A0A087YNB3_POEFO Loading...

Oligophrenin 1

AlphaFold DB , UniProt , Accession A0A087YNB3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 796 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.6	Very low	83.1	Confident	239 Å²	239	76.5 Å²	76.5	100%	1.177	44%	0.439	S	S	*	.				0	125.9	0	-58.2	-62	-96.5	0	0	107.3
2	G	68.1	Low	83.6	Confident	72 Å²	72	81.1 Å²	81.1	74%	0.742	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-81.6	168.2	166.7	0	0	0	0	0	110.6
3	H	77.2	Confident	84.3	Confident	88 Å²	88	85.2 Å²	85.2	41%	0.407	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-83.5	149	165.3	-62.7	-63.7	0	0	0	109.6	C24 Y25	H3-C24 WeakPolarHBondContact ND1-CB 3.28Å; H3-Y25 HydrophobicContact CB-CE2 3.91Å
4	P	82.9	Confident	85.1	Confident	75 Å²	75	80.4 Å²	80.4	49%	0.487	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-58.3	149	168.1	-20.1	32.1	0	0	0	111	T21 Y25	P4-T21 HydrophobicContact CB-CG2 4.11Å; P4-T21 HydrophobicContact CG-CG2 4.41Å; P4-T21 WeakPolarHBondContact O-CG2 3.07Å; P4-Y25 VanDerWaalsContact O-CE2 3.3Å; P4-Y25 WeakPolarHBondContact O-CE2 3.12Å; P4-Y25 PolarHBondContact O-OH 3.19Å
5	P	86.8	Confident	85.8	Confident	79 Å²	79	76.9 Å²	76.9	51%	0.513	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-64.7	152.4	174.6	29.6	-35.3	0	0	0	111.6	E7	P5-E7 PolarHBondContact O-N 2.75Å
6	L	92.2	Very high	86.4	Confident	3 Å²	3	78.6 Å²	78.6	2%	0.016	43%	0.431	C	S	.	.			trans	-90	91.8	172.4	-68.1	169.3	0	0	0	109.7	F18 T21 L22 Y25 V182 I185 H186	L6-F18 HydrophobicContact CD2-CD2 4.25Å; L6-F18 HydrophobicContact CD2-CE2 4.11Å; L6-T21 HydrophobicContact CD2-CG2 3.68Å; L6-T21 HydrophobicContact CG-CG2 4.37Å; L6-L22 HydrophobicContact CD1-CD1 3.95Å; L6-L22 HydrophobicContact CD2-CB 4.2Å; L6-L22 HydrophobicContact CD2-CD1 4.26Å; L6-Y25 HydrophobicContact CD1-CD1 4.39Å; L6-Y25 HydrophobicContact CD1-CD2 3.62Å; L6-Y25 HydrophobicContact CD1-CE2 4.03Å; L6-Y25 HydrophobicContact CD1-CG 3.83Å; L6-Y25 HydrophobicContact CD2-CD2 4.26Å; L6-Y25 HydrophobicContact CD2-CE2 4.44Å; L6-Y25 HydrophobicContact CG-CD2 3.78Å; L6-Y25 HydrophobicContact CG-CE2 3.77Å; L6-Y25 HydrophobicContact CG-CG 4.46Å; L6-V182 HydrophobicContact CB-CG1 3.61Å; L6-V182 HydrophobicContact CB-CG2 4.42Å; L6-V182 HydrophobicContact CD1-CG1 4.45Å; L6-V182 HydrophobicContact CD1-CG2 4.48Å; L6-V182 WeakPolarHBondContact O-CG1 3.45Å; L6-I185 HydrophobicContact CD1-CB 4.46Å; L6-I185 HydrophobicContact CD1-CD1 4.08Å; L6-I185 HydrophobicContact CD1-CG2 3.98Å; L6-H186 PolarHBondContact O-CE1 2.92Å
7	E	90.6	Very high	86.9	Confident	96 Å²	96	80.8 Å²	80.8	45%	0.449	44%	0.442	S	S	.	.			trans	-71.4	133.2	179.6	-66.3	-58.6	149.9	0	0	112.1	P5 S9 D10	P5-E7 PolarHBondContact O-N 2.75Å; E7-S9 PolarHBondContact O-N 2.77Å; E7-S9 VanDerWaalsContact O-N 3.13Å; E7-D10 PolarHBondContact O-N 2.6Å
8	F	92.2	Very high	87.3	Confident	87 Å²	87	76.7 Å²	76.7	38%	0.382	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.6	174.4	-65.7	-55.9	0	0	0	112.6	D10 C11 Y12 V179 V182 Y183	F8-D10 VanDerWaalsContact C-N 3.28Å; F8-D10 PolarHBondContact O-N 2.79Å; F8-C11 WeakPolarHBondContact O-CB 3.25Å; F8-C11 PolarHBondContact O-N 2.81Å; F8-Y12 VanDerWaalsContact O-CD2 3.31Å; F8-Y12 WeakPolarHBondContact O-CD2 3.36Å; F8-Y12 WeakPolarHBondContact O-CE2 3.45Å; F8-V179 HydrophobicContact CD1-CG1 3.87Å; F8-V179 HydrophobicContact CE1-CG1 4.09Å; F8-V182 HydrophobicContact CD1-CB 4.42Å; F8-V182 HydrophobicContact CD1-CG1 4Å; F8-V182 HydrophobicContact CE1-CB 4.24Å; F8-V182 HydrophobicContact CE1-CG1 3.83Å; F8-Y183 HydrophobicContact CZ-CD2 4.39Å
9	S	91.7	Very high	87.8	Confident	64 Å²	64	76.8 Å²	76.8	45%	0.448	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.8	175.8	78.1	0	0	0	0	113.5	E7	E7-S9 PolarHBondContact O-N 2.77Å; E7-S9 VanDerWaalsContact O-N 3.13Å
10	D	92.8	Very high	88.2	Confident	39 Å²	39	79.7 Å²	79.7	21%	0.209	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.4	179.2	-67.4	-39.9	0	0	0	112.5	E7 F8 Y12 K13 D14 F18	E7-D10 PolarHBondContact O-N 2.6Å; F8-D10 VanDerWaalsContact C-N 3.28Å; F8-D10 PolarHBondContact O-N 2.79Å; D10-Y12 PolarHBondContact O-N 3.01Å; D10-Y12 VanDerWaalsContact O-N 3.17Å; D10-K13 PolarHBondContact O-N 3.5Å; D10-K13 WeakPolarHBondContact OD1-CD 3.49Å; D10-K13 WeakPolarHBondContact OD1-CE 3.13Å; D10-K13 IonicContact OD1-NZ 3.12Å; D10-K13 PolarHBondContact OD1-NZ 3.36Å; D10-D14 PolarHBondContact O-N 3.28Å; D10-F18 HydrophobicContact CB-CB 4.13Å; D10-F18 HydrophobicContact CB-CD2 3.81Å; D10-F18 HydrophobicContact CB-CG 4.13Å
11	C	94.1	Very high	88.5	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.2	171.4	-62.7	0	0	0	0	112.8	F8 Y175 S178 V179	F8-C11 WeakPolarHBondContact O-CB 3.25Å; F8-C11 PolarHBondContact O-N 2.81Å; C11-Y175 WeakPolarHBondContact O-CD1 3.21Å; C11-S178 WeakPolarHBondContact CB-OG 3.29Å; C11-V179 HydrophobicContact CB-CG2 3.82Å
12	Y	89.8	Confident	90.9	Very high	131 Å²	131	65.9 Å²	65.9	51%	0.514	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-26.7	176.9	-63.3	-83.6	0	0	0	113.4	F8 D10 Y175	F8-Y12 VanDerWaalsContact O-CD2 3.31Å; F8-Y12 WeakPolarHBondContact O-CD2 3.36Å; F8-Y12 WeakPolarHBondContact O-CE2 3.45Å; D10-Y12 PolarHBondContact O-N 3.01Å; D10-Y12 VanDerWaalsContact O-N 3.17Å; Y12-Y175 HydrophobicContact CD1-CD1 4.2Å; Y12-Y175 AromaticContact CD1-CD2 3.65Å; Y12-Y175 HydrophobicContact CD1-CD2 3.65Å; Y12-Y175 HydrophobicContact CD1-CE1 4.48Å; Y12-Y175 AromaticContact CD1-CE2 3.94Å; Y12-Y175 HydrophobicContact CD1-CE2 3.94Å; Y12-Y175 AromaticContact CD1-CG 3.78Å; Y12-Y175 HydrophobicContact CD1-CG 3.78Å; Y12-Y175 HydrophobicContact CE1-CD2 4.06Å; Y12-Y175 HydrophobicContact CE1-CG 4.16Å; Y12-Y175 VanDerWaalsContact O-CE1 3.23Å; Y12-Y175 WeakPolarHBondContact O-CE1 3.11Å; Y12-Y175 PolarHBondContact O-OH 3.48Å
13	K	91.9	Very high	92.1	Very high	134 Å²	134	68.7 Å²	68.7	58%	0.583	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-30.6	179.7	-55.5	174.6	-158.7	158.1	0	111.9	D10 S15	D10-K13 PolarHBondContact O-N 3.5Å; D10-K13 WeakPolarHBondContact OD1-CD 3.49Å; D10-K13 WeakPolarHBondContact OD1-CE 3.13Å; D10-K13 IonicContact OD1-NZ 3.12Å; D10-K13 PolarHBondContact OD1-NZ 3.36Å; K13-S15 VanDerWaalsContact C-N 3.26Å; K13-S15 PolarHBondContact O-N 3.46Å
14	D	95.4	Very high	93	Very high	18 Å²	18	66.2 Å²	66.2	10%	0.096	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	45.2	-173.8	-160.2	35.5	0	0	0	113.9	D10 R19 Y142 F174	D10-D14 PolarHBondContact O-N 3.28Å; D14-R19 IonicContact OD1-CZ 3.6Å; D14-R19 IonicContact OD1-NE 3.97Å; D14-R19 PolarHBondContact OD1-NE 2.97Å; D14-R19 IonicContact OD1-NH2 2.81Å; D14-R19 PolarHBondContact OD1-NH2 3.11Å; D14-R19 IonicContact OD2-CZ 3.52Å; D14-R19 IonicContact OD2-NE 2.73Å; D14-R19 PolarHBondContact OD2-NE 2.68Å; D14-R19 IonicContact OD2-NH2 3.6Å; D14-R19 PolarHBondContact OD2-NH2 3.03Å; D14-Y142 PolarHBondContact OD2-OH 3.33Å; D14-Y142 VanDerWaalsContact OD2-OH 3.1Å; D14-F174 HydrophobicContact CB-CE1 4.23Å; D14-F174 HydrophobicContact CB-CZ 4.06Å; D14-F174 WeakPolarHBondContact OD2-CZ 3.36Å
15	S	95.9	Very high	93.6	Very high	28 Å²	28	64.1 Å²	64.1	20%	0.196	32%	0.322	C	S	.	.			trans	-68.2	156.5	-173.6	71	0	0	0	0	112.6	K13 D17 F18 R19	K13-S15 VanDerWaalsContact C-N 3.26Å; K13-S15 PolarHBondContact O-N 3.46Å; S15-D17 PolarHBondContact O-N 2.81Å; S15-F18 WeakPolarHBondContact O-CB 3.16Å; S15-F18 PolarHBondContact O-N 2.98Å; S15-F18 VanDerWaalsContact O-N 3.13Å; S15-F18 WeakPolarHBondContact OG-CB 3.47Å; S15-F18 PolarHBondContact OG-N 2.66Å; S15-F18 VanDerWaalsContact OG-N 3.09Å; S15-R19 PolarHBondContact O-N 2.94Å
16	P	95.6	Very high	94	Very high	105 Å²	105	62.3 Å²	62.3	68%	0.682	31%	0.307	S	S	*	.	H	α-helix	trans	-53.7	-38.5	170.6	-27.3	36.3	0	0	0	112.9	R19 E20	P16-R19 PolarHBondContact O-N 2.88Å; P16-E20 PolarHBondContact O-N 2.84Å
17	D	93.9	Very high	94.1	Very high	116 Å²	116	66.4 Å²	66.4	62%	0.62	33%	0.328	S	S	*	.	H	α-helix	trans	-67	-38.7	178.6	-43.6	-56.5	0	0	0	112	S15 E20 T21	S15-D17 PolarHBondContact O-N 2.81Å; D17-E20 PolarHBondContact O-N 3.1Å; D17-T21 WeakPolarHBondContact O-CB 3.47Å; D17-T21 PolarHBondContact O-N 2.97Å; D17-T21 PolarHBondContact O-OG1 3.04Å
18	F	95.6	Very high	94.3	Very high	7 Å²	7	63.5 Å²	63.5	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-63.5	-45.4	171.8	167.3	-105.3	0	0	0	110.8	L6 D10 S15 E20 T21 L22 V182	L6-F18 HydrophobicContact CD2-CD2 4.25Å; L6-F18 HydrophobicContact CD2-CE2 4.11Å; D10-F18 HydrophobicContact CB-CB 4.13Å; D10-F18 HydrophobicContact CB-CD2 3.81Å; D10-F18 HydrophobicContact CB-CG 4.13Å; S15-F18 WeakPolarHBondContact O-CB 3.16Å; S15-F18 PolarHBondContact O-N 2.98Å; S15-F18 VanDerWaalsContact O-N 3.13Å; S15-F18 WeakPolarHBondContact OG-CB 3.47Å; S15-F18 PolarHBondContact OG-N 2.66Å; S15-F18 VanDerWaalsContact OG-N 3.09Å; F18-E20 PolarHBondContact O-N 3.32Å; F18-T21 PolarHBondContact O-N 2.8Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CZ-CD2 4.4Å; F18-L22 VanDerWaalsContact O-CB 3.24Å; F18-L22 WeakPolarHBondContact O-CB 3.14Å; F18-L22 PolarHBondContact O-N 3.08Å; F18-V182 HydrophobicContact CE2-CG2 3.93Å; F18-V182 HydrophobicContact CZ-CG2 3.86Å
19	R	95.9	Very high	94.4	Very high	79 Å²	79	59.8 Å²	59.8	30%	0.298	30%	0.299	S	S	.	.	H	α-helix	trans	-64.3	-37.7	177.1	-71.2	-71.7	-172.9	143.9	5.5	112.8	D14 S15 P16 K23 F134 S138	D14-R19 IonicContact OD1-CZ 3.6Å; D14-R19 IonicContact OD1-NE 3.97Å; D14-R19 PolarHBondContact OD1-NE 2.97Å; D14-R19 IonicContact OD1-NH2 2.81Å; D14-R19 PolarHBondContact OD1-NH2 3.11Å; D14-R19 IonicContact OD2-CZ 3.52Å; D14-R19 IonicContact OD2-NE 2.73Å; D14-R19 PolarHBondContact OD2-NE 2.68Å; D14-R19 IonicContact OD2-NH2 3.6Å; D14-R19 PolarHBondContact OD2-NH2 3.03Å; S15-R19 PolarHBondContact O-N 2.94Å; P16-R19 PolarHBondContact O-N 2.88Å; R19-K23 VanDerWaalsContact O-CB 3.29Å; R19-K23 WeakPolarHBondContact O-CB 3.43Å; R19-K23 PolarHBondContact O-N 2.75Å; R19-F134 VanDerWaalsContact CZ-CZ 3.44Å; R19-S138 PolarHBondContact NH2-OG 2.95Å
20	E	95.1	Very high	94.6	Very high	134 Å²	134	60.4 Å²	60.4	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-68.9	-41.2	173.4	-179.7	160.5	-134.4	0	0	112	P16 D17 F18 K23 C24	P16-E20 PolarHBondContact O-N 2.84Å; D17-E20 PolarHBondContact O-N 3.1Å; F18-E20 PolarHBondContact O-N 3.32Å; E20-K23 PolarHBondContact O-N 2.68Å; E20-C24 PolarHBondContact O-N 2.8Å; E20-C24 PolarHBondContact O-SG 2.6Å
21	T	94.6	Very high	94.7	Very high	24 Å²	24	66.4 Å²	66.4	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-46.7	174.8	-56.9	0	0	0	0	110.7	P4 L6 D17 F18 K23 C24 Y25	P4-T21 HydrophobicContact CB-CG2 4.11Å; P4-T21 HydrophobicContact CG-CG2 4.41Å; P4-T21 WeakPolarHBondContact O-CG2 3.07Å; L6-T21 HydrophobicContact CD2-CG2 3.68Å; L6-T21 HydrophobicContact CG-CG2 4.37Å; D17-T21 WeakPolarHBondContact O-CB 3.47Å; D17-T21 PolarHBondContact O-N 2.97Å; D17-T21 PolarHBondContact O-OG1 3.04Å; F18-T21 PolarHBondContact O-N 2.8Å; T21-K23 PolarHBondContact O-N 2.91Å; T21-C24 WeakPolarHBondContact O-CA 3.47Å; T21-C24 VanDerWaalsContact O-CB 3.28Å; T21-C24 WeakPolarHBondContact O-CB 3.48Å; T21-C24 PolarHBondContact O-N 2.83Å; T21-Y25 HydrophobicContact CG2-CD2 4.35Å; T21-Y25 HydrophobicContact CG2-CE2 4.09Å; T21-Y25 WeakPolarHBondContact O-CD2 3.3Å; T21-Y25 PolarHBondContact O-N 3.31Å
22	L	95.6	Very high	94.8	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-56.7	-47	176.3	-172.7	67	0	0	0	111.6	L6 F18 C24 Y25 E26 F134 Y181 V182 I185	L6-L22 HydrophobicContact CD1-CD1 3.95Å; L6-L22 HydrophobicContact CD2-CB 4.2Å; L6-L22 HydrophobicContact CD2-CD1 4.26Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CZ-CD2 4.4Å; F18-L22 VanDerWaalsContact O-CB 3.24Å; F18-L22 WeakPolarHBondContact O-CB 3.14Å; F18-L22 PolarHBondContact O-N 3.08Å; L22-C24 PolarHBondContact O-N 3.24Å; L22-Y25 PolarHBondContact O-N 3.32Å; L22-E26 PolarHBondContact O-N 2.88Å; L22-F134 HydrophobicContact CD2-CD1 4.48Å; L22-F134 HydrophobicContact CD2-CE1 3.6Å; L22-F134 HydrophobicContact CD2-CZ 4.06Å; L22-Y181 HydrophobicContact CD1-CD1 4.27Å; L22-Y181 HydrophobicContact CD1-CE1 3.96Å; L22-Y181 HydrophobicContact CD2-CD1 4.36Å; L22-Y181 HydrophobicContact CD2-CE1 4.07Å; L22-Y181 HydrophobicContact CG-CE1 4.22Å; L22-V182 HydrophobicContact CD1-CG2 4.22Å; L22-I185 HydrophobicContact CD1-CD1 3.4Å; L22-I185 VanDerWaalsContact CD1-CD1 3.4Å
