low	51.5	Low	77 Å²	77	113.3 Å²	113.3	41%	0.412	54%	0.544	S	S	.	.	H	α-helix	trans	-63.7	-40.9	177.9	-72.3	27.9	0	0	0	112.3	L464 Q470 Y471 N472	L464-N468 WeakPolarHBondContact O-CB 3.41Å; L464-N468 PolarHBondContact O-N 3.15Å; L464-N468 PolarHBondContact O-OD1 2.81Å; L464-N468 VanDerWaalsContact O-OD1 3.11Å; N468-Q470 VanDerWaalsContact C-N 3.26Å; N468-Q470 PolarHBondContact O-N 3.45Å; N468-Y471 PolarHBondContact O-N 3.4Å; N468-N472 PolarHBondContact O-N 3.46Å; N468-N472 PolarHBondContact O-OD1 3.15Å
469	N	52.7	Low	49.5	Very low	100 Å²	100	114 Å²	114	54%	0.535	55%	0.554	S	S	.	*	H	α-helix	trans	-62.8	-35.2	173.4	-79.9	19.3	0	0	0	111.7	L465 Y467 N472 L473	L465-N469 WeakPolarHBondContact O-CB 3.3Å; L465-N469 PolarHBondContact O-N 3.36Å; L465-N469 PolarHBondContact O-OD1 3.41Å; Y467-N469 PolarHBondContact O-N 2.74Å; N469-N472 PolarHBondContact O-N 3.44Å; N469-L473 WeakPolarHBondContact O-CB 3.36Å; N469-L473 PolarHBondContact O-N 2.9Å
470	Q	47.5	Very low	47.6	Very low	126 Å²	126	117.9 Å²	117.9	59%	0.589	57%	0.57	S	S	*	*	H	α-helix	trans	-67.9	-34.5	177.6	-165.7	171.7	10	0	0	112.4	L466 Y467 N468 I474	L466-Q470 WeakPolarHBondContact O-CB 3.47Å; L466-Q470 PolarHBondContact O-N 3.45Å; Y467-Q470 WeakPolarHBondContact O-CB 3.3Å; Y467-Q470 PolarHBondContact O-N 3.42Å; Y467-Q470 VanDerWaalsContact O-N 3.1Å; N468-Q470 VanDerWaalsContact C-N 3.26Å; N468-Q470 PolarHBondContact O-N 3.45Å; Q470-I474 WeakPolarHBondContact O-CD1 3.47Å; Q470-I474 VanDerWaalsContact O-CG1 3.32Å; Q470-I474 WeakPolarHBondContact O-CG1 3.46Å
471	Y	42.5	Very low	45.4	Very low	120 Å²	120	118.9 Å²	118.9	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-72.3	-46	171	-84.2	-90.6	0	0	0	112.4	Y467 N468 L473 I474 D475	Y467-Y471 HydrophobicContact CD1-CD2 4.35Å; Y467-Y471 HydrophobicContact CD1-CE2 4.19Å; Y467-Y471 HydrophobicContact CD2-CE2 4.29Å; Y467-Y471 HydrophobicContact CE1-CD2 4.28Å; Y467-Y471 AromaticContact CE1-CE2 3.71Å; Y467-Y471 HydrophobicContact CE1-CE2 3.71Å; Y467-Y471 AromaticContact CE2-CE2 3.81Å; Y467-Y471 HydrophobicContact CE2-CE2 3.81Å; Y467-Y471 HydrophobicContact CG-CE2 4.47Å; Y467-Y471 AromaticContact CZ-CE2 3.5Å; Y467-Y471 WeakPolarHBondContact O-CD2 3.29Å; Y467-Y471 PolarHBondContact O-N 2.73Å; Y467-Y471 VanDerWaalsContact O-N 3.08Å; Y467-Y471 PolarHBondContact OH-OH 2.84Å; N468-Y471 PolarHBondContact O-N 3.4Å; Y471-L473 PolarHBondContact O-N 3.1Å; Y471-L473 VanDerWaalsContact O-N 3.11Å; Y471-I474 WeakPolarHBondContact O-CB 3.29Å; Y471-I474 PolarHBondContact O-N 3.32Å; Y471-D475 PolarHBondContact O-N 2.94Å
472	N	40.6	Very low	43.3	Very low	103 Å²	103	117.9 Å²	117.9	55%	0.551	59%	0.588	S	S	*	*	H	α-helix	trans	-60.1	-24.3	177.2	-73.6	22	0	0	0	113.1	N468 N469 I476	N468-N472 PolarHBondContact O-N 3.46Å; N468-N472 PolarHBondContact O-OD1 3.15Å; N469-N472 PolarHBondContact O-N 3.44Å; N472-I476 VanDerWaalsContact O-CD1 3.29Å; N472-I476 WeakPolarHBondContact O-CD1 3.44Å; N472-I476 VanDerWaalsContact O-CG1 3.32Å; N472-I476 WeakPolarHBondContact O-CG1 3.42Å
473	L	39.3	Very low	41.5	Very low	97 Å²	97	126.5 Å²	126.5	51%	0.508	62%	0.619	S	S	.	*	H	α-helix	trans	-81.7	-19.9	174.2	-141.7	80.1	0	0	0	113.6	N469 Y471 N477	N469-L473 WeakPolarHBondContact O-CB 3.36Å; N469-L473 PolarHBondContact O-N 2.9Å; Y471-L473 PolarHBondContact O-N 3.1Å; Y471-L473 VanDerWaalsContact O-N 3.11Å; L473-N477 PolarHBondContact O-ND2 2.76Å
474	I	40.7	Very low	39.5	Very low	86 Å²	86	127.8 Å²	127.8	44%	0.441	63%	0.628	S	S	.	*	H	α-helix	trans	-80.9	-46.5	177.3	-70.3	164.3	0	0	0	109.8	Q470 Y471 I476 N477	Q470-I474 WeakPolarHBondContact O-CD1 3.47Å; Q470-I474 VanDerWaalsContact O-CG1 3.32Å; Q470-I474 WeakPolarHBondContact O-CG1 3.46Å; Y471-I474 WeakPolarHBondContact O-CB 3.29Å; Y471-I474 PolarHBondContact O-N 3.32Å; I474-I476 VanDerWaalsContact C-N 3.28Å; I474-I476 PolarHBondContact O-N 3.2Å; I474-N477 PolarHBondContact O-N 3.08Å
475	D	30.5	Very low	37.7	Very low	119 Å²	119	130.3 Å²	130.3	64%	0.636	64%	0.637	S	S	*	*	H	α-helix	trans	-66.9	-26.9	-175.8	-64.3	-23.6	0	0	0	113.1	Y471	Y471-D475 PolarHBondContact O-N 2.94Å
476	I	38.4	Very low	35.9	Very low	128 Å²	128	132.4 Å²	132.4	66%	0.656	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-26.8	177.5	-69.3	173.1	0	0	0	112.4	N472 I474 I478	N472-I476 VanDerWaalsContact O-CD1 3.29Å; N472-I476 WeakPolarHBondContact O-CD1 3.44Å; N472-I476 VanDerWaalsContact O-CG1 3.32Å; N472-I476 WeakPolarHBondContact O-CG1 3.42Å; I474-I476 VanDerWaalsContact C-N 3.28Å; I474-I476 PolarHBondContact O-N 3.2Å; I476-I478 PolarHBondContact O-N 3.18Å
477	N	33.3	Very low	34.3	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	9.3	-165.9	-78.1	-5.3	0	0	0	115.2	L473 I474	L473-N477 PolarHBondContact O-ND2 2.76Å; I474-N477 PolarHBondContact O-N 3.08Å
478	I	34.5	Very low	32.9	Very low	144 Å²	144	140.4 Å²	140.4	74%	0.738	68%	0.684	S	S	*	*	S	Bend	trans	-102.8	-25.1	-176.8	-67.2	-179.8	0	0	0	113.4	I476	I476-I478 PolarHBondContact O-N 3.18Å
479	E	27.8	Very low	32.2	Very low	183 Å²	183	142 Å²	142	86%	0.855	70%	0.699	S	S	*	*	S	Bend	trans	-93.8	-4.2	-163.9	-143.9	171.6	-146.2	0	0	116
480	Q	27.6	Very low	30.6	Very low	176 Å²	176	145 Å²	145	82%	0.822	71%	0.709	S	S	*	*			trans	-141.2	87.1	-178.6	-64.6	-170.3	5.7	0	0	114.2
481	L	25.9	Very low	29.5	Very low	169 Å²	169	147.5 Å²	147.5	89%	0.885	72%	0.721	S	S	*	*			trans	-150.5	74.3	162.8	-157.6	75.6	0	0	0	115.1
482	P	23.7	Very low	28.5	Very low	114 Å²	114	150.7 Å²	150.7	74%	0.74	74%	0.74	S	S	*	*			trans	-87.6	108.9	170.5	33.2	-30.7	0	0	0	112.9
483	W	20	Very low	27.9	Very low	230 Å²	230	150.9 Å²	150.9	87%	0.871	75%	0.747	S	S	*	*			trans	34.8	102.8	145.3	-62	93.9	0	0	0	121.3
484	Q	22.9	Very low	27.1	Very low	185 Å²	185	155.2 Å²	155.2	86%	0.864	77%	0.765	S	S	*	*			trans	-157.9	118.4	135.2	-104.2	161	20.4	0	0	106
485	Q	21.6	Very low	26.4	Very low	157 Å²	157	160.1 Å²	160.1	73%	0.734	79%	0.785	S	S	*	*				50.7	133.5	69.8	-73	-163.6	-72.7	0	0	114.5
486	E	20.9	Very low	26	Very low	136 Å²	136	163.1 Å²	163.1	64%	0.636	80%	0.796	S	S	*	*			cis	-167.4	121.6	-16.3	-176.7	171.5	163.1	0	0	108.9
487	Q	24.7	Very low	25.2	Very low	202 Å²	202	164.8 Å²	164.8	94%	0.944	80%	0.803	S	S	*	*			trans	-161.8	156.4	159.1	-121.9	154.5	86.7	0	0	112.8
488	Q	23.1	Very low	24.8	Very low	173 Å²	173	164.2 Å²	164.2	81%	0.808	80%	0.8	S	S	*	*			trans	-109.2	165.8	-155.1	-88.1	-162	13	0	0	115.3
489	P	37.4	Very low	24.3	Very low	111 Å²	111	165 Å²	165	72%	0.721	80%	0.802	S	S	*	*			trans	-103.5	169.8	-153.8	39.8	-36.9	0	0	0	114.7
490	Q	20.4	Very low	24.3	Very low	163 Å²	163	162.9 Å²	162.9	76%	0.762	80%	0.795	S	S	*	*			trans	-140.5	131.8	150.2	-83.4	-146.8	11.9	0	0	113.7
491	Q	23	Very low	24.2	Very low	177 Å²	177	157.2 Å²	157.2	83%	0.827	78%	0.775	S	S	*	*			trans	79.7	149.3	154.4	-61.3	176.6	48.8	0	0	120
492	Q	22.2	Very low	24.1	Very low	188 Å²	188	156 Å²	156	88%	0.879	77%	0.769	S	S	*	*			trans	-103.4	175.9	-169.4	-75.2	-179.1	-7.2	0	0	109.8
493	P	27.8	Very low	24.3	Very low	106 Å²	106	157.6 Å²	157.6	69%	0.688	77%	0.765	S	S	*	*			cis	-147.3	176.2	23.9	44.1	-23.8	0	0	0	119.9
494	Q	23.2	Very low	24.4	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	76%	0.763	S	S	*	*			trans	58.5	97.7	151.3	-78.1	177.6	-18.3	0	0	119.9	Q496	Q494-Q496 PolarHBondContact O-N 2.91Å
495	Q	24.3	Very low	24.7	Very low	188 Å²	188	149.1 Å²	149.1	88%	0.879	74%	0.739	S	S	*	*			trans	-64.8	114.9	163.4	-61.2	160	-32.9	0	0	112
496	Q	22.1	Very low	24.7	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	74%	0.738	S	S	*	*			trans	-163.3	139.5	145.9	-114.9	173.2	18.3	0	0	111.6	Q494	Q494-Q496 PolarHBondContact O-N 2.91Å
497	M	23	Very low	25	Very low	162 Å²	162	146.8 Å²	146.8	80%	0.798	73%	0.732	S	S	*	*			trans	81	24.4	177.6	-61.3	-64	-153.8	0	0	119.6	M499	M497-M499 PolarHBondContact O-N 3.03Å
498	D	23.6	Very low	25	Very low	113 Å²	113	144.3 Å²	144.3	60%	0.604	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	53.6	162.1	-82.9	-63.8	0	0	0	113.8	S501	D498-S501 WeakPolarHBondContact CB-OG 3.39Å; D498-S501 WeakPolarHBondContact OD1-CB 3.5Å; D498-S501 PolarHBondContact OD1-OG 3.46Å
499	M	24.4	Very low	25.1	Very low	159 Å²	159	142.8 Å²	142.8	78%	0.783	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	2.7	166.6	-81.9	-81.5	-92.5	0	0	112.1	M497	M497-M499 PolarHBondContact O-N 3.03Å
500	I	27.9	Very low	24.4	Very low	140 Å²	140	144.8 Å²	144.8	72%	0.718	72%	0.719	S	S	*	*	S	Bend	trans	-111.6	-31.3	-178.4	-63.8	168.4	0	0	0	111.3	F503	I500-F503 PolarHBondContact O-N 3.17Å
501	S	26.4	Very low	24.6	Very low	56 Å²	56	143.5 Å²	143.5	39%	0.392	72%	0.717	S	S	.	*	G	3₁₀ helix	trans	-64.5	-39.9	175.5	37.5	0	0	0	0	112.8	D498 F503 E504	D498-S501 WeakPolarHBondContact CB-OG 3.39Å; D498-S501 WeakPolarHBondContact OD1-CB 3.5Å; D498-S501 PolarHBondContact OD1-OG 3.46Å; S501-F503 PolarHBondContact O-N 3.44Å; S501-E504 PolarHBondContact O-N 2.99Å
502	N	23.8	Very low	24.7	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-67.3	12.5	174.2	-71.6	-13.5	0	0	0	114.8	E504	N502-E504 VanDerWaalsContact C-N 3.3Å
503	F	27.3	Very low	25.2	Very low	149 Å²	149	138.3 Å²	138.3	65%	0.654	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-93.4	31.9	162.9	-92.1	-82.5	0	0	0	113	I500 S501 T505	I500-F503 PolarHBondContact O-N 3.17Å; S501-F503 PolarHBondContact O-N 3.44Å; F503-T505 HydrophobicContact CD1-CG2 4.06Å; F503-T505 PolarHBondContact O-N 2.81Å; F503-T505 PolarHBondContact O-OG1 3.46Å
504	E	23	Very low	25.1	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	71%	0.706	S	S	*	*			trans	-60.5	68.5	151.8	-73.4	-154.2	128.8	0	0	110.7	S501 N502 T506	S501-E504 PolarHBondContact O-N 2.99Å; N502-E504 VanDerWaalsContact C-N 3.3Å; E504-T506 PolarHBondContact O-N 3.44Å
505	T	28.4	Very low	25.5	Very low	59 Å²	59	135.5 Å²	135.5	36%	0.362	70%	0.701	S	S	.	*			trans	-70.3	125.1	168.5	32.3	0	0	0	0	107.6	F503 Y507	F503-T505 HydrophobicContact CD1-CG2 4.06Å; F503-T505 PolarHBondContact O-N 2.81Å; F503-T505 PolarHBondContact O-OG1 3.46Å; T505-Y507 VanDerWaalsContact C-N 3.28Å; T505-Y507 WeakPolarHBondContact O-CD2 3.37Å; T505-Y507 PolarHBondContact O-N 3.06Å; T505-Y507 WeakPolarHBondContact OG1-CE2 3.24Å
506	T	22.4	Very low	25.5	Very low	117 Å²	117	131.2 Å²	131.2	72%	0.718	68%	0.684	S	S	*	*			trans	-65.1	79.3	-175.6	35.1	0	0	0	0	112.4	E504 I508	E504-T506 PolarHBondContact O-N 3.44Å; T506-I508 PolarHBondContact O-N 2.94Å; T506-I508 VanDerWaalsContact O-N 3.14Å
507	Y	26.7	Very low	26	Very low	127 Å²	127	128.4 Å²	128.4	50%	0.498	68%	0.675	S	S	.	*			trans	-74.5	98.1	168	-69.5	-74.6	0	0	0	109.2	T505 I509	T505-Y507 VanDerWaalsContact C-N 3.28Å; T505-Y507 WeakPolarHBondContact O-CD2 3.37Å; T505-Y507 PolarHBondContact O-N 3.06Å; T505-Y507 WeakPolarHBondContact OG1-CE2 3.24Å; Y507-I509 PolarHBondContact O-N 2.68Å
508	I	24.6	Very low	26.3	Very low	149 Å²	149	123.5 Å²	123.5	76%	0.764	66%	0.656	S	S	*	*			trans	-58.7	110.8	170.3	-63.3	174.1	0	0	0	108	T506 H510	T506-I508 PolarHBondContact O-N 2.94Å; T506-I508 VanDerWaalsContact O-N 3.14Å; I508-H510 PolarHBondContact O-N 3.02Å
509	I	24.3	Very low	26.4	Very low	142 Å²	142	125.7 Å²	125.7	73%	0.728	66%	0.657	S	S	*	*			trans	-73.7	77.9	179	-53.9	176.1	0	0	0	108.6	Y507 N511	Y507-I509 PolarHBondContact O-N 2.68Å; I509-N511 PolarHBondContact O-N 3.16Å
510	H	24.2	Very low	27	Very low	153 Å²	153	122.1 Å²	122.1	71%	0.708	64%	0.641	S	S	*	*			trans	-81.6	77	172.3	-138	-56.7	0	0	0	110.1	I508 N512	I508-H510 PolarHBondContact O-N 3.02Å; H510-N512 VanDerWaalsContact C-N 3.27Å; H510-N512 PolarHBondContact O-N 2.91Å
511	N	24.9	Very low	27.2	Very low	135 Å²	135	121.8 Å²	121.8	72%	0.722	63%	0.634	S	S	*	*			trans	-61.4	89.8	162.7	-82	-22.2	0	0	0	108.9	I509	I509-N511 PolarHBondContact O-N 3.16Å
512	N	24.3	Very low	27.4	Very low	135 Å²	135	127.7 Å²	127.7	72%	0.722	65%	0.649	S	S	*	*	S	Bend	trans	-163.7	155.6	153.6	-104.5	-26.3	0	0	0	113	H510 S514	H510-N512 VanDerWaalsContact C-N 3.27Å; H510-N512 PolarHBondContact O-N 2.91Å; N512-S514 PolarHBondContact O-N 3.4Å
513	S	32.5	Very low	27.7	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	63%	0.634	S	S	*	*	S	Bend	trans	-79	72.2	-168.6	54.9	0	0	0	0	114.2
514	S	26.3	Very low	28.2	Very low	84 Å²	84	121.5 Å²	121.5	59%	0.587	62%	0.618	S	S	*	*			trans	-158.1	89.2	162.1	61.3	0	0	0	0	112	N512 N516	N512-S514 PolarHBondContact O-N 3.4Å; S514-N516 VanDerWaalsContact C-N 3.3Å; S514-N516 PolarHBondContact O-N 3.33Å
515	I	30.5	Very low	29	Very low	152 Å²	152	115.4 Å²	115.4	78%	0.779	60%	0.595	S	S	*	*			trans	-74.8	89.5	166.1	-57.7	178.3	0	0	0	107.4	D517	I515-D517 PolarHBondContact O-N 3.06Å
516	N	25.9	Very low	29.4	Very low	98 Å²	98	116.7 Å²	116.7	52%	0.524	60%	0.599	S	S	.	*			trans	-68.7	121.8	170.3	-78.9	-32	0	0	0	109.3	S514 S518 Y519	S514-N516 VanDerWaalsContact C-N 3.3Å; S514-N516 PolarHBondContact O-N 3.33Å; N516-S518 WeakPolarHBondContact CB-OG 3.49Å; N516-S518 PolarHBondContact O-N 2.83Å; N516-Y519 PolarHBondContact O-N 3.49Å; N516-Y519 VanDerWaalsContact O-N 3.09Å
517	D	32.6	Very low	30.1	Very low	124 Å²	124	113.5 Å²	113.5	66%	0.663	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-12.2	178.5	-76.5	-49.1	0	0	0	114.4	I515 Y519	I515-D517 PolarHBondContact O-N 3.06Å; D517-Y519 VanDerWaalsContact C-N 3.27Å; D517-Y519 PolarHBondContact O-N 2.87Å
518	S	28.5	Very low	30.6	Very low	58 Å²	58	108.9 Å²	108.9	41%	0.406	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.4	-38.6	170.5	55.1	0	0	0	0	112.9	N516 K521 Y522	N516-S518 WeakPolarHBondContact CB-OG 3.49Å; N516-S518 PolarHBondContact O-N 2.83Å; S518-K521 PolarHBondContact O-N 3.16Å; S518-Y522 VanDerWaalsContact O-CD2 3.23Å; S518-Y522 WeakPolarHBondContact O-CD2 3.37Å
519	Y	26.5	Very low	31.3	Very low	159 Å²	159	104.5 Å²	104.5	62%	0.624	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-74.1	-28.1	-174	-79.6	-85.4	0	0	0	114	N516 D517 K521 Y522	N516-Y519 PolarHBondContact O-N 3.49Å; N516-Y519 VanDerWaalsContact O-N 3.09Å; D517-Y519 VanDerWaalsContact C-N 3.27Å; D517-Y519 PolarHBondContact O-N 2.87Å; Y519-K521 PolarHBondContact O-N 3.46Å; Y519-Y522 PolarHBondContact O-N 3.22Å; Y519-Y522 VanDerWaalsContact O-N 3.15Å
520	I	35.6	Very low	32	Very low	85 Å²	85	100.9 Å²	100.9	44%	0.436	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-63.1	-24.1	177.3	-65.7	163.8	0	0	0	111.2	Y522	I520-Y522 VanDerWaalsContact C-N 3.33Å; I520-Y522 PolarHBondContact O-N 3.17Å
521	K	32.6	Very low	32.6	Very low	132 Å²	132	99.7 Å²	99.7	57%	0.574	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-74.3	-11.8	177.6	-71.5	177.4	172.2	174.4	0	115	S518 Y519	S518-K521 PolarHBondContact O-N 3.16Å; Y519-K521 PolarHBondContact O-N 3.46Å
522	Y	31.5	Very low	33.3	Very low	181 Å²	181	99.9 Å²	99.9	71%	0.71	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-19.2	-168.6	-72.2	-76.8	0	0	0	116.6	S518 Y519 I520	S518-Y522 VanDerWaalsContact O-CD2 3.23Å; S518-Y522 WeakPolarHBondContact O-CD2 3.37Å; Y519-Y522 PolarHBondContact O-N 3.22Å; Y519-Y522 VanDerWaalsContact O-N 3.15Å; I520-Y522 VanDerWaalsContact C-N 3.33Å; I520-Y522 PolarHBondContact O-N 3.17Å
523	F	29.5	Very low	34.2	Very low	102 Å²	102	95.5 Å²	95.5	45%	0.447	47%	0.474	S	S	.	.	S	Bend	trans	-81.1	140.3	-177.5	-84	-89.4	0	0	0	113.2	S525 V528	F523-S525 PolarHBondContact O-N 2.98Å; F523-V528 HydrophobicContact CB-CG2 3.33Å; F523-V528 HydrophobicContact CG-CG2 4.34Å
524	N	36.8	Very low	34.5	Very low	60 Å²	60	97.7 Å²	97.7	32%	0.321	46%	0.464	S	S	.	.			trans	-60.2	134.9	175.7	-170	2.5	0	0	0	110.9	L526 I527 V528	N524-L526 VanDerWaalsContact C-N 3.32Å; N524-L526 PolarHBondContact O-N 3.21Å; N524-I527 HydrophobicContact CB-CD1 3.94Å; N524-I527 HydrophobicContact CB-CG1 4.11Å; N524-I527 WeakPolarHBondContact O-CA 3.37Å; N524-I527 WeakPolarHBondContact O-CB 3.27Å; N524-I527 PolarHBondContact O-N 2.89Å; N524-V528 PolarHBondContact O-N 3.28Å
525	S	39.8	Very low	35.3	Very low	49 Å²	49	97 Å²	97	34%	0.343	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-30.1	-158.7	59.1	0	0	0	0	114.8	F523 I527 Y529 Y558	F523-S525 PolarHBondContact O-N 2.98Å; S525-I527 VanDerWaalsContact C-N 3.34Å; S525-Y529 PolarHBondContact O-N 3.44Å; S525-Y558 WeakPolarHBondContact CA-OH 3.39Å; S525-Y558 WeakPolarHBondContact CB-OH 3.39Å; S525-Y558 WeakPolarHBondContact O-CE1 3.49Å; S525-Y558 PolarHBondContact O-OH 2.94Å
526	L	36.6	Very low	35.7	Very low	86 Å²	86	96.9 Å²	96.9	45%	0.45	45%	0.448	S	S	.	.	H	α-helix	trans	-72.3	-28.2	173.6	-163.6	70.2	0	0	0	112.5	N524 N530	N524-L526 VanDerWaalsContact C-N 3.32Å; N524-L526 PolarHBondContact O-N 3.21Å; L526-N530 WeakPolarHBondContact O-CB 3.36Å; L526-N530 PolarHBondContact O-N 3Å
527	I	37.3	Very low	36.5	Very low	51 Å²	51	94.8 Å²	94.8	26%	0.262	44%	0.436	S	S	.	.	H	α-helix	trans	-77	-39	-177.8	-55.5	-177.3	0	0	0	110.6	N524 S525 Y529 N530 Y531	N524-I527 HydrophobicContact CB-CD1 3.94Å; N524-I527 HydrophobicContact CB-CG1 4.11Å; N524-I527 WeakPolarHBondContact O-CA 3.37Å; N524-I527 WeakPolarHBondContact O-CB 3.27Å; N524-I527 PolarHBondContact O-N 2.89Å; S525-I527 VanDerWaalsContact C-N 3.34Å; I527-Y529 VanDerWaalsContact C-N 3.32Å; I527-Y529 PolarHBondContact O-N 2.86Å; I527-N530 PolarHBondContact O-N 3.18Å; I527-Y531 WeakPolarHBondContact O-CB 3.36Å; I527-Y531 PolarHBondContact O-N 2.92Å
528	V	38	Very low	37	Very low	30 Å²	30	92.9 Å²	92.9	18%	0.182	43%	0.429	C	S	.	.	H	α-helix	trans	-63.9	-40.5	173.3	-173.8	0	0	0	0	111	F523 N524 Y531 Y532	F523-V528 HydrophobicContact CB-CG2 3.33Å; F523-V528 HydrophobicContact CG-CG2 4.34Å; N524-V528 PolarHBondContact O-N 3.28Å; V528-Y531 PolarHBondContact O-N 3.41Å; V528-Y532 HydrophobicContact CG1-CD2 4.02Å; V528-Y532 HydrophobicContact CG1-CE2 4.41Å; V528-Y532 PolarHBondContact O-N 3.08Å
529	Y	40	Very low	37.7	Very low	57 Å²	57	95.6 Å²	95.6	22%	0.224	44%	0.439	C	S	.	.	H	α-helix	trans	-60.8	-47.1	173	-176.2	-93.2	0	0	0	111	S525 I527 Y531 Y533	S525-Y529 PolarHBondContact O-N 3.44Å; I527-Y529 VanDerWaalsContact C-N 3.32Å; I527-Y529 PolarHBondContact O-N 2.86Å; Y529-Y531 PolarHBondContact O-N 2.9Å; Y529-Y533 HydrophobicContact CE1-CD2 4.35Å; Y529-Y533 WeakPolarHBondContact O-CB 3.41Å; Y529-Y533 PolarHBondContact O-N 3.06Å
530	N	37.4	Very low	38.3	Very low	66 Å²	66	94.9 Å²	94.9	35%	0.353	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-39.6	175.5	-78.7	-2	0	0	0	113	Y299 L526 I527 Y533 Y534	Y299-N530 PolarHBondContact OH-OD1 3.06Å; L526-N530 WeakPolarHBondContact O-CB 3.36Å; L526-N530 PolarHBondContact O-N 3Å; I527-N530 PolarHBondContact O-N 3.18Å; N530-Y533 PolarHBondContact O-N 3.35Å; N530-Y534 VanDerWaalsContact O-CB 3.25Å; N530-Y534 WeakPolarHBondContact O-CB 3.18Å; N530-Y534 PolarHBondContact O-N 3.28Å
531	Y	37.5	Very low	38.6	Very low	127 Å²	127	96.9 Å²	96.9	50%	0.498	45%	0.453	S	S	.	.	H	α-helix	trans	-64.9	-54.6	178.3	-174.4	-94.7	0	0	0	111.3	I527 V528 Y529 Y533 Y534 T535	I527-Y531 WeakPolarHBondContact O-CB 3.36Å; I527-Y531 PolarHBondContact O-N 2.92Å; V528-Y531 PolarHBondContact O-N 3.41Å; Y529-Y531 PolarHBondContact O-N 2.9Å; Y531-Y533 PolarHBondContact O-N 3.2Å; Y531-Y534 PolarHBondContact O-N 3.42Å; Y531-Y534 VanDerWaalsContact O-N 3.15Å; Y531-T535 WeakPolarHBondContact O-CB 3.36Å; Y531-T535 PolarHBondContact O-N 2.87Å; Y531-T535 PolarHBondContact O-OG1 3.45Å; Y531-T535 VanDerWaalsContact O-OG1 3.07Å
532	Y	39.9	Very low	38.9	Very low	140 Å²	140	98.2 Å²	98.2	55%	0.549	47%	0.466	S	S	.	.	H	α-helix	trans	-61.2	-30.3	175.3	-95.1	-82.2	0	0	0	113	V528 Y536	V528-Y532 HydrophobicContact CG1-CD2 4.02Å; V528-Y532 HydrophobicContact CG1-CE2 4.41Å; V528-Y532 PolarHBondContact O-N 3.08Å; Y532-Y536 VanDerWaalsContact O-CB 3.27Å; Y532-Y536 WeakPolarHBondContact O-CB 3.17Å
533	Y	43.2	Very low	39.3	Very low	42 Å²	42	95 Å²	95	17%	0.165	46%	0.456	C	S	.	.	H	α-helix	trans	-71.5	-43.7	174.3	-175.9	-97.2	0	0	0	111.7	Y529 N530 Y531 I537	Y529-Y533 HydrophobicContact CE1-CD2 4.35Å; Y529-Y533 WeakPolarHBondContact O-CB 3.41Å; Y529-Y533 PolarHBondContact O-N 3.06Å; N530-Y533 PolarHBondContact O-N 3.35Å; Y531-Y533 PolarHBondContact O-N 3.2Å; Y533-I537 HydrophobicContact CD1-CD1 3.91Å; Y533-I537 HydrophobicContact CD2-CD1 3.67Å; Y533-I537 HydrophobicContact CE1-CD1 3.68Å; Y533-I537 HydrophobicContact CE2-CD1 3.43Å; Y533-I537 VanDerWaalsContact CE2-CD1 3.43Å; Y533-I537 HydrophobicContact CG-CD1 3.9Å; Y533-I537 VanDerWaalsContact CZ-CD1 3.43Å; Y533-I537 VanDerWaalsContact O-CB 3.26Å; Y533-I537 WeakPolarHBondContact O-CB 3.34Å; Y533-I537 WeakPolarHBondContact O-CD1 3.44Å; Y533-I537 WeakPolarHBondContact O-CG1 3.3Å; Y533-I537 PolarHBondContact O-N 2.93Å
534	Y	39.1	Very low	40	Very low	168 Å²	168	94 Å²	94	66%	0.659	45%	0.454	S	S	*	.	H	α-helix	trans	-72.6	-51.2	-176.9	-154.9	-88.3	0	0	0	111.6	N530 Y531 Y536 I537 T538	N530-Y534 VanDerWaalsContact O-CB 3.25Å; N530-Y534 WeakPolarHBondContact O-CB 3.18Å; N530-Y534 PolarHBondContact O-N 3.28Å; Y531-Y534 PolarHBondContact O-N 3.42Å; Y531-Y534 VanDerWaalsContact O-N 3.15Å; Y534-Y536 PolarHBondContact O-N 2.96Å; Y534-I537 PolarHBondContact O-N 2.88Å; Y534-I537 VanDerWaalsContact O-N 3.11Å; Y534-T538 HydrophobicContact CD1-CG2 3.8Å; Y534-T538 HydrophobicContact CE1-CG2 3.63Å; Y534-T538 PolarHBondContact O-N 3.34Å; Y534-T538 PolarHBondContact O-OG1 3.39Å
535	T	42	Very low	40.2	Very low	71 Å²	71	99.6 Å²	99.6	44%	0.436	48%	0.476	S	S	.	.	H	α-helix	trans	-62.3	-27	-178.5	-51.7	0	0	0	0	113.3	Y531	Y531-T535 WeakPolarHBondContact O-CB 3.36Å; Y531-T535 PolarHBondContact O-N 2.87Å; Y531-T535 PolarHBondContact O-OG1 3.45Å; Y531-T535 VanDerWaalsContact O-OG1 3.07Å
536	Y	39.3	Very low	40.3	Very low	148 Å²	148	100.4 Å²	100.4	58%	0.58	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.6	179.1	-134.1	-77.5	0	0	0	113.7	Y532 Y534	Y532-Y536 VanDerWaalsContact O-CB 3.27Å; Y532-Y536 WeakPolarHBondContact O-CB 3.17Å; Y534-Y536 PolarHBondContact O-N 2.96Å
537	I	43.2	Very low	40.8	Very low	54 Å²	54	98.4 Å²	98.4	28%	0.277	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-29.4	178.3	-72.8	174.9	0	0	0	112.1	Y533 Y534 N539	Y533-I537 HydrophobicContact CD1-CD1 3.91Å; Y533-I537 HydrophobicContact CD2-CD1 3.67Å; Y533-I537 HydrophobicContact CE1-CD1 3.68Å; Y533-I537 HydrophobicContact CE2-CD1 3.43Å; Y533-I537 VanDerWaalsContact CE2-CD1 3.43Å; Y533-I537 HydrophobicContact CG-CD1 3.9Å; Y533-I537 VanDerWaalsContact CZ-CD1 3.43Å; Y533-I537 VanDerWaalsContact O-CB 3.26Å; Y533-I537 WeakPolarHBondContact O-CB 3.34Å; Y533-I537 WeakPolarHBondContact O-CD1 3.44Å; Y533-I537 WeakPolarHBondContact O-CG1 3.3Å; Y533-I537 PolarHBondContact O-N 2.93Å; Y534-I537 PolarHBondContact O-N 2.88Å; Y534-I537 VanDerWaalsContact O-N 3.11Å; I537-N539 PolarHBondContact O-N 3.18Å