23	K	95.3	Very high	95.1	Very high	131 Å²	131	62.3 Å²	62.3	57%	0.57	31%	0.307	S	S	*	.	H	α-helix	trans	-59.7	-31.3	174.8	-174.8	179.4	-179.1	-177.9	0	113	R19 E20 T21 L27	R19-K23 VanDerWaalsContact O-CB 3.29Å; R19-K23 WeakPolarHBondContact O-CB 3.43Å; R19-K23 PolarHBondContact O-N 2.75Å; E20-K23 PolarHBondContact O-N 2.68Å; T21-K23 PolarHBondContact O-N 2.91Å; K23-L27 VanDerWaalsContact O-CG 3.3Å; K23-L27 WeakPolarHBondContact O-CG 3.41Å; K23-L27 PolarHBondContact O-N 2.81Å; K23-L27 VanDerWaalsContact O-N 3.1Å
24	C	94.8	Very high	95.4	Very high	37 Å²	37	63.1 Å²	63.1	25%	0.25	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-41.5	172.5	-67.8	0	0	0	0	112.3	H3 E20 T21 L22 L27 E28	H3-C24 WeakPolarHBondContact ND1-CB 3.28Å; E20-C24 PolarHBondContact O-N 2.8Å; E20-C24 PolarHBondContact O-SG 2.6Å; T21-C24 WeakPolarHBondContact O-CA 3.47Å; T21-C24 VanDerWaalsContact O-CB 3.28Å; T21-C24 WeakPolarHBondContact O-CB 3.48Å; T21-C24 PolarHBondContact O-N 2.83Å; L22-C24 PolarHBondContact O-N 3.24Å; C24-L27 PolarHBondContact O-N 3.29Å; C24-E28 PolarHBondContact O-N 3.27Å; C24-E28 VanDerWaalsContact O-N 3.08Å
25	Y	95.3	Very high	95.5	Very high	30 Å²	30	68.2 Å²	68.2	12%	0.118	33%	0.332	C	S	.	.	H	α-helix	trans	-67.1	-37.8	173.9	-78.8	-93.8	0	0	0	112.3	H3 P4 L6 T21 L22 L27 E28 L29 I185 Q189	H3-Y25 HydrophobicContact CB-CE2 3.91Å; P4-Y25 VanDerWaalsContact O-CE2 3.3Å; P4-Y25 WeakPolarHBondContact O-CE2 3.12Å; P4-Y25 PolarHBondContact O-OH 3.19Å; L6-Y25 HydrophobicContact CD1-CD1 4.39Å; L6-Y25 HydrophobicContact CD1-CD2 3.62Å; L6-Y25 HydrophobicContact CD1-CE2 4.03Å; L6-Y25 HydrophobicContact CD1-CG 3.83Å; L6-Y25 HydrophobicContact CD2-CD2 4.26Å; L6-Y25 HydrophobicContact CD2-CE2 4.44Å; L6-Y25 HydrophobicContact CG-CD2 3.78Å; L6-Y25 HydrophobicContact CG-CE2 3.77Å; L6-Y25 HydrophobicContact CG-CG 4.46Å; T21-Y25 HydrophobicContact CG2-CD2 4.35Å; T21-Y25 HydrophobicContact CG2-CE2 4.09Å; T21-Y25 WeakPolarHBondContact O-CD2 3.3Å; T21-Y25 PolarHBondContact O-N 3.31Å; L22-Y25 PolarHBondContact O-N 3.32Å; Y25-L27 VanDerWaalsContact C-N 3.34Å; Y25-L27 PolarHBondContact O-N 3.22Å; Y25-E28 PolarHBondContact O-N 2.98Å; Y25-L29 WeakPolarHBondContact O-CG 3.4Å; Y25-L29 PolarHBondContact O-N 3.49Å; Y25-I185 HydrophobicContact CD1-CG2 3.67Å; Y25-I185 HydrophobicContact CG-CG2 3.98Å; Y25-Q189 HydrophobicContact CD1-CG 3.93Å; Y25-Q189 HydrophobicContact CE1-CG 3.97Å
26	E	95.2	Very high	95.6	Very high	42 Å²	42	66.9 Å²	66.9	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-56.9	-46.9	172.4	-69.5	-176.2	-179.8	0	0	111.9	L22 E28 L29 D30 K131 Y181	L22-E26 PolarHBondContact O-N 2.88Å; E26-E28 VanDerWaalsContact C-N 3.3Å; E26-E28 PolarHBondContact O-N 3.18Å; E26-L29 PolarHBondContact O-N 2.9Å; E26-D30 PolarHBondContact O-N 2.82Å; E26-K131 IonicContact OE1-NZ 2.87Å; E26-K131 PolarHBondContact OE1-NZ 2.93Å; E26-K131 IonicContact OE2-NZ 2.66Å; E26-K131 PolarHBondContact OE2-NZ 3.3Å; E26-Y181 WeakPolarHBondContact CG-OH 2.91Å; E26-Y181 PolarHBondContact OE1-OH 3.22Å
27	L	95.2	Very high	95.7	Very high	88 Å²	88	67.6 Å²	67.6	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-31.6	177.3	-70.9	168.8	0	0	0	112.7	K23 C24 Y25 R31	K23-L27 VanDerWaalsContact O-CG 3.3Å; K23-L27 WeakPolarHBondContact O-CG 3.41Å; K23-L27 PolarHBondContact O-N 2.81Å; K23-L27 VanDerWaalsContact O-N 3.1Å; C24-L27 PolarHBondContact O-N 3.29Å; Y25-L27 VanDerWaalsContact C-N 3.34Å; Y25-L27 PolarHBondContact O-N 3.22Å; L27-R31 WeakPolarHBondContact O-CB 3.48Å; L27-R31 VanDerWaalsContact O-CD 3.28Å; L27-R31 WeakPolarHBondContact O-CD 3.5Å; L27-R31 WeakPolarHBondContact O-CG 3.37Å; L27-R31 PolarHBondContact O-N 3Å; L27-R31 VanDerWaalsContact O-N 3.14Å
28	E	93.5	Very high	95.9	Very high	36 Å²	36	65.4 Å²	65.4	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-44.7	172.7	-162.8	-75	147.6	0	0	111.6	C24 Y25 E26 D30 R31 T32 Q189 K192	C24-E28 PolarHBondContact O-N 3.27Å; C24-E28 VanDerWaalsContact O-N 3.08Å; Y25-E28 PolarHBondContact O-N 2.98Å; E26-E28 VanDerWaalsContact C-N 3.3Å; E26-E28 PolarHBondContact O-N 3.18Å; E28-D30 VanDerWaalsContact C-N 3.34Å; E28-D30 PolarHBondContact O-N 3.18Å; E28-R31 WeakPolarHBondContact O-CB 3.18Å; E28-R31 PolarHBondContact O-N 2.87Å; E28-T32 WeakPolarHBondContact O-CB 3.47Å; E28-T32 PolarHBondContact O-N 2.85Å; E28-T32 PolarHBondContact O-OG1 3.23Å; E28-T32 PolarHBondContact OE1-OG1 2.98Å; E28-Q189 PolarHBondContact OE2-NE2 3.09Å; E28-Q189 PolarHBondContact OE2-OE1 3.46Å; E28-K192 IonicContact OE1-NZ 2.97Å; E28-K192 PolarHBondContact OE1-NZ 3.02Å; E28-K192 IonicContact OE2-NZ 3.84Å; E28-K192 PolarHBondContact OE2-NZ 3.5Å
29	L	94.9	Very high	95.9	Very high	9 Å²	9	67.2 Å²	67.2	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-40.2	177.8	-71.6	172.7	0	0	0	112.2	Y25 E26 T32 S33 T127 I185 V188	Y25-L29 WeakPolarHBondContact O-CG 3.4Å; Y25-L29 PolarHBondContact O-N 3.49Å; E26-L29 PolarHBondContact O-N 2.9Å; L29-T32 PolarHBondContact O-N 2.65Å; L29-S33 WeakPolarHBondContact O-CB 3.5Å; L29-S33 PolarHBondContact O-N 2.84Å; L29-T127 HydrophobicContact CD1-CG2 3.74Å; L29-I185 HydrophobicContact CD1-CG1 4.14Å; L29-V188 HydrophobicContact CD2-CB 4.14Å; L29-V188 HydrophobicContact CD2-CG1 3.5Å; L29-V188 VanDerWaalsContact CD2-CG1 3.5Å
30	D	95.6	Very high	96	Very high	77 Å²	77	63.9 Å²	63.9	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-72.1	-34.1	175.8	-93.7	-34.5	0	0	0	113.4	E26 E28 K34 K128	E26-D30 PolarHBondContact O-N 2.82Å; E28-D30 VanDerWaalsContact C-N 3.34Å; E28-D30 PolarHBondContact O-N 3.18Å; D30-K34 WeakPolarHBondContact O-CB 3.37Å; D30-K34 PolarHBondContact O-N 3.21Å; D30-K128 VanDerWaalsContact OD1-CE 3.29Å; D30-K128 WeakPolarHBondContact OD1-CE 3.42Å; D30-K128 IonicContact OD1-NZ 2.73Å; D30-K128 PolarHBondContact OD1-NZ 2.84Å; D30-K128 IonicContact OD2-NZ 3.75Å; D30-K128 PolarHBondContact OD2-NZ 3.39Å
31	R	96.1	Very high	96.1	Very high	164 Å²	164	62.5 Å²	62.5	62%	0.619	29%	0.291	S	S	*	.	H	α-helix	trans	-61.9	-47.2	169.5	-73.8	164.3	-175.1	171.6	2.5	111.1	L27 E28 K34 F35	L27-R31 WeakPolarHBondContact O-CB 3.48Å; L27-R31 VanDerWaalsContact O-CD 3.28Å; L27-R31 WeakPolarHBondContact O-CD 3.5Å; L27-R31 WeakPolarHBondContact O-CG 3.37Å; L27-R31 PolarHBondContact O-N 3Å; L27-R31 VanDerWaalsContact O-N 3.14Å; E28-R31 WeakPolarHBondContact O-CB 3.18Å; E28-R31 PolarHBondContact O-N 2.87Å; R31-K34 PolarHBondContact O-N 3.34Å; R31-F35 WeakPolarHBondContact O-CB 3.2Å; R31-F35 PolarHBondContact O-N 3.32Å
32	T	95.5	Very high	96.2	Very high	23 Å²	23	65.3 Å²	65.3	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-42.3	177.7	-78.4	0	0	0	0	111.5	E28 L29 K34 F35 L36 I124	E28-T32 WeakPolarHBondContact O-CB 3.47Å; E28-T32 PolarHBondContact O-N 2.85Å; E28-T32 PolarHBondContact O-OG1 3.23Å; E28-T32 PolarHBondContact OE1-OG1 2.98Å; L29-T32 PolarHBondContact O-N 2.65Å; T32-K34 PolarHBondContact O-N 2.92Å; T32-F35 PolarHBondContact O-N 3.36Å; T32-L36 HydrophobicContact CG2-CD1 4.03Å; T32-L36 HydrophobicContact CG2-CG 4.47Å; T32-L36 WeakPolarHBondContact O-CB 3.5Å; T32-L36 VanDerWaalsContact O-CG 3.27Å; T32-L36 WeakPolarHBondContact O-CG 3.31Å; T32-L36 PolarHBondContact O-N 2.89Å; T32-I124 HydrophobicContact CG2-CD1 4.05Å
33	S	96.8	Very high	96.2	Very high	23 Å²	23	65.5 Å²	65.5	16%	0.161	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-43	174.6	-165.8	0	0	0	0	112.5	L29 K37 R120	L29-S33 WeakPolarHBondContact O-CB 3.5Å; L29-S33 PolarHBondContact O-N 2.84Å; S33-K37 PolarHBondContact O-N 2.84Å; S33-R120 WeakPolarHBondContact O-CD 3.43Å
34	K	97.5	Very high	96.2	Very high	151 Å²	151	62 Å²	62	66%	0.657	30%	0.295	S	S	*	.	H	α-helix	trans	-65	-44.9	174.9	-174.7	179	178.4	-178.4	0	112	D30 R31 T32 K37 E38	D30-K34 WeakPolarHBondContact O-CB 3.37Å; D30-K34 PolarHBondContact O-N 3.21Å; R31-K34 PolarHBondContact O-N 3.34Å; T32-K34 PolarHBondContact O-N 2.92Å; K34-K37 WeakPolarHBondContact O-CB 3.33Å; K34-K37 PolarHBondContact O-N 2.9Å; K34-E38 PolarHBondContact O-N 2.97Å
35	F	97.3	Very high	96.2	Very high	125 Å²	125	63.4 Å²	63.4	55%	0.548	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-49.7	176	170	-102.5	0	0	0	111.5	R31 T32 K37 E38 L39	R31-F35 WeakPolarHBondContact O-CB 3.2Å; R31-F35 PolarHBondContact O-N 3.32Å; T32-F35 PolarHBondContact O-N 3.36Å; F35-K37 VanDerWaalsContact C-N 3.3Å; F35-K37 PolarHBondContact O-N 3.17Å; F35-E38 PolarHBondContact O-N 2.74Å; F35-L39 HydrophobicContact CE1-CD2 3.9Å; F35-L39 HydrophobicContact CZ-CD2 4.09Å; F35-L39 WeakPolarHBondContact O-CB 3.3Å; F35-L39 PolarHBondContact O-N 2.98Å
36	L	97.8	Very high	96.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.7	-38.9	177.6	-71.6	172.2	0	0	0	112.3	T32 E38 L39 I40 L116 F119 R120 I124 V196	T32-L36 HydrophobicContact CG2-CD1 4.03Å; T32-L36 HydrophobicContact CG2-CG 4.47Å; T32-L36 WeakPolarHBondContact O-CB 3.5Å; T32-L36 VanDerWaalsContact O-CG 3.27Å; T32-L36 WeakPolarHBondContact O-CG 3.31Å; T32-L36 PolarHBondContact O-N 2.89Å; L36-E38 PolarHBondContact O-N 3.47Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 PolarHBondContact O-N 3.39Å; L36-I40 WeakPolarHBondContact O-CB 3.24Å; L36-I40 VanDerWaalsContact O-CD1 3.23Å; L36-I40 WeakPolarHBondContact O-CD1 3.43Å; L36-I40 WeakPolarHBondContact O-CG1 3.35Å; L36-I40 PolarHBondContact O-N 2.89Å; L36-L116 HydrophobicContact CD2-CD2 4.01Å; L36-F119 HydrophobicContact CD1-CD1 3.71Å; L36-F119 HydrophobicContact CD1-CE1 4.16Å; L36-R120 HydrophobicContact CB-CG 4.14Å; L36-R120 HydrophobicContact CD1-CB 4.29Å; L36-R120 HydrophobicContact CD1-CG 4.26Å; L36-I124 HydrophobicContact CD1-CD1 3.83Å; L36-V196 HydrophobicContact CD1-CG2 4.38Å; L36-V196 HydrophobicContact CD2-CB 4.47Å; L36-V196 HydrophobicContact CD2-CG1 3.69Å; L36-V196 HydrophobicContact CD2-CG2 3.93Å
37	K	97.8	Very high	96	Very high	120 Å²	120	63.6 Å²	63.6	52%	0.522	31%	0.312	S	S	.	.	H	α-helix	trans	-60.2	-45.1	176.7	-174.9	-172.4	172.9	-170.9	0	112.1	S33 K34 F35 K41	S33-K37 PolarHBondContact O-N 2.84Å; K34-K37 WeakPolarHBondContact O-CB 3.33Å; K34-K37 PolarHBondContact O-N 2.9Å; F35-K37 VanDerWaalsContact C-N 3.3Å; F35-K37 PolarHBondContact O-N 3.17Å; K37-K41 PolarHBondContact O-N 2.82Å
38	E	98.1	Very high	96	Very high	69 Å²	69	64 Å²	64	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-73.2	-40	178.1	-59	-53.2	127.1	0	0	111.6	K34 F35 L36 I40 K41 D42	K34-E38 PolarHBondContact O-N 2.97Å; F35-E38 PolarHBondContact O-N 2.74Å; L36-E38 PolarHBondContact O-N 3.47Å; E38-I40 VanDerWaalsContact C-N 3.3Å; E38-I40 PolarHBondContact O-N 3.07Å; E38-K41 WeakPolarHBondContact O-CB 3.44Å; E38-K41 PolarHBondContact O-N 2.94Å; E38-K41 WeakPolarHBondContact OE2-CE 3.37Å; E38-K41 IonicContact OE2-NZ 3.9Å; E38-K41 PolarHBondContact OE2-NZ 2.79Å; E38-D42 WeakPolarHBondContact O-CB 3.32Å; E38-D42 VanDerWaalsContact O-CG 3.27Å; E38-D42 PolarHBondContact O-N 2.87Å
39	L	96.8	Very high	96	Very high	45 Å²	45	65.4 Å²	65.4	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-40.8	174.2	179	61.4	0	0	0	112.4	F35 L36 G43 L116 V200	F35-L39 HydrophobicContact CE1-CD2 3.9Å; F35-L39 HydrophobicContact CZ-CD2 4.09Å; F35-L39 WeakPolarHBondContact O-CB 3.3Å; F35-L39 PolarHBondContact O-N 2.98Å; L36-L39 HydrophobicContact CD2-CD2 4.5Å; L36-L39 PolarHBondContact O-N 3.39Å; L39-G43 PolarHBondContact O-N 2.91Å; L39-L116 HydrophobicContact CD2-CD1 3.81Å; L39-L116 HydrophobicContact CG-CD1 4.07Å; L39-V200 HydrophobicContact CD2-CG2 4.21Å