538	T	42.6	Very low	41.6	Very low	85 Å²	85	98.1 Å²	98.1	52%	0.521	46%	0.46	S	S	.	.	S	Bend	trans	-64.1	-23.3	175	48.1	0	0	0	0	113.2	Y534	Y534-T538 HydrophobicContact CD1-CG2 3.8Å; Y534-T538 HydrophobicContact CE1-CG2 3.63Å; Y534-T538 PolarHBondContact O-N 3.34Å; Y534-T538 PolarHBondContact O-OG1 3.39Å
539	N	43.5	Very low	42.2	Very low	114 Å²	114	97 Å²	97	61%	0.61	45%	0.453	S	S	*	.	S	Bend	trans	-108.5	114.4	175.5	-74	-32.7	0	0	0	112.3	I537	I537-N539 PolarHBondContact O-N 3.18Å
540	H	39.7	Very low	42.8	Very low	145 Å²	145	97.4 Å²	97.4	67%	0.671	46%	0.459	S	S	*	.			trans	70.5	89.6	169.7	-59.3	-73.6	0	0	0	119.8	N542 F543	H540-N542 PolarHBondContact O-N 3.03Å; H540-F543 HydrophobicContact CB-CD2 4.25Å; H540-F543 PolarHBondContact O-N 3.49Å
541	N	42.1	Very low	43.4	Very low	126 Å²	126	96.7 Å²	96.7	67%	0.674	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-23.4	170.8	-70.6	-34.5	0	0	0	116.5	I544	N541-I544 VanDerWaalsContact O-CD1 3.24Å; N541-I544 WeakPolarHBondContact O-CD1 3.43Å; N541-I544 WeakPolarHBondContact O-CG1 3.19Å
542	N	38.2	Very low	44.2	Very low	160 Å²	160	90.9 Å²	90.9	86%	0.856	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.8	-174.2	-76.6	-6.7	0	0	0	115	H540 I544	H540-N542 PolarHBondContact O-N 3.03Å; N542-I544 VanDerWaalsContact C-N 3.35Å
543	F	40.8	Very low	45	Very low	114 Å²	114	86 Å²	86	50%	0.5	42%	0.416	S	S	.	.	S	Bend	trans	-82.8	-9.4	-179.3	-98.7	-85.1	0	0	0	114.4	H540 K545 K546 H547	H540-F543 HydrophobicContact CB-CD2 4.25Å; H540-F543 PolarHBondContact O-N 3.49Å; F543-K545 PolarHBondContact O-N 3.32Å; F543-K546 PolarHBondContact O-N 3.46Å; F543-K546 VanDerWaalsContact O-N 3.1Å; F543-H547 AromaticContact CD1-CD2 3.7Å; F543-H547 AromaticContact CD1-NE2 3.45Å; F543-H547 WeakPolarHBondContact CD1-NE2 3.43Å; F543-H547 AromaticContact CE1-NE2 3.91Å
544	I	44.2	Very low	45.7	Very low	80 Å²	80	87.6 Å²	87.6	41%	0.41	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-48.3	-162.8	-63.1	173.8	0	0	0	113.3	N541 N542 K546 I548	N541-I544 VanDerWaalsContact O-CD1 3.24Å; N541-I544 WeakPolarHBondContact O-CD1 3.43Å; N541-I544 WeakPolarHBondContact O-CG1 3.19Å; N542-I544 VanDerWaalsContact C-N 3.35Å; I544-K546 PolarHBondContact O-N 2.97Å; I544-I548 VanDerWaalsContact O-CG1 3.27Å; I544-I548 WeakPolarHBondContact O-CG1 3.32Å
545	K	40.7	Very low	46.6	Very low	178 Å²	178	80.5 Å²	80.5	77%	0.774	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.4	-177.6	-83.4	-174.5	175.8	178	0	114.1	F543 I548	F543-K545 PolarHBondContact O-N 3.32Å; K545-I548 HydrophobicContact CG-CD1 4.39Å
546	K	42.2	Very low	47.5	Very low	66 Å²	66	77.8 Å²	77.8	29%	0.287	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-32	-176.2	-138.5	-168.3	-176.8	-165.6	0	111.9	I82 F543 I544	I82-K546 HydrophobicContact CD1-CD 3.73Å; I82-K546 VanDerWaalsContact CD1-CE 3.45Å; I82-K546 HydrophobicContact CD1-CG 4.03Å; I82-K546 HydrophobicContact CG2-CG 4.36Å; F543-K546 PolarHBondContact O-N 3.46Å; F543-K546 VanDerWaalsContact O-N 3.1Å; I544-K546 PolarHBondContact O-N 2.97Å
547	H	47.2	Very low	48.7	Very low	45 Å²	45	73.9 Å²	73.9	21%	0.208	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	7.6	-174.6	-64.7	-79.9	0	0	0	115.5	F543 S549 L550 L551	F543-H547 AromaticContact CD1-CD2 3.7Å; F543-H547 AromaticContact CD1-NE2 3.45Å; F543-H547 WeakPolarHBondContact CD1-NE2 3.43Å; F543-H547 AromaticContact CE1-NE2 3.91Å; H547-S549 VanDerWaalsContact C-N 3.28Å; H547-S549 PolarHBondContact O-N 3.38Å; H547-L550 PolarHBondContact O-N 2.99Å; H547-L551 WeakPolarHBondContact O-CB 3.32Å; H547-L551 PolarHBondContact O-N 3.26Å
548	I	53.2	Low	49.6	Very low	45 Å²	45	73.9 Å²	73.9	23%	0.231	37%	0.365	C	S	.	.	H	α-helix	trans	-56.4	-44.7	177.5	-58.3	-176.5	0	0	0	110.9	Y291 I544 K545 H552	Y291-I548 HydrophobicContact CD2-CG2 4.23Å; Y291-I548 HydrophobicContact CE2-CG2 4.1Å; I544-I548 VanDerWaalsContact O-CG1 3.27Å; I544-I548 WeakPolarHBondContact O-CG1 3.32Å; K545-I548 HydrophobicContact CG-CD1 4.39Å; I548-H552 WeakPolarHBondContact O-CB 3.34Å; I548-H552 PolarHBondContact O-N 2.83Å
549	S	51.2	Low	50.6	Low	5 Å²	5	70.5 Å²	70.5	4%	0.035	34%	0.343	C	S	.	.	H	α-helix	trans	-60.6	-53.6	177.4	-171.7	0	0	0	0	111.9	H547 L551 H552 N553	H547-S549 VanDerWaalsContact C-N 3.28Å; H547-S549 PolarHBondContact O-N 3.38Å; S549-L551 PolarHBondContact O-N 3.29Å; S549-H552 CarbonylContact O-C 3.29Å; S549-H552 WeakPolarHBondContact O-CA 3.48Å; S549-H552 WeakPolarHBondContact O-CB 3.31Å; S549-H552 PolarHBondContact O-N 3.37Å; S549-N553 WeakPolarHBondContact O-CB 3.26Å; S549-N553 PolarHBondContact O-N 3.44Å
550	L	51.3	Low	51.8	Low	67 Å²	67	65.7 Å²	65.7	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-61.1	-41.6	-178.5	-174.7	143.7	0	0	0	112.1	H547 N553 I554	H547-L550 PolarHBondContact O-N 2.99Å; L550-N553 WeakPolarHBondContact O-CB 3.48Å; L550-N553 PolarHBondContact O-N 3.48Å; L550-I554 HydrophobicContact CD2-CD1 3.69Å; L550-I554 WeakPolarHBondContact O-CG1 3.43Å; L550-I554 PolarHBondContact O-N 3.26Å
551	L	49.6	Very low	53	Low	51 Å²	51	62.4 Å²	62.4	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-69.6	-31.4	175.4	-176.4	57	0	0	0	112.4	K295 H547 S549 H555	K295-L551 HydrophobicContact CD-CD2 4.42Å; H547-L551 WeakPolarHBondContact O-CB 3.32Å; H547-L551 PolarHBondContact O-N 3.26Å; S549-L551 PolarHBondContact O-N 3.29Å; L551-H555 WeakPolarHBondContact O-CB 3.38Å; L551-H555 PolarHBondContact O-N 3.39Å
552	H	56.1	Low	54	Low	4 Å²	4	59.3 Å²	59.3	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-70.4	-38.5	171	-173.6	89.7	0	0	0	111.9	F89 Q287 Y291 I548 S549 H555 M556	F89-H552 AromaticContact CE2-CD2 3.44Å; F89-H552 VanDerWaalsContact CE2-CD2 3.44Å; F89-H552 WeakPolarHBondContact CE2-CD2 3.37Å; F89-H552 AromaticContact CE2-NE2 3.28Å; F89-H552 VanDerWaalsContact CE2-NE2 3.28Å; F89-H552 WeakPolarHBondContact CE2-NE2 3.43Å; F89-H552 AromaticContact CZ-CD2 3.73Å; F89-H552 AromaticContact CZ-NE2 3.44Å; F89-H552 WeakPolarHBondContact CZ-NE2 3.22Å; Q287-H552 PolarHBondContact OE1-CE1 2.97Å; Y291-H552 HydrophobicContact CD2-CB 4.45Å; I548-H552 WeakPolarHBondContact O-CB 3.34Å; I548-H552 PolarHBondContact O-N 2.83Å; S549-H552 CarbonylContact O-C 3.29Å; S549-H552 WeakPolarHBondContact O-CA 3.48Å; S549-H552 WeakPolarHBondContact O-CB 3.31Å; S549-H552 PolarHBondContact O-N 3.37Å; H552-H555 PolarHBondContact O-N 2.91Å; H552-M556 WeakPolarHBondContact NE2-CG 3.31Å; H552-M556 WeakPolarHBondContact O-CB 3.3Å; H552-M556 WeakPolarHBondContact O-CG 3.41Å; H552-M556 PolarHBondContact O-N 3.35Å
553	N	55.5	Low	55.7	Low	39 Å²	39	51.7 Å²	51.7	21%	0.209	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-44	175.1	-167.2	-15.3	0	0	0	110.9	E85 S549 L550 M556 K557	E85-N553 PolarHBondContact OE1-ND2 3.06Å; S549-N553 WeakPolarHBondContact O-CB 3.26Å; S549-N553 PolarHBondContact O-N 3.44Å; L550-N553 WeakPolarHBondContact O-CB 3.48Å; L550-N553 PolarHBondContact O-N 3.48Å; N553-M556 PolarHBondContact O-N 2.88Å; N553-K557 VanDerWaalsContact O-CG 3.29Å; N553-K557 WeakPolarHBondContact O-CG 3.33Å; N553-K557 PolarHBondContact O-N 3.15Å; N553-K557 WeakPolarHBondContact OD1-CE 3.33Å
554	I	58.1	Low	57.5	Low	74 Å²	74	46.9 Å²	46.9	38%	0.379	22%	0.219	S	C	.	.	H	α-helix	trans	-59.5	-49.4	170.9	-68.7	167.8	0	0	0	111.1	L550 M556 K557 Y558	L550-I554 HydrophobicContact CD2-CD1 3.69Å; L550-I554 WeakPolarHBondContact O-CG1 3.43Å; L550-I554 PolarHBondContact O-N 3.26Å; I554-M556 PolarHBondContact O-N 3.11Å; I554-K557 PolarHBondContact O-N 3.12Å; I554-Y558 WeakPolarHBondContact O-CB 3.33Å; I554-Y558 PolarHBondContact O-N 2.95Å
555	H	58.2	Low	59	Low	19 Å²	19	44.6 Å²	44.6	9%	0.088	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-41.5	178.5	169.2	-103.3	0	0	0	112.9	T306 L551 H552 Y558 Q559	T306-H555 WeakPolarHBondContact CG2-NE2 3.34Å; L551-H555 WeakPolarHBondContact O-CB 3.38Å; L551-H555 PolarHBondContact O-N 3.39Å; H552-H555 PolarHBondContact O-N 2.91Å; H555-Y558 WeakPolarHBondContact O-CB 3.4Å; H555-Y558 PolarHBondContact O-N 2.88Å; H555-Q559 PolarHBondContact CE1-NE2 2.96Å; H555-Q559 PolarHBondContact NE2-NE2 3.49Å; H555-Q559 WeakPolarHBondContact O-CG 3.3Å; H555-Q559 PolarHBondContact O-N 3.38Å
556	M	60.9	Low	60.8	Low	15 Å²	15	40.6 Å²	40.6	7%	0.074	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-49.2	174.6	-79.5	-73.6	-72.7	0	0	112.2	W283 Q287 H552 N553 I554 Y558 Q559 I560	W283-M556 HydrophobicContact CZ2-CE 3.87Å; W283-M556 HydrophobicContact CZ2-SD 3.76Å; Q287-M556 HydrophobicContact CG-SD 3.88Å; Q287-M556 PolarHBondContact NE2-SD 3.41Å; Q287-M556 VanDerWaalsContact NE2-SD 3.4Å; H552-M556 WeakPolarHBondContact NE2-CG 3.31Å; H552-M556 WeakPolarHBondContact O-CB 3.3Å; H552-M556 WeakPolarHBondContact O-CG 3.41Å; H552-M556 PolarHBondContact O-N 3.35Å; N553-M556 PolarHBondContact O-N 2.88Å; I554-M556 PolarHBondContact O-N 3.11Å; M556-Y558 PolarHBondContact O-N 2.88Å; M556-Q559 PolarHBondContact O-N 3.26Å; M556-I560 WeakPolarHBondContact O-CG1 3.43Å; M556-I560 PolarHBondContact O-N 2.95Å; M556-I560 VanDerWaalsContact O-N 3.07Å
557	K	63.4	Low	62.6	Low	65 Å²	65	38.6 Å²	38.6	28%	0.283	20%	0.198	S	C	.	.	H	α-helix	trans	-54.6	-40.3	172.8	-70.1	169.4	-177.5	-179	0	111.3	N553 I554 I560 Y561	N553-K557 VanDerWaalsContact O-CG 3.29Å; N553-K557 WeakPolarHBondContact O-CG 3.33Å; N553-K557 PolarHBondContact O-N 3.15Å; N553-K557 WeakPolarHBondContact OD1-CE 3.33Å; I554-K557 PolarHBondContact O-N 3.12Å; K557-I560 WeakPolarHBondContact O-CB 3.49Å; K557-I560 PolarHBondContact O-N 2.79Å; K557-Y561 WeakPolarHBondContact O-CB 3.43Å; K557-Y561 PolarHBondContact O-N 2.95Å
558	Y	62	Low	64.3	Low	54 Å²	54	36.8 Å²	36.8	21%	0.212	19%	0.19	C	C	.	.	H	α-helix	trans	-71	-40.8	-178.1	-161.7	-111.9	0	0	0	113.2	S525 I554 H555 M556 I560 Y561 M562	S525-Y558 WeakPolarHBondContact CA-OH 3.39Å; S525-Y558 WeakPolarHBondContact CB-OH 3.39Å; S525-Y558 WeakPolarHBondContact O-CE1 3.49Å; S525-Y558 PolarHBondContact O-OH 2.94Å; I554-Y558 WeakPolarHBondContact O-CB 3.33Å; I554-Y558 PolarHBondContact O-N 2.95Å; H555-Y558 WeakPolarHBondContact O-CB 3.4Å; H555-Y558 PolarHBondContact O-N 2.88Å; M556-Y558 PolarHBondContact O-N 2.88Å; Y558-I560 VanDerWaalsContact C-N 3.29Å; Y558-I560 PolarHBondContact O-N 3.15Å; Y558-Y561 PolarHBondContact O-N 3.27Å; Y558-M562 HydrophobicContact CD1-CG 4.32Å; Y558-M562 HydrophobicContact CE1-CE 4.27Å; Y558-M562 HydrophobicContact CE1-CG 4.21Å; Y558-M562 HydrophobicContact CE2-CE 3.94Å; Y558-M562 WeakPolarHBondContact O-CB 3.29Å; Y558-M562 WeakPolarHBondContact O-CG 3.42Å; Y558-M562 PolarHBondContact O-N 2.73Å
559	Q	64.4	Low	65.8	Low	14 Å²	14	35 Å²	35	7%	0.065	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-40.1	171.7	-73.3	-171.3	-12.6	0	0	111.8	W283 H555 M556 Y563	W283-Q559 VanDerWaalsContact CH2-OE1 3.24Å; H555-Q559 PolarHBondContact CE1-NE2 2.96Å; H555-Q559 PolarHBondContact NE2-NE2 3.49Å; H555-Q559 WeakPolarHBondContact O-CG 3.3Å; H555-Q559 PolarHBondContact O-N 3.38Å; M556-Q559 PolarHBondContact O-N 3.26Å; Q559-Y563 WeakPolarHBondContact O-CB 3.32Å; Q559-Y563 PolarHBondContact O-N 3.19Å
560	I	68	Low	67.4	Low	13 Å²	13	36.2 Å²	36.2	7%	0.067	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-55	175	-70.2	168.3	0	0	0	109.9	M556 K557 Y558 M562 Y563 Y564 Y905 L908	M556-I560 WeakPolarHBondContact O-CG1 3.43Å; M556-I560 PolarHBondContact O-N 2.95Å; M556-I560 VanDerWaalsContact O-N 3.07Å; K557-I560 WeakPolarHBondContact O-CB 3.49Å; K557-I560 PolarHBondContact O-N 2.79Å; Y558-I560 VanDerWaalsContact C-N 3.29Å; Y558-I560 PolarHBondContact O-N 3.15Å; I560-M562 VanDerWaalsContact C-N 3.34Å; I560-M562 PolarHBondContact O-N 2.88Å; I560-Y563 PolarHBondContact O-N 3.47Å; I560-Y564 HydrophobicContact CG2-CD2 3.69Å; I560-Y564 HydrophobicContact CG2-CE2 3.97Å; I560-Y564 WeakPolarHBondContact O-CD2 3.38Å; I560-Y564 PolarHBondContact O-N 2.87Å; I560-Y905 HydrophobicContact CG2-CD1 4.04Å; I560-L908 HydrophobicContact CG2-CD2 3.92Å
561	Y	65.4	Low	69	Low	77 Å²	77	33.6 Å²	33.6	30%	0.302	18%	0.176	S	C	.	.	H	α-helix	trans	-57	-41.8	179.8	178.8	-115.1	0	0	0	113.4	K557 Y558 Y563 Y905	K557-Y561 WeakPolarHBondContact O-CB 3.43Å; K557-Y561 PolarHBondContact O-N 2.95Å; Y558-Y561 PolarHBondContact O-N 3.27Å; Y561-Y563 VanDerWaalsContact C-N 3.26Å; Y561-Y563 PolarHBondContact O-N 3.14Å; Y561-Y905 AromaticContact CD2-CE1 3.93Å; Y561-Y905 HydrophobicContact CD2-CE1 3.93Å; Y561-Y905 AromaticContact CD2-CZ 3.82Å; Y561-Y905 WeakPolarHBondContact CD2-OH 3.49Å; Y561-Y905 HydrophobicContact CG-CE1 4.44Å
562	M	63.9	Low	70.7	Confident	60 Å²	60	31.2 Å²	31.2	30%	0.296	16%	0.164	S	C	.	.	H	α-helix	trans	-69.7	-20.6	177.3	-74.6	-71.8	155.3	0	0	113.7	Y558 I560	Y558-M562 HydrophobicContact CD1-CG 4.32Å; Y558-M562 HydrophobicContact CE1-CE 4.27Å; Y558-M562 HydrophobicContact CE1-CG 4.21Å; Y558-M562 HydrophobicContact CE2-CE 3.94Å; Y558-M562 WeakPolarHBondContact O-CB 3.29Å; Y558-M562 WeakPolarHBondContact O-CG 3.42Å; Y558-M562 PolarHBondContact O-N 2.73Å; I560-M562 VanDerWaalsContact C-N 3.34Å; I560-M562 PolarHBondContact O-N 2.88Å
563	Y	74.5	Confident	72.2	Confident	1 Å²	1	31.4 Å²	31.4	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-91.4	-44	177.2	177.5	-94.3	0	0	0	112.8	F310 L313 W314 D317 F444 Q559 I560 Y561 T565 I568	F310-Y563 HydrophobicContact CD2-CD2 4.43Å; F310-Y563 AromaticContact CE2-CD2 3.9Å; F310-Y563 HydrophobicContact CE2-CD2 3.9Å; F310-Y563 HydrophobicContact CE2-CG 4.37Å; F310-Y563 AromaticContact CZ-CD2 3.95Å; F310-Y563 HydrophobicContact CZ-CD2 3.95Å; L313-Y563 HydrophobicContact CD2-CD1 3.57Å; L313-Y563 HydrophobicContact CD2-CD2 4.14Å; L313-Y563 HydrophobicContact CD2-CE1 4.23Å; L313-Y563 HydrophobicContact CD2-CG 3.51Å; L313-Y563 HydrophobicContact CG-CD1 3.78Å; L313-Y563 HydrophobicContact CG-CD2 4.15Å; L313-Y563 HydrophobicContact CG-CE1 3.91Å; L313-Y563 HydrophobicContact CG-CE2 4.29Å; L313-Y563 HydrophobicContact CG-CG 3.9Å; W314-Y563 HydrophobicContact CB-CE2 3.87Å; W314-Y563 HydrophobicContact CG-CE2 4.44Å; D317-Y563 WeakPolarHBondContact OD2-CE1 3.43Å; D317-Y563 PolarHBondContact OD2-OH 3.03Å; F444-Y563 WeakPolarHBondContact CZ-OH 3.33Å; Q559-Y563 WeakPolarHBondContact O-CB 3.32Å; Q559-Y563 PolarHBondContact O-N 3.19Å; I560-Y563 PolarHBondContact O-N 3.47Å; Y561-Y563 VanDerWaalsContact C-N 3.26Å; Y561-Y563 PolarHBondContact O-N 3.14Å; Y563-T565 PolarHBondContact O-N 2.91Å; Y563-I568 HydrophobicContact CE1-CG2 4.3Å; Y563-I568 VanDerWaalsContact O-CD1 3.31Å; Y563-I568 WeakPolarHBondContact O-CD1 3.39Å
564	Y	77.1	Confident	73.7	Confident	12 Å²	12	33.5 Å²	33.5	5%	0.047	18%	0.175	C	C	.	.	S	Bend	trans	-80.2	64.3	-179.2	-71.1	-80.4	0	0	0	111.5	I560 I569 L572 R889 L893 L908	I560-Y564 HydrophobicContact CG2-CD2 3.69Å; I560-Y564 HydrophobicContact CG2-CE2 3.97Å; I560-Y564 WeakPolarHBondContact O-CD2 3.38Å; I560-Y564 PolarHBondContact O-N 2.87Å; Y564-I569 HydrophobicContact CD1-CG1 4.3Å; Y564-I569 WeakPolarHBondContact O-CD1 3.28Å; Y564-L572 HydrophobicContact CD1-CD1 3.93Å; Y564-L572 HydrophobicContact CE1-CD1 3.55Å; Y564-R889 PolarHBondContact OH-NH2 2.84Å; Y564-L893 HydrophobicContact CD1-CD2 3.66Å; Y564-L893 HydrophobicContact CE1-CD2 3.8Å; Y564-L908 HydrophobicContact CD1-CD2 4.27Å; Y564-L908 HydrophobicContact CD2-CD2 3.61Å; Y564-L908 HydrophobicContact CE1-CD2 4.28Å; Y564-L908 HydrophobicContact CE2-CD2 3.64Å; Y564-L908 HydrophobicContact CE2-CG 4.33Å; Y564-L908 HydrophobicContact CG-CD2 3.93Å
565	T	76.6	Confident	74.9	Confident	32 Å²	32	30 Å²	30	20%	0.196	16%	0.158	C	C	.	.			trans	-69.7	157.3	175.3	69.5	0	0	0	0	111.6	S451 Y563 S567 I568 I569	S451-T565 WeakPolarHBondContact OG-CG2 3.37Å; S451-T565 PolarHBondContact OG-OG1 3.36Å; Y563-T565 PolarHBondContact O-N 2.91Å; T565-S567 PolarHBondContact O-N 3.43Å; T565-S567 PolarHBondContact OG1-OG 3.04Å; T565-I568 PolarHBondContact O-N 3.27Å; T565-I568 PolarHBondContact OG1-N 3.3Å; T565-I569 WeakPolarHBondContact O-CG1 3.32Å; T565-I569 PolarHBondContact O-N 2.73Å
566	S	77.2	Confident	76.3	Confident	94 Å²	94	29.6 Å²	29.6	66%	0.657	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-10.1	-179.3	-43.6	0	0	0	0	115	P570	S566-P570 WeakPolarHBondContact O-CD 3.35Å; S566-P570 VanDerWaalsContact O-CG 3.29Å; S566-P570 WeakPolarHBondContact O-CG 3.25Å
567	S	81.2	Confident	77.6	Confident	24 Å²	24	30.2 Å²	30.2	17%	0.168	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-33.4	171.6	53.5	0	0	0	0	113.5	A447 S451 T565	A447-S567 WeakPolarHBondContact CB-O 3.35Å; S451-S567 WeakPolarHBondContact CB-OG 3.42Å; T565-S567 PolarHBondContact O-N 3.43Å; T565-S567 PolarHBondContact OG1-OG 3.04Å
568	I	83.1	Confident	78.8	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.036	16%	0.163	C	C	.	.	H	α-helix	trans	-72.5	-44.6	177	-72.3	169.3	0	0	0	110.5	F444 Y563 T565 A571 L572	F444-I568 HydrophobicContact CE2-CG2 4.49Å; Y563-I568 HydrophobicContact CE1-CG2 4.3Å; Y563-I568 VanDerWaalsContact O-CD1 3.31Å; Y563-I568 WeakPolarHBondContact O-CD1 3.39Å; T565-I568 PolarHBondContact O-N 3.27Å; T565-I568 PolarHBondContact OG1-N 3.3Å; I568-A571 PolarHBondContact O-N 3.15Å; I568-A571 VanDerWaalsContact O-N 3.12Å; I568-L572 HydrophobicContact CG2-CD1 3.82Å; I568-L572 HydrophobicContact CG2-CG 4.13Å; I568-L572 WeakPolarHBondContact O-CG 3.23Å; I568-L572 PolarHBondContact O-N 3.32Å
569	I	84.2	Confident	79.9	Confident	7 Å²	7	28.9 Å²	28.9	4%	0.036	16%	0.159	C	C	.	.	H	α-helix	trans	-50.6	-57	179.5	-65.9	165.4	0	0	0	113.2	Y564 T565 A571 L572 I573 L893 E896 W897	Y564-I569 HydrophobicContact CD1-CG1 4.3Å; Y564-I569 WeakPolarHBondContact O-CD1 3.28Å; T565-I569 WeakPolarHBondContact O-CG1 3.32Å; T565-I569 PolarHBondContact O-N 2.73Å; I569-A571 VanDerWaalsContact C-N 3.28Å; I569-A571 PolarHBondContact O-N 3.47Å; I569-L572 WeakPolarHBondContact O-CB 3.39Å; I569-L572 PolarHBondContact O-N 3.18Å; I569-I573 HydrophobicContact CG2-CD1 3.64Å; I569-I573 HydrophobicContact CG2-CG1 4.46Å; I569-I573 WeakPolarHBondContact O-CG1 3.5Å; I569-I573 PolarHBondContact O-N 3.46Å; I569-L893 HydrophobicContact CG1-CD2 4.11Å; I569-L893 HydrophobicContact CG2-CB 4.1Å; I569-L893 HydrophobicContact CG2-CD2 4.08Å; I569-L893 VanDerWaalsContact CG2-O 3.23Å; I569-L893 WeakPolarHBondContact CG2-O 3.25Å; I569-E896 HydrophobicContact CD1-CG 4.05Å; I569-W897 HydrophobicContact CG2-CB 3.79Å; I569-W897 HydrophobicContact CG2-CG 4.3Å
570	P	83.7	Confident	81	Confident	31 Å²	31	28.3 Å²	28.3	20%	0.201	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-29.4	180	25.3	-35	0	0	0	113.2	S566 I573 I574	S566-P570 WeakPolarHBondContact O-CD 3.35Å; S566-P570 VanDerWaalsContact O-CG 3.29Å; S566-P570 WeakPolarHBondContact O-CG 3.25Å; P570-I573 PolarHBondContact O-N 3.43Å; P570-I574 WeakPolarHBondContact O-CB 3.43Å; P570-I574 VanDerWaalsContact O-CG1 3.25Å; P570-I574 WeakPolarHBondContact O-CG1 3.44Å; P570-I574 PolarHBondContact O-N 2.91Å
571	A	85.6	Confident	82	Confident	12 Å²	12	29.2 Å²	29.2	10%	0.099	16%	0.162	C	C	.	.	H	α-helix	trans	-71.4	-33.4	175.8	0	0	0	0	0	112.6	A447 I568 I569 G575	A447-A571 HydrophobicContact CB-CB 3.27Å; I568-A571 PolarHBondContact O-N 3.15Å; I568-A571 VanDerWaalsContact O-N 3.12Å; I569-A571 VanDerWaalsContact C-N 3.28Å; I569-A571 PolarHBondContact O-N 3.47Å; A571-G575 VanDerWaalsContact O-CA 3.27Å; A571-G575 WeakPolarHBondContact O-CA 3.29Å; A571-G575 PolarHBondContact O-N 3.17Å
572	L	86.6	Confident	83	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-49.5	169.5	-65.6	173.8	0	0	0	110.9	D317 F444 Y564 I568 I569 I574 Q576 L893	D317-L572 HydrophobicContact CB-CD2 4.12Å; F444-L572 HydrophobicContact CD2-CD2 3.77Å; F444-L572 HydrophobicContact CE2-CD2 3.89Å; Y564-L572 HydrophobicContact CD1-CD1 3.93Å; Y564-L572 HydrophobicContact CE1-CD1 3.55Å; I568-L572 HydrophobicContact CG2-CD1 3.82Å; I568-L572 HydrophobicContact CG2-CG 4.13Å; I568-L572 WeakPolarHBondContact O-CG 3.23Å; I568-L572 PolarHBondContact O-N 3.32Å; I569-L572 WeakPolarHBondContact O-CB 3.39Å; I569-L572 PolarHBondContact O-N 3.18Å; L572-I574 PolarHBondContact O-N 2.9Å; L572-Q576 HydrophobicContact CD2-CG 4.21Å; L572-Q576 VanDerWaalsContact CD2-NE2 3.29Å; L572-Q576 WeakPolarHBondContact O-CA 3.48Å; L572-Q576 VanDerWaalsContact O-CB 3.27Å; L572-Q576 WeakPolarHBondContact O-CB 3.23Å; L572-Q576 PolarHBondContact O-N 3.3Å; L572-L893 HydrophobicContact CB-CD1 4.06Å; L572-L893 HydrophobicContact CD1-CD1 4.3Å
573	I	87	Confident	84	Confident	9 Å²	9	29.2 Å²	29.2	5%	0.046	17%	0.166	C	C	.	.	I	π-helix	trans	-57.7	-51.5	178.8	-64.1	159.2	0	0	0	111.1	I569 P570 F577 I578 L893 I894	I569-I573 HydrophobicContact CG2-CD1 3.64Å; I569-I573 HydrophobicContact CG2-CG1 4.46Å; I569-I573 WeakPolarHBondContact O-CG1 3.5Å; I569-I573 PolarHBondContact O-N 3.46Å; P570-I573 PolarHBondContact O-N 3.43Å; I573-F577 WeakPolarHBondContact O-CB 3.49Å; I573-F577 PolarHBondContact O-N 2.83Å; I573-I578 HydrophobicContact CG2-CD1 3.7Å; I573-I578 HydrophobicContact CG2-CG1 4.15Å; I573-I578 PolarHBondContact O-N 3.25Å; I573-L893 HydrophobicContact CD1-CB 4Å; I573-L893 HydrophobicContact CG1-CB 3.77Å; I573-I894 HydrophobicContact CD1-CB 4.48Å; I573-I894 HydrophobicContact CD1-CG1 3.68Å; I573-I894 HydrophobicContact CG1-CG1 4.07Å; I573-I894 HydrophobicContact CG2-CD1 4.03Å; I573-I894 HydrophobicContact CG2-CG1 3.89Å
574	I	87	Confident	84.5	Confident	82 Å²	82	29.3 Å²	29.3	42%	0.421	17%	0.166	S	C	.	.	I	π-helix	trans	-73	-46.1	-177	-62.6	167.5	0	0	0	110.9	L443 P570 L572 A579	L443-I574 HydrophobicContact CD1-CG2 4.02Å; P570-I574 WeakPolarHBondContact O-CB 3.43Å; P570-I574 VanDerWaalsContact O-CG1 3.25Å; P570-I574 WeakPolarHBondContact O-CG1 3.44Å; P570-I574 PolarHBondContact O-N 2.91Å; L572-I574 PolarHBondContact O-N 2.9Å; I574-A579 WeakPolarHBondContact O-CB 3.38Å; I574-A579 PolarHBondContact O-N 2.81Å
575	G	83.6	Confident	84.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.01	18%	0.179	C	C	.	.	I	π-helix	trans	-77.5	-47.1	-173	0	0	0	0	0	114.3	P440 A571 P580	P440-G575 VanDerWaalsContact CB-O 3.24Å; P440-G575 WeakPolarHBondContact CB-O 3.27Å; P440-G575 WeakPolarHBondContact CG-O 3.48Å; A571-G575 VanDerWaalsContact O-CA 3.27Å; A571-G575 WeakPolarHBondContact O-CA 3.29Å; A571-G575 PolarHBondContact O-N 3.17Å; G575-P580 WeakPolarHBondContact O-CD 3.48Å; G575-P580 WeakPolarHBondContact O-CG 3.44Å
576	Q	87.2	Confident	85.1	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.047	19%	0.189	C	C	.	.	I	π-helix	trans	-84.5	-26.4	-178.9	-63.6	-171.1	1.1	0	0	113.3	D317 T321 I324 L572	D317-Q576 PolarHBondContact OD1-NE2 2.88Å; T321-Q576 HydrophobicContact CG2-CG 3.77Å; I324-Q576 HydrophobicContact CD1-CB 3.67Å; I324-Q576 HydrophobicContact CD1-CG 3.92Å; L572-Q576 HydrophobicContact CD2-CG 4.21Å; L572-Q576 VanDerWaalsContact CD2-NE2 3.29Å; L572-Q576 WeakPolarHBondContact O-CA 3.48Å; L572-Q576 VanDerWaalsContact O-CB 3.27Å; L572-Q576 WeakPolarHBondContact O-CB 3.23Å; L572-Q576 PolarHBondContact O-N 3.3Å