40	I	97.2	Very high	95.8	Very high	9 Å²	9	66.6 Å²	66.6	5%	0.046	34%	0.342	C	S	.	.	H	α-helix	trans	-65.2	-42.4	174.5	-72.6	159.6	0	0	0	111.3	L36 E38 N44 I113 L116 E117	L36-I40 WeakPolarHBondContact O-CB 3.24Å; L36-I40 VanDerWaalsContact O-CD1 3.23Å; L36-I40 WeakPolarHBondContact O-CD1 3.43Å; L36-I40 WeakPolarHBondContact O-CG1 3.35Å; L36-I40 PolarHBondContact O-N 2.89Å; E38-I40 VanDerWaalsContact C-N 3.3Å; E38-I40 PolarHBondContact O-N 3.07Å; I40-N44 WeakPolarHBondContact O-CB 3.07Å; I40-N44 PolarHBondContact O-N 2.85Å; I40-N44 PolarHBondContact O-ND2 3.2Å; I40-I113 HydrophobicContact CG2-CG2 4.22Å; I40-L116 HydrophobicContact CD1-CB 3.9Å; I40-L116 HydrophobicContact CG1-CB 3.74Å; I40-L116 HydrophobicContact CG1-CD1 4.39Å; I40-E117 HydrophobicContact CD1-CG 3.8Å; I40-E117 HydrophobicContact CG1-CG 4.49Å; I40-E117 HydrophobicContact CG2-CG 4.19Å
41	K	97.6	Very high	95.7	Very high	106 Å²	106	66 Å²	66	46%	0.461	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-45.4	177.6	170	179.5	128.6	-78.4	0	111.5	K37 E38 N44 S45	K37-K41 PolarHBondContact O-N 2.82Å; E38-K41 WeakPolarHBondContact O-CB 3.44Å; E38-K41 PolarHBondContact O-N 2.94Å; E38-K41 WeakPolarHBondContact OE2-CE 3.37Å; E38-K41 IonicContact OE2-NZ 3.9Å; E38-K41 PolarHBondContact OE2-NZ 2.79Å; K41-N44 PolarHBondContact O-N 2.75Å; K41-S45 PolarHBondContact O-N 3.28Å; K41-S45 PolarHBondContact O-OG 3.48Å
42	D	96.6	Very high	95.6	Very high	83 Å²	83	60.1 Å²	60.1	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-74.7	-36.8	-176.2	-62.2	-8.5	0	0	0	110.4	E38 S45 V46	E38-D42 WeakPolarHBondContact O-CB 3.32Å; E38-D42 VanDerWaalsContact O-CG 3.27Å; E38-D42 PolarHBondContact O-N 2.87Å; D42-S45 WeakPolarHBondContact O-CA 3.26Å; D42-S45 WeakPolarHBondContact O-CB 3.32Å; D42-S45 PolarHBondContact O-N 3.28Å; D42-S45 VanDerWaalsContact O-N 3.11Å; D42-V46 WeakPolarHBondContact O-CG2 3.25Å; D42-V46 PolarHBondContact O-N 2.87Å
43	G	95	Very high	95.6	Very high	7 Å²	7	65.4 Å²	65.4	7%	0.072	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-44.7	169.4	0	0	0	0	0	113.3	L39 S45 V46 I47	L39-G43 PolarHBondContact O-N 2.91Å; G43-S45 VanDerWaalsContact C-N 3.27Å; G43-S45 PolarHBondContact O-N 2.92Å; G43-V46 PolarHBondContact O-N 2.91Å; G43-I47 WeakPolarHBondContact O-CG1 3.43Å; G43-I47 PolarHBondContact O-N 3.37Å
44	N	95.3	Very high	95.4	Very high	57 Å²	57	64.3 Å²	64.3	31%	0.305	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-34.2	172.2	-83	-67.8	0	0	0	112.3	I40 K41 I47 T48	I40-N44 WeakPolarHBondContact O-CB 3.07Å; I40-N44 PolarHBondContact O-N 2.85Å; I40-N44 PolarHBondContact O-ND2 3.2Å; K41-N44 PolarHBondContact O-N 2.75Å; N44-I47 PolarHBondContact O-N 2.99Å; N44-T48 WeakPolarHBondContact O-CB 3.44Å; N44-T48 PolarHBondContact O-N 3.26Å; N44-T48 PolarHBondContact O-OG1 3.06Å
45	S	96.1	Very high	95.3	Very high	68 Å²	68	62.1 Å²	62.1	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-67.5	-41.9	176.2	-55.9	0	0	0	0	111.6	K41 D42 G43 T48 A49	K41-S45 PolarHBondContact O-N 3.28Å; K41-S45 PolarHBondContact O-OG 3.48Å; D42-S45 WeakPolarHBondContact O-CA 3.26Å; D42-S45 WeakPolarHBondContact O-CB 3.32Å; D42-S45 PolarHBondContact O-N 3.28Å; D42-S45 VanDerWaalsContact O-N 3.11Å; G43-S45 VanDerWaalsContact C-N 3.27Å; G43-S45 PolarHBondContact O-N 2.92Å; S45-T48 PolarHBondContact O-N 3.39Å; S45-A49 WeakPolarHBondContact O-CB 3.36Å; S45-A49 PolarHBondContact O-N 2.84Å
46	V	93.3	Very high	95.3	Very high	66 Å²	66	59.1 Å²	59.1	40%	0.4	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-48	172.7	173	0	0	0	0	111.3	D42 G43 T48 A49 I50 F203	D42-V46 WeakPolarHBondContact O-CG2 3.25Å; D42-V46 PolarHBondContact O-N 2.87Å; G43-V46 PolarHBondContact O-N 2.91Å; V46-T48 VanDerWaalsContact C-N 3.29Å; V46-T48 PolarHBondContact O-N 3.45Å; V46-A49 PolarHBondContact O-N 3.34Å; V46-I50 HydrophobicContact CG1-CD1 3.83Å; V46-I50 HydrophobicContact CG1-CG1 4.44Å; V46-I50 WeakPolarHBondContact O-CG1 3.29Å; V46-I50 PolarHBondContact O-N 2.95Å; V46-F203 HydrophobicContact CG1-CE1 4.5Å; V46-F203 HydrophobicContact CG1-CZ 4.04Å
47	I	92.4	Very high	95.2	Very high	10 Å²	10	60 Å²	60	5%	0.051	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-43.6	176.9	-70	166.5	0	0	0	110.7	G43 N44 I50 K51 V105 A108 I113 F203	G43-I47 WeakPolarHBondContact O-CG1 3.43Å; G43-I47 PolarHBondContact O-N 3.37Å; N44-I47 PolarHBondContact O-N 2.99Å; I47-I50 PolarHBondContact O-N 2.64Å; I47-K51 WeakPolarHBondContact O-CG 3.5Å; I47-K51 PolarHBondContact O-N 2.83Å; I47-V105 HydrophobicContact CG2-CG1 4.15Å; I47-A108 HydrophobicContact CD1-CB 3.86Å; I47-A108 HydrophobicContact CG1-CB 3.95Å; I47-I113 HydrophobicContact CD1-CD1 4.24Å; I47-I113 HydrophobicContact CD1-CG1 3.79Å; I47-F203 HydrophobicContact CG1-CE2 4.23Å; I47-F203 HydrophobicContact CG1-CZ 4.39Å
48	T	94.2	Very high	95.1	Very high	95 Å²	95	56.9 Å²	56.9	58%	0.583	32%	0.322	S	S	*	.	H	α-helix	trans	-63.3	-43.6	177.3	-57.5	0	0	0	0	111.9	N44 S45 V46 K51 G52	N44-T48 WeakPolarHBondContact O-CB 3.44Å; N44-T48 PolarHBondContact O-N 3.26Å; N44-T48 PolarHBondContact O-OG1 3.06Å; S45-T48 PolarHBondContact O-N 3.39Å; V46-T48 VanDerWaalsContact C-N 3.29Å; V46-T48 PolarHBondContact O-N 3.45Å; T48-K51 PolarHBondContact O-N 3.04Å; T48-G52 PolarHBondContact O-N 3.5Å
49	A	94.7	Very high	95	Very high	66 Å²	66	60.6 Å²	60.6	55%	0.545	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-42.8	178.1	0	0	0	0	0	112.3	S45 V46 G52 Y53	S45-A49 WeakPolarHBondContact O-CB 3.36Å; S45-A49 PolarHBondContact O-N 2.84Å; V46-A49 PolarHBondContact O-N 3.34Å; A49-G52 PolarHBondContact O-N 2.74Å; A49-Y53 PolarHBondContact O-N 3.17Å
50	I	91.2	Very high	95	Very high	35 Å²	35	64.1 Å²	64.1	18%	0.179	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-41.7	177.2	-56.7	162.1	0	0	0	110.5	V46 I47 G52 Y53 S54 R101 V105	V46-I50 HydrophobicContact CG1-CD1 3.83Å; V46-I50 HydrophobicContact CG1-CG1 4.44Å; V46-I50 WeakPolarHBondContact O-CG1 3.29Å; V46-I50 PolarHBondContact O-N 2.95Å; I47-I50 PolarHBondContact O-N 2.64Å; I50-G52 VanDerWaalsContact C-N 3.35Å; I50-G52 PolarHBondContact O-N 2.9Å; I50-Y53 PolarHBondContact O-N 2.86Å; I50-S54 PolarHBondContact O-N 3.07Å; I50-R101 HydrophobicContact CG2-CG 4.13Å; I50-V105 HydrophobicContact CB-CG1 4.45Å; I50-V105 HydrophobicContact CB-CG2 4.2Å; I50-V105 HydrophobicContact CG2-CG1 4.48Å; I50-V105 HydrophobicContact CG2-CG2 3.52Å
51	K	92.5	Very high	95	Very high	64 Å²	64	63.7 Å²	63.7	28%	0.278	35%	0.349	S	S	.	.	H	α-helix	trans	-59.4	-43.7	174.1	-72.9	-171.7	172.2	-168.4	0	112.2	I47 T48 S54 L55 M102 V105	I47-K51 WeakPolarHBondContact O-CG 3.5Å; I47-K51 PolarHBondContact O-N 2.83Å; T48-K51 PolarHBondContact O-N 3.04Å; K51-S54 PolarHBondContact O-N 2.94Å; K51-L55 VanDerWaalsContact O-CG 3.3Å; K51-L55 WeakPolarHBondContact O-CG 3.18Å; K51-L55 PolarHBondContact O-N 3.48Å; K51-M102 HydrophobicContact CG-SD 4.16Å; K51-V105 HydrophobicContact CD-CG1 4.27Å; K51-V105 HydrophobicContact CG-CG1 3.52Å
52	G	94.9	Very high	94.9	Very high	41 Å²	41	64.4 Å²	64.4	42%	0.423	35%	0.354	S	S	.	.	H	α-helix	trans	-61.3	-41.7	176.1	0	0	0	0	0	113.1	T48 A49 I50 A56	T48-G52 PolarHBondContact O-N 3.5Å; A49-G52 PolarHBondContact O-N 2.74Å; I50-G52 VanDerWaalsContact C-N 3.35Å; I50-G52 PolarHBondContact O-N 2.9Å; G52-A56 PolarHBondContact O-N 3.27Å; G52-A56 VanDerWaalsContact O-N 3.17Å
53	Y	94.2	Very high	94.9	Very high	134 Å²	134	64.8 Å²	64.8	53%	0.525	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-49.5	174.9	173.6	-127.1	0	0	0	112.1	A49 I50 L55 A56 V57	A49-Y53 PolarHBondContact O-N 3.17Å; I50-Y53 PolarHBondContact O-N 2.86Å; Y53-L55 VanDerWaalsContact C-N 3.34Å; Y53-L55 PolarHBondContact O-N 2.81Å; Y53-A56 WeakPolarHBondContact O-CB 3.18Å; Y53-A56 PolarHBondContact O-N 3.36Å; Y53-A56 VanDerWaalsContact O-N 3.1Å; Y53-V57 HydrophobicContact CD2-CG2 3.98Å; Y53-V57 HydrophobicContact CE2-CG2 3.51Å; Y53-V57 PolarHBondContact O-N 3.36Å
54	S	93.8	Very high	94.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.9	-40.9	178	-73	0	0	0	0	113.2	I50 K51 A56 V57 Q58 E98 R101	I50-S54 PolarHBondContact O-N 3.07Å; K51-S54 PolarHBondContact O-N 2.94Å; S54-A56 VanDerWaalsContact C-N 3.3Å; S54-A56 PolarHBondContact O-N 3.07Å; S54-V57 PolarHBondContact O-N 3.04Å; S54-Q58 WeakPolarHBondContact O-CB 3.43Å; S54-Q58 VanDerWaalsContact O-CG 3.29Å; S54-Q58 WeakPolarHBondContact O-CG 3.38Å; S54-Q58 PolarHBondContact O-N 2.96Å; S54-E98 VanDerWaalsContact CA-OE2 3.26Å; S54-E98 WeakPolarHBondContact CA-OE2 3.07Å; S54-E98 WeakPolarHBondContact CB-OE2 3.27Å; S54-E98 PolarHBondContact OG-OE2 2.91Å; S54-R101 WeakPolarHBondContact OG-CD 3.43Å
55	L	94.8	Very high	94.7	Very high	105 Å²	105	65.1 Å²	65.1	55%	0.55	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-36	175.9	-71.6	168.7	0	0	0	112.2	K51 Y53 K59	K51-L55 VanDerWaalsContact O-CG 3.3Å; K51-L55 WeakPolarHBondContact O-CG 3.18Å; K51-L55 PolarHBondContact O-N 3.48Å; Y53-L55 VanDerWaalsContact C-N 3.34Å; Y53-L55 PolarHBondContact O-N 2.81Å; L55-K59 WeakPolarHBondContact O-CB 3.39Å; L55-K59 PolarHBondContact O-N 2.87Å
56	A	97.3	Very high	94.4	Very high	61 Å²	61	65.6 Å²	65.6	50%	0.504	37%	0.371	S	S	.	.	H	α-helix	trans	-67.7	-43.2	175.1	0	0	0	0	0	112.1	G52 Y53 S54 K59 F60	G52-A56 PolarHBondContact O-N 3.27Å; G52-A56 VanDerWaalsContact O-N 3.17Å; Y53-A56 WeakPolarHBondContact O-CB 3.18Å; Y53-A56 PolarHBondContact O-N 3.36Å; Y53-A56 VanDerWaalsContact O-N 3.1Å; S54-A56 VanDerWaalsContact C-N 3.3Å; S54-A56 PolarHBondContact O-N 3.07Å; A56-K59 PolarHBondContact O-N 3.09Å; A56-F60 PolarHBondContact O-N 3.38Å
57	V	96.1	Very high	94.1	Very high	19 Å²	19	66.1 Å²	66.1	12%	0.115	37%	0.368	C	S	.	.	H	α-helix	trans	-68.1	-40.2	177.3	178.7	0	0	0	0	111.5	Y53 S54 K59 F60 S61 L94 E98	Y53-V57 HydrophobicContact CD2-CG2 3.98Å; Y53-V57 HydrophobicContact CE2-CG2 3.51Å; Y53-V57 PolarHBondContact O-N 3.36Å; S54-V57 PolarHBondContact O-N 3.04Å; V57-K59 PolarHBondContact O-N 2.99Å; V57-F60 PolarHBondContact O-N 2.92Å; V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3Å; V57-L94 HydrophobicContact CG1-CB 4.21Å; V57-L94 HydrophobicContact CG1-CD2 3.94Å; V57-L94 HydrophobicContact CG1-CG 4.46Å; V57-E98 HydrophobicContact CB-CG 3.74Å; V57-E98 HydrophobicContact CG1-CG 3.57Å; V57-E98 WeakPolarHBondContact CG1-OE1 3.25Å
58	Q	95.2	Very high	93.5	Very high	54 Å²	54	72.5 Å²	72.5	25%	0.252	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-44.8	173.7	-75.7	175.1	-11.3	0	0	111.8	S54 F60 S61 Q62 E98	S54-Q58 WeakPolarHBondContact O-CB 3.43Å; S54-Q58 VanDerWaalsContact O-CG 3.29Å; S54-Q58 WeakPolarHBondContact O-CG 3.38Å; S54-Q58 PolarHBondContact O-N 2.96Å; Q58-F60 PolarHBondContact O-N 3.04Å; Q58-S61 PolarHBondContact O-N 3.26Å; Q58-Q62 WeakPolarHBondContact O-CG 3.37Å; Q58-Q62 PolarHBondContact O-N 2.92Å; Q58-E98 HydrophobicContact CG-CB 3.72Å; Q58-E98 HydrophobicContact CG-CG 4.1Å
59	K	95.9	Very high	92.7	Very high	148 Å²	148	71.4 Å²	71.4	64%	0.643	39%	0.385	S	S	*	.	H	α-helix	trans	-64.9	-37.6	175.9	-175.5	174.5	179.7	177.1	0	112.6	L55 A56 V57 T63	L55-K59 WeakPolarHBondContact O-CB 3.39Å; L55-K59 PolarHBondContact O-N 2.87Å; A56-K59 PolarHBondContact O-N 3.09Å; V57-K59 PolarHBondContact O-N 2.99Å; K59-T63 PolarHBondContact O-N 2.63Å; K59-T63 VanDerWaalsContact O-N 3.13Å; K59-T63 PolarHBondContact O-OG1 2.56Å
60	F	97.6	Very high	91.6	Very high	119 Å²	119	75.8 Å²	75.8	52%	0.522	40%	0.399	S	S	.	.	H	α-helix	trans	-64.5	-46.9	174.4	178	-115.7	0	0	0	111.3	A56 V57 Q58 Q62 T63 L64 L94	A56-F60 PolarHBondContact O-N 3.38Å; V57-F60 PolarHBondContact O-N 2.92Å; Q58-F60 PolarHBondContact O-N 3.04Å; F60-Q62 PolarHBondContact O-N 3.26Å; F60-T63 WeakPolarHBondContact O-CA 3.43Å; F60-T63 VanDerWaalsContact O-CB 3.27Å; F60-T63 WeakPolarHBondContact O-CB 3.37Å; F60-T63 PolarHBondContact O-N 2.58Å; F60-L64 HydrophobicContact CD1-CD1 4.33Å; F60-L64 HydrophobicContact CE1-CD1 3.82Å; F60-L64 HydrophobicContact CE1-CG 4.31Å; F60-L64 HydrophobicContact CE2-CD2 4.17Å; F60-L64 HydrophobicContact CE2-CG 4.48Å; F60-L64 HydrophobicContact CZ-CD1 4.08Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.21Å; F60-L64 PolarHBondContact O-N 3.11Å; F60-L94 HydrophobicContact CD1-CD1 4.01Å; F60-L94 HydrophobicContact CE1-CD1 4.22Å