577	F	88.8	Confident	85.3	Confident	29 Å²	29	29.2 Å²	29.2	13%	0.127	16%	0.16	C	C	.	.	I	π-helix	trans	-117.5	-66.1	-175.3	-171.9	-109.6	0	0	0	114.5	I573 P580 L581 F882 R886 S890	I573-F577 WeakPolarHBondContact O-CB 3.49Å; I573-F577 PolarHBondContact O-N 2.83Å; F577-P580 WeakPolarHBondContact O-CD 3.32Å; F577-L581 HydrophobicContact CE1-CD2 3.94Å; F577-L581 HydrophobicContact CZ-CD2 3.92Å; F577-L581 WeakPolarHBondContact O-CB 3.29Å; F577-L581 PolarHBondContact O-N 3.49Å; F577-F882 AromaticContact CD2-CE1 3.84Å; F577-F882 HydrophobicContact CD2-CE1 3.84Å; F577-F882 HydrophobicContact CD2-CZ 4.38Å; F577-F882 HydrophobicContact CE2-CE1 4.12Å; F577-R886 HydrophobicContact CD2-CB 4.29Å; F577-S890 WeakPolarHBondContact CB-OG 3.37Å; F577-S890 VanDerWaalsContact CG-OG 3.27Å; F577-S890 WeakPolarHBondContact CG-OG 3.33Å
578	I	88.2	Confident	85.2	Confident	73 Å²	73	28.9 Å²	28.9	37%	0.374	16%	0.156	S	C	.	.	I	π-helix	trans	-64.1	-50.7	-168.1	-60.3	176.9	0	0	0	112.2	I573 L581 M582	I573-I578 HydrophobicContact CG2-CD1 3.7Å; I573-I578 HydrophobicContact CG2-CG1 4.15Å; I573-I578 PolarHBondContact O-N 3.25Å; I578-L581 PolarHBondContact O-N 2.96Å; I578-M582 HydrophobicContact CG2-CG 4.24Å; I578-M582 WeakPolarHBondContact O-CB 3.49Å; I578-M582 VanDerWaalsContact O-CG 3.3Å; I578-M582 WeakPolarHBondContact O-CG 3.49Å; I578-M582 PolarHBondContact O-N 2.92Å
579	A	85.6	Confident	85	Confident	17 Å²	17	33.6 Å²	33.6	14%	0.14	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-45.8	-178.5	0	0	0	0	0	112.6	L439 I574 L581 M582 I583	L439-A579 HydrophobicContact CD2-CB 4.23Å; I574-A579 WeakPolarHBondContact O-CB 3.38Å; I574-A579 PolarHBondContact O-N 2.81Å; A579-L581 PolarHBondContact O-N 3.39Å; A579-M582 PolarHBondContact O-N 3.46Å; A579-I583 WeakPolarHBondContact O-CD1 3.44Å; A579-I583 VanDerWaalsContact O-CG1 3.24Å; A579-I583 WeakPolarHBondContact O-CG1 3.27Å; A579-I583 PolarHBondContact O-N 3.36Å
580	P	87.2	Confident	84.7	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.013	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-44.4	171.2	-26.8	35.8	0	0	0	113.4	I324 P440 G575 F577 I583 L584 F882	I324-P580 HydrophobicContact CG2-CB 3.82Å; I324-P580 HydrophobicContact CG2-CG 3.37Å; P440-P580 HydrophobicContact CG-CG 4.3Å; G575-P580 WeakPolarHBondContact O-CD 3.48Å; G575-P580 WeakPolarHBondContact O-CG 3.44Å; F577-P580 WeakPolarHBondContact O-CD 3.32Å; P580-I583 PolarHBondContact O-N 3.46Å; P580-L584 WeakPolarHBondContact O-CB 3.41Å; P580-L584 VanDerWaalsContact O-CG 3.29Å; P580-L584 WeakPolarHBondContact O-CG 3.43Å; P580-L584 PolarHBondContact O-N 3.45Å; P580-F882 HydrophobicContact CB-CE2 4.12Å; P580-F882 HydrophobicContact CB-CZ 3.73Å
581	L	88.1	Confident	84.2	Confident	32 Å²	32	36.6 Å²	36.6	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-50.1	177.4	-179.5	65.9	0	0	0	111.2	F577 I578 A579 I583 L584 I585 L879 F882 V883	F577-L581 HydrophobicContact CE1-CD2 3.94Å; F577-L581 HydrophobicContact CZ-CD2 3.92Å; F577-L581 WeakPolarHBondContact O-CB 3.29Å; F577-L581 PolarHBondContact O-N 3.49Å; I578-L581 PolarHBondContact O-N 2.96Å; A579-L581 PolarHBondContact O-N 3.39Å; L581-I583 VanDerWaalsContact C-N 3.31Å; L581-I583 PolarHBondContact O-N 3.01Å; L581-L584 PolarHBondContact O-N 2.95Å; L581-I585 HydrophobicContact CD1-CD1 4Å; L581-I585 HydrophobicContact CD1-CG1 4.39Å; L581-I585 HydrophobicContact CG-CD1 3.87Å; L581-I585 WeakPolarHBondContact O-CB 3.46Å; L581-I585 WeakPolarHBondContact O-CG1 3.44Å; L581-I585 PolarHBondContact O-N 2.77Å; L581-L879 HydrophobicContact CD1-CD1 3.75Å; L581-F882 HydrophobicContact CB-CE1 4.2Å; L581-F882 HydrophobicContact CD1-CD1 4.44Å; L581-V883 HydrophobicContact CD1-CG2 3.61Å
582	M	86	Confident	83.7	Confident	107 Å²	107	43.2 Å²	43.2	53%	0.527	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-36.5	179.1	-73.9	-62.6	-73.7	0	0	112.4	I578 A579 T586	I578-M582 HydrophobicContact CG2-CG 4.24Å; I578-M582 WeakPolarHBondContact O-CB 3.49Å; I578-M582 VanDerWaalsContact O-CG 3.3Å; I578-M582 WeakPolarHBondContact O-CG 3.49Å; I578-M582 PolarHBondContact O-N 2.92Å; A579-M582 PolarHBondContact O-N 3.46Å; M582-T586 WeakPolarHBondContact O-CB 3.47Å; M582-T586 PolarHBondContact O-N 2.83Å; M582-T586 PolarHBondContact O-OG1 2.74Å
583	I	85.1	Confident	83.1	Confident	30 Å²	30	49.3 Å²	49.3	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-74.4	-36.1	175.9	-61.2	164.5	0	0	0	111.1	L328 L436 A579 P580 L581 T587	L328-I583 HydrophobicContact CD1-CB 3.94Å; L328-I583 HydrophobicContact CD1-CG2 3.63Å; L328-I583 HydrophobicContact CD2-CD1 3.87Å; L328-I583 HydrophobicContact CD2-CG2 4.38Å; L328-I583 HydrophobicContact CG-CG2 4.29Å; L436-I583 HydrophobicContact CD2-CD1 3.95Å; A579-I583 WeakPolarHBondContact O-CD1 3.44Å; A579-I583 VanDerWaalsContact O-CG1 3.24Å; A579-I583 WeakPolarHBondContact O-CG1 3.27Å; A579-I583 PolarHBondContact O-N 3.36Å; P580-I583 PolarHBondContact O-N 3.46Å; L581-I583 VanDerWaalsContact C-N 3.31Å; L581-I583 PolarHBondContact O-N 3.01Å; I583-T587 HydrophobicContact CG2-CG2 4.3Å; I583-T587 VanDerWaalsContact O-CB 3.3Å; I583-T587 WeakPolarHBondContact O-CB 3.28Å; I583-T587 VanDerWaalsContact O-CG2 3.29Å; I583-T587 WeakPolarHBondContact O-CG2 3.18Å; I583-T587 PolarHBondContact O-N 3.29Å; I583-T587 PolarHBondContact O-OG1 3.22Å
584	L	84.6	Confident	82.3	Confident	4 Å²	4	51 Å²	51	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-39.9	173.2	-73.3	171.6	0	0	0	112.2	A331 P580 L581 T587 N588 L879 F882	A331-L584 HydrophobicContact CB-CD2 4.09Å; P580-L584 WeakPolarHBondContact O-CB 3.41Å; P580-L584 VanDerWaalsContact O-CG 3.29Å; P580-L584 WeakPolarHBondContact O-CG 3.43Å; P580-L584 PolarHBondContact O-N 3.45Å; L581-L584 PolarHBondContact O-N 2.95Å; L584-T587 WeakPolarHBondContact CA-OG1 3.33Å; L584-T587 PolarHBondContact O-OG1 3.19Å; L584-T587 VanDerWaalsContact O-OG1 3.13Å; L584-N588 WeakPolarHBondContact O-CB 3.44Å; L584-N588 PolarHBondContact O-N 3.18Å; L584-N588 PolarHBondContact O-ND2 2.9Å; L584-L879 HydrophobicContact CB-CD1 3.93Å; L584-F882 HydrophobicContact CD1-CB 4.35Å; L584-F882 HydrophobicContact CD1-CD1 4.2Å; L584-F882 HydrophobicContact CD1-CD2 4.05Å; L584-F882 HydrophobicContact CD1-CE2 4.47Å; L584-F882 HydrophobicContact CD1-CG 3.93Å
585	I	85	Confident	81.2	Confident	61 Å²	61	49.1 Å²	49.1	31%	0.313	25%	0.246	S	C	.	.	H	α-helix	trans	-66.2	-50.5	172.9	-68.5	170.2	0	0	0	110.1	L581 T587 N588 L589 L879	L581-I585 HydrophobicContact CD1-CD1 4Å; L581-I585 HydrophobicContact CD1-CG1 4.39Å; L581-I585 HydrophobicContact CG-CD1 3.87Å; L581-I585 WeakPolarHBondContact O-CB 3.46Å; L581-I585 WeakPolarHBondContact O-CG1 3.44Å; L581-I585 PolarHBondContact O-N 2.77Å; I585-T587 VanDerWaalsContact C-N 3.3Å; I585-T587 PolarHBondContact O-N 3.26Å; I585-N588 WeakPolarHBondContact O-CB 3.3Å; I585-N588 PolarHBondContact O-N 2.91Å; I585-N588 VanDerWaalsContact O-N 3.14Å; I585-L589 HydrophobicContact CG2-CD1 3.83Å; I585-L589 HydrophobicContact CG2-CG 4.32Å; I585-L589 WeakPolarHBondContact O-CG 3.38Å; I585-L589 PolarHBondContact O-N 2.86Å; I585-L879 HydrophobicContact CG1-CD1 4.03Å; I585-L879 HydrophobicContact CG1-CD2 4.22Å
586	T	83	Confident	80.3	Confident	67 Å²	67	51 Å²	51	41%	0.411	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-41	179.2	-61.2	0	0	0	0	111.7	M582 L589 L590	M582-T586 WeakPolarHBondContact O-CB 3.47Å; M582-T586 PolarHBondContact O-N 2.83Å; M582-T586 PolarHBondContact O-OG1 2.74Å; T586-L589 PolarHBondContact O-N 3.18Å; T586-L590 HydrophobicContact CG2-CD1 3.99Å; T586-L590 HydrophobicContact CG2-CG 4.39Å; T586-L590 WeakPolarHBondContact O-CB 3.28Å; T586-L590 VanDerWaalsContact O-CG 3.28Å; T586-L590 WeakPolarHBondContact O-CG 3.4Å; T586-L590 PolarHBondContact O-N 2.71Å
587	T	81.1	Confident	79.4	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-70.9	-34.3	177.3	50.7	0	0	0	0	113.3	L332 T335 I583 L584 I585 I591	L332-T587 HydrophobicContact CD2-CG2 4.06Å; T335-T587 HydrophobicContact CG2-CG2 3.88Å; I583-T587 HydrophobicContact CG2-CG2 4.3Å; I583-T587 VanDerWaalsContact O-CB 3.3Å; I583-T587 WeakPolarHBondContact O-CB 3.28Å; I583-T587 VanDerWaalsContact O-CG2 3.29Å; I583-T587 WeakPolarHBondContact O-CG2 3.18Å; I583-T587 PolarHBondContact O-N 3.29Å; I583-T587 PolarHBondContact O-OG1 3.22Å; L584-T587 WeakPolarHBondContact CA-OG1 3.33Å; L584-T587 PolarHBondContact O-OG1 3.19Å; L584-T587 VanDerWaalsContact O-OG1 3.13Å; I585-T587 VanDerWaalsContact C-N 3.3Å; I585-T587 PolarHBondContact O-N 3.26Å; T587-I591 WeakPolarHBondContact O-CB 3.11Å; T587-I591 WeakPolarHBondContact O-CG1 3.42Å; T587-I591 PolarHBondContact O-N 3.05Å; T587-I591 VanDerWaalsContact O-N 3.16Å
588	N	79	Confident	78.1	Confident	16 Å²	16	56.4 Å²	56.4	9%	0.086	29%	0.288	C	S	.	.	H	α-helix	trans	-61.3	-48.1	167.7	-89	-66.6	0	0	0	111.6	L584 I585 I591 Y592 L875	L584-N588 WeakPolarHBondContact O-CB 3.44Å; L584-N588 PolarHBondContact O-N 3.18Å; L584-N588 PolarHBondContact O-ND2 2.9Å; I585-N588 WeakPolarHBondContact O-CB 3.3Å; I585-N588 PolarHBondContact O-N 2.91Å; I585-N588 VanDerWaalsContact O-N 3.14Å; N588-I591 WeakPolarHBondContact O-CB 3.48Å; N588-I591 PolarHBondContact O-N 2.97Å; N588-Y592 PolarHBondContact O-N 3.18Å; N588-L875 WeakPolarHBondContact OD1-CD2 3.24Å; N588-L875 VanDerWaalsContact OD1-CG 3.3Å; N588-L875 WeakPolarHBondContact OD1-CG 3.35Å
589	L	78.6	Confident	76.6	Confident	107 Å²	107	54.8 Å²	54.8	56%	0.56	28%	0.28	S	S	*	.	H	α-helix	trans	-64.6	-43.6	-178.9	-70.3	173.2	0	0	0	112.5	I585 T586 I591 Y592 Q593	I585-L589 HydrophobicContact CG2-CD1 3.83Å; I585-L589 HydrophobicContact CG2-CG 4.32Å; I585-L589 WeakPolarHBondContact O-CG 3.38Å; I585-L589 PolarHBondContact O-N 2.86Å; T586-L589 PolarHBondContact O-N 3.18Å; L589-I591 VanDerWaalsContact C-N 3.28Å; L589-I591 PolarHBondContact O-N 2.79Å; L589-Y592 PolarHBondContact O-N 3.44Å; L589-Q593 WeakPolarHBondContact O-CB 3.38Å; L589-Q593 PolarHBondContact O-N 3.19Å
590	L	77.5	Confident	75.2	Confident	93 Å²	93	61.9 Å²	61.9	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-61.8	-35.9	174.3	-73.5	170.6	0	0	0	112.3	T586 K594	T586-L590 HydrophobicContact CG2-CD1 3.99Å; T586-L590 HydrophobicContact CG2-CG 4.39Å; T586-L590 WeakPolarHBondContact O-CB 3.28Å; T586-L590 VanDerWaalsContact O-CG 3.28Å; T586-L590 WeakPolarHBondContact O-CG 3.4Å; T586-L590 PolarHBondContact O-N 2.71Å; L590-K594 WeakPolarHBondContact O-CB 3.14Å; L590-K594 PolarHBondContact O-N 3.26Å
591	I	73.3	Confident	73.6	Confident	8 Å²	8	69.6 Å²	69.6	4%	0.041	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-46.9	172.8	-82.7	177.7	0	0	0	110.6	T335 T587 N588 L589 K594 V595 H868 L872 L875	T335-I591 HydrophobicContact CG2-CD1 3.51Å; T335-I591 HydrophobicContact CG2-CG1 4.24Å; T587-I591 WeakPolarHBondContact O-CB 3.11Å; T587-I591 WeakPolarHBondContact O-CG1 3.42Å; T587-I591 PolarHBondContact O-N 3.05Å; T587-I591 VanDerWaalsContact O-N 3.16Å; N588-I591 WeakPolarHBondContact O-CB 3.48Å; N588-I591 PolarHBondContact O-N 2.97Å; L589-I591 VanDerWaalsContact C-N 3.28Å; L589-I591 PolarHBondContact O-N 2.79Å; I591-K594 PolarHBondContact O-N 2.98Å; I591-V595 PolarHBondContact O-N 3.24Å; I591-H868 WeakPolarHBondContact CG2-CE1 3.21Å; I591-L872 HydrophobicContact CG2-CD1 4.34Å; I591-L875 HydrophobicContact CD1-CD2 3.72Å
592	Y	75.2	Confident	71.7	Confident	150 Å²	150	71.3 Å²	71.3	59%	0.588	34%	0.343	S	S	*	.	H	α-helix	trans	-64.7	-48	179.2	-177	-89.9	0	0	0	112.6	N588 L589 K594 V595 A596 L872	N588-Y592 PolarHBondContact O-N 3.18Å; L589-Y592 PolarHBondContact O-N 3.44Å; Y592-K594 PolarHBondContact O-N 2.84Å; Y592-V595 WeakPolarHBondContact O-CA 3.27Å; Y592-V595 WeakPolarHBondContact O-CB 3.26Å; Y592-V595 PolarHBondContact O-N 3.35Å; Y592-A596 PolarHBondContact O-N 3.09Å; Y592-L872 HydrophobicContact CD2-CD1 4.25Å
593	Q	74.3	Confident	70	Confident	129 Å²	129	73 Å²	73	60%	0.603	35%	0.348	S	S	*	.	H	α-helix	trans	-60.7	-31.2	178.1	-162.7	-167.9	48.1	0	0	111.8	L589 V595 S597	L589-Q593 WeakPolarHBondContact O-CB 3.38Å; L589-Q593 PolarHBondContact O-N 3.19Å; Q593-V595 VanDerWaalsContact C-N 3.34Å; Q593-S597 WeakPolarHBondContact O-CB 3.35Å; Q593-S597 PolarHBondContact O-N 3.03Å; Q593-S597 PolarHBondContact O-OG 3.08Å
594	K	69.3	Low	68.4	Low	46 Å²	46	74.7 Å²	74.7	20%	0.2	36%	0.362	C	S	.	.	H	α-helix	trans	-78.8	-11.3	174.2	-160.1	158.4	-169.1	164.1	0	114.1	H339 L590 I591 Y592 R598	H339-K594 VanDerWaalsContact CD2-CD 3.43Å; H339-K594 WeakPolarHBondContact CD2-CD 3.37Å; H339-K594 PolarHBondContact CD2-NZ 3.36Å; H339-K594 PolarHBondContact CE1-NZ 3.47Å; H339-K594 PolarHBondContact NE2-NZ 3.13Å; H339-K594 PolarHBondContact O-NZ 3.26Å; L590-K594 WeakPolarHBondContact O-CB 3.14Å; L590-K594 PolarHBondContact O-N 3.26Å; I591-K594 PolarHBondContact O-N 2.98Å; Y592-K594 PolarHBondContact O-N 2.84Å; K594-R598 VanDerWaalsContact O-CD 3.32Å; K594-R598 WeakPolarHBondContact O-CD 3.11Å; K594-R598 VanDerWaalsContact O-CG 3.25Å; K594-R598 WeakPolarHBondContact O-CG 3.41Å
595	V	65.4	Low	66.4	Low	42 Å²	42	82.1 Å²	82.1	26%	0.255	39%	0.39	S	S	.	.	H	α-helix	trans	-80	-58.1	162.3	178.8	0	0	0	0	109.4	I591 Y592 Q593 S597 R598 D599 H868	I591-V595 PolarHBondContact O-N 3.24Å; Y592-V595 WeakPolarHBondContact O-CA 3.27Å; Y592-V595 WeakPolarHBondContact O-CB 3.26Å; Y592-V595 PolarHBondContact O-N 3.35Å; Q593-V595 VanDerWaalsContact C-N 3.34Å; V595-S597 VanDerWaalsContact C-N 3.27Å; V595-S597 PolarHBondContact O-N 2.77Å; V595-R598 CarbonylContact O-C 3.59Å; V595-R598 WeakPolarHBondContact O-CA 3.23Å; V595-R598 WeakPolarHBondContact O-CB 3.19Å; V595-R598 PolarHBondContact O-N 3.37Å; V595-D599 WeakPolarHBondContact CG1-OD2 3.04Å; V595-D599 PolarHBondContact O-N 3.34Å; V595-H868 WeakPolarHBondContact CG2-CE1 3.41Å; V595-H868 VanDerWaalsContact CG2-ND1 3.35Å; V595-H868 WeakPolarHBondContact CG2-ND1 3.4Å
596	A	64.8	Low	64.6	Low	41 Å²	41	85.8 Å²	85.8	34%	0.339	41%	0.406	S	S	.	.	H	α-helix	trans	-55.1	-40.8	-176.6	0	0	0	0	0	112.8	Y592 K600	Y592-A596 PolarHBondContact O-N 3.09Å; A596-K600 WeakPolarHBondContact O-CB 3.35Å; A596-K600 WeakPolarHBondContact O-CG 3.34Å; A596-K600 PolarHBondContact O-N 3.42Å
597	S	67.3	Low	63.1	Low	47 Å²	47	86.4 Å²	86.4	33%	0.329	41%	0.413	S	S	.	.	H	α-helix	trans	-78.3	-12.2	176.5	61.6	0	0	0	0	115.2	Q593 V595	Q593-S597 WeakPolarHBondContact O-CB 3.35Å; Q593-S597 PolarHBondContact O-N 3.03Å; Q593-S597 PolarHBondContact O-OG 3.08Å; V595-S597 VanDerWaalsContact C-N 3.27Å; V595-S597 PolarHBondContact O-N 2.77Å
598	R	62	Low	61.6	Low	104 Å²	104	88.7 Å²	88.7	39%	0.392	43%	0.429	S	S	.	.	H	α-helix	trans	-82.8	-49.2	165.4	-82.5	176.9	171.4	136.3	-7.5	110.4	K594 V595 K600 R601 F602	K594-R598 VanDerWaalsContact O-CD 3.32Å; K594-R598 WeakPolarHBondContact O-CD 3.11Å; K594-R598 VanDerWaalsContact O-CG 3.25Å; K594-R598 WeakPolarHBondContact O-CG 3.41Å; V595-R598 CarbonylContact O-C 3.59Å; V595-R598 WeakPolarHBondContact O-CA 3.23Å; V595-R598 WeakPolarHBondContact O-CB 3.19Å; V595-R598 PolarHBondContact O-N 3.37Å; R598-K600 PolarHBondContact O-N 3.42Å; R598-R601 WeakPolarHBondContact O-CA 3.34Å; R598-R601 WeakPolarHBondContact O-CB 3.25Å; R598-R601 PolarHBondContact O-N 3.07Å; R598-F602 WeakPolarHBondContact O-CD2 3.39Å; R598-F602 PolarHBondContact O-N 3.43Å
599	D	55.8	Low	60	Low	39 Å²	39	94.2 Å²	94.2	21%	0.209	46%	0.459	C	S	.	.	H	α-helix	trans	-62	-42.8	-180	-69.7	-46.5	0	0	0	111.5	V595 R601 F602 F603 R865	V595-D599 WeakPolarHBondContact CG1-OD2 3.04Å; V595-D599 PolarHBondContact O-N 3.34Å; D599-R601 PolarHBondContact O-N 3.47Å; D599-F602 PolarHBondContact O-N 3.16Å; D599-F603 VanDerWaalsContact O-CD2 3.23Å; D599-F603 WeakPolarHBondContact O-CD2 3.5Å; D599-F603 PolarHBondContact O-N 3.39Å; D599-R865 IonicContact OD1-CZ 3.69Å; D599-R865 IonicContact OD1-NE 3.65Å; D599-R865 IonicContact OD1-NH2 3.23Å; D599-R865 PolarHBondContact OD1-NH2 3.34Å
600	K	56.8	Low	58.4	Low	166 Å²	166	94.9 Å²	94.9	72%	0.722	47%	0.468	S	S	*	.	H	α-helix	trans	-55.1	-35.7	171.2	-78.6	-170.4	175.2	-168.4	0	113.5	A596 R598 F602 S604	A596-K600 WeakPolarHBondContact O-CB 3.35Å; A596-K600 WeakPolarHBondContact O-CG 3.34Å; A596-K600 PolarHBondContact O-N 3.42Å; R598-K600 PolarHBondContact O-N 3.42Å; K600-F602 VanDerWaalsContact C-N 3.31Å; K600-F602 PolarHBondContact O-N 3.35Å; K600-S604 WeakPolarHBondContact O-CB 3.48Å; K600-S604 PolarHBondContact O-N 2.78Å; K600-S604 PolarHBondContact O-OG 3.37Å
601	R	53.2	Low	56.6	Low	164 Å²	164	94.7 Å²	94.7	62%	0.619	47%	0.474	S	S	*	.	H	α-helix	trans	-73	-18.3	177	-96.6	-173.7	170.3	-162.1	-4	114.2	R598 D599 S604 R605	R598-R601 WeakPolarHBondContact O-CA 3.34Å; R598-R601 WeakPolarHBondContact O-CB 3.25Å; R598-R601 PolarHBondContact O-N 3.07Å; D599-R601 PolarHBondContact O-N 3.47Å; R601-S604 PolarHBondContact O-OG 3.03Å; R601-R605 WeakPolarHBondContact O-CG 3.46Å
602	F	48.8	Very low	54.7	Low	68 Å²	68	103.2 Å²	103.2	30%	0.298	51%	0.51	S	S	.	.	H	α-helix	trans	-86.1	-44.7	174.4	-73.5	-66.2	0	0	0	111.2	R598 D599 K600 S604 R605 Q606 I861	R598-F602 WeakPolarHBondContact O-CD2 3.39Å; R598-F602 PolarHBondContact O-N 3.43Å; D599-F602 PolarHBondContact O-N 3.16Å; K600-F602 VanDerWaalsContact C-N 3.31Å; K600-F602 PolarHBondContact O-N 3.35Å; F602-S604 VanDerWaalsContact C-N 3.33Å; F602-S604 PolarHBondContact O-N 3.2Å; F602-R605 WeakPolarHBondContact O-CA 3.43Å; F602-R605 WeakPolarHBondContact O-CB 3.25Å; F602-R605 PolarHBondContact O-N 3.37Å; F602-Q606 PolarHBondContact O-N 3.36Å; F602-I861 HydrophobicContact CD1-CD1 4.28Å; F602-I861 HydrophobicContact CE1-CD1 3.41Å; F602-I861 VanDerWaalsContact CE1-CD1 3.41Å; F602-I861 HydrophobicContact CE1-CG1 4.38Å; F602-I861 HydrophobicContact CE2-CD1 4.38Å; F602-I861 HydrophobicContact CE2-CG2 4.4Å; F602-I861 HydrophobicContact CZ-CD1 3.48Å; F602-I861 VanDerWaalsContact CZ-CD1 3.48Å; F602-I861 HydrophobicContact CZ-CG1 3.94Å; F602-I861 HydrophobicContact CZ-CG2 4.48Å
603	F	48.9	Very low	52.9	Low	143 Å²	143	101 Å²	101	63%	0.627	52%	0.517	S	S	*	.	H	α-helix	trans	-57.2	-45.9	173.4	-68.7	-66.1	0	0	0	111.7	D599 R605 Q606 S607	D599-F603 VanDerWaalsContact O-CD2 3.23Å; D599-F603 WeakPolarHBondContact O-CD2 3.5Å; D599-F603 PolarHBondContact O-N 3.39Å; F603-R605 PolarHBondContact O-N 2.69Å; F603-R605 VanDerWaalsContact O-N 3.08Å; F603-Q606 PolarHBondContact O-N 2.89Å; F603-S607 PolarHBondContact O-N 3.27Å; F603-S607 VanDerWaalsContact O-N 3.09Å; F603-S607 PolarHBondContact O-OG 3.08Å
604	S	51.6	Low	51	Low	66 Å²	66	99.6 Å²	99.6	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-66.7	-7.7	176.1	74.5	0	0	0	0	115.1	K600 R601 F602	K600-S604 WeakPolarHBondContact O-CB 3.48Å; K600-S604 PolarHBondContact O-N 2.78Å; K600-S604 PolarHBondContact O-OG 3.37Å; R601-S604 PolarHBondContact O-OG 3.03Å; F602-S604 VanDerWaalsContact C-N 3.33Å; F602-S604 PolarHBondContact O-N 3.2Å
605	R	43.4	Very low	49.2	Very low	159 Å²	159	107.2 Å²	107.2	60%	0.6	56%	0.555	S	S	*	*	H	α-helix	trans	-102.9	-24.2	175.5	-88.3	-175.9	160	-148.6	-7.9	112.9	R601 F602 F603 S608 N609	R601-R605 WeakPolarHBondContact O-CG 3.46Å; F602-R605 WeakPolarHBondContact O-CA 3.43Å; F602-R605 WeakPolarHBondContact O-CB 3.25Å; F602-R605 PolarHBondContact O-N 3.37Å; F603-R605 PolarHBondContact O-N 2.69Å; F603-R605 VanDerWaalsContact O-N 3.08Å; R605-S608 WeakPolarHBondContact CA-OG 3.32Å; R605-S608 PolarHBondContact O-OG 3.27Å; R605-S608 VanDerWaalsContact O-OG 3.12Å; R605-N609 PolarHBondContact O-OD1 3.11Å
606	Q	47.5	Very low	47.4	Very low	139 Å²	139	112.4 Å²	112.4	65%	0.65	58%	0.58	S	S	*	*	H	α-helix	trans	-75.8	-41	169.5	-69.2	-177.9	-77.3	0	0	110.2	F602 F603 S608	F602-Q606 PolarHBondContact O-N 3.36Å; F603-Q606 PolarHBondContact O-N 2.89Å; Q606-S608 VanDerWaalsContact C-N 3.29Å; Q606-S608 PolarHBondContact O-N 2.95Å
607	S	50.4	Low	45.7	Very low	80 Å²	80	116.3 Å²	116.3	56%	0.559	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-17.4	178.5	68.1	0	0	0	0	114.9	F603	F603-S607 PolarHBondContact O-N 3.27Å; F603-S607 VanDerWaalsContact O-N 3.09Å; F603-S607 PolarHBondContact O-OG 3.08Å
608	S	50	Low	43.7	Very low	56 Å²	56	117.6 Å²	117.6	39%	0.392	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-14.5	-178.5	59.6	0	0	0	0	114.4	R605 Q606	R605-S608 WeakPolarHBondContact CA-OG 3.32Å; R605-S608 PolarHBondContact O-OG 3.27Å; R605-S608 VanDerWaalsContact O-OG 3.12Å; Q606-S608 VanDerWaalsContact C-N 3.29Å; Q606-S608 PolarHBondContact O-N 2.95Å
609	N	45.5	Very low	42.1	Very low	132 Å²	132	118.7 Å²	118.7	71%	0.706	64%	0.644	S	S	*	*	S	Bend	trans	-101.2	-2.2	-168.3	-72.8	22.8	0	0	0	113.6	R605	R605-N609 PolarHBondContact O-OD1 3.11Å
610	T	45.6	Very low	40.9	Very low	121 Å²	121	122 Å²	122	74%	0.742	67%	0.67	S	S	*	*	S	Bend	trans	-94.4	-6.9	-180	51.9	0	0	0	0	114
611	S	39.6	Very low	39.4	Very low	88 Å²	88	122.1 Å²	122.1	62%	0.615	68%	0.676	S	S	*	*	S	Bend	trans	-130.5	17.2	-165.5	53.3	0	0	0	0	115.3
612	K	32.9	Very low	38.1	Very low	187 Å²	187	119.3 Å²	119.3	81%	0.813	68%	0.682	S	S	*	*			trans	-138.4	60	176.2	-71.8	-159.5	172.1	-164.9	0	114.4
613	S	38	Very low	37	Very low	103 Å²	103	121.4 Å²	121.4	72%	0.72	71%	0.705	S	S	*	*			trans	-95.9	72	159.1	54.8	0	0	0	0	109.9	F615	S613-F615 PolarHBondContact O-N 3.49Å
614	S	33.7	Very low	36.1	Very low	100 Å²	100	121.5 Å²	121.5	70%	0.699	72%	0.717	S	S	*	*			trans	-75.2	114	178.1	51.7	0	0	0	0	110.9	I616	S614-I616 PolarHBondContact O-N 2.89Å; S614-I616 VanDerWaalsContact O-N 3.17Å
615	F	31.3	Very low	35.1	Very low	206 Å²	206	125.4 Å²	125.4	90%	0.904	73%	0.733	S	S	*	*			trans	-62.2	107.5	179.5	-69.7	-106.6	0	0	0	111.8	S613	S613-F615 PolarHBondContact O-N 3.49Å
616	I	27.9	Very low	34.3	Very low	151 Å²	151	122.9 Å²	122.9	77%	0.774	74%	0.74	S	S	*	*			trans	-143.6	97.5	165.8	-54.7	179.9	0	0	0	108.6	S614	S614-I616 PolarHBondContact O-N 2.89Å; S614-I616 VanDerWaalsContact O-N 3.17Å
617	S	28.8	Very low	33.5	Very low	124 Å²	124	122.4 Å²	122.4	87%	0.867	75%	0.748	S	S	*	*			trans	169.1	84.1	153.3	-77.9	0	0	0	0	108.3
618	G	26.9	Very low	32.6	Very low	74 Å²	74	125 Å²	125	76%	0.763	76%	0.762	S	S	*	*			trans	-137.4	48.9	-173.7	0	0	0	0	0	111.9
619	T	27.5	Very low	31.5	Very low	127 Å²	127	132.5 Å²	132.5	78%	0.779	79%	0.787	S	S	*	*			trans	-126.3	49.8	-174.4	55.5	0	0	0	0	111.6	I621	T619-I621 PolarHBondContact O-N 3.1Å
620	S	30.1	Very low	30.7	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	80%	0.798	S	S	*	*			trans	-84.5	90.9	165.6	53	0	0	0	0	109	S622	S620-S622 PolarHBondContact O-N 3.14Å; S620-S622 VanDerWaalsContact O-N 3.14Å
621	I	25	Very low	29.7	Very low	168 Å²	168	141.6 Å²	141.6	86%	0.862	80%	0.803	S	S	*	*			trans	-81.6	88.9	179.2	-52.6	170.2	0	0	0	108.2	T619	T619-I621 PolarHBondContact O-N 3.1Å
622	S	27.5	Very low	28.9	Very low	105 Å²	105	145.1 Å²	145.1	73%	0.734	81%	0.814	S	S	*	*			trans	-112.9	106.5	171.3	59	0	0	0	0	110	S620	S620-S622 PolarHBondContact O-N 3.14Å; S620-S622 VanDerWaalsContact O-N 3.14Å
623	S	25.4	Very low	28.8	Very low	113 Å²	113	142 Å²	142	79%	0.79	81%	0.811	S	S	*	*			trans	-64.5	127.4	178.1	48.7	0	0	0	0	113.4
624	V	28.9	Very low	28.3	Very low	145 Å²	145	143.6 Å²	143.6	88%	0.879	82%	0.816	S	S	*	*			trans	-141	147.3	146.8	-175.6	0	0	0	0	108
625	N	30.5	Very low	28.2	Very low	148 Å²	148	145.3 Å²	145.3	79%	0.791	82%	0.823	S	S	*	*			trans	-74.1	153.1	-175.3	-68.6	-31.1	0	0	0	114.3
626	S	27.5	Very low	28	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	82%	0.817	S	S	*	*			trans	58.9	138.2	156.7	62.6	0	0	0	0	120.9	T628	S626-T628 PolarHBondContact O-N 3.35Å
627	P	30.7	Very low	28	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	82%	0.816	S	S	*	*			trans	-93.2	85.8	-173.2	36.5	-35.8	0	0	0	113.9	K629	P627-K629 PolarHBondContact O-N 3.32Å
628	T	31.3	Very low	28	Very low	136 Å²	136	142.4 Å²	142.4	83%	0.834	81%	0.812	S	S	*	*			trans	-76.4	114.4	168.2	9.2	0	0	0	0	111.4	S626 R630	S626-T628 PolarHBondContact O-N 3.35Å; T628-R630 PolarHBondContact O-N 3.41Å; T628-R630 VanDerWaalsContact O-N 3.08Å
629	K	27.3	Very low	28.2	Very low	212 Å²	212	148.9 Å²	148.9	92%	0.922	82%	0.819	S	S	*	*			trans	-59.2	109	177.9	-62.2	172.9	-177.3	173.1	0	111.2	P627	P627-K629 PolarHBondContact O-N 3.32Å
630	R	28.5	Very low	28.6	Very low	251 Å²	251	148.3 Å²	148.3	95%	0.947	82%	0.818	S	S	*	*			trans	-127.6	139.8	158.5	-106	179.6	178.8	163.4	1.6	112.5	T628	T628-R630 PolarHBondContact O-N 3.41Å; T628-R630 VanDerWaalsContact O-N 3.08Å
631	K	25.5	Very low	28.8	Very low	194 Å²	194	150.5 Å²	150.5	84%	0.843	82%	0.82	S	S	*	*			trans	-77.7	147.7	-162	-170.8	176.2	-179.9	-179.7	0	111.1	T633	K631-T633 PolarHBondContact O-N 2.98Å
632	L	22.5	Very low	29.1	Very low	161 Å²	161	148 Å²	148	84%	0.843	81%	0.814	S	S	*	*			trans	-57.3	127.3	172.9	-136.8	76.7	0	0	0	110.5
633	T	31	Very low	29.4	Very low	123 Å²	123	151.2 Å²	151.2	76%	0.755	82%	0.822	S	S	*	*			trans	-133.4	125.1	164.7	49.5	0	0	0	0	109.3	K631 T635	K631-T633 PolarHBondContact O-N 2.98Å; T633-T635 PolarHBondContact O-N 3.31Å
634	T	26.5	Very low	29.6	Very low	135 Å²	135	153.8 Å²	153.8	83%	0.828	83%	0.826	S	S	*	*			trans	-82.9	110.2	-174	46.3	0	0	0	0	112.1
635	T	31.1	Very low	29.8	Very low	137 Å²	137	157.6 Å²	157.6	84%	0.84	83%	0.825	S	S	*	*			trans	-130.4	123.3	157.4	46	0	0	0	0	109.7	T633	T633-T635 PolarHBondContact O-N 3.31Å
636	T	26.7	Very low	29.9	Very low	128 Å²	128	157 Å²	157	79%	0.785	83%	0.827	S	S	*	*			trans	-72	142.4	173.5	48.6	0	0	0	0	111
637	I	29.4	Very low	30	Very low	146 Å²	146	159.8 Å²	159.8	75%	0.749	83%	0.832	S	S	*	*				165.3	142.5	129.9	-86.8	157.2	0	0	0	111.3
638	N	29.2	Very low	29.9	Very low	146 Å²	146	162.2 Å²	162.2	78%	0.781	83%	0.832	S	S	*	*			trans	50.1	95.1	165	-63.3	-10.9	0	0	0	120.1
639	F	31.2	Very low	29.8	Very low	209 Å²	209	161 Å²	161	92%	0.917	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-77.5	128	143.3	-82.2	-82.4	0	0	0	109.7
640	P	34.2	Very low	29.9	Very low	115 Å²	115	155.5 Å²	155.5	75%	0.747	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73.2	135.3	175.6	29.4	-33.5	0	0	0	111.2
641	I	35.1	Very low	29.9	Very low	155 Å²	155	151.2 Å²	151.2	80%	0.795	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.3	123.2	172	-62.7	169.1	0	0	0	108.2	L643	I641-L643 PolarHBondContact O-N 2.86Å
642	P	31	Very low	30.3	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-67.5	117.8	-179.7	26.1	-33.3	0	0	0	110.9	L644	P642-L644 PolarHBondContact O-N 2.9Å; P642-L644 VanDerWaalsContact O-N 3.17Å
643	L	33.1	Very low	30.6	Very low	174 Å²	174	150.7 Å²	150.7	91%	0.911	82%	0.815	S	S	*	*			trans	-68.6	109.3	177.3	-80.6	163.7	0	0	0	110.6	I641 R645	I641-L643 PolarHBondContact O-N 2.86Å; L643-R645 VanDerWaalsContact C-N 3.33Å; L643-R645 PolarHBondContact O-N 3.06Å
644	L	31.4	Very low	30.4	Very low	167 Å²	167	152.5 Å²	152.5	87%	0.874	82%	0.818	S	S	*	*			trans	-66.7	88.3	172.4	-99.5	157.5	0	0	0	110.5	P642 V646	P642-L644 PolarHBondContact O-N 2.9Å; P642-L644 VanDerWaalsContact O-N 3.17Å; L644-V646 PolarHBondContact O-N 3.03Å
645	R	32.7	Very low	30.2	Very low	225 Å²	225	156.9 Å²	156.9	85%	0.849	82%	0.82	S	S	*	*			trans	-64.6	112	173.4	-153.4	178.5	-156.6	166.9	5.8	108.8	L643 L647	L643-R645 VanDerWaalsContact C-N 3.33Å; L643-R645 PolarHBondContact O-N 3.06Å; R645-L647 PolarHBondContact O-N 3.46Å
646	V	32.7	Very low	30.1	Very low	136 Å²	136	158.6 Å²	158.6	82%	0.824	82%	0.82	S	S	*	*			trans	-68.7	115.3	173.9	177.2	0	0	0	0	107.9	L644 E648	L644-V646 PolarHBondContact O-N 3.03Å; V646-E648 PolarHBondContact O-N 3.25Å; V646-E648 VanDerWaalsContact O-N 3.08Å
647	L	28.4	Very low	30.1	Very low	162 Å²	162	159.3 Å²	159.3	85%	0.848	82%	0.819	S	S	*	*			trans	-76.2	90.6	175.3	-65.3	172.9	0	0	0	109.1	R645	R645-L647 PolarHBondContact O-N 3.46Å
648	E	30.2	Very low	30	Very low	181 Å²	181	162.1 Å²	162.1	85%	0.846	83%	0.826	S	S	*	*			trans	-75.3	143.8	159.4	-165.6	153.5	-138.9	0	0	109	V646 S650	V646-E648 PolarHBondContact O-N 3.25Å; V646-E648 VanDerWaalsContact O-N 3.08Å; E648-S650 PolarHBondContact O-N 3.5Å
649	S	28.2	Very low	30.1	Very low	111 Å²	111	162.2 Å²	162.2	78%	0.776	83%	0.827	S	S	*	*			trans	-71.6	126.8	-160.3	52.5	0	0	0	0	113.8
650	S	30.2	Very low	30.1	Very low	96 Å²	96	159.3 Å²	159.3	67%	0.671	82%	0.821	S	S	*	*			trans	-117.3	120.5	161.9	-173.6	0	0	0	0	109.9	E648	E648-S650 PolarHBondContact O-N 3.5Å
651	N	27.5	Very low	29.7	Very low	161 Å²	161	161.6 Å²	161.6	86%	0.861	83%	0.827	S	S	*	*			trans	-95.3	98.6	166.5	-68.4	-10.1	0	0	0	107.6
652	Q	33.7	Very low	29.5	Very low	176 Å²	176	162.6 Å²	162.6	82%	0.822	83%	0.828	S	S	*	*			trans	-139.3	136.3	164.8	-72.3	-164.5	-37.3	0	0	110.3
653	D	29.1	Very low	29.3	Very low	167 Å²	167	165.1 Å²	165.1	89%	0.893	83%	0.832	S	S	*	*			trans	-80.7	164.6	-171.4	-74.8	-71	0	0	0	114
654	I	26.3	Very low	29.1	Very low	161 Å²	161	164.6 Å²	164.6	83%	0.826	83%	0.83	S	S	*	*			trans	-73.6	122.3	179.3	-56.6	158.2	0	0	0	110.1
655	R	22.8	Very low	28.7	Very low	227 Å²	227	162.3 Å²	162.3	86%	0.857	82%	0.823	S	S	*	*			trans	171	121.7	134.8	-97.6	163.4	179.8	-154.6	-2.6	113.6
656	M	28.5	Very low	28.5	Very low	173 Å²	173	157.8 Å²	157.8	85%	0.852	82%	0.821	S	S	*	*				-169.9	142.7	112.3	-93.2	-60.8	-172.7	0	0	107.2
657	N	26.5	Very low	28.1	Very low	144 Å²	144	158 Å²	158	77%	0.77	82%	0.818	S	S	*	*			trans	-83.8	147.7	-176	-63.6	7.8	0	0	0	111.2
658	F	28.1	Very low	28.2	Very low	204 Å²	204	158.4 Å²	158.4	90%	0.895	82%	0.82	S	S	*	*			trans	-140	84.9	160.8	-83.6	-76.2	0	0	0	107.9
659	D	30.2	Very low	28	Very low	148 Å²	148	155.5 Å²	155.5	79%	0.791	82%	0.815	S	S	*	*			trans	-141.2	158.7	171.7	-79.1	-60.2	0	0	0	108.8
660	D	31.5	Very low	27.9	Very low	148 Å²	148	155.9 Å²	155.9	79%	0.791	81%	0.813	S	S	*	*			trans	80.3	66.9	173.7	-56.6	-25.2	0	0	0	118.6	H662	D660-H662 PolarHBondContact O-N 2.84Å
661	D	27.1	Very low	27.8	Very low	164 Å²	164	157.6 Å²	157.6	88%	0.877	82%	0.815	S	S	*	*			trans	-61.5	106.9	141.4	-86	-45.5	0	0	0	109.4
662	H	30.1	Very low	27.7	Very low	175 Å²	175	155.9 Å²	155.9	81%	0.81	81%	0.805	S	S	*	*			trans	-144.6	123.7	160.9	-116.1	-75.6	0	0	0	113.5	D660 N664	D660-H662 PolarHBondContact O-N 2.84Å; H662-N664 PolarHBondContact O-N 3.4Å
663	M	27.6	Very low	27.2	Very low	168 Å²	168	154 Å²	154	83%	0.828	81%	0.806	S	S	*	*			trans	-56.6	133.3	171.7	-77.7	-79.4	-177.2	0	0	111.4
664	N	27.5	Very low	27.1	Very low	162 Å²	162	151.6 Å²	151.6	87%	0.866	80%	0.803	S	S	*	*			trans	-142.2	117	152.3	-125.4	-16.4	0	0	0	109.9	H662	H662-N664 PolarHBondContact O-N 3.4Å
665	T	23.5	Very low	26.9	Very low	119 Å²	119	152.9 Å²	152.9	73%	0.73	80%	0.802	S	S	*	*			trans	-96.1	106.3	-171.2	-50	0	0	0	0	110.6
666	T	28.6	Very low	27	Very low	130 Å²	130	150.8 Å²	150.8	80%	0.798	80%	0.802	S	S	*	*			trans	-141.5	125.8	164	-29.9	0	0	0	0	110.9
667	N	24.6	Very low	26.7	Very low	142 Å²	142	150.4 Å²	150.4	76%	0.759	80%	0.798	S	S	*	*			trans	-70.6	144	174.8	-63.2	-40.1	0	0	0	110.7
668	N	30.8	Very low	26.8	Very low	170 Å²	170	152.6 Å²	152.6	91%	0.909	80%	0.803	S	S	*	*			trans	-148.7	118.8	144.4	-106.4	-29.7	0	0	0	110.2
669	T	24.9	Very low	26.5	Very low	120 Å²	120	147.7 Å²	147.7	74%	0.736	79%	0.79	S	S	*	*			trans	-80.1	142.2	177.9	43.4	0	0	0	0	111.7
670	T	27.5	Very low	26.4	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.724	79%	0.789	S	S	*	*				178.6	136.3	118.6	24	0	0	0	0	112.6
671	N	27.1	Very low	26	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	79%	0.785	S	S	*	*			trans	60.3	148.9	144.5	-54.1	-8.2	0	0	0	119.5
672	N	26.3	Very low	26.1	Very low	124 Å²	124	148.2 Å²	148.2	66%	0.663	78%	0.784	S	S	*	*			cis	-167.7	148.7	-17.5	-103.1	-16	0	0	0	108.1
673	T	22.8	Very low	26	Very low	136 Å²	136	149 Å²	149	83%	0.834	79%	0.785	S	S	*	*			trans	53.1	148.6	151.3	52.3	0	0	0	0	120.7
674	S	26.4	Very low	26.5	Very low	118 Å²	118	146.4 Å²	146.4	83%	0.825	78%	0.781	S	S	*	*			cis	-156	167.5	3.6	40.2	0	0	0	0	112.3
675	K	22.4	Very low	26.3	Very low	187 Å²	187	146.7 Å²	146.7	81%	0.813	78%	0.781	S	S	*	*			trans	-67.3	155.6	174.4	-54.9	159.8	177.8	175.3	0	113.1
676	E	25.5	Very low	26.4	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	78%	0.783	S	S	*	*				165.5	121.4	128.3	-90.5	164.9	-165.7	0	0	108.8
677	H	21.5	Very low	26.3	Very low	164 Å²	164	148.3 Å²	148.3	76%	0.759	78%	0.781	S	S	*	*				66.2	105.2	65.5	-89.8	-73.7	0	0	0	116.2
678	H	29.3	Very low	26.2	Very low	190 Å²	190	149.1 Å²	149.1	88%	0.88	78%	0.78	S	S	*	*			trans	-153.2	155.2	145.8	-119.6	-84.3	0	0	0	111.1
679	T	22.4	Very low	26	Very low	101 Å²	101	149.2 Å²	149.2	62%	0.62	78%	0.78	S	S	*	*			trans	-146.4	-176.2	-165.2	54.4	0	0	0	0	113.3
680	L	26.8	Very low	26	Very low	148 Å²	148	149 Å²	149	78%	0.775	77%	0.774	S	S	*	*			trans	79.1	131.4	-179	-59.4	117.1	0	0	0	115.5
681	I	24	Very low	25.9	Very low	136 Å²	136	149.3 Å²	149.3	70%	0.697	78%	0.776	S	S	*	*			cis	98.1	104.4	16.3	-56.5	164.1	0	0	0	115.6
682	H	28.3	Very low	25.8	Very low	188 Å²	188	149.7 Å²	149.7	87%	0.87	78%	0.778	S	S	*	*			trans	-155.4	119.1	146	-93.9	-94.3	0	0	0	105.2
683	K	27.8	Very low	25.7	Very low	191 Å²	191	151 Å²	151	83%	0.83	78%	0.78	S	S	*	*				86.1	142.5	54	-89.5	-147.1	168.8	-175.9	0	115.4
684	P	38	Very low	25.8	Very low	113 Å²	113	149.1 Å²	149.1	73%	0.734	77%	0.772	S	S	*	*			trans	-129.1	-171.2	-149.1	43.2	-26.2	0	0	0	115
685	L	25	Very low	25.6	Very low	168 Å²	168	151 Å²	151	88%	0.88	77%	0.771	S	S	*	*			trans	-143.1	167.2	161.2	-151.8	66.8	0	0	0	111.2
686	N	23.7	Very low	25.8	Very low	142 Å²	142	147.5 Å²	147.5	76%	0.759	77%	0.771	S	S	*	*			trans	-127.7	-164.2	-158.6	-112.6	15	0	0	0	113.2
687	D	27.4	Very low	25.7	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	77%	0.767	S	S	*	*			trans	90.4	120.1	166.3	-47.9	-19.2	0	0	0	114.8
688	Q	23.3	Very low	26	Very low	158 Å²	158	145.2 Å²	145.2	74%	0.738	77%	0.768	S	S	*	*			cis	90.1	115.6	23.4	-163.6	-179.3	-0.8	0	0	116.2	D690	Q688-D690 PolarHBondContact NE2-OD2 3.39Å; Q688-D690 VanDerWaalsContact NE2-OD2 3.16Å
689	L	26.7	Very low	25.6	Very low	173 Å²	173	144.2 Å²	144.2	91%	0.906	76%	0.764	S	S	*	*			trans	-158.4	154.5	155	-145.5	75.9	0	0	0	110.9
690	D	23.8	Very low	25.8	Very low	114 Å²	114	147.3 Å²	147.3	61%	0.61	77%	0.772	S	S	*	*			trans	-132.3	-171.1	-165.5	-83.7	-71.2	0	0	0	114	Q688	Q688-D690 PolarHBondContact NE2-OD2 3.39Å; Q688-D690 VanDerWaalsContact NE2-OD2 3.16Å
691	T	25.2	Very low	25.5	Very low	125 Å²	125	148.9 Å²	148.9	77%	0.767	78%	0.775	S	S	*	*			trans	80	167.2	173.9	82.2	0	0	0	0	116.1
692	N	24.6	Very low	25.5	Very low	141 Å²	141	151.9 Å²	151.9	75%	0.754	78%	0.783	S	S	*	*			cis	-166.5	171.9	-8.6	-116.7	-7.6	0	0	0	107.9
693	H	24.6	Very low	25.1	Very low	151 Å²	151	150.8 Å²	150.8	70%	0.699	78%	0.778	S	S	*	*			cis	-164.1	178.8	-27.1	-160.9	-116.5	0	0	0	110
694	S	25.1	Very low	24.8	Very low	98 Å²	98	148.3 Å²	148.3	69%	0.685	77%	0.774	S	S	*	*			trans	54.8	152.8	170	59.3	0	0	0	0	119.4
695	I	22.1	Very low	24.1	Very low	157 Å²	157	149 Å²	149	81%	0.805	78%	0.776	S	S	*	*			cis	113.4	96.1	0.2	-60.2	170.4	0	0	0	116.9
696	S	27.6	Very low	23.9	Very low	114 Å²	114	148.7 Å²	148.7	80%	0.797	78%	0.775	S	S	*	*			trans	-175.2	151.5	147	55.3	0	0	0	0	108.8
697	N	21.7	Very low	23.9	Very low	147 Å²	147	149.7 Å²	149.7	79%	0.786	78%	0.779	S	S	*	*			cis	110.6	152	-5.8	-151	12.4	0	0	0	117.4
698	I	28.5	Very low	23.8	Very low	153 Å²	153	148.5 Å²	148.5	79%	0.785	78%	0.776	S	S	*	*			trans	77.6	145.8	-172.4	-54.9	174.1	0	0	0	114.7
699	Q	21.5	Very low	23.9	Very low	168 Å²	168	146.3 Å²	146.3	79%	0.785	78%	0.776	S	S	*	*				175.4	172.4	-53.1	173.9	167.5	-4	0	0	108.8
700	E	26.1	Very low	23.7	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	77%	0.774	S	S	*	*			trans	109	136.6	167.7	-64	-129.8	121.1	0	0	118
701	Q	20	Very low	23.9	Very low	180 Å²	180	149.3 Å²	149.3	84%	0.841	78%	0.782	S	S	*	*			trans	-114.5	151.1	178.2	-53	151	-57.4	0	0	108.5
702	K	25.2	Very low	23.8	Very low	200 Å²	200	150.7 Å²	150.7	87%	0.87	79%	0.785	S	S	*	*			trans	-161.7	166.2	144.9	-111.5	147.4	-169	163.4	0	112.4
703	Q	19.7	Very low	23.7	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	79%	0.788	S	S	*	*			trans	-120	160.3	-161.3	-59.2	173.2	-31.6	0	0	112.7
704	N	22.1	Very low	23.7	Very low	138 Å²	138	151.5 Å²	151.5	74%	0.738	79%	0.794	S	S	*	*			trans	74.3	163.1	148.5	-61.8	-19	0	0	0	121.3
705	T	22.7	Very low	23.5	Very low	127 Å²	127	154.7 Å²	154.7	78%	0.779	80%	0.798	S	S	*	*			trans	67.5	71.3	162.8	35	0	0	0	0	119	L707	T705-L707 PolarHBondContact O-N 2.85Å
706	L	21.2	Very low	23.6	Very low	163 Å²	163	154.7 Å²	154.7	85%	0.853	80%	0.799	S	S	*	*			trans	-14	115.3	133.7	-168.5	164.9	0	0	0	114.7
707	L	23.9	Very low	23.4	Very low	163 Å²	163	155 Å²	155	85%	0.853	80%	0.801	S	S	*	*			trans	-138.7	155.2	164.6	-131.3	92.8	0	0	0	110.7	T705	T705-L707 PolarHBondContact O-N 2.85Å
708	V	24.1	Very low	23.4	Very low	116 Å²	116	157.3 Å²	157.3	70%	0.703	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.9	132	-172.1	179.2	0	0	0	0	111.2
709	P	26.7	Very low	23.1	Very low	113 Å²	113	158.5 Å²	158.5	73%	0.734	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77.3	126.2	176.2	30.5	-33.5	0	0	0	111.7
710	F	22.4	Very low	23	Very low	198 Å²	198	161 Å²	161	87%	0.868	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-68.3	157.5	159.4	-82.8	-98.1	0	0	0	110.4
711	I	26.4	Very low	22.7	Very low	151 Å²	151	157.5 Å²	157.5	77%	0.774	81%	0.805	S	S	*	*			trans	-112.4	109.9	171.2	-63.1	172.8	0	0	0	106.8	L713	I711-L713 PolarHBondContact O-N 3.41Å
712	D	22.9	Very low	22.7	Very low	154 Å²	154	154.6 Å²	154.6	82%	0.824	80%	0.804	S	S	*	*			trans	-71.5	123.2	170.5	-72.9	-45.9	0	0	0	110.3	N714	D712-N714 PolarHBondContact O-N 2.86Å
713	L	24.3	Very low	22.7	Very low	155 Å²	155	152.3 Å²	152.3	81%	0.812	80%	0.8	S	S	*	*			trans	-82.4	96	170.8	-76.7	162.7	0	0	0	108.8	I711 E715	I711-L713 PolarHBondContact O-N 3.41Å; L713-E715 PolarHBondContact O-N 3.28Å
714	N	23.1	Very low	22.8	Very low	155 Å²	155	153.3 Å²	153.3	83%	0.829	80%	0.802	S	S	*	*			trans	-95.4	79.7	170.1	-159.3	-0.9	0	0	0	110.5	D712 N716	D712-N714 PolarHBondContact O-N 2.86Å; N714-N716 PolarHBondContact O-N 2.88Å
715	E	20.5	Very low	22.8	Very low	164 Å²	164	154.1 Å²	154.1	77%	0.766	81%	0.806	S	S	*	*			trans	-73.5	95.7	170.3	-66.6	-171.6	129.5	0	0	110.1	L713	L713-E715 PolarHBondContact O-N 3.28Å
716	N	24.4	Very low	22.9	Very low	157 Å²	157	155.9 Å²	155.9	84%	0.84	81%	0.81	S	S	*	*			trans	-176	83.4	152.2	-98.5	-40.7	0	0	0	113.9	N714	N714-N716 PolarHBondContact O-N 2.88Å
717	S	25.1	Very low	22.9	Very low	120 Å²	120	152.1 Å²	152.1	84%	0.839	80%	0.798	S	S	*	*			trans	-172.4	80.2	146.7	62.7	0	0	0	0	112.4
718	F	21.1	Very low	22.8	Very low	196 Å²	196	151.2 Å²	151.2	86%	0.86	79%	0.794	S	S	*	*			trans	-78.4	120.2	159.3	-98.1	-88.4	0	0	0	109.2
719	Q	20.9	Very low	22.7	Very low	178 Å²	178	151.9 Å²	151.9	83%	0.832	80%	0.798	S	S	*	*			trans	-141.3	107.8	154.7	-107.1	-172.4	4.2	0	0	111.2
720	Y	19.7	Very low	22.5	Very low	222 Å²	222	151.8 Å²	151.8	87%	0.871	80%	0.796	S	S	*	*			trans	-83.4	122.5	157.4	-99.7	-96.3	0	0	0	107.9
721	S	21.3	Very low	22.6	Very low	92 Å²	92	148.8 Å²	148.8	64%	0.643	79%	0.789	S	S	*	*			trans	-144.4	102.3	170.8	57.4	0	0	0	0	111.4
722	S	18.7	Very low	22.4	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	79%	0.787	S	S	*	*			trans	-98.3	90.4	177	57	0	0	0	0	111.3
723	I	25.1	Very low	22.5	Very low	152 Å²	152	146.4 Å²	146.4	78%	0.779	79%	0.787	S	S	*	*			trans	-134.8	114.3	175.1	-54.4	176.7	0	0	0	105.6
724	K	21.8	Very low	22.5	Very low	186 Å²	186	147.5 Å²	147.5	81%	0.809	79%	0.787	S	S	*	*			cis	82.1	84.7	37.5	-153.8	-175.5	-173.2	-172.9	0	113.3
725	N	21.9	Very low	22.5	Very low	155 Å²	155	145.1 Å²	145.1	83%	0.829	78%	0.783	S	S	*	*			trans	39.2	104	158.6	-61.3	10.9	0	0	0	120
726	L	26.7	Very low	22.7	Very low	164 Å²	164	145.4 Å²	145.4	86%	0.859	79%	0.789	S	S	*	*			trans	-157.4	120.2	143.4	-140	69	0	0	0	105.6
727	S	20.7	Very low	22.6	Very low	85 Å²	85	144.9 Å²	144.9	59%	0.594	79%	0.786	S	S	*	*			cis	87.1	112.8	31.3	85	0	0	0	0	115.3
728	N	21.4	Very low	22.5	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	78%	0.78	S	S	*	*			trans	81.3	145.2	159.8	-58.5	-7.6	0	0	0	120
729	T	21.4	Very low	22.7	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	77%	0.768	S	S	*	*			trans	66.2	142.2	158.6	44.4	0	0	0	0	117.7
730	T	23.6	Very low	22.9	Very low	112 Å²	112	142.2 Å²	142.2	69%	0.687	77%	0.765	S	S	*	*			cis	-153.1	163.5	7.8	-6.8	0	0	0	0	112.4
731	N	24.6	Very low	23.1	Very low	135 Å²	135	138.4 Å²	138.4	72%	0.722	76%	0.76	S	S	*	*			trans	58	99.7	148.1	-63.1	-3.4	0	0	0	121.6
732	T	20.9	Very low	23.3	Very low	121 Å²	121	140 Å²	140	74%	0.742	76%	0.761	S	S	*	*				32.7	114.8	118.8	57.7	0	0	0	0	120.1
733	T	25.6	Very low	23.8	Very low	134 Å²	134	139.4 Å²	139.4	82%	0.822	76%	0.758	S	S	*	*				-161	151.6	111.7	11.4	0	0	0	0	111.6
734	H	24.9	Very low	23.9	Very low	177 Å²	177	138 Å²	138	82%	0.819	76%	0.761	S	S	*	*			trans	21.3	117.2	171.4	-72.2	-82.9	0	0	0	121.2
735	S	21.6	Very low	24.5	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	76%	0.76	S	S	*	*			trans	-62.8	132.5	159.8	53.5	0	0	0	0	113
736	L	25.8	Very low	25.1	Very low	169 Å²	169	134.7 Å²	134.7	89%	0.885	75%	0.751	S	S	*	*			trans	-158.9	122.2	137.9	-109.7	165.4	0	0	0	109.9
737	L	21.4	Very low	25.5	Very low	147 Å²	147	132.2 Å²	132.2	77%	0.77	74%	0.738	S	S	*	*			trans	-83.4	128.7	170.7	-75.4	75.8	0	0	0	108.8
738	H	23.8	Very low	26.2	Very low	155 Å²	155	136.1 Å²	136.1	72%	0.718	75%	0.745	S	S	*	*				-173.7	138.1	107.9	-112.3	-82.7	0	0	0	115.1
739	N	25.7	Very low	26.8	Very low	116 Å²	116	136.8 Å²	136.8	62%	0.62	74%	0.743	S	S	*	*			trans	38.4	85.3	151	-63.1	-3.2	0	0	0	120	N741	N739-N741 PolarHBondContact O-N 2.92Å
740	H	24.3	Very low	27.4	Very low	166 Å²	166	137.6 Å²	137.6	77%	0.769	74%	0.736	S	S	*	*			trans	-85.2	81.5	154.8	-151.7	-11.2	0	0	0	110.6	N742	H740-N742 VanDerWaalsContact C-N 3.29Å; H740-N742 PolarHBondContact CE1-ND2 3.33Å; H740-N742 PolarHBondContact O-N 3.33Å
741	N	25	Very low	27.8	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	74%	0.736	S	S	*	*			trans	-78.3	72.4	177	-88.5	-7.7	0	0	0	111.7	N739	N739-N741 PolarHBondContact O-N 2.92Å
742	N	23.7	Very low	28.2	Very low	125 Å²	125	140.1 Å²	140.1	67%	0.668	73%	0.732	S	S	*	*			trans	-128.9	110.7	175.9	-97.2	-7	0	0	0	112.3	H740	H740-N742 VanDerWaalsContact C-N 3.29Å; H740-N742 PolarHBondContact CE1-ND2 3.33Å; H740-N742 PolarHBondContact O-N 3.33Å
743	S	30.5	Very low	28.8	Very low	108 Å²	108	141 Å²	141	76%	0.755	73%	0.726	S	S	*	*			trans	178.1	107.1	140	31.8	0	0	0	0	110.6	I745	S743-I745 PolarHBondContact O-N 2.94Å
744	S	27.2	Very low	29.2	Very low	123 Å²	123	139 Å²	139	86%	0.86	71%	0.71	S	S	*	*			trans	-75.3	99.5	168.9	51.4	0	0	0	0	109.9
745	I	33.8	Very low	29.7	Very low	152 Å²	152	137.7 Å²	137.7	78%	0.779	71%	0.705	S	S	*	*			trans	-80.9	125.5	171.9	-63.5	176.6	0	0	0	109.1	S743 N747	S743-I745 PolarHBondContact O-N 2.94Å; I745-N747 PolarHBondContact O-N 3.4Å
746	D	34.5	Very low	30.3	Very low	119 Å²	119	142 Å²	142	64%	0.636	71%	0.705	S	S	*	*			trans	-57.2	126.7	-164.6	-100.9	-62	0	0	0	115.7	K748	D746-K748 PolarHBondContact O-N 3.11Å; D746-K748 VanDerWaalsContact O-N 3.1Å
747	N	34.8	Very low	30.9	Very low	111 Å²	111	142 Å²	142	59%	0.594	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-12.3	175.2	-83.5	-59.5	0	0	0	113.8	I745 Q749 K750	I745-N747 PolarHBondContact O-N 3.4Å; N747-Q749 PolarHBondContact O-N 3.31Å; N747-K750 VanDerWaalsContact O-CB 3.29Å; N747-K750 WeakPolarHBondContact O-CB 3.5Å; N747-K750 PolarHBondContact O-N 2.86Å; N747-K750 VanDerWaalsContact O-N 3.11Å
748	K	35.7	Very low	31.6	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	69%	0.687	S	S	*	*	H	α-helix	trans	-61.7	-38.1	-175.5	-70.6	179.8	178.4	173	0	113.7	D746 K750 Y751	D746-K748 PolarHBondContact O-N 3.11Å; D746-K748 VanDerWaalsContact O-N 3.1Å; K748-K750 PolarHBondContact O-N 2.86Å; K748-Y751 PolarHBondContact O-N 2.8Å
749	Q	34.2	Very low	32.1	Very low	159 Å²	159	137.3 Å²	137.3	74%	0.743	68%	0.681	S	S	*	*	H	α-helix	trans	-65.6	-21.6	177.3	-69.5	-169.2	-0.8	0	0	113.3	N747	N747-Q749 PolarHBondContact O-N 3.31Å
750	K	34.4	Very low	32.2	Very low	145 Å²	145	138.1 Å²	138.1	63%	0.63	68%	0.683	S	S	*	*	H	α-helix	trans	-77.1	-27.5	-175.6	-153.9	172.1	-175	176.6	0	113	N747 K748	N747-K750 VanDerWaalsContact O-CB 3.29Å; N747-K750 WeakPolarHBondContact O-CB 3.5Å; N747-K750 PolarHBondContact O-N 2.86Å; N747-K750 VanDerWaalsContact O-N 3.11Å; K748-K750 PolarHBondContact O-N 2.86Å
751	Y	32.1	Very low	32.4	Very low	175 Å²	175	134.3 Å²	134.3	69%	0.686	68%	0.676	S	S	*	*	H	α-helix	trans	-75.1	-46.1	179.1	-82.3	-89.2	0	0	0	112.5	K748 F753 N754 E755	K748-Y751 PolarHBondContact O-N 2.8Å; Y751-F753 PolarHBondContact O-N 2.77Å; Y751-F753 VanDerWaalsContact O-N 3.14Å; Y751-N754 PolarHBondContact O-N 2.88Å; Y751-E755 PolarHBondContact O-N 2.62Å
752	L	33	Very low	32.5	Very low	125 Å²	125	133.3 Å²	133.3	65%	0.654	67%	0.674	S	S	*	*	H	α-helix	trans	-54.8	-34.1	179.6	-101.7	163.9	0	0	0	113.7
753	F	33.5	Very low	32.6	Very low	140 Å²	140	134.3 Å²	134.3	61%	0.614	68%	0.678	S	S	*	*	H	α-helix	trans	-82.5	-15.8	176.4	-83.2	-70	0	0	0	115.1	Y751 R757	Y751-F753 PolarHBondContact O-N 2.77Å; Y751-F753 VanDerWaalsContact O-N 3.14Å; F753-R757 WeakPolarHBondContact O-CD 3.45Å; F753-R757 VanDerWaalsContact O-CG 3.24Å; F753-R757 WeakPolarHBondContact O-CG 3.22Å; F753-R757 PolarHBondContact O-NE 3.37Å