61	S	97	Very high	90.2	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-57.4	-44.9	174.2	167.4	0	0	0	0	112.7	V57 Q58 T63 L64 S65 A91 Q95	V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3Å; Q58-S61 PolarHBondContact O-N 3.26Å; S61-T63 PolarHBondContact O-N 3.44Å; S61-L64 WeakPolarHBondContact O-CB 3.4Å; S61-L64 PolarHBondContact O-N 2.98Å; S61-S65 PolarHBondContact O-N 2.92Å; S61-S65 PolarHBondContact O-OG 2.96Å; S61-A91 WeakPolarHBondContact O-CB 3.3Å; S61-A91 VanDerWaalsContact OG-C 3.3Å; S61-A91 VanDerWaalsContact OG-CA 3.23Å; S61-A91 WeakPolarHBondContact OG-CA 3.34Å; S61-A91 WeakPolarHBondContact OG-CB 3.34Å; S61-A91 PolarHBondContact OG-O 2.84Å; S61-Q95 WeakPolarHBondContact OG-CG 3.11Å; S61-Q95 PolarHBondContact OG-NE2 3.19Å
62	Q	94.8	Very high	88.7	Confident	121 Å²	121	85.4 Å²	85.4	57%	0.565	45%	0.446	S	S	*	.	H	α-helix	trans	-55.9	-39	173.7	-75.2	170.1	-10.7	0	0	112.3	Q58 F60 S65 A66	Q58-Q62 WeakPolarHBondContact O-CG 3.37Å; Q58-Q62 PolarHBondContact O-N 2.92Å; F60-Q62 PolarHBondContact O-N 3.26Å; Q62-S65 WeakPolarHBondContact CA-OG 3.49Å; Q62-S65 PolarHBondContact O-N 3.36Å; Q62-S65 PolarHBondContact O-OG 3.46Å; Q62-A66 WeakPolarHBondContact O-CB 3.35Å; Q62-A66 PolarHBondContact O-N 3.12Å; Q62-A66 VanDerWaalsContact O-N 3.15Å
63	T	95.8	Very high	87.4	Confident	90 Å²	90	85.9 Å²	85.9	55%	0.552	45%	0.451	S	S	*	.	H	α-helix	trans	-67	-37.1	177.1	-49.4	0	0	0	0	111.6	K59 F60 S61	K59-T63 PolarHBondContact O-N 2.63Å; K59-T63 VanDerWaalsContact O-N 3.13Å; K59-T63 PolarHBondContact O-OG1 2.56Å; F60-T63 WeakPolarHBondContact O-CA 3.43Å; F60-T63 VanDerWaalsContact O-CB 3.27Å; F60-T63 WeakPolarHBondContact O-CB 3.37Å; F60-T63 PolarHBondContact O-N 2.58Å; S61-T63 PolarHBondContact O-N 3.44Å
64	L	94.6	Very high	86.2	Confident	26 Å²	26	87.8 Å²	87.8	14%	0.136	47%	0.47	C	S	.	.	H	α-helix	trans	-68.1	-45.3	173.4	-60.1	-177.9	0	0	0	111.8	F60 S61 A66 F67 F87 F90 A91 L94	F60-L64 HydrophobicContact CD1-CD1 4.33Å; F60-L64 HydrophobicContact CE1-CD1 3.82Å; F60-L64 HydrophobicContact CE1-CG 4.31Å; F60-L64 HydrophobicContact CE2-CD2 4.17Å; F60-L64 HydrophobicContact CE2-CG 4.48Å; F60-L64 HydrophobicContact CZ-CD1 4.08Å; F60-L64 HydrophobicContact CZ-CD2 3.97Å; F60-L64 HydrophobicContact CZ-CG 4.21Å; F60-L64 PolarHBondContact O-N 3.11Å; S61-L64 WeakPolarHBondContact O-CB 3.4Å; S61-L64 PolarHBondContact O-N 2.98Å; L64-A66 PolarHBondContact O-N 3.3Å; L64-F67 WeakPolarHBondContact O-CB 3.16Å; L64-F67 PolarHBondContact O-N 3.36Å; L64-F67 VanDerWaalsContact O-N 3.08Å; L64-F87 HydrophobicContact CB-CB 4.4Å; L64-F87 HydrophobicContact CD2-CD1 3.98Å; L64-F87 HydrophobicContact CD2-CE1 4.46Å; L64-F90 HydrophobicContact CD1-CB 4.07Å; L64-A91 HydrophobicContact CB-CB 4.13Å; L64-L94 HydrophobicContact CD1-CD1 4.2Å
65	S	91.7	Very high	85.3	Confident	45 Å²	45	92.1 Å²	92.1	32%	0.315	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-19	179.6	55.7	0	0	0	0	114.4	S61 Q62	S61-S65 PolarHBondContact O-N 2.92Å; S61-S65 PolarHBondContact O-OG 2.96Å; Q62-S65 WeakPolarHBondContact CA-OG 3.49Å; Q62-S65 PolarHBondContact O-N 3.36Å; Q62-S65 PolarHBondContact O-OG 3.46Å
66	A	90.4	Very high	84.3	Confident	79 Å²	79	90.4 Å²	90.4	65%	0.653	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.8	175.8	0	0	0	0	0	113.3	Q62 L64	Q62-A66 WeakPolarHBondContact O-CB 3.35Å; Q62-A66 PolarHBondContact O-N 3.12Å; Q62-A66 VanDerWaalsContact O-N 3.15Å; L64-A66 PolarHBondContact O-N 3.3Å
67	F	88	Confident	83.3	Confident	77 Å²	77	91 Å²	91	34%	0.338	49%	0.489	S	S	.	.			trans	-76.5	130	179.1	-177.2	-89.4	0	0	0	111.5	L64 F69 F87	L64-F67 WeakPolarHBondContact O-CB 3.16Å; L64-F67 PolarHBondContact O-N 3.36Å; L64-F67 VanDerWaalsContact O-N 3.08Å; F67-F69 HydrophobicContact CE1-CD1 4.28Å; F67-F69 AromaticContact CE1-CD2 3.97Å; F67-F69 HydrophobicContact CE1-CD2 3.97Å; F67-F69 HydrophobicContact CE1-CE1 4.08Å; F67-F69 AromaticContact CE1-CE2 3.75Å; F67-F69 HydrophobicContact CE1-CE2 3.75Å; F67-F69 HydrophobicContact CE1-CG 4.23Å; F67-F69 AromaticContact CE1-CZ 3.8Å; F67-F69 HydrophobicContact CE1-CZ 3.8Å; F67-F69 HydrophobicContact CZ-CD1 4.01Å; F67-F69 AromaticContact CZ-CE1 3.79Å; F67-F69 HydrophobicContact CZ-CE1 3.79Å; F67-F69 HydrophobicContact CZ-CE2 4.31Å; F67-F69 HydrophobicContact CZ-CG 4.37Å; F67-F69 AromaticContact CZ-CZ 3.95Å; F67-F69 HydrophobicContact CZ-CZ 3.95Å; F67-F87 HydrophobicContact CB-CD2 4.49Å; F67-F87 AromaticContact CD1-CD2 3.44Å; F67-F87 HydrophobicContact CD1-CD2 3.44Å; F67-F87 VanDerWaalsContact CD1-CD2 3.44Å; F67-F87 AromaticContact CD1-CE2 3.86Å; F67-F87 HydrophobicContact CD1-CE2 3.86Å; F67-F87 HydrophobicContact CD1-CG 4.35Å; F67-F87 AromaticContact CE1-CD2 3.89Å; F67-F87 HydrophobicContact CE1-CD2 3.89Å; F67-F87 AromaticContact CE1-CE2 3.88Å; F67-F87 HydrophobicContact CE1-CE2 3.88Å; F67-F87 HydrophobicContact CG-CD2 4.07Å; F67-F87 HydrophobicContact CG-CE2 4.44Å; F67-F87 HydrophobicContact CZ-CE2 4.47Å
68	Q	79.8	Confident	82.4	Confident	143 Å²	143	95.6 Å²	95.6	67%	0.668	51%	0.513	S	S	*	.			trans	-141.9	154.5	168.4	-61.1	-175.3	4.7	0	0	107.8
69	F	77	Confident	81.4	Confident	73 Å²	73	95.4 Å²	95.4	32%	0.32	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-82.8	131	171.3	-71.3	-78.9	0	0	0	110.5	F67 F71 L76 E80 I83 A84	F67-F69 HydrophobicContact CE1-CD1 4.28Å; F67-F69 AromaticContact CE1-CD2 3.97Å; F67-F69 HydrophobicContact CE1-CD2 3.97Å; F67-F69 HydrophobicContact CE1-CE1 4.08Å; F67-F69 AromaticContact CE1-CE2 3.75Å; F67-F69 HydrophobicContact CE1-CE2 3.75Å; F67-F69 HydrophobicContact CE1-CG 4.23Å; F67-F69 AromaticContact CE1-CZ 3.8Å; F67-F69 HydrophobicContact CE1-CZ 3.8Å; F67-F69 HydrophobicContact CZ-CD1 4.01Å; F67-F69 AromaticContact CZ-CE1 3.79Å; F67-F69 HydrophobicContact CZ-CE1 3.79Å; F67-F69 HydrophobicContact CZ-CE2 4.31Å; F67-F69 HydrophobicContact CZ-CG 4.37Å; F67-F69 AromaticContact CZ-CZ 3.95Å; F67-F69 HydrophobicContact CZ-CZ 3.95Å; F69-F71 PolarHBondContact O-N 2.85Å; F69-L76 HydrophobicContact CB-CD2 4.16Å; F69-E80 HydrophobicContact CD2-CB 3.9Å; F69-E80 HydrophobicContact CD2-CG 4.31Å; F69-E80 WeakPolarHBondContact CD2-O 3.34Å; F69-E80 HydrophobicContact CE2-CB 4.34Å; F69-E80 WeakPolarHBondContact CE2-O 3.23Å; F69-E80 HydrophobicContact CG-CB 4.38Å; F69-E80 HydrophobicContact CG-CG 4.44Å; F69-I83 HydrophobicContact CE2-CB 3.92Å; F69-I83 HydrophobicContact CE2-CG2 3.73Å; F69-I83 HydrophobicContact CZ-CB 4.33Å; F69-I83 HydrophobicContact CZ-CG2 3.77Å; F69-A84 HydrophobicContact CD2-CB 4.16Å; F69-A84 HydrophobicContact CE2-CB 4.43Å
70	D	70.5	Confident	80.6	Confident	158 Å²	158	91 Å²	91	85%	0.845	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-68	118.6	161.3	-69.2	-48.7	0	0	0	108.3
71	F	61.9	Low	79.9	Confident	134 Å²	134	88.2 Å²	88.2	59%	0.588	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-76.9	141.5	-173.5	69.8	-88.3	0	0	0	112.5	F69 G73 L76	F69-F71 PolarHBondContact O-N 2.85Å; F71-G73 VanDerWaalsContact CD2-O 3.3Å; F71-G73 WeakPolarHBondContact CD2-O 3.49Å; F71-G73 WeakPolarHBondContact CE2-O 3.08Å; F71-L76 HydrophobicContact CB-CD2 3.67Å; F71-L76 HydrophobicContact CB-CG 4.02Å
72	I	61.5	Low	79.1	Confident	167 Å²	167	90.9 Å²	90.9	86%	0.856	50%	0.5	S	S	*	.			trans	-121.5	96.3	176.7	-57.3	179.1	0	0	0	108.7
73	G	66.7	Low	78.5	Confident	50 Å²	50	86.8 Å²	86.8	52%	0.515	48%	0.481	S	S	.	.	S	Bend	trans	135.1	-159.1	-174.3	0	0	0	0	0	111.1	F71	F71-G73 VanDerWaalsContact CD2-O 3.3Å; F71-G73 WeakPolarHBondContact CD2-O 3.49Å; F71-G73 WeakPolarHBondContact CE2-O 3.08Å
74	D	69.3	Low	78	Confident	175 Å²	175	83.1 Å²	83.1	94%	0.936	46%	0.46	S	S	*	.	S	Bend	trans	-88.9	-15	-179.6	-61.8	-47.3	0	0	0	113.7
75	S	75.1	Confident	77.7	Confident	91 Å²	91	85 Å²	85	64%	0.636	47%	0.468	S	S	*	.	S	Bend	trans	-160.9	152.2	179.7	60.1	0	0	0	0	112.1
76	L	73.2	Confident	77.7	Confident	68 Å²	68	83 Å²	83	36%	0.356	45%	0.454	S	S	.	.			trans	-62.8	149.5	165.5	-70.2	169.5	0	0	0	111.5	F69 F71 E80 I81	F69-L76 HydrophobicContact CB-CD2 4.16Å; F71-L76 HydrophobicContact CB-CD2 3.67Å; F71-L76 HydrophobicContact CB-CG 4.02Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; L76-I81 HydrophobicContact CB-CD1 4.14Å; L76-I81 HydrophobicContact CB-CG1 3.94Å; L76-I81 HydrophobicContact CD1-CG1 4.18Å
77	T	77.3	Confident	77.8	Confident	75 Å²	75	82.1 Å²	82.1	46%	0.46	44%	0.436	S	S	.	.			trans	-80.3	157.5	169.4	62.2	0	0	0	0	112.1	D79 E80 I81	T77-D79 PolarHBondContact O-N 3.35Å; T77-E80 WeakPolarHBondContact CB-OE2 3.32Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.34Å; T77-E80 PolarHBondContact N-OE2 3.36Å; T77-E80 PolarHBondContact O-N 3.21Å; T77-E80 VanDerWaalsContact OG1-CD 3.3Å; T77-E80 VanDerWaalsContact OG1-CG 3.28Å; T77-E80 WeakPolarHBondContact OG1-CG 3.37Å; T77-E80 PolarHBondContact OG1-N 3.21Å; T77-E80 PolarHBondContact OG1-OE2 3.39Å; T77-I81 WeakPolarHBondContact O-CG1 3.16Å; T77-I81 PolarHBondContact O-N 3.01Å; T77-I81 VanDerWaalsContact O-N 3.09Å
78	D	76.3	Confident	78	Confident	115 Å²	115	82.8 Å²	82.8	62%	0.615	44%	0.44	S	S	*	.	H	α-helix	trans	-56.2	-35.6	173.6	-73.7	-16	0	0	0	111.3	N82	D78-N82 WeakPolarHBondContact O-CB 3.26Å; D78-N82 PolarHBondContact O-N 3.28Å; D78-N82 PolarHBondContact O-ND2 3.05Å
79	D	76.1	Confident	78.6	Confident	50 Å²	50	77.7 Å²	77.7	27%	0.267	42%	0.416	S	S	.	.	H	α-helix	trans	-70.6	-42.2	179.1	-85.8	8.4	0	0	0	112.6	T77 I81 N82 I83 S235	T77-D79 PolarHBondContact O-N 3.35Å; D79-I81 VanDerWaalsContact C-N 3.31Å; D79-I81 PolarHBondContact O-N 3.36Å; D79-N82 PolarHBondContact O-N 3.45Å; D79-I83 WeakPolarHBondContact O-CB 3.24Å; D79-I83 WeakPolarHBondContact O-CD1 3.3Å; D79-I83 VanDerWaalsContact O-CG1 3.22Å; D79-I83 WeakPolarHBondContact O-CG1 3.39Å; D79-I83 PolarHBondContact O-N 3.3Å; D79-S235 VanDerWaalsContact CG-OG 3.24Å; D79-S235 WeakPolarHBondContact OD2-CA 3.43Å; D79-S235 WeakPolarHBondContact OD2-CB 3.37Å; D79-S235 PolarHBondContact OD2-OG 3.31Å
80	E	78.9	Confident	79.5	Confident	55 Å²	55	77.2 Å²	77.2	26%	0.257	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-39.1	174.4	-71.7	161.2	128.1	0	0	111.7	F69 L76 T77 A84	F69-E80 HydrophobicContact CD2-CB 3.9Å; F69-E80 HydrophobicContact CD2-CG 4.31Å; F69-E80 WeakPolarHBondContact CD2-O 3.34Å; F69-E80 HydrophobicContact CE2-CB 4.34Å; F69-E80 WeakPolarHBondContact CE2-O 3.23Å; F69-E80 HydrophobicContact CG-CB 4.38Å; F69-E80 HydrophobicContact CG-CG 4.44Å; L76-E80 HydrophobicContact CD2-CB 4.11Å; T77-E80 WeakPolarHBondContact CB-OE2 3.32Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.34Å; T77-E80 PolarHBondContact N-OE2 3.36Å; T77-E80 PolarHBondContact O-N 3.21Å; T77-E80 VanDerWaalsContact OG1-CD 3.3Å; T77-E80 VanDerWaalsContact OG1-CG 3.28Å; T77-E80 WeakPolarHBondContact OG1-CG 3.37Å; T77-E80 PolarHBondContact OG1-N 3.21Å; T77-E80 PolarHBondContact OG1-OE2 3.39Å; E80-A84 WeakPolarHBondContact O-CB 3.12Å; E80-A84 PolarHBondContact O-N 3.39Å
81	I	81.2	Confident	80.6	Confident	60 Å²	60	69.8 Å²	69.8	31%	0.308	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-53.7	174.6	-66.6	164.5	0	0	0	110	L76 T77 D79 I83 A84 E85	L76-I81 HydrophobicContact CB-CD1 4.14Å; L76-I81 HydrophobicContact CB-CG1 3.94Å; L76-I81 HydrophobicContact CD1-CG1 4.18Å; T77-I81 WeakPolarHBondContact O-CG1 3.16Å; T77-I81 PolarHBondContact O-N 3.01Å; T77-I81 VanDerWaalsContact O-N 3.09Å; D79-I81 VanDerWaalsContact C-N 3.31Å; D79-I81 PolarHBondContact O-N 3.36Å; I81-I83 VanDerWaalsContact C-N 3.29Å; I81-I83 PolarHBondContact O-N 3.5Å; I81-A84 PolarHBondContact O-N 2.85Å; I81-E85 HydrophobicContact CG2-CG 4.38Å; I81-E85 WeakPolarHBondContact O-CB 3.45Å; I81-E85 WeakPolarHBondContact O-CG 3.42Å; I81-E85 PolarHBondContact O-N 3.21Å
82	N	81.6	Confident	82.1	Confident	57 Å²	57	64.8 Å²	64.8	31%	0.305	36%	0.361	S	S	.	.	H	α-helix	trans	-58.5	-38.8	179.3	-79.5	-67.7	0	0	0	112.3	D78 D79 S86	D78-N82 WeakPolarHBondContact O-CB 3.26Å; D78-N82 PolarHBondContact O-N 3.28Å; D78-N82 PolarHBondContact O-ND2 3.05Å; D79-N82 PolarHBondContact O-N 3.45Å; N82-S86 WeakPolarHBondContact O-CB 3.18Å; N82-S86 PolarHBondContact O-N 3.06Å