754	N	34	Very low	32.3	Very low	92 Å²	92	137 Å²	137	49%	0.492	68%	0.679	S	S	.	*	H	α-helix	trans	-87.6	-42.7	174.3	-84.6	-9	0	0	0	111.5	Y751 R756 R757 N758	Y751-N754 PolarHBondContact O-N 2.88Å; N754-R756 PolarHBondContact O-N 3.39Å; N754-R757 WeakPolarHBondContact O-CB 3.4Å; N754-R757 PolarHBondContact O-N 3.18Å; N754-N758 PolarHBondContact O-N 3.15Å
755	E	35.3	Very low	32.3	Very low	149 Å²	149	137.2 Å²	137.2	70%	0.696	68%	0.677	S	S	*	*	H	α-helix	trans	-61.6	-44.6	180	-169.7	161.5	-140.7	0	0	111.5	Y751 R757 N758 S759	Y751-E755 PolarHBondContact O-N 2.62Å; E755-R757 PolarHBondContact O-N 2.98Å; E755-N758 PolarHBondContact O-N 3.27Å; E755-S759 PolarHBondContact O-N 3.12Å; E755-S759 PolarHBondContact O-OG 2.91Å
756	R	34.5	Very low	31.9	Very low	196 Å²	196	136.2 Å²	136.2	74%	0.74	68%	0.678	S	S	*	*	H	α-helix	trans	-67.4	-1.8	174	-146.1	176	-164.5	165	6.1	114.7	N754	N754-R756 PolarHBondContact O-N 3.39Å
757	R	37.3	Very low	31.4	Very low	171 Å²	171	138.3 Å²	138.3	65%	0.645	69%	0.688	S	S	*	*	H	α-helix	trans	-102.6	-29.9	172.9	-73.2	174.9	-177.7	-179.7	3	113.1	F753 N754 E755	F753-R757 WeakPolarHBondContact O-CD 3.45Å; F753-R757 VanDerWaalsContact O-CG 3.24Å; F753-R757 WeakPolarHBondContact O-CG 3.22Å; F753-R757 PolarHBondContact O-NE 3.37Å; N754-R757 WeakPolarHBondContact O-CB 3.4Å; N754-R757 PolarHBondContact O-N 3.18Å; E755-R757 PolarHBondContact O-N 2.98Å
758	N	36.5	Very low	31	Very low	120 Å²	120	138.6 Å²	138.6	64%	0.642	70%	0.698	S	S	*	*	H	α-helix	trans	-77.8	-29.3	177.6	-73.5	-1.2	0	0	0	112.5	N754 E755 I760 S761	N754-N758 PolarHBondContact O-N 3.15Å; E755-N758 PolarHBondContact O-N 3.27Å; N758-I760 VanDerWaalsContact C-N 3.25Å; N758-I760 PolarHBondContact O-N 3.5Å; N758-S761 PolarHBondContact O-N 2.92Å; N758-S761 PolarHBondContact O-OG 3.21Å
759	S	33.4	Very low	30.5	Very low	83 Å²	83	135.3 Å²	135.3	58%	0.58	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-5.9	-179.4	54	0	0	0	0	115.5	E755	E755-S759 PolarHBondContact O-N 3.12Å; E755-S759 PolarHBondContact O-OG 2.91Å
760	I	29.2	Very low	29.9	Very low	132 Å²	132	138 Å²	138	68%	0.677	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-7.8	179.7	-60.4	178.7	0	0	0	112.1	N758	N758-I760 VanDerWaalsContact C-N 3.25Å; N758-I760 PolarHBondContact O-N 3.5Å
761	S	28.5	Very low	29.4	Very low	87 Å²	87	139.3 Å²	139.3	61%	0.608	72%	0.715	S	S	*	*	S	Bend	trans	-86.2	-12.4	174.9	35.7	0	0	0	0	114.9	N758	N758-S761 PolarHBondContact O-N 2.92Å; N758-S761 PolarHBondContact O-OG 3.21Å
762	V	26.2	Very low	29	Very low	120 Å²	120	138.4 Å²	138.4	73%	0.727	72%	0.717	S	S	*	*			trans	-110.6	61.8	-179.1	-165.7	0	0	0	0	111.1
763	I	25.7	Very low	28.5	Very low	146 Å²	146	140.4 Å²	140.4	75%	0.749	72%	0.717	S	S	*	*			trans	-121.7	67.2	156.3	-50.6	-179.1	0	0	0	107.6
764	Q	24.1	Very low	28.2	Very low	165 Å²	165	145.3 Å²	145.3	77%	0.771	73%	0.733	S	S	*	*			trans	-73.7	139.9	149.4	-77.3	-178.7	-89.3	0	0	107.3	T766	Q764-T766 PolarHBondContact O-N 3.36Å
765	P	27.2	Very low	27.7	Very low	127 Å²	127	146.8 Å²	146.8	83%	0.825	74%	0.738	S	S	*	*			trans	-64.3	114	177.8	26.5	-33.1	0	0	0	109.3	I767	P765-I767 PolarHBondContact O-N 3.21Å
766	T	25.6	Very low	27.2	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	75%	0.747	S	S	*	*			trans	-62.8	120.8	170.3	30.7	0	0	0	0	109.5	Q764 S768	Q764-T766 PolarHBondContact O-N 3.36Å; T766-S768 PolarHBondContact O-N 2.98Å
767	I	25.1	Very low	26.7	Very low	162 Å²	162	145.1 Å²	145.1	83%	0.831	74%	0.743	S	S	*	*			trans	15.5	95.3	147	-51.9	170	0	0	0	114	P765	P765-I767 PolarHBondContact O-N 3.21Å
768	S	26	Very low	26.2	Very low	117 Å²	117	142.3 Å²	142.3	82%	0.818	75%	0.75	S	S	*	*			trans	-83.3	141.4	141.9	45.4	0	0	0	0	108.3	T766	T766-S768 PolarHBondContact O-N 2.98Å
769	S	23.7	Very low	25.6	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	76%	0.756	S	S	*	*	S	Bend	trans	-61.7	138.1	-173.4	40.1	0	0	0	0	113.4
770	Y	22.9	Very low	25.5	Very low	215 Å²	215	146.5 Å²	146.5	84%	0.843	77%	0.77	S	S	*	*				174.8	94	124	-100.7	-69.8	0	0	0	108.7
771	N	24	Very low	25.2	Very low	174 Å²	174	146 Å²	146	93%	0.93	77%	0.774	S	S	*	*			trans	-162.3	94.3	167.5	-108.4	-3.3	0	0	0	106.4
772	E	22.6	Very low	24.8	Very low	155 Å²	155	149.9 Å²	149.9	72%	0.724	79%	0.787	S	S	*	*			trans	-126.2	147.9	180	-132.4	-176.9	171.9	0	0	109
773	Y	24	Very low	24.9	Very low	168 Å²	168	151.4 Å²	151.4	66%	0.659	79%	0.789	S	S	*	*			trans	46.2	87.9	173.4	-65.1	-77.8	0	0	0	118
774	Y	27.2	Very low	24.7	Very low	242 Å²	242	149.6 Å²	149.6	95%	0.949	79%	0.79	S	S	*	*				-137.4	114.4	112.7	-97.8	-79.2	0	0	0	108.8
775	E	22.5	Very low	24.8	Very low	124 Å²	124	151.4 Å²	151.4	58%	0.579	80%	0.795	S	S	*	*			trans	-74.7	146.8	174.9	-65.4	-172.3	113.2	0	0	111.4	H777	E775-H777 IonicContact OE1-CD2 2.77Å; E775-H777 IonicContact OE1-CE1 2.71Å; E775-H777 IonicContact OE1-NE2 2.83Å; E775-H777 PolarHBondContact OE1-NE2 3.27Å
776	N	25.5	Very low	24.6	Very low	167 Å²	167	151.7 Å²	151.7	89%	0.893	80%	0.795	S	S	*	*			trans	-156.1	103.1	149.4	-117.6	-37.1	0	0	0	108.1
777	H	23.1	Very low	24.5	Very low	143 Å²	143	152.1 Å²	152.1	66%	0.662	79%	0.791	S	S	*	*			trans	-80.3	127.5	-173.8	-70.8	-83.7	0	0	0	111.8	E775	E775-H777 IonicContact OE1-CD2 2.77Å; E775-H777 IonicContact OE1-CE1 2.71Å; E775-H777 IonicContact OE1-NE2 2.83Å; E775-H777 PolarHBondContact OE1-NE2 3.27Å
778	S	26.4	Very low	24.4	Very low	112 Å²	112	152.2 Å²	152.2	78%	0.783	79%	0.793	S	S	*	*			trans	-151.5	90	160.2	51.3	0	0	0	0	111.1
779	N	25.6	Very low	24.1	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	78%	0.784	S	S	*	*			trans	-69.2	134.3	174.9	-70.8	-36.9	0	0	0	111.1
780	V	30.4	Very low	24.3	Very low	144 Å²	144	152.7 Å²	152.7	87%	0.873	79%	0.787	S	S	*	*			trans	-130.5	107.7	160.4	-177.8	0	0	0	0	107.9
781	T	23.3	Very low	24.2	Very low	123 Å²	123	148.3 Å²	148.3	76%	0.755	78%	0.783	S	S	*	*			trans	-82.2	150.4	-168.8	-31.2	0	0	0	0	112.4
782	L	20.5	Very low	24.3	Very low	168 Å²	168	145.9 Å²	145.9	88%	0.88	77%	0.774	S	S	*	*			trans	-60.9	139	164.2	-95.3	77.6	0	0	0	110.6
783	I	26.6	Very low	24.3	Very low	151 Å²	151	144 Å²	144	77%	0.774	77%	0.774	S	S	*	*			trans	-128.8	115	157.5	-63.1	-178.8	0	0	0	108.1
784	S	21.9	Very low	24.2	Very low	109 Å²	109	142 Å²	142	76%	0.762	78%	0.779	S	S	*	*			trans	-79.1	141.2	164.4	44.3	0	0	0	0	110
785	K	27.3	Very low	24.1	Very low	202 Å²	202	136.7 Å²	136.7	88%	0.878	77%	0.772	S	S	*	*			trans	-133.6	139.8	162.2	-88.4	-168.5	172.4	-176.9	0	110.7
786	T	23.2	Very low	24.2	Very low	134 Å²	134	137.7 Å²	137.7	82%	0.822	78%	0.781	S	S	*	*			trans	-108.1	154.6	-167.2	-29.3	0	0	0	0	110.5
787	L	22	Very low	24.2	Very low	141 Å²	141	136.1 Å²	136.1	74%	0.738	78%	0.778	S	S	*	*			trans	19.9	120.5	154.1	-165.3	77.3	0	0	0	118.4
788	L	23	Very low	24.3	Very low	164 Å²	164	134.7 Å²	134.7	86%	0.859	78%	0.779	S	S	*	*			trans	-123	129.1	150.8	-143.4	84.1	0	0	0	109.1
789	T	21.1	Very low	24.4	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	78%	0.779	S	S	*	*			trans	-118.8	123.3	178.3	-47.4	0	0	0	0	107.8
790	T	26.7	Very low	24.4	Very low	120 Å²	120	136 Å²	136	74%	0.736	78%	0.778	S	S	*	*			trans	-130.7	115	-177.5	-35.3	0	0	0	0	110.6
791	T	20.7	Very low	24.3	Very low	123 Å²	123	136.8 Å²	136.8	76%	0.755	78%	0.777	S	S	*	*			trans	-120.5	111.6	-179.3	46.6	0	0	0	0	111.1
792	T	26.7	Very low	24.2	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	78%	0.777	S	S	*	*			trans	-152.5	108.6	164.2	42.3	0	0	0	0	107.2
793	T	22.9	Very low	24.4	Very low	117 Å²	117	134.6 Å²	134.6	72%	0.718	77%	0.771	S	S	*	*				59.1	98	77.1	64.5	0	0	0	0	114.7
794	T	22.5	Very low	24.5	Very low	126 Å²	126	134.3 Å²	134.3	77%	0.773	77%	0.769	S	S	*	*			trans	37.8	121.4	134.6	55.7	0	0	0	0	120.1
795	T	25.2	Very low	24.6	Very low	130 Å²	130	135.7 Å²	135.7	80%	0.798	77%	0.768	S	S	*	*				-169.7	147	98.8	33.3	0	0	0	0	113.6
796	N	23.8	Very low	24.6	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	77%	0.767	S	S	*	*			trans	-15.8	140	161.5	-45	-17.7	0	0	0	118.8
797	T	26.3	Very low	24.7	Very low	134 Å²	134	133.8 Å²	133.8	82%	0.822	77%	0.767	S	S	*	*				-166.4	134.3	109.7	11.5	0	0	0	0	114.4
798	T	24.3	Very low	25	Very low	112 Å²	112	134.3 Å²	134.3	69%	0.687	77%	0.769	S	S	*	*			trans	-0	125.8	149.6	53.1	0	0	0	0	119.8
799	N	28.1	Very low	25.1	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	76%	0.763	S	S	*	*				-173.1	169.9	89	-103	-27.2	0	0	0	114.2
800	N	26.3	Very low	25.3	Very low	141 Å²	141	134.5 Å²	134.5	75%	0.754	77%	0.766	S	S	*	*			trans	-56.4	142.4	-175.6	-51.3	-28.1	0	0	0	114.2
801	D	27.2	Very low	25.2	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	77%	0.767	S	S	*	*				-160.5	162.9	100	-102.7	-20.4	0	0	0	112.3
802	T	21.2	Very low	25.3	Very low	122 Å²	122	139.9 Å²	139.9	75%	0.748	78%	0.776	S	S	*	*			trans	-89.8	137.7	-167.7	53.5	0	0	0	0	114.2
803	T	26.2	Very low	25.2	Very low	123 Å²	123	144.6 Å²	144.6	76%	0.755	78%	0.78	S	S	*	*				-174.7	125.8	127.8	23.8	0	0	0	0	115.2
804	I	27.5	Very low	25.2	Very low	145 Å²	145	145.9 Å²	145.9	74%	0.744	79%	0.788	S	S	*	*			trans	53.9	103.6	136.9	-51.1	173.9	0	0	0	119.6
805	N	24.4	Very low	25.3	Very low	138 Å²	138	145 Å²	145	74%	0.738	78%	0.783	S	S	*	*				22	127.6	126.5	-49.1	-6.8	0	0	0	118
806	N	27.5	Very low	25.4	Very low	160 Å²	160	143.5 Å²	143.5	86%	0.856	78%	0.777	S	S	*	*				-162.9	153.5	61.1	-98.7	-38.7	0	0	0	112.4
807	T	24.3	Very low	25.5	Very low	135 Å²	135	143.1 Å²	143.1	83%	0.828	78%	0.78	S	S	*	*			trans	-108.1	124.7	-178.7	-49.6	0	0	0	0	112
808	I	28.9	Very low	25.4	Very low	152 Å²	152	145 Å²	145	78%	0.779	78%	0.78	S	S	*	*			trans	-137	117.2	159	-65	-174.7	0	0	0	109.5
809	H	26.1	Very low	25.6	Very low	156 Å²	156	145.8 Å²	145.8	72%	0.722	79%	0.785	S	S	*	*			trans	16.8	139.9	144	-59.6	-91.3	0	0	0	120.6
810	T	25.1	Very low	25.4	Very low	117 Å²	117	144 Å²	144	72%	0.718	78%	0.784	S	S	*	*			cis	-168.7	166.5	-7.4	12	0	0	0	0	109.8
811	S	24.6	Very low	25.3	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	78%	0.783	S	S	*	*			trans	50.8	81.8	150.3	-62.2	0	0	0	0	120.3	R813	S811-R813 PolarHBondContact O-N 3.36Å
812	R	23	Very low	25.4	Very low	250 Å²	250	140 Å²	140	94%	0.943	78%	0.779	S	S	*	*				11.8	103.5	120.5	-170.8	-165.8	-133.6	175.8	5.8	116.4
813	R	23.1	Very low	25.7	Very low	220 Å²	220	139.4 Å²	139.4	83%	0.83	78%	0.775	S	S	*	*			trans	-148.9	107.2	147.7	-154.7	175.1	-167.6	165.7	5.2	112.8	S811 T815	S811-R813 PolarHBondContact O-N 3.36Å; R813-T815 VanDerWaalsContact C-N 3.33Å; R813-T815 HydrophobicContact CG-CG2 4.13Å; R813-T815 PolarHBondContact O-N 3.37Å; R813-T815 VanDerWaalsContact O-N 3.1Å
814	T	23.5	Very low	25.8	Very low	145 Å²	145	141.9 Å²	141.9	89%	0.89	78%	0.781	S	S	*	*			trans	-75.7	86.1	160.7	47	0	0	0	0	108.9	S816	T814-S816 PolarHBondContact O-N 3.16Å
815	T	25.3	Very low	25.8	Very low	108 Å²	108	144.6 Å²	144.6	66%	0.663	78%	0.783	S	S	*	*			trans	-72.2	123.4	160.5	44.7	0	0	0	0	108.6	R813	R813-T815 VanDerWaalsContact C-N 3.33Å; R813-T815 HydrophobicContact CG-CG2 4.13Å; R813-T815 PolarHBondContact O-N 3.37Å; R813-T815 VanDerWaalsContact O-N 3.1Å
816	S	26.1	Very low	26.1	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	79%	0.786	S	S	*	*			trans	-49.7	153.8	168.4	44.7	0	0	0	0	111.6	T814 E818	T814-S816 PolarHBondContact O-N 3.16Å; S816-E818 VanDerWaalsContact C-N 3.26Å; S816-E818 PolarHBondContact O-N 3.05Å
817	T	27.6	Very low	26.3	Very low	137 Å²	137	143.7 Å²	143.7	84%	0.84	78%	0.781	S	S	*	*			trans	-63.5	85.4	169.6	50.3	0	0	0	0	110.6	T819	T817-T819 PolarHBondContact O-N 2.89Å
818	E	23.6	Very low	26.6	Very low	173 Å²	173	145.1 Å²	145.1	81%	0.808	78%	0.779	S	S	*	*			trans	-59.9	106.3	154.3	-72.1	-169.7	171.2	0	0	106.7	S816 S820	S816-E818 VanDerWaalsContact C-N 3.26Å; S816-E818 PolarHBondContact O-N 3.05Å; E818-S820 PolarHBondContact O-N 3.05Å
819	T	28.8	Very low	27	Very low	129 Å²	129	148.1 Å²	148.1	79%	0.791	79%	0.786	S	S	*	*			trans	-65.7	85.6	171.1	48.8	0	0	0	0	107.6	T817 S821	T817-T819 PolarHBondContact O-N 2.89Å; T819-S821 PolarHBondContact O-N 2.63Å; T819-S821 VanDerWaalsContact O-N 3.13Å
820	S	24	Very low	27.4	Very low	109 Å²	109	149.9 Å²	149.9	76%	0.762	79%	0.786	S	S	*	*			trans	-53.6	121.2	-174.1	50.7	0	0	0	0	109.2	E818 S822	E818-S820 PolarHBondContact O-N 3.05Å; S820-S822 VanDerWaalsContact C-N 3.31Å; S820-S822 PolarHBondContact O-N 2.84Å
821	S	24.4	Very low	27.9	Very low	105 Å²	105	155 Å²	155	73%	0.734	79%	0.792	S	S	*	*			trans	-71.9	86.3	-165.2	47.4	0	0	0	0	110.3	T819 T823	T819-S821 PolarHBondContact O-N 2.63Å; T819-S821 VanDerWaalsContact O-N 3.13Å; S821-T823 PolarHBondContact O-N 2.75Å
822	S	27.7	Very low	28.7	Very low	112 Å²	112	156.2 Å²	156.2	78%	0.783	79%	0.785	S	S	*	*			trans	-53.5	105.4	164.5	57.1	0	0	0	0	107.7	S820 M824	S820-S822 VanDerWaalsContact C-N 3.31Å; S820-S822 PolarHBondContact O-N 2.84Å; S822-M824 PolarHBondContact O-N 2.84Å
823	T	27.6	Very low	30	Very low	108 Å²	108	146.8 Å²	146.8	66%	0.663	76%	0.757	S	S	*	*			trans	-65.8	101.5	-170.7	26.3	0	0	0	0	107.9	S821 Y825	S821-T823 PolarHBondContact O-N 2.75Å; T823-Y825 VanDerWaalsContact C-N 3.25Å; T823-Y825 WeakPolarHBondContact O-CD2 3.3Å; T823-Y825 PolarHBondContact O-N 3.36Å
824	M	27.8	Very low	31.1	Very low	176 Å²	176	141 Å²	141	87%	0.867	75%	0.746	S	S	*	*			trans	-68.4	84.8	-170.7	-166.1	-169.8	-151.4	0	0	109.7	S822 T826	S822-M824 PolarHBondContact O-N 2.84Å; M824-T826 PolarHBondContact O-N 3.2Å; M824-T826 VanDerWaalsContact O-N 3.12Å
825	Y	29.3	Very low	32.2	Very low	201 Å²	201	139.1 Å²	139.1	79%	0.788	73%	0.73	S	S	*	*			trans	-48	121.9	179.1	-88.5	-87.9	0	0	0	109.2	T823 I827	T823-Y825 VanDerWaalsContact C-N 3.25Å; T823-Y825 WeakPolarHBondContact O-CD2 3.3Å; T823-Y825 PolarHBondContact O-N 3.36Å; Y825-I827 WeakPolarHBondContact O-CG1 3.43Å; Y825-I827 PolarHBondContact O-N 3.27Å
826	T	30	Very low	33.1	Very low	132 Å²	132	137.7 Å²	137.7	81%	0.81	72%	0.719	S	S	*	*			trans	-62.4	100	-174.1	42	0	0	0	0	109.3	M824 Q828	M824-T826 PolarHBondContact O-N 3.2Å; M824-T826 VanDerWaalsContact O-N 3.12Å; T826-Q828 VanDerWaalsContact C-N 3.28Å; T826-Q828 PolarHBondContact O-N 3.11Å
827	I	32.6	Very low	34.2	Very low	147 Å²	147	137.9 Å²	137.9	75%	0.754	71%	0.711	S	S	*	*			trans	-65.7	92.4	-176.8	-56.7	-177.8	0	0	0	108	Y825 K829	Y825-I827 WeakPolarHBondContact O-CG1 3.43Å; Y825-I827 PolarHBondContact O-N 3.27Å; I827-K829 PolarHBondContact O-N 3.21Å
828	Q	29.8	Very low	34.9	Very low	165 Å²	165	137.2 Å²	137.2	77%	0.771	70%	0.697	S	S	*	*			trans	-47.3	135.8	167.7	-70.8	-174.7	-10.4	0	0	108.1	T826 R830	T826-Q828 VanDerWaalsContact C-N 3.28Å; T826-Q828 PolarHBondContact O-N 3.11Å; Q828-R830 PolarHBondContact O-N 3.1Å
829	K	36.9	Very low	35.9	Very low	215 Å²	215	133.6 Å²	133.6	94%	0.935	68%	0.683	S	S	*	*			trans	-74.3	44.8	-172.3	-158.3	169.1	-178.2	172.2	0	112.6	I827 R831	I827-K829 PolarHBondContact O-N 3.21Å; K829-R831 PolarHBondContact O-N 3.44Å
830	R	34.3	Very low	36.6	Very low	193 Å²	193	129.5 Å²	129.5	73%	0.728	66%	0.66	S	S	*	*			trans	-53.4	130.2	175.2	-169.2	171.2	-175.8	153.1	-1.4	108.1	Q828 K832	Q828-R830 PolarHBondContact O-N 3.1Å; R830-K832 VanDerWaalsContact C-N 3.33Å; R830-K832 PolarHBondContact O-N 3.16Å
831	R	37	Very low	37.6	Very low	224 Å²	224	127.9 Å²	127.9	85%	0.845	64%	0.642	S	S	*	*			trans	-64.4	93.7	178	-69.3	177.8	178	160	1.3	108.6	K829 S833	K829-R831 PolarHBondContact O-N 3.44Å; R831-S833 PolarHBondContact O-N 3.48Å
832	K	41.4	Very low	38.5	Very low	134 Å²	134	129 Å²	129	58%	0.583	63%	0.634	S	S	*	*			trans	-48.3	130.1	176.8	-70.2	-170.6	177.5	-171.7	0	109.2	R830 D836	R830-K832 VanDerWaalsContact C-N 3.33Å; R830-K832 PolarHBondContact O-N 3.16Å; K832-D836 HydrophobicContact CB-CB 4.13Å
833	S	49.4	Very low	39.1	Very low	51 Å²	51	130.8 Å²	130.8	36%	0.357	63%	0.63	S	S	.	*			trans	-64.8	163.4	173.6	74.9	0	0	0	0	109.6	R831 N835 D836 L837	R831-S833 PolarHBondContact O-N 3.48Å; S833-N835 PolarHBondContact O-N 3.5Å; S833-N835 PolarHBondContact OG-N 3.08Å; S833-D836 WeakPolarHBondContact CA-OD2 3.19Å; S833-D836 VanDerWaalsContact CB-OD2 3.23Å; S833-D836 WeakPolarHBondContact CB-OD2 3.21Å; S833-D836 PolarHBondContact N-OD2 3.2Å; S833-D836 PolarHBondContact O-N 3.18Å; S833-D836 PolarHBondContact OG-N 3.07Å; S833-D836 PolarHBondContact OG-OD2 3.41Å; S833-L837 PolarHBondContact O-N 3.44Å; S833-L837 VanDerWaalsContact O-N 3.16Å
834	T	46.9	Very low	39.6	Very low	99 Å²	99	129.1 Å²	129.1	61%	0.607	62%	0.623	S	S	*	*	H	α-helix	trans	-57.7	-29.9	172.9	42.5	0	0	0	0	112.1	L837 F838	T834-L837 WeakPolarHBondContact O-CB 3.42Å; T834-L837 PolarHBondContact O-N 3.49Å; T834-F838 WeakPolarHBondContact O-CD2 3.25Å; T834-F838 PolarHBondContact O-N 2.76Å
835	N	45.8	Very low	40.1	Very low	105 Å²	105	124.9 Å²	124.9	56%	0.561	60%	0.598	S	S	*	*	H	α-helix	trans	-75.2	-37.9	-177.8	-59.4	16.7	0	0	0	110.8	S833 L837 F838 N839	S833-N835 PolarHBondContact O-N 3.5Å; S833-N835 PolarHBondContact OG-N 3.08Å; N835-L837 PolarHBondContact O-N 2.69Å; N835-F838 PolarHBondContact O-N 2.88Å; N835-N839 WeakPolarHBondContact O-CB 3.43Å; N835-N839 PolarHBondContact O-N 3.35Å; N835-N839 PolarHBondContact O-OD1 2.95Å
836	D	44.2	Very low	40.6	Very low	78 Å²	78	120.6 Å²	120.6	42%	0.417	59%	0.592	S	S	.	*	H	α-helix	trans	-64.9	-33.6	172.6	-49.7	-49.7	0	0	0	111.3	K832 S833 N839 S840	K832-D836 HydrophobicContact CB-CB 4.13Å; S833-D836 WeakPolarHBondContact CA-OD2 3.19Å; S833-D836 VanDerWaalsContact CB-OD2 3.23Å; S833-D836 WeakPolarHBondContact CB-OD2 3.21Å; S833-D836 PolarHBondContact N-OD2 3.2Å; S833-D836 PolarHBondContact O-N 3.18Å; S833-D836 PolarHBondContact OG-N 3.07Å; S833-D836 PolarHBondContact OG-OD2 3.41Å; D836-N839 PolarHBondContact O-N 2.93Å; D836-S840 WeakPolarHBondContact O-CB 3.39Å; D836-S840 PolarHBondContact O-N 3.14Å; D836-S840 PolarHBondContact O-OG 3.01Å
837	L	48.8	Very low	40.9	Very low	102 Å²	102	122.9 Å²	122.9	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-70.1	-31	175.5	-126.8	171.7	0	0	0	112.3	S833 T834 N835 L841	S833-L837 PolarHBondContact O-N 3.44Å; S833-L837 VanDerWaalsContact O-N 3.16Å; T834-L837 WeakPolarHBondContact O-CB 3.42Å; T834-L837 PolarHBondContact O-N 3.49Å; N835-L837 PolarHBondContact O-N 2.69Å; L837-L841 WeakPolarHBondContact O-CB 3.27Å; L837-L841 PolarHBondContact O-N 3.39Å
838	F	43.1	Very low	40.9	Very low	123 Å²	123	122.6 Å²	122.6	54%	0.539	59%	0.594	S	S	.	*	H	α-helix	trans	-74.1	-48.4	168.8	-79.8	-67.2	0	0	0	111.4	T834 N835 S840 L841 F842	T834-F838 WeakPolarHBondContact O-CD2 3.25Å; T834-F838 PolarHBondContact O-N 2.76Å; N835-F838 PolarHBondContact O-N 2.88Å; F838-S840 VanDerWaalsContact C-N 3.35Å; F838-S840 PolarHBondContact O-N 3.43Å; F838-L841 CarbonylContact O-C 3.59Å; F838-L841 WeakPolarHBondContact O-CA 3.27Å; F838-L841 VanDerWaalsContact O-CB 3.26Å; F838-L841 WeakPolarHBondContact O-CB 3.37Å; F838-L841 PolarHBondContact O-N 3.03Å; F838-F842 HydrophobicContact CB-CE2 4.38Å; F838-F842 WeakPolarHBondContact O-CD2 3.4Å; F838-F842 PolarHBondContact O-N 3.44Å
839	N	44.1	Very low	41.3	Very low	97 Å²	97	121.3 Å²	121.3	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-62.1	-40.4	-178.2	-72	5.4	0	0	0	111.9	N835 D836 L841 F842 Q843	N835-N839 WeakPolarHBondContact O-CB 3.43Å; N835-N839 PolarHBondContact O-N 3.35Å; N835-N839 PolarHBondContact O-OD1 2.95Å; D836-N839 PolarHBondContact O-N 2.93Å; N839-L841 VanDerWaalsContact C-N 3.26Å; N839-L841 PolarHBondContact O-N 3.34Å; N839-F842 PolarHBondContact O-N 3.25Å; N839-Q843 PolarHBondContact O-N 3.29Å
840	S	44	Very low	41.2	Very low	44 Å²	44	118.2 Å²	118.2	31%	0.308	58%	0.584	S	S	.	*	H	α-helix	trans	-68	-25.5	173.3	70.2	0	0	0	0	113.1	D836 F838 S844	D836-S840 WeakPolarHBondContact O-CB 3.39Å; D836-S840 PolarHBondContact O-N 3.14Å; D836-S840 PolarHBondContact O-OG 3.01Å; F838-S840 VanDerWaalsContact C-N 3.35Å; F838-S840 PolarHBondContact O-N 3.43Å; S840-S844 VanDerWaalsContact O-CB 3.25Å; S840-S844 WeakPolarHBondContact O-CB 3.45Å; S840-S844 PolarHBondContact O-N 3.28Å; S840-S844 PolarHBondContact O-OG 3.37Å; S840-S844 VanDerWaalsContact O-OG 3.09Å
841	L	43.8	Very low	41.1	Very low	74 Å²	74	117.8 Å²	117.8	39%	0.387	59%	0.59	S	S	.	*	H	α-helix	trans	-75.1	-25.9	173.9	-117.4	163.5	0	0	0	112.8	L837 F838 N839	L837-L841 WeakPolarHBondContact O-CB 3.27Å; L837-L841 PolarHBondContact O-N 3.39Å; F838-L841 CarbonylContact O-C 3.59Å; F838-L841 WeakPolarHBondContact O-CA 3.27Å; F838-L841 VanDerWaalsContact O-CB 3.26Å; F838-L841 WeakPolarHBondContact O-CB 3.37Å; F838-L841 PolarHBondContact O-N 3.03Å; N839-L841 VanDerWaalsContact C-N 3.26Å; N839-L841 PolarHBondContact O-N 3.34Å
842	F	44.8	Very low	41	Very low	129 Å²	129	111.8 Å²	111.8	57%	0.566	58%	0.578	S	S	*	*	H	α-helix	trans	-82.1	-38.9	170.3	-69.3	-66.1	0	0	0	111.7	F838 N839 R845	F838-F842 HydrophobicContact CB-CE2 4.38Å; F838-F842 WeakPolarHBondContact O-CD2 3.4Å; F838-F842 PolarHBondContact O-N 3.44Å; N839-F842 PolarHBondContact O-N 3.25Å; F842-R845 WeakPolarHBondContact O-CB 3.25Å; F842-R845 PolarHBondContact O-N 3.39Å
843	Q	39	Very low	40.9	Very low	149 Å²	149	118 Å²	118	70%	0.696	60%	0.598	S	S	*	*	H	α-helix	trans	-73.2	-32.4	176.6	-75.1	-176.1	-40.4	0	0	113.9	N839 R845 T846	N839-Q843 PolarHBondContact O-N 3.29Å; Q843-R845 PolarHBondContact O-N 3.48Å; Q843-T846 PolarHBondContact O-OG1 3.38Å; Q843-T846 VanDerWaalsContact O-OG1 3.13Å
844	S	39.9	Very low	40.6	Very low	74 Å²	74	119.4 Å²	119.4	52%	0.517	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-74.2	-4.5	172.2	72.7	0	0	0	0	113.3	S840 T846	S840-S844 VanDerWaalsContact O-CB 3.25Å; S840-S844 WeakPolarHBondContact O-CB 3.45Å; S840-S844 PolarHBondContact O-N 3.28Å; S840-S844 PolarHBondContact O-OG 3.37Å; S840-S844 VanDerWaalsContact O-OG 3.09Å; S844-T846 VanDerWaalsContact C-N 3.32Å
845	R	36.9	Very low	40.6	Very low	86 Å²	86	116 Å²	116	33%	0.325	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-86.6	2.4	-176.8	-127.4	175.7	-172.2	168.1	4.5	113.5	F842 Q843 L849 S855 D856	F842-R845 WeakPolarHBondContact O-CB 3.25Å; F842-R845 PolarHBondContact O-N 3.39Å; Q843-R845 PolarHBondContact O-N 3.48Å; R845-L849 WeakPolarHBondContact O-CD1 3.47Å; R845-S855 PolarHBondContact NH2-OG 3.1Å; R845-D856 IonicContact CZ-OD2 3.69Å; R845-D856 IonicContact NH1-OD2 3.36Å; R845-D856 PolarHBondContact NH1-OD2 3.45Å; R845-D856 IonicContact NH2-OD1 3.17Å; R845-D856 PolarHBondContact NH2-OD1 3.33Å; R845-D856 VanDerWaalsContact NH2-OD1 3.17Å; R845-D856 IonicContact NH2-OD2 3Å; R845-D856 PolarHBondContact NH2-OD2 3.34Å
846	T	40.5	Very low	40.6	Very low	111 Å²	111	115.5 Å²	115.5	68%	0.681	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-88.6	-15.9	-178.5	51.8	0	0	0	0	114.6	Q843 S844	Q843-T846 PolarHBondContact O-OG1 3.38Å; Q843-T846 VanDerWaalsContact O-OG1 3.13Å; S844-T846 VanDerWaalsContact C-N 3.32Å
847	Q	35.8	Very low	40.4	Very low	180 Å²	180	117.9 Å²	117.9	84%	0.841	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-42	-179.6	-69.9	-175.5	-46.1	0	0	112.9	L849	Q847-L849 VanDerWaalsContact C-N 3.27Å; Q847-L849 PolarHBondContact O-N 2.84Å; Q847-L849 VanDerWaalsContact O-N 3.16Å
848	D	33.1	Very low	40.9	Very low	142 Å²	142	116.1 Å²	116.1	76%	0.759	59%	0.59	S	S	*	*			trans	-88.9	42.3	177.3	-61.4	-32.6	0	0	0	113.1	I850	D848-I850 PolarHBondContact O-N 2.93Å
849	L	36.8	Very low	41.5	Very low	137 Å²	137	114.7 Å²	114.7	72%	0.717	59%	0.587	S	S	*	*			trans	-81.3	35.4	-173.8	-160.5	71.9	0	0	0	114	R845 Q847	R845-L849 WeakPolarHBondContact O-CD1 3.47Å; Q847-L849 VanDerWaalsContact C-N 3.27Å; Q847-L849 PolarHBondContact O-N 2.84Å; Q847-L849 VanDerWaalsContact O-N 3.16Å
850	I	35.7	Very low	41.8	Very low	150 Å²	150	115.5 Å²	115.5	77%	0.769	59%	0.591	S	S	*	*	S	Bend	trans	-128.4	120.5	172	-58.8	-177.5	0	0	0	109.5	D848	D848-I850 PolarHBondContact O-N 2.93Å
851	Q	32.4	Very low	42.2	Very low	184 Å²	184	115.2 Å²	115.2	86%	0.86	59%	0.586	S	S	*	*	S	Bend	trans	72.3	45	158.9	-153.4	177.6	13.7	0	0	120.9
852	T	34.8	Very low	43	Very low	98 Å²	98	116 Å²	116	60%	0.601	59%	0.588	S	S	*	*			trans	-148.6	66.8	153.2	43.2	0	0	0	0	116	S854	T852-S854 PolarHBondContact O-N 3.28Å
853	R	38.5	Very low	43.4	Very low	264 Å²	264	112.5 Å²	112.5	100%	0.996	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	21.5	171.3	-151.4	177.7	-177.5	176.4	2.3	114.5
854	S	44.3	Very low	44.1	Very low	81 Å²	81	110 Å²	110	57%	0.566	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	-4.5	-177	54.3	0	0	0	0	113.8	T852 D856 S858	T852-S854 PolarHBondContact O-N 3.28Å; S854-D856 PolarHBondContact O-N 3.01Å; S854-S858 PolarHBondContact O-N 3.17Å
855	S	47	Very low	45.3	Very low	28 Å²	28	111.4 Å²	111.4	20%	0.196	57%	0.567	C	S	.	*	H	α-helix	trans	-58.4	-41.9	-174.2	55.2	0	0	0	0	113.6	R845 S858 I859	R845-S855 PolarHBondContact NH2-OG 3.1Å; S855-S858 WeakPolarHBondContact O-CA 3.2Å; S855-S858 WeakPolarHBondContact O-CB 3.14Å; S855-S858 PolarHBondContact O-N 3.13Å; S855-S858 PolarHBondContact O-OG 3Å; S855-I859 WeakPolarHBondContact O-CG1 3.39Å; S855-I859 PolarHBondContact O-N 2.93Å
856	D	44.6	Very low	46.8	Very low	95 Å²	95	114.3 Å²	114.3	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-82.2	-31.7	-158.8	-56.6	-15.4	0	0	0	111.9	R845 S854	R845-D856 IonicContact CZ-OD2 3.69Å; R845-D856 IonicContact NH1-OD2 3.36Å; R845-D856 PolarHBondContact NH1-OD2 3.45Å; R845-D856 IonicContact NH2-OD1 3.17Å; R845-D856 PolarHBondContact NH2-OD1 3.33Å; R845-D856 VanDerWaalsContact NH2-OD1 3.17Å; R845-D856 IonicContact NH2-OD2 3Å; R845-D856 PolarHBondContact NH2-OD2 3.34Å; S854-D856 PolarHBondContact O-N 3.01Å
857	E	41.3	Very low	47.9	Very low	128 Å²	128	114.6 Å²	114.6	60%	0.598	57%	0.572	S	S	*	*	H	α-helix	trans	-64.4	-43.9	161.2	-73.5	-154.1	148.6	0	0	111.1	I859 L860 I861	E857-I859 VanDerWaalsContact C-N 3.31Å; E857-I859 PolarHBondContact O-N 3.41Å; E857-L860 PolarHBondContact O-N 3.3Å; E857-I861 HydrophobicContact CB-CD1 4.05Å; E857-I861 WeakPolarHBondContact O-CB 3.27Å; E857-I861 WeakPolarHBondContact O-CD1 3.33Å; E857-I861 WeakPolarHBondContact O-CG1 3.46Å; E857-I861 PolarHBondContact O-N 2.95Å
858	S	58.1	Low	49.4	Very low	64 Å²	64	107.3 Å²	107.3	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-60.4	-38.5	-174.3	87.8	0	0	0	0	112.7	S854 S855 Q862	S854-S858 PolarHBondContact O-N 3.17Å; S855-S858 WeakPolarHBondContact O-CA 3.2Å; S855-S858 WeakPolarHBondContact O-CB 3.14Å; S855-S858 PolarHBondContact O-N 3.13Å; S855-S858 PolarHBondContact O-OG 3Å; S858-Q862 VanDerWaalsContact O-CB 3.24Å; S858-Q862 WeakPolarHBondContact O-CB 3.43Å; S858-Q862 PolarHBondContact O-N 2.96Å
859	I	57	Low	51.3	Low	93 Å²	93	108.8 Å²	108.8	48%	0.477	53%	0.532	S	S	.	.	H	α-helix	trans	-69.9	-43.9	179.3	-66	166	0	0	0	110.8	S855 E857 Q862 A863	S855-I859 WeakPolarHBondContact O-CG1 3.39Å; S855-I859 PolarHBondContact O-N 2.93Å; E857-I859 VanDerWaalsContact C-N 3.31Å; E857-I859 PolarHBondContact O-N 3.41Å; I859-Q862 PolarHBondContact O-N 2.97Å; I859-A863 WeakPolarHBondContact O-CB 3.42Å; I859-A863 PolarHBondContact O-N 3.42Å
860	L	50.4	Low	53	Low	114 Å²	114	110.6 Å²	110.6	60%	0.597	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-42.2	175.9	-173.5	117.5	0	0	0	111.4	E857 A863 L864	E857-L860 PolarHBondContact O-N 3.3Å; L860-A863 PolarHBondContact O-N 3.45Å; L860-L864 HydrophobicContact CD2-CD1 3.81Å; L860-L864 HydrophobicContact CG-CD1 4.27Å; L860-L864 WeakPolarHBondContact O-CB 3.41Å; L860-L864 VanDerWaalsContact O-CG 3.29Å; L860-L864 WeakPolarHBondContact O-CG 3.21Å; L860-L864 PolarHBondContact O-N 2.95Å
861	I	51.4	Low	54.7	Low	38 Å²	38	104.8 Å²	104.8	20%	0.195	50%	0.501	C	S	.	.	H	α-helix	trans	-63.7	-42.4	174.6	-67.8	161.1	0	0	0	110.6	F602 E857 L864 R865	F602-I861 HydrophobicContact CD1-CD1 4.28Å; F602-I861 HydrophobicContact CE1-CD1 3.41Å; F602-I861 VanDerWaalsContact CE1-CD1 3.41Å; F602-I861 HydrophobicContact CE1-CG1 4.38Å; F602-I861 HydrophobicContact CE2-CD1 4.38Å; F602-I861 HydrophobicContact CE2-CG2 4.4Å; F602-I861 HydrophobicContact CZ-CD1 3.48Å; F602-I861 VanDerWaalsContact CZ-CD1 3.48Å; F602-I861 HydrophobicContact CZ-CG1 3.94Å; F602-I861 HydrophobicContact CZ-CG2 4.48Å; E857-I861 HydrophobicContact CB-CD1 4.05Å; E857-I861 WeakPolarHBondContact O-CB 3.27Å; E857-I861 WeakPolarHBondContact O-CD1 3.33Å; E857-I861 WeakPolarHBondContact O-CG1 3.46Å; E857-I861 PolarHBondContact O-N 2.95Å; I861-L864 PolarHBondContact O-N 3.23Å; I861-R865 WeakPolarHBondContact O-CB 3.42Å; I861-R865 PolarHBondContact O-N 3.47Å
862	Q	60	Low	56.7	Low	92 Å²	92	97.9 Å²	97.9	43%	0.43	47%	0.47	S	S	.	.	H	α-helix	trans	-66.8	-39.1	177.5	-162.8	-162.9	85.9	0	0	111.5	S858 I859 R865 R866	S858-Q862 VanDerWaalsContact O-CB 3.24Å; S858-Q862 WeakPolarHBondContact O-CB 3.43Å; S858-Q862 PolarHBondContact O-N 2.96Å; I859-Q862 PolarHBondContact O-N 2.97Å; Q862-R865 PolarHBondContact O-N 3.44Å; Q862-R866 VanDerWaalsContact O-CB 3.31Å; Q862-R866 WeakPolarHBondContact O-CB 3.28Å; Q862-R866 VanDerWaalsContact O-CG 3.25Å; Q862-R866 WeakPolarHBondContact O-CG 3.37Å; Q862-R866 PolarHBondContact O-N 3.5Å; Q862-R866 VanDerWaalsContact OE1-NH2 3.15Å
863	A	54.5	Low	58.7	Low	54 Å²	54	102.1 Å²	102.1	45%	0.446	48%	0.475	S	S	.	.	H	α-helix	trans	-64	-44.4	173.7	0	0	0	0	0	111.8	I859 L860 R866 Q867	I859-A863 WeakPolarHBondContact O-CB 3.42Å; I859-A863 PolarHBondContact O-N 3.42Å; L860-A863 PolarHBondContact O-N 3.45Å; A863-R866 PolarHBondContact O-N 2.93Å; A863-Q867 WeakPolarHBondContact O-CB 3.38Å; A863-Q867 PolarHBondContact O-N 3.47Å
864	L	53.3	Low	60.4	Low	97 Å²	97	91 Å²	91	51%	0.508	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-43.7	173.5	-74.2	169.8	0	0	0	111.7	L860 I861 Q867 H868	L860-L864 HydrophobicContact CD2-CD1 3.81Å; L860-L864 HydrophobicContact CG-CD1 4.27Å; L860-L864 WeakPolarHBondContact O-CB 3.41Å; L860-L864 VanDerWaalsContact O-CG 3.29Å; L860-L864 WeakPolarHBondContact O-CG 3.21Å; L860-L864 PolarHBondContact O-N 2.95Å; I861-L864 PolarHBondContact O-N 3.23Å; L864-Q867 PolarHBondContact O-N 3.27Å; L864-H868 WeakPolarHBondContact O-CB 3.48Å; L864-H868 PolarHBondContact O-N 3.05Å
865	R	64.8	Low	61.9	Low	103 Å²	103	87.5 Å²	87.5	39%	0.389	41%	0.41	S	S	.	.	H	α-helix	trans	-62.2	-41.9	176	-173.3	-178.2	-84.8	167.2	-5.7	111.1	D599 I861 Q862 H868 R869	D599-R865 IonicContact OD1-CZ 3.69Å; D599-R865 IonicContact OD1-NE 3.65Å; D599-R865 IonicContact OD1-NH2 3.23Å; D599-R865 PolarHBondContact OD1-NH2 3.34Å; I861-R865 WeakPolarHBondContact O-CB 3.42Å; I861-R865 PolarHBondContact O-N 3.47Å; Q862-R865 PolarHBondContact O-N 3.44Å; R865-H868 PolarHBondContact O-N 2.89Å; R865-R869 WeakPolarHBondContact O-CB 3.46Å; R865-R869 WeakPolarHBondContact O-CG 3.46Å; R865-R869 PolarHBondContact O-N 3.25Å
866	R	68.6	Low	63.4	Low	148 Å²	148	90.2 Å²	90.2	56%	0.558	42%	0.422	S	S	*	.	H	α-helix	trans	-63.7	-44.7	172.9	-76.5	170.5	172.1	-179	-1.5	111.9	Q862 A863 R870	Q862-R866 VanDerWaalsContact O-CB 3.31Å; Q862-R866 WeakPolarHBondContact O-CB 3.28Å; Q862-R866 VanDerWaalsContact O-CG 3.25Å; Q862-R866 WeakPolarHBondContact O-CG 3.37Å; Q862-R866 PolarHBondContact O-N 3.5Å; Q862-R866 VanDerWaalsContact OE1-NH2 3.15Å; A863-R866 PolarHBondContact O-N 2.93Å; R866-R870 WeakPolarHBondContact O-CD 3.39Å; R866-R870 VanDerWaalsContact O-CG 3.27Å; R866-R870 WeakPolarHBondContact O-CG 3.48Å; R866-R870 PolarHBondContact O-N 2.89Å
867	Q	64.4	Low	65	Low	117 Å²	117	88.7 Å²	88.7	55%	0.547	41%	0.413	S	S	.	.	H	α-helix	trans	-65.3	-41.6	175.8	-178.9	171.8	-34	0	0	111.7	A863 L864 R870 T871	A863-Q867 WeakPolarHBondContact O-CB 3.38Å; A863-Q867 PolarHBondContact O-N 3.47Å; L864-Q867 PolarHBondContact O-N 3.27Å; Q867-R870 WeakPolarHBondContact O-CB 3.23Å; Q867-R870 PolarHBondContact O-N 2.88Å; Q867-T871 PolarHBondContact O-N 3.34Å; Q867-T871 PolarHBondContact O-OG1 3.03Å
868	H	67.5	Low	66.7	Low	26 Å²	26	82.9 Å²	82.9	12%	0.12	39%	0.386	C	S	.	.	H	α-helix	trans	-70.8	-42.3	-177.8	-161.7	-66.7	0	0	0	112.5	I591 V595 L864 R865 R870 T871 L872	I591-H868 WeakPolarHBondContact CG2-CE1 3.21Å; V595-H868 WeakPolarHBondContact CG2-CE1 3.41Å; V595-H868 VanDerWaalsContact CG2-ND1 3.35Å; V595-H868 WeakPolarHBondContact CG2-ND1 3.4Å; L864-H868 WeakPolarHBondContact O-CB 3.48Å; L864-H868 PolarHBondContact O-N 3.05Å; R865-H868 PolarHBondContact O-N 2.89Å; H868-R870 PolarHBondContact O-N 3.48Å; H868-T871 PolarHBondContact O-N 3.05Å; H868-L872 WeakPolarHBondContact O-CB 3.31Å; H868-L872 PolarHBondContact O-N 2.9Å
869	R	72.8	Confident	67.9	Low	173 Å²	173	81.6 Å²	81.6	65%	0.653	37%	0.374	S	S	*	.	H	α-helix	trans	-59	-36.9	171.3	-75.3	-177.8	178.3	-171.7	-0.6	111.3	R865 R873	R865-R869 WeakPolarHBondContact O-CB 3.46Å; R865-R869 WeakPolarHBondContact O-CG 3.46Å; R865-R869 PolarHBondContact O-N 3.25Å; R869-R873 WeakPolarHBondContact O-CB 3.46Å; R869-R873 WeakPolarHBondContact O-CG 3.5Å; R869-R873 PolarHBondContact O-N 3.3Å
870	R	72.5	Confident	69.1	Low	175 Å²	175	81.9 Å²	81.9	66%	0.66	38%	0.376	S	S	*	.	H	α-helix	trans	-66.6	-45.2	172.8	-71.6	167.4	177.7	173.3	-1.2	112.4	R866 Q867 H868 R873 I874	R866-R870 WeakPolarHBondContact O-CD 3.39Å; R866-R870 VanDerWaalsContact O-CG 3.27Å; R866-R870 WeakPolarHBondContact O-CG 3.48Å; R866-R870 PolarHBondContact O-N 2.89Å; Q867-R870 WeakPolarHBondContact O-CB 3.23Å; Q867-R870 PolarHBondContact O-N 2.88Å; H868-R870 PolarHBondContact O-N 3.48Å; R870-R873 PolarHBondContact O-N 3.09Å; R870-I874 WeakPolarHBondContact O-CD1 3.49Å; R870-I874 VanDerWaalsContact O-CG1 3.28Å; R870-I874 WeakPolarHBondContact O-CG1 3.5Å; R870-I874 PolarHBondContact O-N 3.25Å
871	T	71	Confident	70.6	Confident	28 Å²	28	78.1 Å²	78.1	17%	0.172	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-42.7	176.6	-62	0	0	0	0	112.1	I338 Q867 H868 I874 L875	I338-T871 HydrophobicContact CD1-CG2 3.94Å; Q867-T871 PolarHBondContact O-N 3.34Å; Q867-T871 PolarHBondContact O-OG1 3.03Å; H868-T871 PolarHBondContact O-N 3.05Å; T871-I874 PolarHBondContact O-N 2.83Å; T871-L875 WeakPolarHBondContact O-CB 3.43Å; T871-L875 PolarHBondContact O-N 2.77Å
872	L	73.6	Confident	72.2	Confident	40 Å²	40	76.5 Å²	76.5	21%	0.209	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-43.4	178.4	179	142.1	0	0	0	111.9	I591 Y592 H868 I874 L875 I876	I591-L872 HydrophobicContact CG2-CD1 4.34Å; Y592-L872 HydrophobicContact CD2-CD1 4.25Å; H868-L872 WeakPolarHBondContact O-CB 3.31Å; H868-L872 PolarHBondContact O-N 2.9Å; L872-I874 VanDerWaalsContact C-N 3.33Å; L872-I874 PolarHBondContact O-N 3.32Å; L872-L875 PolarHBondContact O-N 2.84Å; L872-L875 VanDerWaalsContact O-N 3.16Å; L872-I876 HydrophobicContact CD2-CD1 3.57Å; L872-I876 HydrophobicContact CG-CD1 4.1Å; L872-I876 WeakPolarHBondContact O-CG1 3.17Å; L872-I876 PolarHBondContact O-N 3.37Å
873	R	77.1	Confident	73.4	Confident	186 Å²	186	75 Å²	75	70%	0.702	34%	0.344	S	S	*	.	H	α-helix	trans	-56.3	-46.2	171.5	-77.3	-178.4	-179.8	-169.8	-1.3	111.9	R869 R870 L875 I876 I877	R869-R873 WeakPolarHBondContact O-CB 3.46Å; R869-R873 WeakPolarHBondContact O-CG 3.5Å; R869-R873 PolarHBondContact O-N 3.3Å; R870-R873 PolarHBondContact O-N 3.09Å; R873-L875 VanDerWaalsContact C-N 3.33Å; R873-L875 PolarHBondContact O-N 3.17Å; R873-I876 PolarHBondContact O-N 3.14Å; R873-I877 WeakPolarHBondContact O-CB 3.46Å; R873-I877 WeakPolarHBondContact O-CD1 3.42Å; R873-I877 VanDerWaalsContact O-CG1 3.29Å; R873-I877 WeakPolarHBondContact O-CG1 3.48Å; R873-I877 PolarHBondContact O-N 3.45Å
874	I	74.1	Confident	74.8	Confident	30 Å²	30	76.1 Å²	76.1	15%	0.154	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-37.8	177.9	-66.8	163.9	0	0	0	111.3	R870 T871 L872 I877 L878 W929	R870-I874 WeakPolarHBondContact O-CD1 3.49Å; R870-I874 VanDerWaalsContact O-CG1 3.28Å; R870-I874 WeakPolarHBondContact O-CG1 3.5Å; R870-I874 PolarHBondContact O-N 3.25Å; T871-I874 PolarHBondContact O-N 2.83Å; L872-I874 VanDerWaalsContact C-N 3.33Å; L872-I874 PolarHBondContact O-N 3.32Å; I874-I877 PolarHBondContact O-N 3.38Å; I874-L878 HydrophobicContact CG2-CD1 3.94Å; I874-L878 HydrophobicContact CG2-CG 4.48Å; I874-L878 WeakPolarHBondContact O-CB 3.1Å; I874-L878 WeakPolarHBondContact O-CD1 3.33Å; I874-L878 VanDerWaalsContact O-CG 3.24Å; I874-L878 WeakPolarHBondContact O-CG 3.42Å; I874-L878 PolarHBondContact O-N 2.95Å; I874-W929 HydrophobicContact CG1-CZ3 4.49Å
875	L	76.1	Confident	76.3	Confident	8 Å²	8	71.6 Å²	71.6	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-76	-27.3	-178.8	-162.5	64	0	0	0	113.3	N588 I591 T871 L872 R873 L878 L879	N588-L875 WeakPolarHBondContact OD1-CD2 3.24Å; N588-L875 VanDerWaalsContact OD1-CG 3.3Å; N588-L875 WeakPolarHBondContact OD1-CG 3.35Å; I591-L875 HydrophobicContact CD1-CD2 3.72Å; T871-L875 WeakPolarHBondContact O-CB 3.43Å; T871-L875 PolarHBondContact O-N 2.77Å; L872-L875 PolarHBondContact O-N 2.84Å; L872-L875 VanDerWaalsContact O-N 3.16Å; R873-L875 VanDerWaalsContact C-N 3.33Å; R873-L875 PolarHBondContact O-N 3.17Å; L875-L878 HydrophobicContact CD1-CD1 4.3Å; L875-L879 WeakPolarHBondContact O-CB 3.42Å; L875-L879 PolarHBondContact O-N 3Å
876	I	79.1	Confident	77.2	Confident	86 Å²	86	66.9 Å²	66.9	44%	0.441	30%	0.3	S	S	.	.	H	α-helix	trans	-72.6	-44.5	168.9	-68.5	171.8	0	0	0	110.8	L872 R873 L878 L879 L880	L872-I876 HydrophobicContact CD2-CD1 3.57Å; L872-I876 HydrophobicContact CG-CD1 4.1Å; L872-I876 WeakPolarHBondContact O-CG1 3.17Å; L872-I876 PolarHBondContact O-N 3.37Å; R873-I876 PolarHBondContact O-N 3.14Å; I876-L878 VanDerWaalsContact C-N 3.28Å; I876-L878 PolarHBondContact O-N 3.1Å; I876-L879 PolarHBondContact O-N 3Å; I876-L879 VanDerWaalsContact O-N 3.16Å; I876-L880 WeakPolarHBondContact O-CB 3.35Å; I876-L880 PolarHBondContact O-N 2.95Å
877	I	78.2	Confident	77.9	Confident	63 Å²	63	60 Å²	60	32%	0.323	28%	0.276	S	S	.	.	H	α-helix	trans	-59.2	-41.5	174.5	-71.3	160.9	0	0	0	110.6	R873 I874 L880 I881 W929	R873-I877 WeakPolarHBondContact O-CB 3.46Å; R873-I877 WeakPolarHBondContact O-CD1 3.42Å; R873-I877 VanDerWaalsContact O-CG1 3.29Å; R873-I877 WeakPolarHBondContact O-CG1 3.48Å; R873-I877 PolarHBondContact O-N 3.45Å; I874-I877 PolarHBondContact O-N 3.38Å; I877-L880 PolarHBondContact O-N 3.08Å; I877-I881 HydrophobicContact CG2-CD1 3.69Å; I877-I881 HydrophobicContact CG2-CG1 4.46Å; I877-I881 WeakPolarHBondContact O-CB 3.43Å; I877-I881 VanDerWaalsContact O-CG1 3.32Å; I877-I881 WeakPolarHBondContact O-CG1 3.36Å; I877-I881 PolarHBondContact O-N 3.08Å; I877-W929 HydrophobicContact CD1-CH2 4.19Å; I877-W929 HydrophobicContact CD1-CZ3 4.35Å
878	L	76.3	Confident	78.9	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-42.6	173.9	-79.2	166.1	0	0	0	112.9	I874 L875 I876 I881 F882 I925 Y926	I874-L878 HydrophobicContact CG2-CD1 3.94Å; I874-L878 HydrophobicContact CG2-CG 4.48Å; I874-L878 WeakPolarHBondContact O-CB 3.1Å; I874-L878 WeakPolarHBondContact O-CD1 3.33Å; I874-L878 VanDerWaalsContact O-CG 3.24Å; I874-L878 WeakPolarHBondContact O-CG 3.42Å; I874-L878 PolarHBondContact O-N 2.95Å; L875-L878 HydrophobicContact CD1-CD1 4.3Å; I876-L878 VanDerWaalsContact C-N 3.28Å; I876-L878 PolarHBondContact O-N 3.1Å; L878-I881 PolarHBondContact O-N 2.73Å; L878-F882 VanDerWaalsContact O-CB 3.23Å; L878-F882 WeakPolarHBondContact O-CB 3.21Å; L878-F882 PolarHBondContact O-N 3.28Å; L878-I925 HydrophobicContact CD2-CB 4.29Å; L878-I925 HydrophobicContact CD2-CG2 3.5Å; L878-I925 HydrophobicContact CG-CG2 4.06Å; L878-Y926 HydrophobicContact CD1-CE1 3.77Å; L878-Y926 HydrophobicContact CD1-CE2 4.42Å; L878-Y926 HydrophobicContact CD2-CD2 4.03Å; L878-Y926 HydrophobicContact CD2-CE1 4.2Å; L878-Y926 HydrophobicContact CD2-CE2 3.36Å; L878-Y926 VanDerWaalsContact CD2-CZ 3.47Å
879	L	82.3	Confident	79.7	Confident	38 Å²	38	55.3 Å²	55.3	20%	0.199	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-45.1	175.9	-178.7	68.1	0	0	0	111.4	L581 L584 I585 L875 I876 F882 V883	L581-L879 HydrophobicContact CD1-CD1 3.75Å; L584-L879 HydrophobicContact CB-CD1 3.93Å; I585-L879 HydrophobicContact CG1-CD1 4.03Å; I585-L879 HydrophobicContact CG1-CD2 4.22Å; L875-L879 WeakPolarHBondContact O-CB 3.42Å; L875-L879 PolarHBondContact O-N 3Å; I876-L879 PolarHBondContact O-N 3Å; I876-L879 VanDerWaalsContact O-N 3.16Å; L879-F882 PolarHBondContact O-N 3.36Å; L879-V883 WeakPolarHBondContact O-CB 3.49Å; L879-V883 VanDerWaalsContact O-CG2 3.32Å; L879-V883 WeakPolarHBondContact O-CG2 3.29Å; L879-V883 PolarHBondContact O-N 3.17Å
880	L	82.9	Confident	80.3	Confident	99 Å²	99	47.4 Å²	47.4	52%	0.518	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-45.4	178.2	177.9	146.8	0	0	0	111.7	I876 I877 V883 I884	I876-L880 WeakPolarHBondContact O-CB 3.35Å; I876-L880 PolarHBondContact O-N 2.95Å; I877-L880 PolarHBondContact O-N 3.08Å; L880-V883 PolarHBondContact O-N 3.29Å; L880-I884 HydrophobicContact CD2-CD1 3.57Å; L880-I884 HydrophobicContact CG-CD1 4.08Å; L880-I884 WeakPolarHBondContact O-CB 3.35Å; L880-I884 WeakPolarHBondContact O-CG1 3.33Å; L880-I884 PolarHBondContact O-N 3.38Å
881	I	83.2	Confident	80.9	Confident	34 Å²	34	43.8 Å²	43.8	17%	0.174	22%	0.222	C	C	.	.	H	α-helix	trans	-69.6	-37.2	179.3	-68.5	173.2	0	0	0	111.1	I877 L878 I884 C885 L921 I925	I877-I881 HydrophobicContact CG2-CD1 3.69Å; I877-I881 HydrophobicContact CG2-CG1 4.46Å; I877-I881 WeakPolarHBondContact O-CB 3.43Å; I877-I881 VanDerWaalsContact O-CG1 3.32Å; I877-I881 WeakPolarHBondContact O-CG1 3.36Å; I877-I881 PolarHBondContact O-N 3.08Å; L878-I881 PolarHBondContact O-N 2.73Å; I881-I884 PolarHBondContact O-N 2.86Å; I881-C885 WeakPolarHBondContact O-CB 3.36Å; I881-C885 PolarHBondContact O-N 3.11Å; I881-C885 PolarHBondContact O-SG 2.71Å; I881-L921 HydrophobicContact CG2-CB 4.35Å; I881-L921 HydrophobicContact CG2-CD1 4.17Å; I881-I925 HydrophobicContact CB-CD1 4.43Å; I881-I925 HydrophobicContact CD1-CD1 3.52Å; I881-I925 HydrophobicContact CG2-CD1 3.91Å
882	F	83.7	Confident	81.5	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-49.2	171.8	178.2	-85.7	0	0	0	111.8	F577 P580 L581 L584 L878 L879 C885 R886	F577-F882 AromaticContact CD2-CE1 3.84Å; F577-F882 HydrophobicContact CD2-CE1 3.84Å; F577-F882 HydrophobicContact CD2-CZ 4.38Å; F577-F882 HydrophobicContact CE2-CE1 4.12Å; P580-F882 HydrophobicContact CB-CE2 4.12Å; P580-F882 HydrophobicContact CB-CZ 3.73Å; L581-F882 HydrophobicContact CB-CE1 4.2Å; L581-F882 HydrophobicContact CD1-CD1 4.44Å; L584-F882 HydrophobicContact CD1-CB 4.35Å; L584-F882 HydrophobicContact CD1-CD1 4.2Å; L584-F882 HydrophobicContact CD1-CD2 4.05Å; L584-F882 HydrophobicContact CD1-CE2 4.47Å; L584-F882 HydrophobicContact CD1-CG 3.93Å; L878-F882 VanDerWaalsContact O-CB 3.23Å; L878-F882 WeakPolarHBondContact O-CB 3.21Å; L878-F882 PolarHBondContact O-N 3.28Å; L879-F882 PolarHBondContact O-N 3.36Å; F882-C885 PolarHBondContact O-N 3.18Å; F882-R886 PolarHBondContact O-N 3.23Å
883	V	85.4	Confident	81.9	Confident	60 Å²	60	41.3 Å²	41.3	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-43.8	178.7	169.2	0	0	0	0	111.3	L581 L879 L880 G887	L581-V883 HydrophobicContact CD1-CG2 3.61Å; L879-V883 WeakPolarHBondContact O-CB 3.49Å; L879-V883 VanDerWaalsContact O-CG2 3.32Å; L879-V883 WeakPolarHBondContact O-CG2 3.29Å; L879-V883 PolarHBondContact O-N 3.17Å; L880-V883 PolarHBondContact O-N 3.29Å; V883-G887 WeakPolarHBondContact O-CA 3.44Å; V883-G887 PolarHBondContact O-N 2.92Å
884	I	83.9	Confident	82.3	Confident	78 Å²	78	35.4 Å²	35.4	40%	0.4	19%	0.189	S	C	.	.	H	α-helix	trans	-61.3	-53	176.7	-73.9	174.6	0	0	0	110.8	L880 I881 R886 P888 F914	L880-I884 HydrophobicContact CD2-CD1 3.57Å; L880-I884 HydrophobicContact CG-CD1 4.08Å; L880-I884 WeakPolarHBondContact O-CB 3.35Å; L880-I884 WeakPolarHBondContact O-CG1 3.33Å; L880-I884 PolarHBondContact O-N 3.38Å; I881-I884 PolarHBondContact O-N 2.86Å; I884-R886 PolarHBondContact O-N 2.95Å; I884-P888 WeakPolarHBondContact O-CD 3.31Å; I884-F914 HydrophobicContact CG2-CE1 3.73Å; I884-F914 HydrophobicContact CG2-CZ 4.04Å; I884-F914 VanDerWaalsContact O-CE1 3.25Å; I884-F914 WeakPolarHBondContact O-CE1 3.26Å
885	C	84.1	Confident	82.6	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	20%	0.196	C	C	.	.	H	α-helix	trans	-72.1	-33.4	-171.7	-56.5	0	0	0	0	113.9	I881 F882 S915 L921	I881-C885 WeakPolarHBondContact O-CB 3.36Å; I881-C885 PolarHBondContact O-N 3.11Å; I881-C885 PolarHBondContact O-SG 2.71Å; F882-C885 PolarHBondContact O-N 3.18Å; C885-S915 WeakPolarHBondContact O-CA 3.48Å; C885-L921 WeakPolarHBondContact SG-CD1 3.11Å
886	R	84.1	Confident	82.7	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-110.8	-16.8	-171.8	-64.4	176.2	175.5	100.5	-4.5	113.7	E323 F577 F882 I884 S890 S918 D922	E323-R886 IonicContact OE1-NH2 3.27Å; E323-R886 PolarHBondContact OE1-NH2 2.89Å; E323-R886 IonicContact OE2-CZ 3.55Å; E323-R886 IonicContact OE2-NH2 3.92Å; E323-R886 PolarHBondContact OE2-NH2 3.49Å; F577-R886 HydrophobicContact CD2-CB 4.29Å; F882-R886 PolarHBondContact O-N 3.23Å; I884-R886 PolarHBondContact O-N 2.95Å; R886-S890 WeakPolarHBondContact O-CB 3.47Å; R886-S890 PolarHBondContact O-N 3.39Å; R886-S890 PolarHBondContact O-OG 3.44Å; R886-S918 VanDerWaalsContact CZ-OG 3.24Å; R886-S918 PolarHBondContact NH2-OG 3.49Å; R886-D922 IonicContact CZ-OD2 3.7Å; R886-D922 IonicContact NH1-OD2 3.73Å; R886-D922 PolarHBondContact NH1-OD2 3.19Å; R886-D922 IonicContact NH2-OD2 3.63Å; R886-D922 PolarHBondContact NH2-OD2 3.45Å
887	G	84.6	Confident	82.7	Confident	4 Å²	4	39.9 Å²	39.9	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-52.2	177.4	0	0	0	0	0	114.2	V883 R889 S890 I891	V883-G887 WeakPolarHBondContact O-CA 3.44Å; V883-G887 PolarHBondContact O-N 2.92Å; G887-R889 PolarHBondContact O-N 2.98Å; G887-S890 CarbonylContact O-C 3.6Å; G887-S890 WeakPolarHBondContact O-CA 3.24Å; G887-S890 WeakPolarHBondContact O-CB 3.25Å; G887-S890 PolarHBondContact O-N 3.12Å; G887-I891 WeakPolarHBondContact O-CG1 3.2Å; G887-I891 PolarHBondContact O-N 2.88Å