83	I	81.6	Confident	83.6	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-41.1	178.8	-66.9	166	0	0	0	111.1	F69 D79 I81 S86 F87 L232	F69-I83 HydrophobicContact CE2-CB 3.92Å; F69-I83 HydrophobicContact CE2-CG2 3.73Å; F69-I83 HydrophobicContact CZ-CB 4.33Å; F69-I83 HydrophobicContact CZ-CG2 3.77Å; D79-I83 WeakPolarHBondContact O-CB 3.24Å; D79-I83 WeakPolarHBondContact O-CD1 3.3Å; D79-I83 VanDerWaalsContact O-CG1 3.22Å; D79-I83 WeakPolarHBondContact O-CG1 3.39Å; D79-I83 PolarHBondContact O-N 3.3Å; I81-I83 VanDerWaalsContact C-N 3.29Å; I81-I83 PolarHBondContact O-N 3.5Å; I83-S86 WeakPolarHBondContact O-CB 3.31Å; I83-S86 PolarHBondContact O-N 3.12Å; I83-S86 PolarHBondContact O-OG 3.45Å; I83-F87 HydrophobicContact CG2-CE2 4.03Å; I83-F87 WeakPolarHBondContact O-CD2 3.42Å; I83-F87 PolarHBondContact O-N 3.1Å; I83-L232 HydrophobicContact CD1-CD2 4Å; I83-L232 HydrophobicContact CG1-CD2 3.98Å
84	A	84.6	Confident	85	Confident	13 Å²	13	58.3 Å²	58.3	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-44.1	174.6	0	0	0	0	0	112	F69 E80 I81 S86 F87 Q88	F69-A84 HydrophobicContact CD2-CB 4.16Å; F69-A84 HydrophobicContact CE2-CB 4.43Å; E80-A84 WeakPolarHBondContact O-CB 3.12Å; E80-A84 PolarHBondContact O-N 3.39Å; I81-A84 PolarHBondContact O-N 2.85Å; A84-S86 PolarHBondContact O-N 2.9Å; A84-F87 PolarHBondContact O-N 3.24Å; A84-Q88 PolarHBondContact O-N 3.24Å
85	E	88.6	Confident	86.1	Confident	66 Å²	66	53.7 Å²	53.7	31%	0.308	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-35.8	172.4	-72.8	-176.3	177.3	0	0	111.4	I81 F87 Q88 E89	I81-E85 HydrophobicContact CG2-CG 4.38Å; I81-E85 WeakPolarHBondContact O-CB 3.45Å; I81-E85 WeakPolarHBondContact O-CG 3.42Å; I81-E85 PolarHBondContact O-N 3.21Å; E85-F87 VanDerWaalsContact C-N 3.33Å; E85-F87 PolarHBondContact O-N 2.91Å; E85-Q88 CarbonylContact O-C 3.47Å; E85-Q88 WeakPolarHBondContact O-CA 3.33Å; E85-Q88 WeakPolarHBondContact O-CB 3.35Å; E85-Q88 PolarHBondContact O-N 2.78Å; E85-E89 PolarHBondContact O-N 3.27Å
86	S	92.6	Very high	86.9	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.028	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-34.9	177.7	82.5	0	0	0	0	114.3	N82 I83 A84 Q88 E89 F90 Y224	N82-S86 WeakPolarHBondContact O-CB 3.18Å; N82-S86 PolarHBondContact O-N 3.06Å; I83-S86 WeakPolarHBondContact O-CB 3.31Å; I83-S86 PolarHBondContact O-N 3.12Å; I83-S86 PolarHBondContact O-OG 3.45Å; A84-S86 PolarHBondContact O-N 2.9Å; S86-Q88 VanDerWaalsContact C-N 3.3Å; S86-Q88 PolarHBondContact O-N 2.99Å; S86-E89 PolarHBondContact O-N 2.94Å; S86-F90 WeakPolarHBondContact O-CB 3.49Å; S86-F90 WeakPolarHBondContact O-CD2 3.31Å; S86-F90 WeakPolarHBondContact O-CG 3.38Å; S86-F90 PolarHBondContact O-N 2.95Å; S86-Y224 WeakPolarHBondContact CA-OH 3.41Å; S86-Y224 VanDerWaalsContact CB-OH 3.3Å; S86-Y224 WeakPolarHBondContact CB-OH 3.29Å
87	F	92.8	Very high	87.8	Confident	60 Å²	60	49.8 Å²	49.8	26%	0.263	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-29.3	172.6	-70.3	-61.5	0	0	0	112.3	L64 F67 I83 A84 E85 F90 A91	L64-F87 HydrophobicContact CB-CB 4.4Å; L64-F87 HydrophobicContact CD2-CD1 3.98Å; L64-F87 HydrophobicContact CD2-CE1 4.46Å; F67-F87 HydrophobicContact CB-CD2 4.49Å; F67-F87 AromaticContact CD1-CD2 3.44Å; F67-F87 HydrophobicContact CD1-CD2 3.44Å; F67-F87 VanDerWaalsContact CD1-CD2 3.44Å; F67-F87 AromaticContact CD1-CE2 3.86Å; F67-F87 HydrophobicContact CD1-CE2 3.86Å; F67-F87 HydrophobicContact CD1-CG 4.35Å; F67-F87 AromaticContact CE1-CD2 3.89Å; F67-F87 HydrophobicContact CE1-CD2 3.89Å; F67-F87 AromaticContact CE1-CE2 3.88Å; F67-F87 HydrophobicContact CE1-CE2 3.88Å; F67-F87 HydrophobicContact CG-CD2 4.07Å; F67-F87 HydrophobicContact CG-CE2 4.44Å; F67-F87 HydrophobicContact CZ-CE2 4.47Å; I83-F87 HydrophobicContact CG2-CE2 4.03Å; I83-F87 WeakPolarHBondContact O-CD2 3.42Å; I83-F87 PolarHBondContact O-N 3.1Å; A84-F87 PolarHBondContact O-N 3.24Å; E85-F87 VanDerWaalsContact C-N 3.33Å; E85-F87 PolarHBondContact O-N 2.91Å; F87-F90 AromaticContact CD1-CD2 3.98Å; F87-F90 HydrophobicContact CD1-CD2 3.98Å; F87-F90 HydrophobicContact CD1-CE2 4.38Å; F87-A91 VanDerWaalsContact O-CB 3.27Å; F87-A91 WeakPolarHBondContact O-CB 3.37Å; F87-A91 PolarHBondContact O-N 3.2Å
88	Q	91.5	Very high	88.5	Confident	90 Å²	90	46.3 Å²	46.3	42%	0.421	24%	0.238	S	C	.	.	H	α-helix	trans	-73.6	-41.3	173.3	-59.8	-176.7	21.3	0	0	112	A84 E85 S86 A91 G92	A84-Q88 PolarHBondContact O-N 3.24Å; E85-Q88 CarbonylContact O-C 3.47Å; E85-Q88 WeakPolarHBondContact O-CA 3.33Å; E85-Q88 WeakPolarHBondContact O-CB 3.35Å; E85-Q88 PolarHBondContact O-N 2.78Å; S86-Q88 VanDerWaalsContact C-N 3.3Å; S86-Q88 PolarHBondContact O-N 2.99Å; Q88-A91 WeakPolarHBondContact O-CB 3.39Å; Q88-A91 PolarHBondContact O-N 3.3Å; Q88-G92 PolarHBondContact O-N 3.19Å
89	E	92.8	Very high	89.2	Confident	37 Å²	37	46.6 Å²	46.6	17%	0.173	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-39.2	174.6	-71.2	-73.6	-167.1	0	0	111.5	E85 S86 A91 G92 L93 F221 Y224 I591	E85-E89 PolarHBondContact O-N 3.27Å; S86-E89 PolarHBondContact O-N 2.94Å; E89-A91 PolarHBondContact O-N 3.15Å; E89-G92 PolarHBondContact O-N 2.91Å; E89-L93 PolarHBondContact O-N 2.75Å; E89-F221 HydrophobicContact CB-CE2 4.39Å; E89-Y224 HydrophobicContact CB-CE1 4.02Å; E89-Y224 HydrophobicContact CG-CE2 4.2Å; E89-I591 PolarHBondContact OE1-N 3.35Å; E89-I591 WeakPolarHBondContact OE2-CB 3.35Å
90	F	94.6	Very high	89.8	Confident	63 Å²	63	44.9 Å²	44.9	28%	0.276	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-42.7	168.9	-63.4	-31.6	0	0	0	112.2	L64 S86 F87 L94 F221 L228	L64-F90 HydrophobicContact CD1-CB 4.07Å; S86-F90 WeakPolarHBondContact O-CB 3.49Å; S86-F90 WeakPolarHBondContact O-CD2 3.31Å; S86-F90 WeakPolarHBondContact O-CG 3.38Å; S86-F90 PolarHBondContact O-N 2.95Å; F87-F90 AromaticContact CD1-CD2 3.98Å; F87-F90 HydrophobicContact CD1-CD2 3.98Å; F87-F90 HydrophobicContact CD1-CE2 4.38Å; F90-L94 WeakPolarHBondContact O-CG 3.44Å; F90-L94 PolarHBondContact O-N 2.96Å; F90-L94 VanDerWaalsContact O-N 3.17Å; F90-F221 AromaticContact CD1-CE1 3.85Å; F90-F221 HydrophobicContact CD1-CE1 3.85Å; F90-F221 AromaticContact CD1-CZ 3.6Å; F90-F221 HydrophobicContact CD1-CZ 3.6Å; F90-F221 AromaticContact CE1-CE1 3.84Å; F90-F221 HydrophobicContact CE1-CE1 3.84Å; F90-F221 AromaticContact CE1-CZ 3.85Å; F90-F221 HydrophobicContact CE1-CZ 3.85Å; F90-L228 HydrophobicContact CE1-CD2 3.98Å; F90-L228 HydrophobicContact CE2-CD2 4.29Å; F90-L228 HydrophobicContact CZ-CD2 3.43Å; F90-L228 VanDerWaalsContact CZ-CD2 3.43Å
91	A	95.1	Very high	90.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-42.6	177.5	0	0	0	0	0	111.6	S61 L64 F87 Q88 E89 L94 Q95	S61-A91 WeakPolarHBondContact O-CB 3.3Å; S61-A91 VanDerWaalsContact OG-C 3.3Å; S61-A91 VanDerWaalsContact OG-CA 3.23Å; S61-A91 WeakPolarHBondContact OG-CA 3.34Å; S61-A91 WeakPolarHBondContact OG-CB 3.34Å; S61-A91 PolarHBondContact OG-O 2.84Å; L64-A91 HydrophobicContact CB-CB 4.13Å; F87-A91 VanDerWaalsContact O-CB 3.27Å; F87-A91 WeakPolarHBondContact O-CB 3.37Å; F87-A91 PolarHBondContact O-N 3.2Å; Q88-A91 WeakPolarHBondContact O-CB 3.39Å; Q88-A91 PolarHBondContact O-N 3.3Å; E89-A91 PolarHBondContact O-N 3.15Å; A91-L94 PolarHBondContact O-N 3.38Å; A91-Q95 WeakPolarHBondContact O-CB 3.44Å; A91-Q95 WeakPolarHBondContact O-CG 3.45Å; A91-Q95 PolarHBondContact O-N 3.4Å
92	G	93.1	Very high	90.6	Very high	30 Å²	30	42.4 Å²	42.4	31%	0.309	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-51.1	177.4	0	0	0	0	0	112.7	Q88 E89 L94 Q95 E96	Q88-G92 PolarHBondContact O-N 3.19Å; E89-G92 PolarHBondContact O-N 2.91Å; G92-L94 VanDerWaalsContact C-N 3.34Å; G92-L94 PolarHBondContact O-N 2.97Å; G92-Q95 PolarHBondContact O-N 3.03Å; G92-Q95 VanDerWaalsContact O-N 3.15Å; G92-E96 PolarHBondContact O-N 3.48Å
93	L	93.5	Very high	90.8	Very high	34 Å²	34	43.8 Å²	43.8	18%	0.178	21%	0.214	C	C	.	.	H	α-helix	trans	-55.2	-48.6	175.8	178.7	69.3	0	0	0	111.6	E89 Q95 E96 V97 M217 F221	E89-L93 PolarHBondContact O-N 2.75Å; L93-Q95 PolarHBondContact O-N 2.99Å; L93-E96 PolarHBondContact O-N 3.03Å; L93-V97 WeakPolarHBondContact O-CG2 3.49Å; L93-V97 PolarHBondContact O-N 3.11Å; L93-M217 HydrophobicContact CD1-CB 4.31Å; L93-M217 HydrophobicContact CD1-CE 4.4Å; L93-F221 HydrophobicContact CB-CD2 4.39Å; L93-F221 HydrophobicContact CB-CE2 4.44Å; L93-F221 HydrophobicContact CD1-CB 4.27Å; L93-F221 HydrophobicContact CD1-CD2 4.39Å; L93-F221 HydrophobicContact CD1-CG 4.46Å; L93-F221 HydrophobicContact CD2-CB 4.05Å; L93-F221 HydrophobicContact CD2-CD1 3.83Å; L93-F221 HydrophobicContact CD2-CD2 3.96Å; L93-F221 HydrophobicContact CD2-CE1 4.25Å; L93-F221 HydrophobicContact CD2-CE2 4.36Å; L93-F221 HydrophobicContact CD2-CG 3.68Å; L93-F221 HydrophobicContact CD2-CZ 4.49Å; L93-F221 HydrophobicContact CG-CD2 4.48Å
94	L	94.6	Very high	90.9	Very high	47 Å²	47	44.4 Å²	44.4	25%	0.246	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-39.6	178.4	-69.3	174.6	0	0	0	112	V57 F60 L64 F90 A91 G92 V97 E98	V57-L94 HydrophobicContact CG1-CB 4.21Å; V57-L94 HydrophobicContact CG1-CD2 3.94Å; V57-L94 HydrophobicContact CG1-CG 4.46Å; F60-L94 HydrophobicContact CD1-CD1 4.01Å; F60-L94 HydrophobicContact CE1-CD1 4.22Å; L64-L94 HydrophobicContact CD1-CD1 4.2Å; F90-L94 WeakPolarHBondContact O-CG 3.44Å; F90-L94 PolarHBondContact O-N 2.96Å; F90-L94 VanDerWaalsContact O-N 3.17Å; A91-L94 PolarHBondContact O-N 3.38Å; G92-L94 VanDerWaalsContact C-N 3.34Å; G92-L94 PolarHBondContact O-N 2.97Å; L94-V97 PolarHBondContact O-N 3.1Å; L94-E98 WeakPolarHBondContact O-CG 3.33Å; L94-E98 PolarHBondContact O-N 3.37Å
95	Q	94	Very high	90.8	Very high	78 Å²	78	44.1 Å²	44.1	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-65	-38.8	176.2	-84.1	166.2	48.2	0	0	112.5	S61 A91 G92 L93 R99	S61-Q95 WeakPolarHBondContact OG-CG 3.11Å; S61-Q95 PolarHBondContact OG-NE2 3.19Å; A91-Q95 WeakPolarHBondContact O-CB 3.44Å; A91-Q95 WeakPolarHBondContact O-CG 3.45Å; A91-Q95 PolarHBondContact O-N 3.4Å; G92-Q95 PolarHBondContact O-N 3.03Å; G92-Q95 VanDerWaalsContact O-N 3.15Å; L93-Q95 PolarHBondContact O-N 2.99Å; Q95-R99 VanDerWaalsContact O-CB 3.22Å; Q95-R99 WeakPolarHBondContact O-CB 3.47Å; Q95-R99 PolarHBondContact O-N 3.43Å
96	E	91.4	Very high	90.5	Very high	65 Å²	65	46.5 Å²	46.5	30%	0.304	23%	0.225	S	C	.	.	H	α-helix	trans	-66	-47.6	176.2	-167.2	175.4	-162.5	0	0	110.9	G92 L93 E98 R99 D100 M217	G92-E96 PolarHBondContact O-N 3.48Å; L93-E96 PolarHBondContact O-N 3.03Å; E96-E98 PolarHBondContact O-N 3.04Å; E96-R99 WeakPolarHBondContact O-CB 3.49Å; E96-R99 PolarHBondContact O-N 3.31Å; E96-D100 PolarHBondContact O-N 3.39Å; E96-M217 HydrophobicContact CB-CE 3.51Å; E96-M217 HydrophobicContact CG-CE 3.33Å
97	V	91.6	Very high	90.2	Very high	11 Å²	11	50.2 Å²	50.2	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-45.5	177.2	171.8	0	0	0	0	111.8	L93 L94 R101 T214 M217	L93-V97 WeakPolarHBondContact O-CG2 3.49Å; L93-V97 PolarHBondContact O-N 3.11Å; L94-V97 PolarHBondContact O-N 3.1Å; V97-R101 WeakPolarHBondContact O-CB 3.35Å; V97-R101 PolarHBondContact O-N 3.07Å; V97-R101 VanDerWaalsContact O-N 3.11Å; V97-T214 HydrophobicContact CG1-CG2 4.09Å; V97-M217 HydrophobicContact CB-CE 4.38Å; V97-M217 HydrophobicContact CG2-CB 4.39Å; V97-M217 HydrophobicContact CG2-CE 3.5Å; V97-M217 VanDerWaalsContact CG2-CE 3.5Å; V97-M217 HydrophobicContact CG2-SD 3.81Å
98	E	92.2	Very high	89.9	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-74.8	-24.6	179.8	-62.4	-45.4	141.5	0	0	113.7	S54 V57 Q58 L94 E96 R101 M102	S54-E98 VanDerWaalsContact CA-OE2 3.26Å; S54-E98 WeakPolarHBondContact CA-OE2 3.07Å; S54-E98 WeakPolarHBondContact CB-OE2 3.27Å; S54-E98 PolarHBondContact OG-OE2 2.91Å; V57-E98 HydrophobicContact CB-CG 3.74Å; V57-E98 HydrophobicContact CG1-CG 3.57Å; V57-E98 WeakPolarHBondContact CG1-OE1 3.25Å; Q58-E98 HydrophobicContact CG-CB 3.72Å; Q58-E98 HydrophobicContact CG-CG 4.1Å; L94-E98 WeakPolarHBondContact O-CG 3.33Å; L94-E98 PolarHBondContact O-N 3.37Å; E96-E98 PolarHBondContact O-N 3.04Å; E98-R101 IonicContact OE1-CZ 2.65Å; E98-R101 IonicContact OE1-NH1 2.73Å; E98-R101 PolarHBondContact OE1-NH1 2.74Å; E98-R101 IonicContact OE1-NH2 2.88Å; E98-R101 IonicContact OE2-CZ 2.61Å; E98-R101 IonicContact OE2-NE 2.8Å; E98-R101 IonicContact OE2-NH1 2.79Å; E98-R101 PolarHBondContact OE2-NH1 3.41Å; E98-M102 VanDerWaalsContact O-CB 3.26Å; E98-M102 WeakPolarHBondContact O-CB 3.31Å; E98-M102 PolarHBondContact O-N 3.29Å