888	P	84.6	Confident	82.7	Confident	42 Å²	42	42.5 Å²	42.5	27%	0.273	22%	0.217	S	C	.	.	H	α-helix	trans	-56.4	-46.6	-177.6	-28.3	36.3	0	0	0	113.6	I884 S890 I891 I892 T911 F914	I884-P888 WeakPolarHBondContact O-CD 3.31Å; P888-S890 VanDerWaalsContact C-N 3.28Å; P888-S890 PolarHBondContact O-N 3.38Å; P888-I891 PolarHBondContact O-N 3.23Å; P888-I892 PolarHBondContact O-N 3.37Å; P888-I892 VanDerWaalsContact O-N 3.07Å; P888-T911 HydrophobicContact CB-CG2 3.61Å; P888-F914 HydrophobicContact CG-CD1 4.35Å
889	R	85.2	Confident	82.5	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-42.9	175.6	-170.8	-171.4	-179.8	-162.3	5.2	110.9	D317 Y564 G887 I892 L893 L908	D317-R889 IonicContact OD1-CZ 3.29Å; D317-R889 VanDerWaalsContact OD1-CZ 3.29Å; D317-R889 IonicContact OD1-NH1 2.84Å; D317-R889 PolarHBondContact OD1-NH1 3Å; D317-R889 IonicContact OD1-NH2 2.8Å; D317-R889 PolarHBondContact OD1-NH2 3.07Å; D317-R889 IonicContact OD2-NH2 3.23Å; D317-R889 PolarHBondContact OD2-NH2 3.41Å; Y564-R889 PolarHBondContact OH-NH2 2.84Å; G887-R889 PolarHBondContact O-N 2.98Å; R889-I892 PolarHBondContact O-N 3.19Å; R889-L893 HydrophobicContact CG-CD1 4.04Å; R889-L893 WeakPolarHBondContact O-CB 3.39Å; R889-L893 VanDerWaalsContact O-CG 3.25Å; R889-L893 WeakPolarHBondContact O-CG 3.43Å; R889-L893 PolarHBondContact O-N 3.04Å; R889-L908 HydrophobicContact CG-CD1 4.33Å
890	S	85.5	Confident	81.2	Confident	8 Å²	8	54.8 Å²	54.8	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-69	-34	-178.6	-52.7	0	0	0	0	112.5	F577 R886 G887 P888 I894	F577-S890 WeakPolarHBondContact CB-OG 3.37Å; F577-S890 VanDerWaalsContact CG-OG 3.27Å; F577-S890 WeakPolarHBondContact CG-OG 3.33Å; R886-S890 WeakPolarHBondContact O-CB 3.47Å; R886-S890 PolarHBondContact O-N 3.39Å; R886-S890 PolarHBondContact O-OG 3.44Å; G887-S890 CarbonylContact O-C 3.6Å; G887-S890 WeakPolarHBondContact O-CA 3.24Å; G887-S890 WeakPolarHBondContact O-CB 3.25Å; G887-S890 PolarHBondContact O-N 3.12Å; P888-S890 VanDerWaalsContact C-N 3.28Å; P888-S890 PolarHBondContact O-N 3.38Å; S890-I894 WeakPolarHBondContact O-CD1 3.38Å; S890-I894 WeakPolarHBondContact O-CG1 3.15Å; S890-I894 PolarHBondContact O-N 3.24Å
891	I	85.1	Confident	79.9	Confident	99 Å²	99	56.6 Å²	56.6	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-67.1	-48.6	174.8	-69.4	163	0	0	0	110.2	G887 P888 L893 I894 I895	G887-I891 WeakPolarHBondContact O-CG1 3.2Å; G887-I891 PolarHBondContact O-N 2.88Å; P888-I891 PolarHBondContact O-N 3.23Å; I891-L893 PolarHBondContact O-N 3.24Å; I891-I894 WeakPolarHBondContact O-CB 3.18Å; I891-I894 PolarHBondContact O-N 2.99Å; I891-I895 HydrophobicContact CG2-CD1 3.91Å; I891-I895 WeakPolarHBondContact O-CG1 3.43Å; I891-I895 PolarHBondContact O-N 3.32Å
892	I	82.7	Confident	78.6	Confident	13 Å²	13	59 Å²	59	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-40.5	178.5	-72.4	147	0	0	0	111.5	P888 R889 I894 I895 E896 W907 L908 T911	P888-I892 PolarHBondContact O-N 3.37Å; P888-I892 VanDerWaalsContact O-N 3.07Å; R889-I892 PolarHBondContact O-N 3.19Å; I892-I894 VanDerWaalsContact C-N 3.26Å; I892-I894 PolarHBondContact O-N 3.23Å; I892-I895 PolarHBondContact O-N 2.89Å; I892-I895 VanDerWaalsContact O-N 3.1Å; I892-E896 WeakPolarHBondContact O-CB 3.37Å; I892-E896 PolarHBondContact O-N 2.99Å; I892-W907 HydrophobicContact CD1-CB 3.81Å; I892-W907 HydrophobicContact CD1-CE3 4.18Å; I892-W907 HydrophobicContact CG1-CB 4.18Å; I892-W907 HydrophobicContact CG2-CB 4.29Å; I892-L908 HydrophobicContact CG2-CB 4.03Å; I892-L908 HydrophobicContact CG2-CD1 4.25Å; I892-T911 HydrophobicContact CD1-CG2 3.36Å; I892-T911 VanDerWaalsContact CD1-OG1 3.29Å; I892-T911 WeakPolarHBondContact CD1-OG1 3.29Å
893	L	82.5	Confident	77.6	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-35.4	171.8	-75.9	170.2	0	0	0	112.4	Y564 I569 L572 I573 R889 I891 W897 L908	Y564-L893 HydrophobicContact CD1-CD2 3.66Å; Y564-L893 HydrophobicContact CE1-CD2 3.8Å; I569-L893 HydrophobicContact CG1-CD2 4.11Å; I569-L893 HydrophobicContact CG2-CB 4.1Å; I569-L893 HydrophobicContact CG2-CD2 4.08Å; I569-L893 VanDerWaalsContact CG2-O 3.23Å; I569-L893 WeakPolarHBondContact CG2-O 3.25Å; L572-L893 HydrophobicContact CB-CD1 4.06Å; L572-L893 HydrophobicContact CD1-CD1 4.3Å; I573-L893 HydrophobicContact CD1-CB 4Å; I573-L893 HydrophobicContact CG1-CB 3.77Å; R889-L893 HydrophobicContact CG-CD1 4.04Å; R889-L893 WeakPolarHBondContact O-CB 3.39Å; R889-L893 VanDerWaalsContact O-CG 3.25Å; R889-L893 WeakPolarHBondContact O-CG 3.43Å; R889-L893 PolarHBondContact O-N 3.04Å; I891-L893 PolarHBondContact O-N 3.24Å; L893-W897 VanDerWaalsContact O-CB 3.24Å; L893-W897 WeakPolarHBondContact O-CB 3.11Å; L893-W897 PolarHBondContact O-N 2.98Å; L893-L908 HydrophobicContact CD2-CD1 3.83Å; L893-L908 HydrophobicContact CG-CD1 3.93Å
894	I	84.1	Confident	76.6	Confident	62 Å²	62	61 Å²	61	32%	0.318	30%	0.302	S	S	.	.	H	α-helix	trans	-68.1	-41.9	173.7	-71.4	161.8	0	0	0	111	I573 S890 I891 I892 W897 L898	I573-I894 HydrophobicContact CD1-CB 4.48Å; I573-I894 HydrophobicContact CD1-CG1 3.68Å; I573-I894 HydrophobicContact CG1-CG1 4.07Å; I573-I894 HydrophobicContact CG2-CD1 4.03Å; I573-I894 HydrophobicContact CG2-CG1 3.89Å; S890-I894 WeakPolarHBondContact O-CD1 3.38Å; S890-I894 WeakPolarHBondContact O-CG1 3.15Å; S890-I894 PolarHBondContact O-N 3.24Å; I891-I894 WeakPolarHBondContact O-CB 3.18Å; I891-I894 PolarHBondContact O-N 2.99Å; I892-I894 VanDerWaalsContact C-N 3.26Å; I892-I894 PolarHBondContact O-N 3.23Å; I894-W897 PolarHBondContact O-N 3.09Å; I894-L898 HydrophobicContact CG2-CD1 3.98Å; I894-L898 VanDerWaalsContact O-CG 3.25Å; I894-L898 WeakPolarHBondContact O-CG 3.03Å; I894-L898 PolarHBondContact O-N 3.45Å
895	I	81.9	Confident	75.7	Confident	59 Å²	59	59.7 Å²	59.7	30%	0.303	29%	0.292	S	S	.	.	H	α-helix	trans	-68.1	-40.6	179.7	-58.5	164.1	0	0	0	110.8	I891 I892 L898 Q899 Y900 L904	I891-I895 HydrophobicContact CG2-CD1 3.91Å; I891-I895 WeakPolarHBondContact O-CG1 3.43Å; I891-I895 PolarHBondContact O-N 3.32Å; I892-I895 PolarHBondContact O-N 2.89Å; I892-I895 VanDerWaalsContact O-N 3.1Å; I895-L898 CarbonylContact O-C 3.56Å; I895-L898 PolarHBondContact O-N 2.83Å; I895-Q899 PolarHBondContact O-N 3.5Å; I895-Y900 HydrophobicContact CG2-CD1 4.49Å; I895-Y900 PolarHBondContact O-N 2.83Å; I895-L904 HydrophobicContact CB-CD1 4.19Å; I895-L904 HydrophobicContact CG2-CD1 3.75Å; I895-L904 HydrophobicContact CG2-CD2 4.46Å
896	E	78	Confident	74.9	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.121	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-41.5	173.5	-176.4	177.9	-146.6	0	0	111.6	I569 I892 L898 Q899 L904 L908	I569-E896 HydrophobicContact CD1-CG 4.05Å; I892-E896 WeakPolarHBondContact O-CB 3.37Å; I892-E896 PolarHBondContact O-N 2.99Å; E896-L898 VanDerWaalsContact C-N 3.28Å; E896-L898 PolarHBondContact O-N 3.16Å; E896-Q899 WeakPolarHBondContact O-CA 3.5Å; E896-Q899 PolarHBondContact O-N 3.06Å; E896-L904 HydrophobicContact CB-CD1 4.11Å; E896-L908 WeakPolarHBondContact OE2-CD2 3.49Å
897	W	78.2	Confident	74.5	Confident	134 Å²	134	65.2 Å²	65.2	51%	0.508	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-33	173.6	-172.9	66	0	0	0	113.1	I569 L893 I894 Q899	I569-W897 HydrophobicContact CG2-CB 3.79Å; I569-W897 HydrophobicContact CG2-CG 4.3Å; L893-W897 VanDerWaalsContact O-CB 3.24Å; L893-W897 WeakPolarHBondContact O-CB 3.11Å; L893-W897 PolarHBondContact O-N 2.98Å; I894-W897 PolarHBondContact O-N 3.09Å; W897-Q899 PolarHBondContact O-N 3.37Å
898	L	79.4	Confident	74.1	Confident	117 Å²	117	65.1 Å²	65.1	61%	0.613	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	2	172	-68	168.2	0	0	0	113.4	I894 I895 E896 Y900	I894-L898 HydrophobicContact CG2-CD1 3.98Å; I894-L898 VanDerWaalsContact O-CG 3.25Å; I894-L898 WeakPolarHBondContact O-CG 3.03Å; I894-L898 PolarHBondContact O-N 3.45Å; I895-L898 CarbonylContact O-C 3.56Å; I895-L898 PolarHBondContact O-N 2.83Å; E896-L898 VanDerWaalsContact C-N 3.28Å; E896-L898 PolarHBondContact O-N 3.16Å; L898-Y900 VanDerWaalsContact C-N 3.33Å; L898-Y900 PolarHBondContact O-N 3.09Å
899	Q	72	Confident	73.5	Confident	148 Å²	148	65 Å²	65	69%	0.692	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	31.9	176.1	-59.5	-178.4	55.2	0	0	114.9	I895 E896 W897 E901	I895-Q899 PolarHBondContact O-N 3.5Å; E896-Q899 WeakPolarHBondContact O-CA 3.5Å; E896-Q899 PolarHBondContact O-N 3.06Å; W897-Q899 PolarHBondContact O-N 3.37Å; Q899-E901 PolarHBondContact O-N 3.33Å
900	Y	55.2	Low	73	Confident	154 Å²	154	66.5 Å²	66.5	60%	0.604	32%	0.315	S	S	*	.			trans	-86.7	103.3	178.2	-166.6	-87.4	0	0	0	112.3	I895 L898 L904	I895-Y900 HydrophobicContact CG2-CD1 4.49Å; I895-Y900 PolarHBondContact O-N 2.83Å; L898-Y900 VanDerWaalsContact C-N 3.33Å; L898-Y900 PolarHBondContact O-N 3.09Å; Y900-L904 VanDerWaalsContact O-CD1 3.24Å; Y900-L904 WeakPolarHBondContact O-CD1 3.34Å
901	E	54.1	Low	72.6	Confident	136 Å²	136	66.7 Å²	66.7	64%	0.636	32%	0.316	S	S	*	.			trans	61.3	149.3	173.1	-65.8	-166.6	173.2	0	0	119.2	Q899 N903	Q899-E901 PolarHBondContact O-N 3.33Å; E901-N903 PolarHBondContact O-N 2.85Å
902	S	56.5	Low	72.4	Confident	85 Å²	85	62.6 Å²	62.6	59%	0.594	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.5	-169.8	54.9	0	0	0	0	115.6	Y905	S902-Y905 WeakPolarHBondContact O-CD2 3.32Å; S902-Y905 WeakPolarHBondContact O-CE2 3.36Å
903	N	61.8	Low	72.3	Confident	83 Å²	83	62.1 Å²	62.1	44%	0.444	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	0.5	-173.4	-83	-45.6	0	0	0	115.3	E901 Y905	E901-N903 PolarHBondContact O-N 2.85Å; N903-Y905 PolarHBondContact O-N 2.82Å; N903-Y905 VanDerWaalsContact O-N 3.15Å
904	L	65.1	Low	72.1	Confident	24 Å²	24	62.5 Å²	62.5	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-18.2	-175.9	-67.3	179.1	0	0	0	115.5	I895 E896 Y900 T906 W907 L908	I895-L904 HydrophobicContact CB-CD1 4.19Å; I895-L904 HydrophobicContact CG2-CD1 3.75Å; I895-L904 HydrophobicContact CG2-CD2 4.46Å; E896-L904 HydrophobicContact CB-CD1 4.11Å; Y900-L904 VanDerWaalsContact O-CD1 3.24Å; Y900-L904 WeakPolarHBondContact O-CD1 3.34Å; L904-T906 PolarHBondContact O-N 3.05Å; L904-T906 VanDerWaalsContact O-N 3.16Å; L904-W907 WeakPolarHBondContact O-CA 3.35Å; L904-W907 WeakPolarHBondContact O-CB 3.26Å; L904-W907 PolarHBondContact O-N 3.14Å; L904-L908 PolarHBondContact O-N 3.37Å
905	Y	66.3	Low	71.9	Confident	49 Å²	49	59.6 Å²	59.6	19%	0.192	28%	0.281	C	S	.	.	H	α-helix	trans	-57.3	-34.4	-177.5	-51.6	-62	0	0	0	113.7	I560 Y561 S902 N903 L908 Q909	I560-Y905 HydrophobicContact CG2-CD1 4.04Å; Y561-Y905 AromaticContact CD2-CE1 3.93Å; Y561-Y905 HydrophobicContact CD2-CE1 3.93Å; Y561-Y905 AromaticContact CD2-CZ 3.82Å; Y561-Y905 WeakPolarHBondContact CD2-OH 3.49Å; Y561-Y905 HydrophobicContact CG-CE1 4.44Å; S902-Y905 WeakPolarHBondContact O-CD2 3.32Å; S902-Y905 WeakPolarHBondContact O-CE2 3.36Å; N903-Y905 PolarHBondContact O-N 2.82Å; N903-Y905 VanDerWaalsContact O-N 3.15Å; Y905-L908 PolarHBondContact O-N 3.14Å; Y905-Q909 PolarHBondContact O-N 3.43Å
906	T	66.6	Low	72	Confident	18 Å²	18	57.5 Å²	57.5	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-67.9	-42	176.1	-62.4	0	0	0	0	111.2	K29 L904 Q909 Y910	K29-T906 HydrophobicContact CD-CG2 4.18Å; K29-T906 PolarHBondContact NZ-OG1 3.48Å; L904-T906 PolarHBondContact O-N 3.05Å; L904-T906 VanDerWaalsContact O-N 3.16Å; T906-Q909 PolarHBondContact O-N 2.91Å; T906-Y910 HydrophobicContact CG2-CD2 3.98Å; T906-Y910 HydrophobicContact CG2-CE2 3.47Å; T906-Y910 VanDerWaalsContact CG2-CE2 3.47Å; T906-Y910 WeakPolarHBondContact O-CD2 3.38Å; T906-Y910 PolarHBondContact O-N 3.35Å
907	W	75.4	Confident	72.1	Confident	105 Å²	105	56.3 Å²	56.3	40%	0.398	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-41	173.1	-82.3	110	0	0	0	112.6	T26 I892 L904 Y910 T911	T26-W907 HydrophobicContact CG2-CD2 4.34Å; T26-W907 VanDerWaalsContact CG2-CE2 3.49Å; T26-W907 HydrophobicContact CG2-CH2 4.17Å; T26-W907 HydrophobicContact CG2-CZ2 3.4Å; I892-W907 HydrophobicContact CD1-CB 3.81Å; I892-W907 HydrophobicContact CD1-CE3 4.18Å; I892-W907 HydrophobicContact CG1-CB 4.18Å; I892-W907 HydrophobicContact CG2-CB 4.29Å; L904-W907 WeakPolarHBondContact O-CA 3.35Å; L904-W907 WeakPolarHBondContact O-CB 3.26Å; L904-W907 PolarHBondContact O-N 3.14Å; W907-Y910 PolarHBondContact O-N 2.81Å; W907-T911 PolarHBondContact O-N 3.4Å; W907-T911 PolarHBondContact O-OG1 3.29Å
908	L	75.4	Confident	72.3	Confident	1 Å²	1	50 Å²	50	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-40.3	178.7	-175.6	61.4	0	0	0	111.5	I560 Y564 R889 I892 L893 E896 L904 Y905 T911 S912	I560-L908 HydrophobicContact CG2-CD2 3.92Å; Y564-L908 HydrophobicContact CD1-CD2 4.27Å; Y564-L908 HydrophobicContact CD2-CD2 3.61Å; Y564-L908 HydrophobicContact CE1-CD2 4.28Å; Y564-L908 HydrophobicContact CE2-CD2 3.64Å; Y564-L908 HydrophobicContact CE2-CG 4.33Å; Y564-L908 HydrophobicContact CG-CD2 3.93Å; R889-L908 HydrophobicContact CG-CD1 4.33Å; I892-L908 HydrophobicContact CG2-CB 4.03Å; I892-L908 HydrophobicContact CG2-CD1 4.25Å; L893-L908 HydrophobicContact CD2-CD1 3.83Å; L893-L908 HydrophobicContact CG-CD1 3.93Å; E896-L908 WeakPolarHBondContact OE2-CD2 3.49Å; L904-L908 PolarHBondContact O-N 3.37Å; Y905-L908 PolarHBondContact O-N 3.14Å; L908-T911 PolarHBondContact O-OG1 3.09Å; L908-S912 WeakPolarHBondContact O-CB 3.4Å; L908-S912 PolarHBondContact O-N 3.46Å
909	Q	73.3	Confident	72.2	Confident	41 Å²	41	44.4 Å²	44.4	19%	0.192	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-54.1	173.8	-177.3	169.7	-36.2	0	0	111.2	Y905 T906 T911 S912 I913	Y905-Q909 PolarHBondContact O-N 3.43Å; T906-Q909 PolarHBondContact O-N 2.91Å; Q909-T911 VanDerWaalsContact C-N 3.34Å; Q909-T911 PolarHBondContact O-N 3.35Å; Q909-S912 PolarHBondContact O-N 2.88Å; Q909-S912 PolarHBondContact O-OG 3.22Å; Q909-I913 WeakPolarHBondContact O-CG1 3.48Å; Q909-I913 PolarHBondContact O-N 3.02Å; Q909-I913 VanDerWaalsContact O-N 3.07Å
910	Y	73.8	Confident	72.6	Confident	32 Å²	32	37.7 Å²	37.7	13%	0.125	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-36.1	-179	-68.5	-51.9	0	0	0	113.8	Y21 I25 D92 T906 W907 I913 F914	Y21-Y910 HydrophobicContact CE1-CE1 4.49Å; I25-Y910 HydrophobicContact CB-CE2 4.44Å; I25-Y910 HydrophobicContact CD1-CE1 3.86Å; I25-Y910 HydrophobicContact CD1-CE2 4.11Å; I25-Y910 WeakPolarHBondContact CD1-OH 3.46Å; I25-Y910 HydrophobicContact CG2-CE2 4.02Å; D92-Y910 WeakPolarHBondContact OD2-CE1 3.19Å; D92-Y910 VanDerWaalsContact OD2-CZ 3.29Å; D92-Y910 PolarHBondContact OD2-OH 2.63Å; T906-Y910 HydrophobicContact CG2-CD2 3.98Å; T906-Y910 HydrophobicContact CG2-CE2 3.47Å; T906-Y910 VanDerWaalsContact CG2-CE2 3.47Å; T906-Y910 WeakPolarHBondContact O-CD2 3.38Å; T906-Y910 PolarHBondContact O-N 3.35Å; W907-Y910 PolarHBondContact O-N 2.81Å; Y910-I913 HydrophobicContact CD1-CD1 4.21Å; Y910-I913 WeakPolarHBondContact O-CB 3.48Å; Y910-I913 PolarHBondContact O-N 3.18Å; Y910-F914 PolarHBondContact O-N 2.76Å
911	T	77.3	Confident	73.8	Confident	13 Å²	13	31.7 Å²	31.7	8%	0.08	16%	0.158	C	C	.	.	H	α-helix	trans	-80.7	-20.7	177	57.3	0	0	0	0	113.7	P888 I892 W907 L908 Q909 F914 S915	P888-T911 HydrophobicContact CB-CG2 3.61Å; I892-T911 HydrophobicContact CD1-CG2 3.36Å; I892-T911 VanDerWaalsContact CD1-OG1 3.29Å; I892-T911 WeakPolarHBondContact CD1-OG1 3.29Å; W907-T911 PolarHBondContact O-N 3.4Å; W907-T911 PolarHBondContact O-OG1 3.29Å; L908-T911 PolarHBondContact O-OG1 3.09Å; Q909-T911 VanDerWaalsContact C-N 3.34Å; Q909-T911 PolarHBondContact O-N 3.35Å; T911-F914 PolarHBondContact O-N 3.39Å; T911-S915 PolarHBondContact O-N 3.29Å
912	S	81	Confident	75	Confident	12 Å²	12	25.4 Å²	25.4	8%	0.084	13%	0.128	C	C	.	.	H	α-helix	trans	-65.4	-43.1	163.7	83.1	0	0	0	0	111.4	L908 Q909 F914 S915 Y916	L908-S912 WeakPolarHBondContact O-CB 3.4Å; L908-S912 PolarHBondContact O-N 3.46Å; Q909-S912 PolarHBondContact O-N 2.88Å; Q909-S912 PolarHBondContact O-OG 3.22Å; S912-F914 VanDerWaalsContact C-N 3.29Å; S912-F914 PolarHBondContact O-N 2.96Å; S912-S915 CarbonylContact O-C 3.56Å; S912-S915 WeakPolarHBondContact O-CA 3.46Å; S912-S915 VanDerWaalsContact O-CB 3.27Å; S912-S915 WeakPolarHBondContact O-CB 3.48Å; S912-S915 PolarHBondContact O-N 3.13Å; S912-Y916 WeakPolarHBondContact CB-OH 3.37Å; S912-Y916 VanDerWaalsContact O-CD2 3.23Å; S912-Y916 WeakPolarHBondContact O-CD2 3.49Å; S912-Y916 WeakPolarHBondContact O-CE2 3.4Å; S912-Y916 VanDerWaalsContact O-CG 3.25Å; S912-Y916 PolarHBondContact O-N 2.9Å
913	I	80	Confident	76.1	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-56.8	-45.1	173	-65.8	171.5	0	0	0	110.2	I18 I95 I96 L99 Q909 Y910 S915 Y916 T917	I18-I913 HydrophobicContact CG2-CG2 4.5Å; I95-I913 HydrophobicContact CG2-CG2 3.74Å; I96-I913 HydrophobicContact CD1-CD1 4.11Å; I96-I913 HydrophobicContact CD1-CG1 4.29Å; I96-I913 HydrophobicContact CG1-CD1 3.98Å; I96-I913 HydrophobicContact CG1-CG1 3.94Å; L99-I913 HydrophobicContact CD1-CG2 3.69Å; Q909-I913 WeakPolarHBondContact O-CG1 3.48Å; Q909-I913 PolarHBondContact O-N 3.02Å; Q909-I913 VanDerWaalsContact O-N 3.07Å; Y910-I913 HydrophobicContact CD1-CD1 4.21Å; Y910-I913 WeakPolarHBondContact O-CB 3.48Å; Y910-I913 PolarHBondContact O-N 3.18Å; I913-S915 VanDerWaalsContact C-N 3.33Å; I913-S915 PolarHBondContact O-N 3.5Å; I913-Y916 PolarHBondContact O-N 3.4Å; I913-Y916 VanDerWaalsContact O-N 3.09Å; I913-T917 PolarHBondContact O-N 3.16Å
914	F	78.1	Confident	76.8	Confident	10 Å²	10	19.9 Å²	19.9	4%	0.044	9%	0.092	C	C	.	.	H	α-helix	trans	-60.4	-41.4	175.3	-150.3	-106.8	0	0	0	112.4	I15 I18 Q19 I884 P888 Y910 T911 S912 Y916 T917	I15-F914 HydrophobicContact CG2-CE2 3.61Å; I15-F914 HydrophobicContact CG2-CZ 3.79Å; I18-F914 HydrophobicContact CG2-CD2 4.35Å; Q19-F914 HydrophobicContact CG-CD2 4.33Å; Q19-F914 HydrophobicContact CG-CE2 3.55Å; Q19-F914 HydrophobicContact CG-CZ 4Å; I884-F914 HydrophobicContact CG2-CE1 3.73Å; I884-F914 HydrophobicContact CG2-CZ 4.04Å; I884-F914 VanDerWaalsContact O-CE1 3.25Å; I884-F914 WeakPolarHBondContact O-CE1 3.26Å; P888-F914 HydrophobicContact CG-CD1 4.35Å; Y910-F914 PolarHBondContact O-N 2.76Å; T911-F914 PolarHBondContact O-N 3.39Å; S912-F914 VanDerWaalsContact C-N 3.29Å; S912-F914 PolarHBondContact O-N 2.96Å; F914-Y916 VanDerWaalsContact C-N 3.31Å; F914-Y916 PolarHBondContact O-N 3.39Å; F914-T917 WeakPolarHBondContact O-CB 3.43Å; F914-T917 PolarHBondContact O-N 2.89Å; F914-T917 VanDerWaalsContact O-N 3.17Å; F914-T917 PolarHBondContact O-OG1 3.18Å
915	S	81	Confident	77.2	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.007	9%	0.089	C	C	.	.	H	α-helix	trans	-61.5	-35.2	173.4	-162.4	0	0	0	0	112.5	Q320 C885 T911 S912 I913 T917 S918	Q320-S915 PolarHBondContact NE2-OG 3.19Å; Q320-S915 VanDerWaalsContact NE2-OG 3.12Å; C885-S915 WeakPolarHBondContact O-CA 3.48Å; T911-S915 PolarHBondContact O-N 3.29Å; S912-S915 CarbonylContact O-C 3.56Å; S912-S915 WeakPolarHBondContact O-CA 3.46Å; S912-S915 VanDerWaalsContact O-CB 3.27Å; S912-S915 WeakPolarHBondContact O-CB 3.48Å; S912-S915 PolarHBondContact O-N 3.13Å; I913-S915 VanDerWaalsContact C-N 3.33Å; I913-S915 PolarHBondContact O-N 3.5Å; S915-T917 VanDerWaalsContact C-N 3.34Å; S915-T917 PolarHBondContact O-N 3.41Å; S915-S918 WeakPolarHBondContact O-CB 3.44Å; S915-S918 PolarHBondContact O-N 3.2Å; S915-S918 PolarHBondContact O-OG 2.82Å
916	Y	83.5	Confident	77.3	Confident	15 Å²	15	17.1 Å²	17.1	6%	0.059	8%	0.08	C	C	.	.	H	α-helix	trans	-70.7	-25.3	175.8	-50.7	-37.6	0	0	0	113.3	L276 L280 I316 Q320 S912 I913 F914 S918 A919	L276-Y916 HydrophobicContact CD1-CD1 4.03Å; L276-Y916 HydrophobicContact CD1-CE1 4.29Å; L276-Y916 HydrophobicContact CD2-CD1 4.33Å; L280-Y916 HydrophobicContact CD1-CD1 4.38Å; L280-Y916 HydrophobicContact CD1-CD2 4.1Å; L280-Y916 HydrophobicContact CD1-CG 3.92Å; L280-Y916 HydrophobicContact CD2-CD2 3.73Å; L280-Y916 HydrophobicContact CD2-CE1 4.46Å; L280-Y916 HydrophobicContact CD2-CE2 3.65Å; L280-Y916 HydrophobicContact CD2-CG 4.22Å; I316-Y916 HydrophobicContact CG2-CD1 4.35Å; I316-Y916 HydrophobicContact CG2-CE1 3.4Å; I316-Y916 VanDerWaalsContact CG2-CE1 3.4Å; Q320-Y916 VanDerWaalsContact NE2-CD1 3.32Å; S912-Y916 WeakPolarHBondContact CB-OH 3.37Å; S912-Y916 VanDerWaalsContact O-CD2 3.23Å; S912-Y916 WeakPolarHBondContact O-CD2 3.49Å; S912-Y916 WeakPolarHBondContact O-CE2 3.4Å; S912-Y916 VanDerWaalsContact O-CG 3.25Å; S912-Y916 PolarHBondContact O-N 2.9Å; I913-Y916 PolarHBondContact O-N 3.4Å; I913-Y916 VanDerWaalsContact O-N 3.09Å; F914-Y916 VanDerWaalsContact C-N 3.31Å; F914-Y916 PolarHBondContact O-N 3.39Å; Y916-S918 PolarHBondContact O-N 3.17Å; Y916-A919 WeakPolarHBondContact O-CB 3.49Å; Y916-A919 PolarHBondContact O-N 2.85Å; Y916-A919 VanDerWaalsContact O-N 3.16Å
917	T	80.8	Confident	77.4	Confident	2 Å²	2	16.3 Å²	16.3	1%	0.012	8%	0.076	C	C	.	.	H	α-helix	trans	-61.2	-26.1	173.9	74.2	0	0	0	0	112.8	L99 I913 F914 S915 A919 I920 L921	L99-T917 HydrophobicContact CD1-CG2 4.11Å; L99-T917 HydrophobicContact CD2-CG2 4Å; I913-T917 PolarHBondContact O-N 3.16Å; F914-T917 WeakPolarHBondContact O-CB 3.43Å; F914-T917 PolarHBondContact O-N 2.89Å; F914-T917 VanDerWaalsContact O-N 3.17Å; F914-T917 PolarHBondContact O-OG1 3.18Å; S915-T917 VanDerWaalsContact C-N 3.34Å; S915-T917 PolarHBondContact O-N 3.41Å; T917-A919 PolarHBondContact O-N 3.18Å; T917-I920 PolarHBondContact O-N 3.24Å; T917-I920 VanDerWaalsContact O-N 3.11Å; T917-L921 PolarHBondContact O-N 3.32Å; T917-L921 VanDerWaalsContact O-N 3.16Å
918	S	81.4	Confident	76.9	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-58.2	-32.2	176.9	68.7	0	0	0	0	112.4	R886 S915 Y916 I920 L921 D922	R886-S918 VanDerWaalsContact CZ-OG 3.24Å; R886-S918 PolarHBondContact NH2-OG 3.49Å; S915-S918 WeakPolarHBondContact O-CB 3.44Å; S915-S918 PolarHBondContact O-N 3.2Å; S915-S918 PolarHBondContact O-OG 2.82Å; Y916-S918 PolarHBondContact O-N 3.17Å; S918-I920 PolarHBondContact O-N 2.88Å; S918-I920 VanDerWaalsContact O-N 3.17Å; S918-L921 PolarHBondContact O-N 3.19Å; S918-L921 VanDerWaalsContact O-N 3.14Å; S918-D922 WeakPolarHBondContact O-CB 3.18Å; S918-D922 PolarHBondContact O-N 3.12Å
919	A	78.4	Confident	76.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.008	8%	0.083	C	C	.	.	H	α-helix	trans	-65.2	-23	-179.8	0	0	0	0	0	114.2	N273 L276 E323 Y916 T917 T923	N273-A919 HydrophobicContact CB-CB 4.09Å; N273-A919 VanDerWaalsContact ND2-CA 3.26Å; N273-A919 WeakPolarHBondContact ND2-CA 3.38Å; N273-A919 PolarHBondContact ND2-O 2.74Å; N273-A919 VanDerWaalsContact ND2-O 3.16Å; L276-A919 HydrophobicContact CD2-CB 3.67Å; E323-A919 VanDerWaalsContact OE1-CA 3.31Å; E323-A919 WeakPolarHBondContact OE1-CA 3.45Å; Y916-A919 WeakPolarHBondContact O-CB 3.49Å; Y916-A919 PolarHBondContact O-N 2.85Å; Y916-A919 VanDerWaalsContact O-N 3.16Å; T917-A919 PolarHBondContact O-N 3.18Å; A919-T923 WeakPolarHBondContact O-CG2 3.46Å; A919-T923 PolarHBondContact O-OG1 3.2Å