99	R	90.9	Very high	89.7	Confident	120 Å²	120	45.1 Å²	45.1	45%	0.453	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-51.8	175.1	-169.8	-165.5	-48.9	120.2	3.4	110.2	Q95 E96 R101 M102 M103	Q95-R99 VanDerWaalsContact O-CB 3.22Å; Q95-R99 WeakPolarHBondContact O-CB 3.47Å; Q95-R99 PolarHBondContact O-N 3.43Å; E96-R99 WeakPolarHBondContact O-CB 3.49Å; E96-R99 PolarHBondContact O-N 3.31Å; R99-R101 VanDerWaalsContact C-N 3.35Å; R99-M102 PolarHBondContact O-N 3.18Å; R99-M102 VanDerWaalsContact O-N 3.17Å; R99-M103 HydrophobicContact CG-CE 3.88Å; R99-M103 WeakPolarHBondContact O-CG 3.26Å; R99-M103 PolarHBondContact O-N 2.74Å
100	D	87.8	Confident	89.5	Confident	15 Å²	15	46.6 Å²	46.6	8%	0.08	24%	0.236	C	C	.	.	H	α-helix	trans	-70.7	-35.7	-177	-65.8	1.8	0	0	0	110.6	E96 M103 L104 L213 F599	E96-D100 PolarHBondContact O-N 3.39Å; D100-M103 PolarHBondContact O-N 2.96Å; D100-L104 PolarHBondContact O-N 3.25Å; D100-L104 VanDerWaalsContact O-N 3.15Å; D100-L213 HydrophobicContact CB-CD2 3.93Å; D100-F599 HydrophobicContact CB-CE2 4.33Å; D100-F599 HydrophobicContact CB-CZ 4.44Å
101	R	88.9	Confident	89.4	Confident	18 Å²	18	46.5 Å²	46.5	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-47.5	167.9	-170.9	166.8	-54.6	136.6	7.3	112.3	I50 S54 V97 E98 R99 L104 V105 L210	I50-R101 HydrophobicContact CG2-CG 4.13Å; S54-R101 WeakPolarHBondContact OG-CD 3.43Å; V97-R101 WeakPolarHBondContact O-CB 3.35Å; V97-R101 PolarHBondContact O-N 3.07Å; V97-R101 VanDerWaalsContact O-N 3.11Å; E98-R101 IonicContact OE1-CZ 2.65Å; E98-R101 IonicContact OE1-NH1 2.73Å; E98-R101 PolarHBondContact OE1-NH1 2.74Å; E98-R101 IonicContact OE1-NH2 2.88Å; E98-R101 IonicContact OE2-CZ 2.61Å; E98-R101 IonicContact OE2-NE 2.8Å; E98-R101 IonicContact OE2-NH1 2.79Å; E98-R101 PolarHBondContact OE2-NH1 3.41Å; R99-R101 VanDerWaalsContact C-N 3.35Å; R101-L104 PolarHBondContact O-N 3.43Å; R101-V105 HydrophobicContact CG-CG2 4.12Å; R101-V105 WeakPolarHBondContact O-CB 3.47Å; R101-V105 WeakPolarHBondContact O-CG2 3.35Å; R101-V105 PolarHBondContact O-N 3.36Å; R101-L210 HydrophobicContact CB-CD1 3.76Å; R101-L210 HydrophobicContact CB-CD2 4.4Å; R101-L210 HydrophobicContact CG-CD1 3.99Å; R101-L210 HydrophobicContact CG-CD2 3.68Å; R101-L210 HydrophobicContact CG-CG 4.47Å
102	M	88.6	Confident	89.5	Confident	44 Å²	44	46.7 Å²	46.7	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-67.8	-37.3	-177.7	-167.9	61.5	66.3	0	0	112.1	K51 E98 R99 L104 V105 Q106	K51-M102 HydrophobicContact CG-SD 4.16Å; E98-M102 VanDerWaalsContact O-CB 3.26Å; E98-M102 WeakPolarHBondContact O-CB 3.31Å; E98-M102 PolarHBondContact O-N 3.29Å; R99-M102 PolarHBondContact O-N 3.18Å; R99-M102 VanDerWaalsContact O-N 3.17Å; M102-L104 PolarHBondContact O-N 2.87Å; M102-V105 PolarHBondContact O-N 2.85Å; M102-Q106 VanDerWaalsContact O-CB 3.3Å; M102-Q106 WeakPolarHBondContact O-CB 3.41Å; M102-Q106 PolarHBondContact O-N 3.39Å
103	M	86.6	Confident	89.6	Confident	87 Å²	87	45.6 Å²	45.6	43%	0.429	23%	0.226	S	C	.	.	H	α-helix	trans	-57.8	-48.3	172.7	-69.7	-163.8	-123.1	0	0	111.5	R99 D100 Q106 N107	R99-M103 HydrophobicContact CG-CE 3.88Å; R99-M103 WeakPolarHBondContact O-CG 3.26Å; R99-M103 PolarHBondContact O-N 2.74Å; D100-M103 PolarHBondContact O-N 2.96Å; M103-Q106 PolarHBondContact O-N 2.92Å; M103-N107 PolarHBondContact O-N 3.41Å
104	L	82.5	Confident	89.7	Confident	46 Å²	46	51.8 Å²	51.8	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-44.2	179	-170.1	75.1	0	0	0	112.5	D100 R101 M102 Q106 N107 A108 S206 L210	D100-L104 PolarHBondContact O-N 3.25Å; D100-L104 VanDerWaalsContact O-N 3.15Å; R101-L104 PolarHBondContact O-N 3.43Å; M102-L104 PolarHBondContact O-N 2.87Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.11Å; L104-N107 CarbonylContact O-C 3.53Å; L104-N107 PolarHBondContact O-N 2.85Å; L104-N107 VanDerWaalsContact O-N 3.12Å; L104-A108 PolarHBondContact O-N 3.15Å; L104-S206 WeakPolarHBondContact CD2-O 3.33Å; L104-L210 HydrophobicContact CD2-CB 3.69Å; L104-L210 HydrophobicContact CD2-CD2 4.22Å; L104-L210 HydrophobicContact CD2-CG 4.45Å
105	V	83.3	Confident	89.8	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-70.8	-26.2	-179.1	174.6	0	0	0	0	112.1	I47 I50 K51 R101 M102 A108	I47-V105 HydrophobicContact CG2-CG1 4.15Å; I50-V105 HydrophobicContact CB-CG1 4.45Å; I50-V105 HydrophobicContact CB-CG2 4.2Å; I50-V105 HydrophobicContact CG2-CG1 4.48Å; I50-V105 HydrophobicContact CG2-CG2 3.52Å; K51-V105 HydrophobicContact CD-CG1 4.27Å; K51-V105 HydrophobicContact CG-CG1 3.52Å; R101-V105 HydrophobicContact CG-CG2 4.12Å; R101-V105 WeakPolarHBondContact O-CB 3.47Å; R101-V105 WeakPolarHBondContact O-CG2 3.35Å; R101-V105 PolarHBondContact O-N 3.36Å; M102-V105 PolarHBondContact O-N 2.85Å; V105-A108 WeakPolarHBondContact O-CB 3.46Å
106	Q	81.9	Confident	90	Very high	116 Å²	116	47.8 Å²	47.8	54%	0.542	23%	0.23	S	C	.	.	H	α-helix	trans	-68.9	-38.1	169.5	-166.3	73.3	-24.5	0	0	111.4	M102 M103 L104	M102-Q106 VanDerWaalsContact O-CB 3.3Å; M102-Q106 WeakPolarHBondContact O-CB 3.41Å; M102-Q106 PolarHBondContact O-N 3.39Å; M103-Q106 PolarHBondContact O-N 2.92Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.11Å
107	N	86	Confident	90.3	Very high	83 Å²	83	47.5 Å²	47.5	44%	0.444	23%	0.229	S	C	.	.	H	α-helix	trans	-73.8	-24.3	174.8	-73.2	-27	0	0	0	113.7	M103 L104 S109 N110 L111	M103-N107 PolarHBondContact O-N 3.41Å; L104-N107 CarbonylContact O-C 3.53Å; L104-N107 PolarHBondContact O-N 2.85Å; L104-N107 VanDerWaalsContact O-N 3.12Å; N107-S109 PolarHBondContact O-N 2.92Å; N107-S109 VanDerWaalsContact O-N 3.12Å; N107-N110 WeakPolarHBondContact O-CA 3.46Å; N107-N110 WeakPolarHBondContact O-CB 3.48Å; N107-N110 PolarHBondContact O-N 3.24Å; N107-L111 HydrophobicContact CB-CD1 4.44Å; N107-L111 PolarHBondContact O-N 3.16Å
108	A	86.2	Confident	90.5	Very high	5 Å²	5	52.6 Å²	52.6	4%	0.041	25%	0.25	C	S	.	.	H	α-helix	trans	-55.2	-31.3	-179.9	0	0	0	0	0	114.7	I47 L104 V105 N110 L111 L112 F203	I47-A108 HydrophobicContact CD1-CB 3.86Å; I47-A108 HydrophobicContact CG1-CB 3.95Å; L104-A108 PolarHBondContact O-N 3.15Å; V105-A108 WeakPolarHBondContact O-CB 3.46Å; A108-N110 VanDerWaalsContact C-N 3.34Å; A108-L111 PolarHBondContact O-N 3.29Å; A108-L112 WeakPolarHBondContact O-CB 3.31Å; A108-L112 PolarHBondContact O-N 2.9Å; A108-F203 HydrophobicContact CB-CD2 3.89Å; A108-F203 HydrophobicContact CB-CE2 3.71Å
109	S	87.4	Confident	90.8	Very high	38 Å²	38	52.7 Å²	52.7	27%	0.266	25%	0.251	S	S	.	.	I	π-helix	trans	-66.7	-35.3	173.4	-178.8	0	0	0	0	112.4	N107 I113 R114	N107-S109 PolarHBondContact O-N 2.92Å; N107-S109 VanDerWaalsContact O-N 3.12Å; S109-I113 WeakPolarHBondContact O-CB 3.4Å; S109-I113 PolarHBondContact O-N 3.37Å; S109-R114 WeakPolarHBondContact O-CG 3.44Å; S109-R114 PolarHBondContact O-N 3.41Å
110	N	90.1	Very high	91.1	Very high	67 Å²	67	50.1 Å²	50.1	36%	0.358	24%	0.241	S	C	.	.	I	π-helix	trans	-76.6	-33	176.2	-59.5	-30.5	0	0	0	112.3	N107 A108 R114 P115	N107-N110 WeakPolarHBondContact O-CA 3.46Å; N107-N110 WeakPolarHBondContact O-CB 3.48Å; N107-N110 PolarHBondContact O-N 3.24Å; A108-N110 VanDerWaalsContact C-N 3.34Å; N110-R114 WeakPolarHBondContact OD1-CD 3.4Å; N110-R114 PolarHBondContact OD1-NE 2.93Å; N110-R114 VanDerWaalsContact OD1-NE 3.13Å; N110-R114 PolarHBondContact OD1-NH1 3.03Å; N110-R114 VanDerWaalsContact OD1-NH1 3.14Å; N110-P115 WeakPolarHBondContact O-CD 3.3Å; N110-P115 WeakPolarHBondContact O-CG 3.29Å
111	L	92.8	Very high	91.5	Very high	62 Å²	62	55.1 Å²	55.1	33%	0.325	26%	0.262	S	S	.	.	I	π-helix	trans	-79.9	-39.6	-178.8	-65.4	172.6	0	0	0	113.3	N107 A108 P199	N107-L111 HydrophobicContact CB-CD1 4.44Å; N107-L111 PolarHBondContact O-N 3.16Å; A108-L111 PolarHBondContact O-N 3.29Å; L111-P199 WeakPolarHBondContact O-CA 3.33Å; L111-P199 VanDerWaalsContact O-CB 3.3Å; L111-P199 WeakPolarHBondContact O-CB 3.44Å
112	L	95.4	Very high	91.8	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.026	28%	0.28	C	S	.	.	I	π-helix	trans	-108	-56.4	-175.9	-175.2	70.2	0	0	0	113	A108 L116 P199 V200 F203	A108-L112 WeakPolarHBondContact O-CB 3.31Å; A108-L112 PolarHBondContact O-N 2.9Å; L112-L116 HydrophobicContact CD1-CD1 3.66Å; L112-L116 HydrophobicContact CD1-CG 4.49Å; L112-L116 HydrophobicContact CG-CD1 4.07Å; L112-L116 WeakPolarHBondContact O-CB 3.18Å; L112-L116 VanDerWaalsContact O-CG 3.23Å; L112-L116 WeakPolarHBondContact O-CG 3.34Å; L112-L116 PolarHBondContact O-N 2.92Å; L112-P199 HydrophobicContact CD1-CB 4.41Å; L112-V200 HydrophobicContact CD1-CB 4.46Å; L112-V200 HydrophobicContact CD1-CG2 3.85Å; L112-F203 HydrophobicContact CB-CB 4.11Å; L112-F203 HydrophobicContact CB-CD2 4.43Å; L112-F203 HydrophobicContact CB-CG 4.2Å; L112-F203 HydrophobicContact CD1-CB 4.24Å; L112-F203 HydrophobicContact CD2-CD1 3.77Å; L112-F203 HydrophobicContact CD2-CD2 4.48Å; L112-F203 HydrophobicContact CD2-CE1 3.99Å; L112-F203 HydrophobicContact CD2-CG 4.02Å; L112-F203 HydrophobicContact CD2-CZ 4.44Å; L112-F203 HydrophobicContact CG-CG 4.49Å
113	I	95.9	Very high	92.1	Very high	7 Å²	7	58 Å²	58	4%	0.036	28%	0.275	C	S	.	.	I	π-helix	trans	-73.1	-49	-164.2	-56.8	-53.8	0	0	0	111.5	I40 I47 S109 E117	I40-I113 HydrophobicContact CG2-CG2 4.22Å; I47-I113 HydrophobicContact CD1-CD1 4.24Å; I47-I113 HydrophobicContact CD1-CG1 3.79Å; S109-I113 WeakPolarHBondContact O-CB 3.4Å; S109-I113 PolarHBondContact O-N 3.37Å; I113-E117 WeakPolarHBondContact O-CB 3.37Å; I113-E117 PolarHBondContact O-N 2.8Å
114	R	95.8	Very high	92.5	Very high	163 Å²	163	54 Å²	54	62%	0.615	26%	0.256	S	S	*	.	H	α-helix	trans	-63.5	-45.5	-179	-67.4	-178.2	-174.6	-174.9	2.1	113	S109 N110 E117 K118	S109-R114 WeakPolarHBondContact O-CG 3.44Å; S109-R114 PolarHBondContact O-N 3.41Å; N110-R114 WeakPolarHBondContact OD1-CD 3.4Å; N110-R114 PolarHBondContact OD1-NE 2.93Å; N110-R114 VanDerWaalsContact OD1-NE 3.13Å; N110-R114 PolarHBondContact OD1-NH1 3.03Å; N110-R114 VanDerWaalsContact OD1-NH1 3.14Å; R114-E117 PolarHBondContact O-N 2.91Å; R114-K118 VanDerWaalsContact O-CB 3.27Å; R114-K118 WeakPolarHBondContact O-CB 3.32Å; R114-K118 PolarHBondContact O-N 3.27Å
115	P	97.5	Very high	93.1	Very high	42 Å²	42	52.9 Å²	52.9	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-64.2	-43.4	178.1	-26.5	38.1	0	0	0	113.2	N110 E117 K118 F119 P199	N110-P115 WeakPolarHBondContact O-CD 3.3Å; N110-P115 WeakPolarHBondContact O-CG 3.29Å; P115-E117 PolarHBondContact O-N 2.88Å; P115-K118 WeakPolarHBondContact O-CB 3.36Å; P115-K118 PolarHBondContact O-N 3.03Å; P115-F119 PolarHBondContact O-N 3.29Å; P115-P199 HydrophobicContact CB-CB 4.06Å; P115-P199 HydrophobicContact CB-CG 3.52Å; P115-P199 HydrophobicContact CG-CB 4.47Å; P115-P199 HydrophobicContact CG-CG 4.27Å
116	L	97.9	Very high	93.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-37.8	177.7	-64.3	-179.5	0	0	0	112.1	L36 L39 I40 L112 R120 V196 P199 V200	L36-L116 HydrophobicContact CD2-CD2 4.01Å; L39-L116 HydrophobicContact CD2-CD1 3.81Å; L39-L116 HydrophobicContact CG-CD1 4.07Å; I40-L116 HydrophobicContact CD1-CB 3.9Å; I40-L116 HydrophobicContact CG1-CB 3.74Å; I40-L116 HydrophobicContact CG1-CD1 4.39Å; L112-L116 HydrophobicContact CD1-CD1 3.66Å; L112-L116 HydrophobicContact CD1-CG 4.49Å; L112-L116 HydrophobicContact CG-CD1 4.07Å; L112-L116 WeakPolarHBondContact O-CB 3.18Å; L112-L116 VanDerWaalsContact O-CG 3.23Å; L112-L116 WeakPolarHBondContact O-CG 3.34Å; L112-L116 PolarHBondContact O-N 2.92Å; L116-R120 WeakPolarHBondContact O-CB 3.36Å; L116-R120 PolarHBondContact O-N 3.09Å; L116-V196 HydrophobicContact CD2-CB 4.2Å; L116-V196 HydrophobicContact CD2-CG1 3.94Å; L116-V196 HydrophobicContact CD2-CG2 4.38Å; L116-P199 HydrophobicContact CD2-CB 4.23Å; L116-P199 HydrophobicContact CD2-CG 4.33Å; L116-P199 HydrophobicContact CG-CB 4.21Å; L116-V200 HydrophobicContact CD1-CG2 4.46Å
117	E	97.2	Very high	94.3	Very high	58 Å²	58	49.1 Å²	49.1	27%	0.271	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-41.3	170.2	-83.1	-163.6	-153.2	0	0	112.4	I40 I113 R114 P115 R120 K121	I40-E117 HydrophobicContact CD1-CG 3.8Å; I40-E117 HydrophobicContact CG1-CG 4.49Å; I40-E117 HydrophobicContact CG2-CG 4.19Å; I113-E117 WeakPolarHBondContact O-CB 3.37Å; I113-E117 PolarHBondContact O-N 2.8Å; R114-E117 PolarHBondContact O-N 2.91Å; P115-E117 PolarHBondContact O-N 2.88Å; E117-R120 PolarHBondContact O-N 3.27Å; E117-K121 VanDerWaalsContact O-CB 3.3Å; E117-K121 WeakPolarHBondContact O-CB 3.24Å; E117-K121 VanDerWaalsContact O-CG 3.25Å; E117-K121 WeakPolarHBondContact O-CG 3.32Å; E117-K121 PolarHBondContact O-N 3.16Å; E117-K121 VanDerWaalsContact OE2-CE 3.27Å; E117-K121 WeakPolarHBondContact OE2-CE 3.46Å; E117-K121 IonicContact OE2-NZ 2.69Å; E117-K121 PolarHBondContact OE2-NZ 3.49Å
118	K	96.8	Very high	94.7	Very high	119 Å²	119	49.1 Å²	49.1	52%	0.517	24%	0.241	S	C	.	.	H	α-helix	trans	-59	-50.9	177.3	-169	-179	-179.8	179.6	0	110.4	R114 P115 R120 K121 E122	R114-K118 VanDerWaalsContact O-CB 3.27Å; R114-K118 WeakPolarHBondContact O-CB 3.32Å; R114-K118 PolarHBondContact O-N 3.27Å; P115-K118 WeakPolarHBondContact O-CB 3.36Å; P115-K118 PolarHBondContact O-N 3.03Å; K118-R120 PolarHBondContact O-N 3.39Å; K118-K121 PolarHBondContact O-N 3.37Å; K118-E122 VanDerWaalsContact CE-OE1 3.26Å; K118-E122 WeakPolarHBondContact CE-OE1 3.49Å; K118-E122 WeakPolarHBondContact CE-OE2 3.21Å; K118-E122 HydrophobicContact CG-CG 4.18Å; K118-E122 WeakPolarHBondContact CG-OE1 3.42Å; K118-E122 WeakPolarHBondContact CG-OE2 3.3Å; K118-E122 IonicContact NZ-OE2 3.42Å; K118-E122 WeakPolarHBondContact O-CB 3.47Å; K118-E122 PolarHBondContact O-N 3.36Å
119	F	97.8	Very high	95.1	Very high	5 Å²	5	54 Å²	54	2%	0.022	26%	0.263	C	S	.	.	I	π-helix	trans	-58.8	-47.2	176.3	-172.1	-95.9	0	0	0	112.1	L36 P115 K121 Q123 I124 V188 R191 K192 D195 V196	L36-F119 HydrophobicContact CD1-CD1 3.71Å; L36-F119 HydrophobicContact CD1-CE1 4.16Å; P115-F119 PolarHBondContact O-N 3.29Å; F119-K121 VanDerWaalsContact C-N 3.32Å; F119-K121 PolarHBondContact O-N 2.97Å; F119-Q123 HydrophobicContact CD2-CB 3.91Å; F119-Q123 HydrophobicContact CD2-CG 3.6Å; F119-Q123 HydrophobicContact CE2-CB 3.88Å; F119-Q123 HydrophobicContact CE2-CG 3.87Å; F119-Q123 HydrophobicContact CG-CB 4.4Å; F119-Q123 HydrophobicContact CG-CG 4.34Å; F119-Q123 HydrophobicContact CZ-CB 4.35Å; F119-Q123 VanDerWaalsContact O-CB 3.32Å; F119-Q123 WeakPolarHBondContact O-CB 3.45Å; F119-Q123 PolarHBondContact O-N 2.88Å; F119-Q123 VanDerWaalsContact O-N 3.11Å; F119-I124 HydrophobicContact CD1-CD1 4.26Å; F119-I124 HydrophobicContact CD1-CG1 4.36Å; F119-I124 HydrophobicContact CE1-CD1 4Å; F119-I124 HydrophobicContact CE1-CG1 4.02Å; F119-I124 PolarHBondContact O-N 3.02Å; F119-V188 HydrophobicContact CE1-CG1 4.33Å; F119-V188 HydrophobicContact CZ-CG1 3.82Å; F119-R191 HydrophobicContact CE2-CB 3.82Å; F119-K192 HydrophobicContact CE1-CB 3.97Å; F119-K192 HydrophobicContact CE2-CB 4.46Å; F119-K192 HydrophobicContact CZ-CB 3.58Å; F119-D195 HydrophobicContact CD2-CB 3.39Å; F119-D195 WeakPolarHBondContact CD2-OD2 3.44Å; F119-D195 HydrophobicContact CE2-CB 3.85Å; F119-D195 HydrophobicContact CG-CB 4.17Å; F119-V196 HydrophobicContact CD1-CG2 3.7Å; F119-V196 HydrophobicContact CE1-CG2 3.88Å; F119-V196 HydrophobicContact CG-CG2 4.15Å; F119-V196 HydrophobicContact CZ-CG2 4.47Å
120	R	97	Very high	95.6	Very high	65 Å²	65	54.9 Å²	54.9	25%	0.245	26%	0.262	C	S	.	.	I	π-helix	trans	-66.7	-29.9	-179.2	-154.4	-167.1	82.3	-137.1	3.7	113.5	S33 L36 L116 E117 K118 I124	S33-R120 WeakPolarHBondContact O-CD 3.43Å; L36-R120 HydrophobicContact CB-CG 4.14Å; L36-R120 HydrophobicContact CD1-CB 4.29Å; L36-R120 HydrophobicContact CD1-CG 4.26Å; L116-R120 WeakPolarHBondContact O-CB 3.36Å; L116-R120 PolarHBondContact O-N 3.09Å; E117-R120 PolarHBondContact O-N 3.27Å; K118-R120 PolarHBondContact O-N 3.39Å; R120-I124 HydrophobicContact CG-CD1 4.39Å
121	K	95.6	Very high	95.9	Very high	120 Å²	120	53.9 Å²	53.9	52%	0.522	26%	0.255	S	S	.	.	I	π-helix	trans	-89.3	-53.6	-179.7	-70.1	172.5	-173.5	172.2	0	112.5	E117 K118 F119 G125	E117-K121 VanDerWaalsContact O-CB 3.3Å; E117-K121 WeakPolarHBondContact O-CB 3.24Å; E117-K121 VanDerWaalsContact O-CG 3.25Å; E117-K121 WeakPolarHBondContact O-CG 3.32Å; E117-K121 PolarHBondContact O-N 3.16Å; E117-K121 VanDerWaalsContact OE2-CE 3.27Å; E117-K121 WeakPolarHBondContact OE2-CE 3.46Å; E117-K121 IonicContact OE2-NZ 2.69Å; E117-K121 PolarHBondContact OE2-NZ 3.49Å; K118-K121 PolarHBondContact O-N 3.37Å; F119-K121 VanDerWaalsContact C-N 3.32Å; F119-K121 PolarHBondContact O-N 2.97Å; K121-G125 WeakPolarHBondContact O-CA 3.44Å; K121-G125 PolarHBondContact O-N 3.34Å
122	E	94.9	Very high	96.1	Very high	98 Å²	98	56.3 Å²	56.3	46%	0.458	26%	0.263	S	S	.	.	I	π-helix	trans	-81.2	-44.2	-172.2	-63.3	177.8	-168	0	0	112	K118 A126	K118-E122 VanDerWaalsContact CE-OE1 3.26Å; K118-E122 WeakPolarHBondContact CE-OE1 3.49Å; K118-E122 WeakPolarHBondContact CE-OE2 3.21Å; K118-E122 HydrophobicContact CG-CG 4.18Å; K118-E122 WeakPolarHBondContact CG-OE1 3.42Å; K118-E122 WeakPolarHBondContact CG-OE2 3.3Å; K118-E122 IonicContact NZ-OE2 3.42Å; K118-E122 WeakPolarHBondContact O-CB 3.47Å; K118-E122 PolarHBondContact O-N 3.36Å; E122-A126 WeakPolarHBondContact O-CB 3.37Å; E122-A126 PolarHBondContact O-N 3.1Å
123	Q	95.5	Very high	96.2	Very high	24 Å²	24	59.1 Å²	59.1	11%	0.112	28%	0.275	C	S	.	.	I	π-helix	trans	-81.7	-62.3	-175.5	-53.4	-59.9	-64.4	0	0	110.5	F119 G125 A126 T127 V188 R191	F119-Q123 HydrophobicContact CD2-CB 3.91Å; F119-Q123 HydrophobicContact CD2-CG 3.6Å; F119-Q123 HydrophobicContact CE2-CB 3.88Å; F119-Q123 HydrophobicContact CE2-CG 3.87Å; F119-Q123 HydrophobicContact CG-CB 4.4Å; F119-Q123 HydrophobicContact CG-CG 4.34Å; F119-Q123 HydrophobicContact CZ-CB 4.35Å; F119-Q123 VanDerWaalsContact O-CB 3.32Å; F119-Q123 WeakPolarHBondContact O-CB 3.45Å; F119-Q123 PolarHBondContact O-N 2.88Å; F119-Q123 VanDerWaalsContact O-N 3.11Å; Q123-G125 VanDerWaalsContact C-N 3.32Å; Q123-G125 PolarHBondContact O-N 2.73Å; Q123-A126 PolarHBondContact O-N 3.29Å; Q123-T127 PolarHBondContact O-N 2.91Å; Q123-T127 PolarHBondContact O-OG1 2.96Å; Q123-T127 VanDerWaalsContact O-OG1 3.04Å; Q123-V188 HydrophobicContact CB-CG2 4.09Å; Q123-R191 VanDerWaalsContact OE1-CD 3.26Å
124	I	96.1	Very high	96.3	Very high	3 Å²	3	58.9 Å²	58.9	2%	0.015	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-33.3	-179.5	-52.4	178.7	0	0	0	111.8	T32 L36 F119 R120 T127 K128 V188	T32-I124 HydrophobicContact CG2-CD1 4.05Å; L36-I124 HydrophobicContact CD1-CD1 3.83Å; F119-I124 HydrophobicContact CD1-CD1 4.26Å; F119-I124 HydrophobicContact CD1-CG1 4.36Å; F119-I124 HydrophobicContact CE1-CD1 4Å; F119-I124 HydrophobicContact CE1-CG1 4.02Å; F119-I124 PolarHBondContact O-N 3.02Å; R120-I124 HydrophobicContact CG-CD1 4.39Å; I124-T127 PolarHBondContact O-N 3.34Å; I124-K128 PolarHBondContact O-N 3.15Å; I124-V188 HydrophobicContact CG1-CG1 4.09Å
125	G	94.3	Very high	96.4	Very high	23 Å²	23	54.9 Å²	54.9	24%	0.237	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-44.2	176.7	0	0	0	0	0	112.8	K121 Q123 T127 K128 E129	K121-G125 WeakPolarHBondContact O-CA 3.44Å; K121-G125 PolarHBondContact O-N 3.34Å; Q123-G125 VanDerWaalsContact C-N 3.32Å; Q123-G125 PolarHBondContact O-N 2.73Å; G125-T127 VanDerWaalsContact C-N 3.29Å; G125-T127 PolarHBondContact O-N 3.45Å; G125-K128 WeakPolarHBondContact O-CB 3.36Å; G125-K128 PolarHBondContact O-N 3.08Å; G125-E129 PolarHBondContact O-N 3.01Å; G125-E129 VanDerWaalsContact O-N 3.17Å
126	A	93.4	Very high	96.4	Very high	43 Å²	43	59 Å²	59	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-61.1	-37.8	174.6	0	0	0	0	0	112.1	E122 Q123 K128 E129 K130	E122-A126 WeakPolarHBondContact O-CB 3.37Å; E122-A126 PolarHBondContact O-N 3.1Å; Q123-A126 PolarHBondContact O-N 3.29Å; A126-K128 VanDerWaalsContact C-N 3.25Å; A126-K128 PolarHBondContact O-N 3.35Å; A126-E129 PolarHBondContact O-N 3.32Å; A126-E129 VanDerWaalsContact O-N 3.15Å; A126-K130 PolarHBondContact O-N 3Å
127	T	96.4	Very high	96.5	Very high	2 Å²	2	60 Å²	60	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-34.2	173.1	-48.3	0	0	0	0	112.4	L29 Q123 I124 G125 K131 Y181 Q184 I185 V188	L29-T127 HydrophobicContact CD1-CG2 3.74Å; Q123-T127 PolarHBondContact O-N 2.91Å; Q123-T127 PolarHBondContact O-OG1 2.96Å; Q123-T127 VanDerWaalsContact O-OG1 3.04Å; I124-T127 PolarHBondContact O-N 3.34Å; G125-T127 VanDerWaalsContact C-N 3.29Å; G125-T127 PolarHBondContact O-N 3.45Å; T127-K131 PolarHBondContact O-N 3.25Å; T127-Y181 HydrophobicContact CG2-CD2 4.4Å; T127-Y181 HydrophobicContact CG2-CE2 3.78Å; T127-Y181 WeakPolarHBondContact O-CE2 3.28Å; T127-Q184 HydrophobicContact CG2-CG 4.44Å; T127-I185 HydrophobicContact CG2-CG1 3.93Å; T127-V188 WeakPolarHBondContact OG1-CG2 3.15Å
128	K	94.8	Very high	96.5	Very high	83 Å²	83	57.7 Å²	57.7	36%	0.361	27%	0.27	S	S	.	.	H	α-helix	trans	-74.1	-30.8	175.8	-73.4	178.4	179.4	-84.1	0	113.2	D30 I124 G125 A126 K132	D30-K128 VanDerWaalsContact OD1-CE 3.29Å; D30-K128 WeakPolarHBondContact OD1-CE 3.42Å; D30-K128 IonicContact OD1-NZ 2.73Å; D30-K128 PolarHBondContact OD1-NZ 2.84Å; D30-K128 IonicContact OD2-NZ 3.75Å; D30-K128 PolarHBondContact OD2-NZ 3.39Å; I124-K128 PolarHBondContact O-N 3.15Å; G125-K128 WeakPolarHBondContact O-CB 3.36Å; G125-K128 PolarHBondContact O-N 3.08Å; A126-K128 VanDerWaalsContact C-N 3.25Å; A126-K128 PolarHBondContact O-N 3.35Å; K128-K132 WeakPolarHBondContact O-CG 3.38Å; K128-K132 PolarHBondContact O-N 3.34Å
129	E	95.3	Very high	96.5	Very high	108 Å²	108	58.9 Å²	58.9	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-74.9	-35.2	171.1	-56.2	-47.7	121.1	0	0	112.2	G125 A126 K132 K133	G125-E129 PolarHBondContact O-N 3.01Å; G125-E129 VanDerWaalsContact O-N 3.17Å; A126-E129 PolarHBondContact O-N 3.32Å; A126-E129 VanDerWaalsContact O-N 3.15Å; E129-K132 PolarHBondContact O-N 3.34Å; E129-K132 IonicContact OE1-NZ 2.73Å; E129-K132 PolarHBondContact OE1-NZ 2.9Å; E129-K132 VanDerWaalsContact OE2-CD 3.23Å; E129-K132 WeakPolarHBondContact OE2-CD 3.17Å; E129-K132 IonicContact OE2-NZ 2.73Å; E129-K132 PolarHBondContact OE2-NZ 2.98Å; E129-K133 PolarHBondContact O-N 2.82Å
130	K	96.6	Very high	96.5	Very high	55 Å²	55	62.4 Å²	62.4	24%	0.239	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-41.3	169	-74.5	-58.6	-161.4	-172.7	0	112.2	A126 K132 K133 F134 E180 Y181 Q184	A126-K130 PolarHBondContact O-N 3Å; K130-K132 PolarHBondContact O-N 2.84Å; K130-K133 PolarHBondContact O-N 2.87Å; K130-F134 PolarHBondContact O-N 2.96Å; K130-E180 HydrophobicContact CD-CB 4.43Å; K130-E180 IonicContact NZ-OE1 3.62Å; K130-E180 PolarHBondContact NZ-OE1 3.34Å; K130-E180 IonicContact NZ-OE2 3.02Å; K130-E180 PolarHBondContact NZ-OE2 2.81Å; K130-Y181 HydrophobicContact CB-CD2 3.87Å; K130-Q184 HydrophobicContact CG-CB 4.25Å; K130-Q184 HydrophobicContact CG-CG 4.22Å
131	K	97.3	Very high	96.5	Very high	46 Å²	46	60.4 Å²	60.4	20%	0.2	29%	0.285	C	S	.	.	H	α-helix	trans	-54.7	-49.7	172.3	-176	179.4	156.4	73.2	0	111.4	E26 T127 K133 F134 E135 Y181	E26-K131 IonicContact OE1-NZ 2.87Å; E26-K131 PolarHBondContact OE1-NZ 2.93Å; E26-K131 IonicContact OE2-NZ 2.66Å; E26-K131 PolarHBondContact OE2-NZ 3.3Å; T127-K131 PolarHBondContact O-N 3.25Å; K131-K133 PolarHBondContact O-N 3.28Å; K131-F134 WeakPolarHBondContact O-CB 3.28Å; K131-F134 PolarHBondContact O-N 2.93Å; K131-F134 VanDerWaalsContact O-N 3.16Å; K131-E135 WeakPolarHBondContact CE-OE1 3.5Å; K131-E135 HydrophobicContact CG-CG 4.27Å; K131-E135 IonicContact NZ-OE1 2.68Å; K131-E135 PolarHBondContact NZ-OE1 3.4Å; K131-E135 WeakPolarHBondContact O-CG 3.33Å; K131-E135 PolarHBondContact O-N 3.2Å; K131-Y181 HydrophobicContact CB-CD2 4.33Å; K131-Y181 HydrophobicContact CB-CE1 4.15Å; K131-Y181 HydrophobicContact CB-CE2 3.62Å; K131-Y181 HydrophobicContact CG-CE1 4.09Å; K131-Y181 HydrophobicContact CG-CE2 4.37Å