920	I	80.5	Confident	75.9	Confident	6 Å²	6	16.9 Å²	16.9	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-87.9	-45.2	172.9	-60.2	165.3	0	0	0	109.7	L11 L99 T106 T917 S918 T923 I924	L11-I920 HydrophobicContact CD1-CG2 4.1Å; L11-I920 HydrophobicContact CD2-CG2 4.04Å; L99-I920 HydrophobicContact CD2-CD1 3.64Å; T106-I920 HydrophobicContact CG2-CG2 4.36Å; T917-I920 PolarHBondContact O-N 3.24Å; T917-I920 VanDerWaalsContact O-N 3.11Å; S918-I920 PolarHBondContact O-N 2.88Å; S918-I920 VanDerWaalsContact O-N 3.17Å; I920-T923 PolarHBondContact O-OG1 3.15Å; I920-I924 HydrophobicContact CG2-CD1 3.85Å; I920-I924 VanDerWaalsContact O-CG1 3.27Å; I920-I924 WeakPolarHBondContact O-CG1 3.33Å; I920-I924 PolarHBondContact O-N 3.11Å; I920-I924 VanDerWaalsContact O-N 3.1Å
921	L	79.4	Confident	75.5	Confident	29 Å²	29	17.4 Å²	17.4	15%	0.152	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-49.6	-179.2	-73	168.7	0	0	0	112.8	L11 I15 I881 C885 T917 S918 T923 I924 I925	L11-L921 HydrophobicContact CD2-CD2 3.69Å; L11-L921 HydrophobicContact CD2-CG 4.32Å; I15-L921 HydrophobicContact CD1-CD1 3.94Å; I15-L921 HydrophobicContact CD1-CD2 4.03Å; I15-L921 HydrophobicContact CD1-CG 4.15Å; I881-L921 HydrophobicContact CG2-CB 4.35Å; I881-L921 HydrophobicContact CG2-CD1 4.17Å; C885-L921 WeakPolarHBondContact SG-CD1 3.11Å; T917-L921 PolarHBondContact O-N 3.32Å; T917-L921 VanDerWaalsContact O-N 3.16Å; S918-L921 PolarHBondContact O-N 3.19Å; S918-L921 VanDerWaalsContact O-N 3.14Å; L921-T923 VanDerWaalsContact C-N 3.27Å; L921-T923 PolarHBondContact O-N 3.33Å; L921-I924 CarbonylContact O-C 3.59Å; L921-I924 PolarHBondContact O-N 2.83Å; L921-I924 VanDerWaalsContact O-N 3.15Å; L921-I925 HydrophobicContact CB-CD1 4.27Å; L921-I925 VanDerWaalsContact O-CD1 3.28Å; L921-I925 WeakPolarHBondContact O-CD1 3.37Å; L921-I925 WeakPolarHBondContact O-CG1 3.43Å; L921-I925 PolarHBondContact O-N 2.73Å
922	D	80.3	Confident	74.8	Confident	3 Å²	3	25 Å²	25	2%	0.016	11%	0.113	C	C	.	.	H	α-helix	trans	-63.2	-33.1	-178.3	-82.3	-49.9	0	0	0	111.3	I327 R886 S918 I925 Y926	I327-D922 HydrophobicContact CD1-CB 4.16Å; I327-D922 WeakPolarHBondContact CD1-OD2 3.45Å; R886-D922 IonicContact CZ-OD2 3.7Å; R886-D922 IonicContact NH1-OD2 3.73Å; R886-D922 PolarHBondContact NH1-OD2 3.19Å; R886-D922 IonicContact NH2-OD2 3.63Å; R886-D922 PolarHBondContact NH2-OD2 3.45Å; S918-D922 WeakPolarHBondContact O-CB 3.18Å; S918-D922 PolarHBondContact O-N 3.12Å; D922-I925 PolarHBondContact O-N 2.98Å; D922-Y926 HydrophobicContact CB-CD2 4.2Å; D922-Y926 VanDerWaalsContact O-CB 3.28Å; D922-Y926 WeakPolarHBondContact O-CB 3.45Å; D922-Y926 WeakPolarHBondContact O-CD2 3.49Å; D922-Y926 PolarHBondContact O-N 3.42Å; D922-Y926 WeakPolarHBondContact OD1-CE2 3.44Å
923	T	78.1	Confident	73.7	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-73.4	-37.1	174.8	61.8	0	0	0	0	112.3	N107 L110 L269 A919 I920 L921 G927 F928	N107-T923 WeakPolarHBondContact OD1-CG2 3.43Å; L110-T923 HydrophobicContact CD2-CG2 4.45Å; L269-T923 HydrophobicContact CD2-CG2 4.26Å; L269-T923 HydrophobicContact CG-CG2 4.31Å; A919-T923 WeakPolarHBondContact O-CG2 3.46Å; A919-T923 PolarHBondContact O-OG1 3.2Å; I920-T923 PolarHBondContact O-OG1 3.15Å; L921-T923 VanDerWaalsContact C-N 3.27Å; L921-T923 PolarHBondContact O-N 3.33Å; T923-G927 VanDerWaalsContact O-CA 3.23Å; T923-G927 WeakPolarHBondContact O-CA 3.28Å; T923-G927 PolarHBondContact O-N 2.9Å; T923-F928 PolarHBondContact O-N 3.09Å
924	I	76.3	Confident	72.7	Confident	52 Å²	52	28.5 Å²	28.5	27%	0.267	14%	0.136	S	C	.	.	I	π-helix	trans	-61.7	-43.1	169.5	-68.6	169.5	0	0	0	111.7	L11 I920 L921 F928 W929	L11-I924 HydrophobicContact CD2-CD1 3.97Å; I920-I924 HydrophobicContact CG2-CD1 3.85Å; I920-I924 VanDerWaalsContact O-CG1 3.27Å; I920-I924 WeakPolarHBondContact O-CG1 3.33Å; I920-I924 PolarHBondContact O-N 3.11Å; I920-I924 VanDerWaalsContact O-N 3.1Å; L921-I924 CarbonylContact O-C 3.59Å; L921-I924 PolarHBondContact O-N 2.83Å; L921-I924 VanDerWaalsContact O-N 3.15Å; I924-F928 HydrophobicContact CG1-CD2 4.38Å; I924-F928 PolarHBondContact O-N 2.7Å; I924-W929 WeakPolarHBondContact O-CB 3.42Å; I924-W929 PolarHBondContact O-N 3.21Å
925	I	74.1	Confident	71.8	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.062	15%	0.152	C	C	.	.	I	π-helix	trans	-81.9	-46.9	-174.2	-58.9	154.4	0	0	0	112	L878 I881 L921 D922 W929 G930	L878-I925 HydrophobicContact CD2-CB 4.29Å; L878-I925 HydrophobicContact CD2-CG2 3.5Å; L878-I925 HydrophobicContact CG-CG2 4.06Å; I881-I925 HydrophobicContact CB-CD1 4.43Å; I881-I925 HydrophobicContact CD1-CD1 3.52Å; I881-I925 HydrophobicContact CG2-CD1 3.91Å; L921-I925 HydrophobicContact CB-CD1 4.27Å; L921-I925 VanDerWaalsContact O-CD1 3.28Å; L921-I925 WeakPolarHBondContact O-CD1 3.37Å; L921-I925 WeakPolarHBondContact O-CG1 3.43Å; L921-I925 PolarHBondContact O-N 2.73Å; D922-I925 PolarHBondContact O-N 2.98Å; I925-W929 HydrophobicContact CG2-CE3 4.45Å; I925-G930 WeakPolarHBondContact O-CA 3.29Å; I925-G930 PolarHBondContact O-N 2.93Å
926	Y	69.1	Low	70.9	Confident	3 Å²	3	37.2 Å²	37.2	1%	0.012	17%	0.174	C	C	.	.	I	π-helix	trans	-81.3	-45.8	-179	-75.6	-76.8	0	0	0	112.9	Y262 I327 I330 L878 D922	Y262-Y926 PolarHBondContact OH-O 2.85Å; I327-Y926 HydrophobicContact CB-CE2 4.49Å; I327-Y926 HydrophobicContact CG1-CE2 4.07Å; I327-Y926 HydrophobicContact CG2-CE2 4.08Å; I327-Y926 WeakPolarHBondContact CG2-OH 3.26Å; I330-Y926 HydrophobicContact CB-CD1 4.28Å; I330-Y926 HydrophobicContact CB-CE1 4.14Å; I330-Y926 HydrophobicContact CD1-CD1 4.19Å; I330-Y926 HydrophobicContact CD1-CG 4.34Å; I330-Y926 HydrophobicContact CG2-CD1 3.53Å; I330-Y926 HydrophobicContact CG2-CE1 3.59Å; L878-Y926 HydrophobicContact CD1-CE1 3.77Å; L878-Y926 HydrophobicContact CD1-CE2 4.42Å; L878-Y926 HydrophobicContact CD2-CD2 4.03Å; L878-Y926 HydrophobicContact CD2-CE1 4.2Å; L878-Y926 HydrophobicContact CD2-CE2 3.36Å; L878-Y926 VanDerWaalsContact CD2-CZ 3.47Å; D922-Y926 HydrophobicContact CB-CD2 4.2Å; D922-Y926 VanDerWaalsContact O-CB 3.28Å; D922-Y926 WeakPolarHBondContact O-CB 3.45Å; D922-Y926 WeakPolarHBondContact O-CD2 3.49Å; D922-Y926 PolarHBondContact O-N 3.42Å; D922-Y926 WeakPolarHBondContact OD1-CE2 3.44Å
927	G	67.8	Low	69.9	Low	2 Å²	2	42.6 Å²	42.6	2%	0.021	20%	0.196	C	C	.	.	I	π-helix	trans	-74.8	-66.4	-177.1	0	0	0	0	0	111.7	T923 N931	T923-G927 VanDerWaalsContact O-CA 3.23Å; T923-G927 WeakPolarHBondContact O-CA 3.28Å; T923-G927 PolarHBondContact O-N 2.9Å; G927-N931 WeakPolarHBondContact O-CB 3.45Å
928	F	66.2	Low	68.8	Low	15 Å²	15	43.8 Å²	43.8	7%	0.066	20%	0.201	C	C	.	.	I	π-helix	trans	-77.2	-65	-172.5	-64.2	-66.7	0	0	0	112.4	L113 T923 I924 G930 Y934	L113-F928 HydrophobicContact CD1-CD1 3.84Å; L113-F928 HydrophobicContact CD1-CE1 3.45Å; L113-F928 VanDerWaalsContact CD1-CE1 3.45Å; T923-F928 PolarHBondContact O-N 3.09Å; I924-F928 HydrophobicContact CG1-CD2 4.38Å; I924-F928 PolarHBondContact O-N 2.7Å; F928-G930 PolarHBondContact O-N 2.94Å; F928-Y934 HydrophobicContact CB-CD1 4.06Å; F928-Y934 HydrophobicContact CB-CE1 3.65Å; F928-Y934 HydrophobicContact CD1-CD1 4.28Å; F928-Y934 AromaticContact CD1-CD2 3.86Å; F928-Y934 HydrophobicContact CD1-CD2 3.86Å; F928-Y934 AromaticContact CD1-CE1 3.84Å; F928-Y934 HydrophobicContact CD1-CE1 3.84Å; F928-Y934 AromaticContact CD1-CE2 3.37Å; F928-Y934 HydrophobicContact CD1-CE2 3.37Å; F928-Y934 HydrophobicContact CD1-CG 4.25Å; F928-Y934 AromaticContact CD1-CZ 3.3Å; F928-Y934 WeakPolarHBondContact CD1-OH 3.12Å; F928-Y934 HydrophobicContact CE1-CD2 4.45Å; F928-Y934 AromaticContact CE1-CE2 3.83Å; F928-Y934 HydrophobicContact CE1-CE2 3.83Å; F928-Y934 HydrophobicContact CG-CE1 4.19Å; F928-Y934 HydrophobicContact CG-CE2 4.45Å; F928-Y934 AromaticContact CG-CZ 4Å; F928-Y934 WeakPolarHBondContact O-CD1 3.45Å
929	W	64.7	Low	68.1	Low	131 Å²	131	51.1 Å²	51.1	50%	0.496	23%	0.233	S	C	.	.	I	π-helix	trans	-69.5	-35	-175.2	-160.3	55.4	0	0	0	113.4	I874 I877 I924 I925 R935	I874-W929 HydrophobicContact CG1-CZ3 4.49Å; I877-W929 HydrophobicContact CD1-CH2 4.19Å; I877-W929 HydrophobicContact CD1-CZ3 4.35Å; I924-W929 WeakPolarHBondContact O-CB 3.42Å; I924-W929 PolarHBondContact O-N 3.21Å; I925-W929 HydrophobicContact CG2-CE3 4.45Å; W929-R935 VanDerWaalsContact O-CD 3.29Å; W929-R935 WeakPolarHBondContact O-CD 3.42Å; W929-R935 PolarHBondContact O-NE 3.16Å; W929-R935 PolarHBondContact O-NH2 3.08Å
930	G	62.4	Low	67.5	Low	13 Å²	13	55.8 Å²	55.8	13%	0.134	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-41.1	179.1	0	0	0	0	0	113.3	I925 F928 R935	I925-G930 WeakPolarHBondContact O-CA 3.29Å; I925-G930 PolarHBondContact O-N 2.93Å; F928-G930 PolarHBondContact O-N 2.94Å; G930-R935 PolarHBondContact O-NH2 3.29Å
931	N	65.7	Low	66.7	Low	43 Å²	43	57.7 Å²	57.7	23%	0.23	27%	0.268	C	S	.	.			trans	-71.9	136.6	-173.5	-169.1	-9.1	0	0	0	112.3	G927 A933 R935	G927-N931 WeakPolarHBondContact O-CB 3.45Å; N931-A933 WeakPolarHBondContact OD1-CB 3.26Å; N931-A933 PolarHBondContact OD1-N 3.11Å; N931-R935 WeakPolarHBondContact O-CG 3.34Å; N931-R935 PolarHBondContact O-N 3.02Å; N931-R935 PolarHBondContact O-NE 3.05Å
932	R	61.9	Low	65.8	Low	172 Å²	172	59.9 Å²	59.9	65%	0.649	29%	0.285	S	S	*	.	H	α-helix	trans	-80.3	-31.5	174.7	-179.8	172.5	172.3	168.5	-1.9	112.1	L936	R932-L936 HydrophobicContact CG-CD1 4.38Å; R932-L936 WeakPolarHBondContact O-CG 3.18Å; R932-L936 PolarHBondContact O-N 2.96Å
933	A	57.3	Low	65.1	Low	54 Å²	54	64.7 Å²	64.7	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-65.1	-50.3	178.2	0	0	0	0	0	110.4	N931 R935 L936 Y937	N931-A933 WeakPolarHBondContact OD1-CB 3.26Å; N931-A933 PolarHBondContact OD1-N 3.11Å; A933-R935 PolarHBondContact O-N 3.05Å; A933-L936 WeakPolarHBondContact O-CB 3.45Å; A933-L936 PolarHBondContact O-N 3.29Å; A933-Y937 PolarHBondContact O-N 3.1Å
934	Y	59.6	Low	64.4	Low	35 Å²	35	70.5 Å²	70.5	14%	0.137	33%	0.334	C	S	.	.	H	α-helix	trans	-58.6	-43.8	175.1	179.2	-97.9	0	0	0	112.8	L113 F928 L936 Y937 M938	L113-Y934 HydrophobicContact CD1-CD2 3.49Å; L113-Y934 VanDerWaalsContact CD1-CD2 3.49Å; L113-Y934 HydrophobicContact CD1-CE2 3.81Å; L113-Y934 HydrophobicContact CD1-CG 4.47Å; L113-Y934 HydrophobicContact CD2-CD2 4.48Å; F928-Y934 HydrophobicContact CB-CD1 4.06Å; F928-Y934 HydrophobicContact CB-CE1 3.65Å; F928-Y934 HydrophobicContact CD1-CD1 4.28Å; F928-Y934 AromaticContact CD1-CD2 3.86Å; F928-Y934 HydrophobicContact CD1-CD2 3.86Å; F928-Y934 AromaticContact CD1-CE1 3.84Å; F928-Y934 HydrophobicContact CD1-CE1 3.84Å; F928-Y934 AromaticContact CD1-CE2 3.37Å; F928-Y934 HydrophobicContact CD1-CE2 3.37Å; F928-Y934 HydrophobicContact CD1-CG 4.25Å; F928-Y934 AromaticContact CD1-CZ 3.3Å; F928-Y934 WeakPolarHBondContact CD1-OH 3.12Å; F928-Y934 HydrophobicContact CE1-CD2 4.45Å; F928-Y934 AromaticContact CE1-CE2 3.83Å; F928-Y934 HydrophobicContact CE1-CE2 3.83Å; F928-Y934 HydrophobicContact CG-CE1 4.19Å; F928-Y934 HydrophobicContact CG-CE2 4.45Å; F928-Y934 AromaticContact CG-CZ 4Å; F928-Y934 WeakPolarHBondContact O-CD1 3.45Å; Y934-L936 PolarHBondContact O-N 3.39Å; Y934-Y937 CarbonylContact O-C 3.58Å; Y934-Y937 PolarHBondContact O-N 3.44Å; Y934-Y937 VanDerWaalsContact O-N 3.08Å; Y934-M938 HydrophobicContact CD1-CG 4.13Å; Y934-M938 HydrophobicContact CD2-CG 4.27Å; Y934-M938 HydrophobicContact CE1-CB 4.35Å; Y934-M938 HydrophobicContact CE1-CG 3.53Å; Y934-M938 HydrophobicContact CE2-CE 3.8Å; Y934-M938 HydrophobicContact CE2-CG 3.68Å; Y934-M938 PolarHBondContact O-N 2.73Å; Y934-M938 WeakPolarHBondContact OH-CE 3.34Å
935	R	60.4	Low	63.5	Low	102 Å²	102	70.4 Å²	70.4	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-66	-15.5	176.2	-76.9	-176.7	-69.9	-177.8	-14.7	115.2	W929 G930 N931 A933 K939	W929-R935 VanDerWaalsContact O-CD 3.29Å; W929-R935 WeakPolarHBondContact O-CD 3.42Å; W929-R935 PolarHBondContact O-NE 3.16Å; W929-R935 PolarHBondContact O-NH2 3.08Å; G930-R935 PolarHBondContact O-NH2 3.29Å; N931-R935 WeakPolarHBondContact O-CG 3.34Å; N931-R935 PolarHBondContact O-N 3.02Å; N931-R935 PolarHBondContact O-NE 3.05Å; A933-R935 PolarHBondContact O-N 3.05Å; R935-K939 WeakPolarHBondContact O-CG 3.24Å
936	L	62.1	Low	62.9	Low	92 Å²	92	72.5 Å²	72.5	48%	0.482	36%	0.357	S	S	.	.	H	α-helix	trans	-85.4	-44.7	167.2	-69.3	168.4	0	0	0	110.4	R932 A933 Y934 M938 K939 N940	R932-L936 HydrophobicContact CG-CD1 4.38Å; R932-L936 WeakPolarHBondContact O-CG 3.18Å; R932-L936 PolarHBondContact O-N 2.96Å; A933-L936 WeakPolarHBondContact O-CB 3.45Å; A933-L936 PolarHBondContact O-N 3.29Å; Y934-L936 PolarHBondContact O-N 3.39Å; L936-M938 PolarHBondContact O-N 3.12Å; L936-K939 PolarHBondContact O-N 3.24Å; L936-K939 VanDerWaalsContact O-N 3.16Å; L936-N940 PolarHBondContact O-N 3.04Å; L936-N940 PolarHBondContact O-OD1 3.13Å
937	Y	60.7	Low	62.5	Low	128 Å²	128	77.1 Å²	77.1	50%	0.502	38%	0.381	S	S	.	.	H	α-helix	trans	-59.7	-46.4	176.9	-172.7	-112.3	0	0	0	112.6	A933 Y934 K939 N940 L941	A933-Y937 PolarHBondContact O-N 3.1Å; Y934-Y937 CarbonylContact O-C 3.58Å; Y934-Y937 PolarHBondContact O-N 3.44Å; Y934-Y937 VanDerWaalsContact O-N 3.08Å; Y937-K939 VanDerWaalsContact C-N 3.34Å; Y937-K939 PolarHBondContact O-N 3.46Å; Y937-N940 WeakPolarHBondContact O-CB 3.25Å; Y937-N940 PolarHBondContact O-N 3Å; Y937-N940 VanDerWaalsContact O-N 3.1Å; Y937-L941 HydrophobicContact CD1-CD1 3.87Å; Y937-L941 HydrophobicContact CD1-CG 4.35Å; Y937-L941 HydrophobicContact CE1-CD1 3.45Å; Y937-L941 VanDerWaalsContact CE1-CD1 3.45Å; Y937-L941 HydrophobicContact CE1-CG 4.03Å; Y937-L941 PolarHBondContact O-N 2.77Å
938	M	57.6	Low	62.1	Low	26 Å²	26	84.9 Å²	84.9	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-65.7	-31.9	174	-86.5	-60.2	174.4	0	0	113.3	I5 Y934 L936 N940 L941 C942	I5-M938 HydrophobicContact CD1-CE 3.65Å; I5-M938 HydrophobicContact CD1-SD 3.94Å; I5-M938 HydrophobicContact CG1-CE 4.46Å; Y934-M938 HydrophobicContact CD1-CG 4.13Å; Y934-M938 HydrophobicContact CD2-CG 4.27Å; Y934-M938 HydrophobicContact CE1-CB 4.35Å; Y934-M938 HydrophobicContact CE1-CG 3.53Å; Y934-M938 HydrophobicContact CE2-CE 3.8Å; Y934-M938 HydrophobicContact CE2-CG 3.68Å; Y934-M938 PolarHBondContact O-N 2.73Å; Y934-M938 WeakPolarHBondContact OH-CE 3.34Å; L936-M938 PolarHBondContact O-N 3.12Å; M938-N940 VanDerWaalsContact C-N 3.3Å; M938-N940 PolarHBondContact O-N 2.85Å; M938-L941 HydrophobicContact CE-CD1 4.07Å; M938-L941 PolarHBondContact O-N 2.84Å; M938-L941 HydrophobicContact SD-CB 4.29Å; M938-L941 HydrophobicContact SD-CD1 3.88Å; M938-C942 WeakPolarHBondContact O-CB 3.42Å; M938-C942 PolarHBondContact O-N 2.78Å; M938-C942 PolarHBondContact O-SG 2.84Å
939	K	67.1	Low	61.6	Low	154 Å²	154	91.8 Å²	91.8	67%	0.67	44%	0.441	S	S	*	.	H	α-helix	trans	-66.4	-34.9	171.1	-83.2	-175.7	174.3	-115.5	0	112	R935 L936 Y937 H943	R935-K939 WeakPolarHBondContact O-CG 3.24Å; L936-K939 PolarHBondContact O-N 3.24Å; L936-K939 VanDerWaalsContact O-N 3.16Å; Y937-K939 VanDerWaalsContact C-N 3.34Å; Y937-K939 PolarHBondContact O-N 3.46Å; K939-H943 WeakPolarHBondContact O-CB 3.23Å; K939-H943 PolarHBondContact O-N 3.03Å; K939-H943 VanDerWaalsContact O-N 3.14Å
940	N	66.9	Low	61.4	Low	99 Å²	99	92.9 Å²	92.9	53%	0.529	45%	0.446	S	S	.	.	H	α-helix	trans	-70.9	-45.9	174.4	-66.3	1.4	0	0	0	111.1	L936 Y937 M938 H943 Q944	L936-N940 PolarHBondContact O-N 3.04Å; L936-N940 PolarHBondContact O-OD1 3.13Å; Y937-N940 WeakPolarHBondContact O-CB 3.25Å; Y937-N940 PolarHBondContact O-N 3Å; Y937-N940 VanDerWaalsContact O-N 3.1Å; M938-N940 VanDerWaalsContact C-N 3.3Å; M938-N940 PolarHBondContact O-N 2.85Å; N940-H943 WeakPolarHBondContact O-CB 3.45Å; N940-H943 PolarHBondContact O-N 3.18Å; N940-H943 VanDerWaalsContact O-N 3.17Å; N940-Q944 WeakPolarHBondContact O-CG 3.47Å; N940-Q944 PolarHBondContact O-N 3.5Å
941	L	62.6	Low	61.1	Low	46 Å²	46	96.2 Å²	96.2	24%	0.241	47%	0.467	C	S	.	.	H	α-helix	trans	-59.9	-49.4	175.2	-74.6	179.6	0	0	0	111.9	Y937 M938 H943 Q944 C945	Y937-L941 HydrophobicContact CD1-CD1 3.87Å; Y937-L941 HydrophobicContact CD1-CG 4.35Å; Y937-L941 HydrophobicContact CE1-CD1 3.45Å; Y937-L941 VanDerWaalsContact CE1-CD1 3.45Å; Y937-L941 HydrophobicContact CE1-CG 4.03Å; Y937-L941 PolarHBondContact O-N 2.77Å; M938-L941 HydrophobicContact CE-CD1 4.07Å; M938-L941 PolarHBondContact O-N 2.84Å; M938-L941 HydrophobicContact SD-CB 4.29Å; M938-L941 HydrophobicContact SD-CD1 3.88Å; L941-H943 PolarHBondContact O-N 3.2Å; L941-Q944 CarbonylContact O-C 3.59Å; L941-Q944 PolarHBondContact O-N 2.78Å; L941-Q944 VanDerWaalsContact O-N 3.09Å; L941-C945 WeakPolarHBondContact O-CB 3.34Å; L941-C945 PolarHBondContact O-N 2.79Å; L941-C945 PolarHBondContact O-SG 3.26Å; L941-C945 VanDerWaalsContact O-SG 3.32Å
942	C	61.7	Low	60.9	Low	76 Å²	76	99.5 Å²	99.5	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-32.9	176.4	-66.9	0	0	0	0	112.2	M938 A946	M938-C942 WeakPolarHBondContact O-CB 3.42Å; M938-C942 PolarHBondContact O-N 2.78Å; M938-C942 PolarHBondContact O-SG 2.84Å; C942-A946 WeakPolarHBondContact O-CB 3.4Å; C942-A946 PolarHBondContact O-N 3.31Å
943	H	64.2	Low	60.7	Low	104 Å²	104	102.2 Å²	102.2	48%	0.481	49%	0.493	S	S	.	.	H	α-helix	trans	-70.4	-39.4	174.7	-163.5	-7.5	0	0	0	112.2	K939 N940 L941 L947	K939-H943 WeakPolarHBondContact O-CB 3.23Å; K939-H943 PolarHBondContact O-N 3.03Å; K939-H943 VanDerWaalsContact O-N 3.14Å; N940-H943 WeakPolarHBondContact O-CB 3.45Å; N940-H943 PolarHBondContact O-N 3.18Å; N940-H943 VanDerWaalsContact O-N 3.17Å; L941-H943 PolarHBondContact O-N 3.2Å; H943-L947 VanDerWaalsContact O-CG 3.29Å; H943-L947 WeakPolarHBondContact O-CG 3.14Å; H943-L947 PolarHBondContact O-N 3.36Å
944	Q	64.7	Low	60.5	Low	121 Å²	121	108.7 Å²	108.7	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-68	-43	174	-71.9	175.6	-56.2	0	0	111.9	N940 L941 L947 Y948	N940-Q944 WeakPolarHBondContact O-CG 3.47Å; N940-Q944 PolarHBondContact O-N 3.5Å; L941-Q944 CarbonylContact O-C 3.59Å; L941-Q944 PolarHBondContact O-N 2.78Å; L941-Q944 VanDerWaalsContact O-N 3.09Å; Q944-L947 PolarHBondContact O-N 3.34Å; Q944-Y948 WeakPolarHBondContact O-CB 3.47Å; Q944-Y948 PolarHBondContact O-N 2.97Å
945	C	57.7	Low	60.5	Low	51 Å²	51	112.4 Å²	112.4	35%	0.345	53%	0.533	S	S	.	.	H	α-helix	trans	-68.2	-32.3	175.6	-64.9	0	0	0	0	112.5	L941 Y948 K949	L941-C945 WeakPolarHBondContact O-CB 3.34Å; L941-C945 PolarHBondContact O-N 2.79Å; L941-C945 PolarHBondContact O-SG 3.26Å; L941-C945 VanDerWaalsContact O-SG 3.32Å; C945-Y948 PolarHBondContact O-N 3Å; C945-K949 WeakPolarHBondContact O-CB 3.42Å; C945-K949 PolarHBondContact O-N 3.1Å
946	A	61.5	Low	60.5	Low	56 Å²	56	112.9 Å²	112.9	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-67.2	-42.5	171.5	0	0	0	0	0	111.5	C942 Y950	C942-A946 WeakPolarHBondContact O-CB 3.4Å; C942-A946 PolarHBondContact O-N 3.31Å; A946-Y950 PolarHBondContact O-N 3.5Å
947	L	60.8	Low	60.4	Low	100 Å²	100	114.1 Å²	114.1	52%	0.524	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-43.3	172.3	-71.8	165.1	0	0	0	111.3	H943 Q944 Y950 C951	H943-L947 VanDerWaalsContact O-CG 3.29Å; H943-L947 WeakPolarHBondContact O-CG 3.14Å; H943-L947 PolarHBondContact O-N 3.36Å; Q944-L947 PolarHBondContact O-N 3.34Å; L947-Y950 CarbonylContact O-C 3.59Å; L947-Y950 WeakPolarHBondContact O-CA 3.29Å; L947-Y950 VanDerWaalsContact O-CB 3.28Å; L947-Y950 WeakPolarHBondContact O-CB 3.43Å; L947-Y950 PolarHBondContact O-N 2.92Å; L947-C951 PolarHBondContact O-N 3.38Å; L947-C951 PolarHBondContact O-SG 3.25Å
948	Y	57.8	Low	60.4	Low	165 Å²	165	113.3 Å²	113.3	65%	0.647	55%	0.547	S	S	*	.	H	α-helix	trans	-65.6	-40.7	178.2	-169.4	-114.9	0	0	0	112.7	Q944 C945 Y950 C951 I952	Q944-Y948 WeakPolarHBondContact O-CB 3.47Å; Q944-Y948 PolarHBondContact O-N 2.97Å; C945-Y948 PolarHBondContact O-N 3Å; Y948-Y950 PolarHBondContact O-N 3.29Å; Y948-C951 PolarHBondContact O-N 3.39Å; Y948-I952 HydrophobicContact CD1-CD1 3.84Å; Y948-I952 HydrophobicContact CE1-CD1 3.43Å; Y948-I952 VanDerWaalsContact CE1-CD1 3.43Å; Y948-I952 HydrophobicContact CE2-CD1 4.18Å; Y948-I952 HydrophobicContact CG-CD1 4.38Å; Y948-I952 WeakPolarHBondContact O-CG1 3.33Å; Y948-I952 PolarHBondContact O-N 3.38Å; Y948-I952 VanDerWaalsContact O-N 3.09Å
949	K	56.6	Low	60.6	Low	159 Å²	159	118.8 Å²	118.8	69%	0.691	57%	0.573	S	S	*	*	H	α-helix	trans	-64.7	-23.5	169.6	-87.6	-165	171.8	-172.3	0	113.2	C945	C945-K949 WeakPolarHBondContact O-CB 3.42Å; C945-K949 PolarHBondContact O-N 3.1Å
950	Y	59.5	Low	60.1	Low	155 Å²	155	116.4 Å²	116.4	61%	0.608	57%	0.566	S	S	*	*	H	α-helix	trans	-77.4	-45.2	173.2	-146.2	-82.8	0	0	0	110.8	A946 L947 Y948 I952 R953 Q954	A946-Y950 PolarHBondContact O-N 3.5Å; L947-Y950 CarbonylContact O-C 3.59Å; L947-Y950 WeakPolarHBondContact O-CA 3.29Å; L947-Y950 VanDerWaalsContact O-CB 3.28Å; L947-Y950 WeakPolarHBondContact O-CB 3.43Å; L947-Y950 PolarHBondContact O-N 2.92Å; Y948-Y950 PolarHBondContact O-N 3.29Å; Y950-I952 PolarHBondContact O-N 3.16Å; Y950-R953 CarbonylContact O-C 3.55Å; Y950-R953 WeakPolarHBondContact O-CA 3.25Å; Y950-R953 PolarHBondContact O-N 3.27Å; Y950-Q954 HydrophobicContact CD1-CG 4.3Å; Y950-Q954 HydrophobicContact CE1-CG 4.43Å; Y950-Q954 PolarHBondContact O-N 3.03Å
951	C	57.8	Low	59.7	Low	83 Å²	83	117.6 Å²	117.6	56%	0.561	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-4	175.8	-62.9	0	0	0	0	115.3	L947 Y948	L947-C951 PolarHBondContact O-N 3.38Å; L947-C951 PolarHBondContact O-SG 3.25Å; Y948-C951 PolarHBondContact O-N 3.39Å
952	I	60.3	Low	59.4	Low	112 Å²	112	123.2 Å²	123.2	57%	0.574	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-9.1	168.5	-71.9	171.4	0	0	0	111.1	Y948 Y950	Y948-I952 HydrophobicContact CD1-CD1 3.84Å; Y948-I952 HydrophobicContact CE1-CD1 3.43Å; Y948-I952 VanDerWaalsContact CE1-CD1 3.43Å; Y948-I952 HydrophobicContact CE2-CD1 4.18Å; Y948-I952 HydrophobicContact CG-CD1 4.38Å; Y948-I952 WeakPolarHBondContact O-CG1 3.33Å; Y948-I952 PolarHBondContact O-N 3.38Å; Y948-I952 VanDerWaalsContact O-N 3.09Å; Y950-I952 PolarHBondContact O-N 3.16Å
953	R	57	Low	59.2	Low	228 Å²	228	127.1 Å²	127.1	86%	0.86	60%	0.601	S	S	*	*			trans	-101.8	4.8	172.4	-86.3	-173.2	163.2	-159	-5.4	112.9	Y950	Y950-R953 CarbonylContact O-C 3.55Å; Y950-R953 WeakPolarHBondContact O-CA 3.25Å; Y950-R953 PolarHBondContact O-N 3.27Å
954	Q	53.1	Low	58.8	Low	191 Å²	191	129.2 Å²	129.2	89%	0.893	61%	0.612	S	S	*	*			trans	-116.4	0	168.8	-63.6	-172.8	-71.6	0	0	107.6	Y950	Y950-Q954 HydrophobicContact CD1-CG 4.3Å; Y950-Q954 HydrophobicContact CE1-CG 4.43Å; Y950-Q954 PolarHBondContact O-N 3.03Å

Retrieved 954 of 954 residues in 477.6 ms (Link to these results)

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