132	K	97.6	Very high	96.7	Very high	113 Å²	113	59.4 Å²	59.4	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-37.8	177.1	-70.5	162.9	172.4	169.5	0	113.4	K128 E129 K130 K136	K128-K132 WeakPolarHBondContact O-CG 3.38Å; K128-K132 PolarHBondContact O-N 3.34Å; E129-K132 PolarHBondContact O-N 3.34Å; E129-K132 IonicContact OE1-NZ 2.73Å; E129-K132 PolarHBondContact OE1-NZ 2.9Å; E129-K132 VanDerWaalsContact OE2-CD 3.23Å; E129-K132 WeakPolarHBondContact OE2-CD 3.17Å; E129-K132 IonicContact OE2-NZ 2.73Å; E129-K132 PolarHBondContact OE2-NZ 2.98Å; K130-K132 PolarHBondContact O-N 2.84Å; K132-K136 VanDerWaalsContact O-CB 3.24Å; K132-K136 WeakPolarHBondContact O-CB 3.43Å; K132-K136 PolarHBondContact O-N 3.37Å; K132-K136 VanDerWaalsContact O-N 3.09Å
133	K	97.4	Very high	96.8	Very high	64 Å²	64	57.7 Å²	57.7	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-55.6	171.5	-176.8	-171	170	-171.7	0	108.8	E129 K130 K131 E135 K136 E137 E176 E180	E129-K133 PolarHBondContact O-N 2.82Å; K130-K133 PolarHBondContact O-N 2.87Å; K131-K133 PolarHBondContact O-N 3.28Å; K133-E135 PolarHBondContact O-N 3.46Å; K133-K136 PolarHBondContact O-N 3.2Å; K133-E137 HydrophobicContact CG-CG 4.09Å; K133-E137 WeakPolarHBondContact O-CG 3.26Å; K133-E137 PolarHBondContact O-N 3.46Å; K133-E176 IonicContact NZ-OE2 3.89Å; K133-E176 PolarHBondContact NZ-OE2 3.16Å; K133-E180 IonicContact NZ-OE2 2.71Å; K133-E180 PolarHBondContact NZ-OE2 3.49Å
134	F	98.1	Very high	96.9	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-56.3	-47.1	-179.3	169.5	-114.6	0	0	0	113.5	R19 L22 K130 K131 K136 S138 F174 S178 Y181	R19-F134 VanDerWaalsContact CZ-CZ 3.44Å; L22-F134 HydrophobicContact CD2-CD1 4.48Å; L22-F134 HydrophobicContact CD2-CE1 3.6Å; L22-F134 HydrophobicContact CD2-CZ 4.06Å; K130-F134 PolarHBondContact O-N 2.96Å; K131-F134 WeakPolarHBondContact O-CB 3.28Å; K131-F134 PolarHBondContact O-N 2.93Å; K131-F134 VanDerWaalsContact O-N 3.16Å; F134-K136 PolarHBondContact O-N 3.3Å; F134-S138 WeakPolarHBondContact O-CB 3.41Å; F134-S138 PolarHBondContact O-N 2.99Å; F134-F174 HydrophobicContact CD2-CE2 4.06Å; F134-F174 HydrophobicContact CE2-CD2 4.37Å; F134-F174 AromaticContact CE2-CE2 3.52Å; F134-F174 HydrophobicContact CE2-CE2 3.52Å; F134-F174 HydrophobicContact CE2-CZ 4.13Å; F134-F174 HydrophobicContact CZ-CE2 4.37Å; F134-S178 WeakPolarHBondContact CE2-OG 3.46Å; F134-Y181 HydrophobicContact CB-CD1 4.03Å; F134-Y181 HydrophobicContact CB-CG 4.26Å; F134-Y181 AromaticContact CD1-CD1 3.52Å; F134-Y181 HydrophobicContact CD1-CD1 3.52Å; F134-Y181 AromaticContact CD1-CE1 3.93Å; F134-Y181 HydrophobicContact CD1-CE1 3.93Å; F134-Y181 HydrophobicContact CE1-CD1 4.13Å; F134-Y181 HydrophobicContact CE1-CE1 4.41Å; F134-Y181 AromaticContact CG-CD1 3.88Å; F134-Y181 HydrophobicContact CG-CD1 3.88Å
135	E	97.8	Very high	96.9	Very high	79 Å²	79	60 Å²	60	37%	0.369	29%	0.291	S	S	.	.	H	α-helix	trans	-59.3	-48.1	176.6	-71.8	174.3	141.4	0	0	111.4	K131 K133 S138 E139	K131-E135 WeakPolarHBondContact CE-OE1 3.5Å; K131-E135 HydrophobicContact CG-CG 4.27Å; K131-E135 IonicContact NZ-OE1 2.68Å; K131-E135 PolarHBondContact NZ-OE1 3.4Å; K131-E135 WeakPolarHBondContact O-CG 3.33Å; K131-E135 PolarHBondContact O-N 3.2Å; K133-E135 PolarHBondContact O-N 3.46Å; E135-S138 WeakPolarHBondContact O-CB 3.3Å; E135-S138 PolarHBondContact O-N 3.34Å; E135-E139 WeakPolarHBondContact O-CG 3.43Å; E135-E139 PolarHBondContact O-N 3.39Å
136	K	98.1	Very high	97.1	Very high	128 Å²	128	63.6 Å²	63.6	56%	0.557	30%	0.304	S	S	*	.	H	α-helix	trans	-63.9	-45.2	179.4	-178.3	-171.4	174.9	-169.8	0	113.3	K132 K133 F134 S138 E139 K140	K132-K136 VanDerWaalsContact O-CB 3.24Å; K132-K136 WeakPolarHBondContact O-CB 3.43Å; K132-K136 PolarHBondContact O-N 3.37Å; K132-K136 VanDerWaalsContact O-N 3.09Å; K133-K136 PolarHBondContact O-N 3.2Å; F134-K136 PolarHBondContact O-N 3.3Å; K136-S138 VanDerWaalsContact C-N 3.3Å; K136-E139 PolarHBondContact O-N 2.81Å; K136-K140 HydrophobicContact CG-CD 4.45Å; K136-K140 WeakPolarHBondContact O-CD 3.12Å; K136-K140 VanDerWaalsContact O-CG 3.3Å; K136-K140 WeakPolarHBondContact O-CG 3.38Å; K136-K140 PolarHBondContact O-N 3Å
137	E	98	Very high	97.2	Very high	22 Å²	22	67.3 Å²	67.3	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-72.4	-27.8	179.7	-55.5	-50.3	118.7	0	0	111.2	K133 K140 Y141	K133-E137 HydrophobicContact CG-CG 4.09Å; K133-E137 WeakPolarHBondContact O-CG 3.26Å; K133-E137 PolarHBondContact O-N 3.46Å; E137-K140 VanDerWaalsContact CD-CD 3.48Å; E137-K140 WeakPolarHBondContact OE1-CD 3.37Å; E137-K140 IonicContact OE1-NZ 3.3Å; E137-K140 VanDerWaalsContact OE2-CD 3.22Å; E137-K140 WeakPolarHBondContact OE2-CD 3.43Å; E137-K140 WeakPolarHBondContact OE2-CE 3.13Å; E137-K140 IonicContact OE2-NZ 3.75Å; E137-K140 PolarHBondContact OE2-NZ 2.85Å; E137-Y141 WeakPolarHBondContact O-CB 3.48Å; E137-Y141 PolarHBondContact O-N 2.91Å
138	S	97.4	Very high	97.2	Very high	9 Å²	9	69 Å²	69	6%	0.063	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-46.6	170	-166.3	0	0	0	0	112.3	R19 F134 E135 K136 K140 Y141 Y142 F174	R19-S138 PolarHBondContact NH2-OG 2.95Å; F134-S138 WeakPolarHBondContact O-CB 3.41Å; F134-S138 PolarHBondContact O-N 2.99Å; E135-S138 WeakPolarHBondContact O-CB 3.3Å; E135-S138 PolarHBondContact O-N 3.34Å; K136-S138 VanDerWaalsContact C-N 3.3Å; S138-K140 PolarHBondContact O-N 3.36Å; S138-Y141 PolarHBondContact O-N 2.94Å; S138-Y142 VanDerWaalsContact O-CD2 3.31Å; S138-Y142 WeakPolarHBondContact O-CD2 3.47Å; S138-Y142 PolarHBondContact O-N 3.5Å; S138-F174 WeakPolarHBondContact OG-CE2 3.32Å
139	E	97.8	Very high	97.3	Very high	145 Å²	145	71.1 Å²	71.1	68%	0.678	34%	0.335	S	S	*	.	H	α-helix	trans	-58.7	-44.9	174.4	-75.7	178.7	176.7	0	0	111.9	E135 K136 S143	E135-E139 WeakPolarHBondContact O-CG 3.43Å; E135-E139 PolarHBondContact O-N 3.39Å; K136-E139 PolarHBondContact O-N 2.81Å; E139-S143 WeakPolarHBondContact O-CB 3.21Å; E139-S143 PolarHBondContact O-N 3.04Å
140	K	97.6	Very high	97.3	Very high	78 Å²	78	71.6 Å²	71.6	34%	0.339	34%	0.341	S	S	.	.	H	α-helix	trans	-56.9	-54.5	173.8	-75.4	161.7	120.7	-135.5	0	111.8	K136 E137 S138 S143 L144 E170	K136-K140 HydrophobicContact CG-CD 4.45Å; K136-K140 WeakPolarHBondContact O-CD 3.12Å; K136-K140 VanDerWaalsContact O-CG 3.3Å; K136-K140 WeakPolarHBondContact O-CG 3.38Å; K136-K140 PolarHBondContact O-N 3Å; E137-K140 VanDerWaalsContact CD-CD 3.48Å; E137-K140 WeakPolarHBondContact OE1-CD 3.37Å; E137-K140 IonicContact OE1-NZ 3.3Å; E137-K140 VanDerWaalsContact OE2-CD 3.22Å; E137-K140 WeakPolarHBondContact OE2-CD 3.43Å; E137-K140 WeakPolarHBondContact OE2-CE 3.13Å; E137-K140 IonicContact OE2-NZ 3.75Å; E137-K140 PolarHBondContact OE2-NZ 2.85Å; S138-K140 PolarHBondContact O-N 3.36Å; K140-S143 PolarHBondContact O-N 3.38Å; K140-L144 WeakPolarHBondContact O-CB 3.48Å; K140-L144 PolarHBondContact O-N 3.26Å; K140-E170 IonicContact NZ-OE2 3.88Å; K140-E170 PolarHBondContact NZ-OE2 3.42Å
141	Y	97.9	Very high	97.2	Very high	23 Å²	23	71.1 Å²	71.1	9%	0.09	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-50.1	-175.2	171	-118.2	0	0	0	111.2	E137 S138 S143 L144 L145 L167 R171 F174	E137-Y141 WeakPolarHBondContact O-CB 3.48Å; E137-Y141 PolarHBondContact O-N 2.91Å; S138-Y141 PolarHBondContact O-N 2.94Å; Y141-S143 PolarHBondContact O-N 2.66Å; Y141-L144 PolarHBondContact O-N 2.97Å; Y141-L145 WeakPolarHBondContact O-CB 3.36Å; Y141-L145 PolarHBondContact O-N 3.35Å; Y141-L167 HydrophobicContact CD2-CD1 4.04Å; Y141-L167 HydrophobicContact CE2-CD1 3.7Å; Y141-L167 HydrophobicContact CE2-CG 4.48Å; Y141-R171 HydrophobicContact CD2-CB 4.01Å; Y141-R171 HydrophobicContact CE2-CB 3.53Å; Y141-R171 HydrophobicContact CE2-CG 3.78Å; Y141-F174 HydrophobicContact CD1-CB 4.3Å; Y141-F174 AromaticContact CD1-CD1 3.64Å; Y141-F174 HydrophobicContact CD1-CD1 3.64Å; Y141-F174 HydrophobicContact CD1-CE1 4.19Å; Y141-F174 AromaticContact CD1-CG 3.98Å; Y141-F174 HydrophobicContact CD1-CG 3.98Å; Y141-F174 HydrophobicContact CE1-CD1 4.03Å; Y141-F174 HydrophobicContact CE1-CE1 4.4Å; Y141-F174 HydrophobicContact CG-CB 4.11Å; Y141-F174 HydrophobicContact CG-CD1 4.29Å; Y141-F174 HydrophobicContact CG-CG 4.28Å
142	Y	97.8	Very high	97.1	Very high	100 Å²	100	72.3 Å²	72.3	39%	0.392	36%	0.355	S	S	.	.	H	α-helix	trans	-67.2	-35.3	178.6	-75.1	-63.5	0	0	0	113	D14 S138 L144 L145 D146	D14-Y142 PolarHBondContact OD2-OH 3.33Å; D14-Y142 VanDerWaalsContact OD2-OH 3.1Å; S138-Y142 VanDerWaalsContact O-CD2 3.31Å; S138-Y142 WeakPolarHBondContact O-CD2 3.47Å; S138-Y142 PolarHBondContact O-N 3.5Å; Y142-L144 VanDerWaalsContact C-N 3.32Å; Y142-L144 PolarHBondContact O-N 3.49Å; Y142-L145 HydrophobicContact CD1-CD2 4.11Å; Y142-L145 HydrophobicContact CE1-CD2 4.32Å; Y142-L145 PolarHBondContact O-N 3.37Å; Y142-D146 PolarHBondContact O-N 3.41Å
143	S	97.6	Very high	96.8	Very high	62 Å²	62	71.4 Å²	71.4	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-69.5	-27.9	173.9	-166.2	0	0	0	0	113.1	E139 K140 Y141 K147	E139-S143 WeakPolarHBondContact O-CB 3.21Å; E139-S143 PolarHBondContact O-N 3.04Å; K140-S143 PolarHBondContact O-N 3.38Å; Y141-S143 PolarHBondContact O-N 2.66Å; S143-K147 VanDerWaalsContact O-CG 3.29Å; S143-K147 WeakPolarHBondContact O-CG 3.48Å; S143-K147 PolarHBondContact O-NZ 3.45Å; S143-K147 PolarHBondContact OG-NZ 2.69Å
144	L	97.6	Very high	96.6	Very high	34 Å²	34	77.8 Å²	77.8	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-79.5	-40.9	173.2	-179.1	62.4	0	0	0	111.3	K140 Y141 Y142 D146 K147 H148 L166 L167 E170	K140-L144 WeakPolarHBondContact O-CB 3.48Å; K140-L144 PolarHBondContact O-N 3.26Å; Y141-L144 PolarHBondContact O-N 2.97Å; Y142-L144 VanDerWaalsContact C-N 3.32Å; Y142-L144 PolarHBondContact O-N 3.49Å; L144-D146 PolarHBondContact O-N 2.96Å; L144-K147 PolarHBondContact O-N 3.3Å; L144-H148 WeakPolarHBondContact O-CB 3.44Å; L144-H148 PolarHBondContact O-N 2.86Å; L144-L166 HydrophobicContact CD1-CD2 4.23Å; L144-L166 HydrophobicContact CD2-CD2 4.47Å; L144-L166 HydrophobicContact CD2-CG 3.97Å; L144-L167 HydrophobicContact CD2-CD1 4.36Å; L144-L167 HydrophobicContact CG-CD1 4.21Å; L144-E170 HydrophobicContact CD2-CB 3.99Å; L144-E170 HydrophobicContact CD2-CG 3.73Å
145	L	97.5	Very high	96.4	Very high	41 Å²	41	82.2 Å²	82.2	22%	0.215	42%	0.416	C	S	.	.	H	α-helix	trans	-58.3	-45.9	176.8	-179.9	62.1	0	0	0	111.5	Y141 Y142 H148 L149 L167	Y141-L145 WeakPolarHBondContact O-CB 3.36Å; Y141-L145 PolarHBondContact O-N 3.35Å; Y142-L145 HydrophobicContact CD1-CD2 4.11Å; Y142-L145 HydrophobicContact CE1-CD2 4.32Å; Y142-L145 PolarHBondContact O-N 3.37Å; L145-H148 PolarHBondContact O-N 3.01Å; L145-L149 HydrophobicContact CD1-CD1 4.06Å; L145-L149 HydrophobicContact CD1-CG 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.97Å; L145-L149 HydrophobicContact CG-CG 4.45Å; L145-L149 WeakPolarHBondContact O-CB 3.35Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.44Å; L145-L149 PolarHBondContact O-N 3.39Å; L145-L167 HydrophobicContact CB-CD1 4Å; L145-L167 HydrophobicContact CD1-CD1 4.11Å; L145-L167 HydrophobicContact CD1-CD2 3.79Å
146	D	97.3	Very high	96.3	Very high	98 Å²	98	85.7 Å²	85.7	52%	0.524	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-46	174.3	175.3	71	0	0	0	112	Y142 L144 H148 L149 N150	Y142-D146 PolarHBondContact O-N 3.41Å; L144-D146 PolarHBondContact O-N 2.96Å; D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 3.36Å; D146-L149 PolarHBondContact O-N 2.87Å; D146-N150 WeakPolarHBondContact O-CB 3.04Å; D146-N150 PolarHBondContact O-N 3Å; D146-N150 PolarHBondContact O-ND2 3.47Å; D146-N150 PolarHBondContact OD1-ND2 3.11Å
147	K	95.9	Very high	96.1	Very high	121 Å²	121	86.7 Å²	86.7	53%	0.526	44%	0.436	S	S	.	.	H	α-helix	trans	-61.5	-36.8	175.7	-70	180	-161.7	85.1	0	112.6	S143 L144	S143-K147 VanDerWaalsContact O-CG 3.29Å; S143-K147 WeakPolarHBondContact O-CG 3.48Å; S143-K147 PolarHBondContact O-NZ 3.45Å; S143-K147 PolarHBondContact OG-NZ 2.69Å; L144-K147 PolarHBondContact O-N 3.3Å
148	H	96.7	Very high	95.9	Very high	38 Å²	38	89.5 Å²	89.5	18%	0.176	46%	0.458	C	S	.	.	H	α-helix	trans	-68.8	-49	177.8	176.4	108.4	0	0	0	110.9	L144 L145 D146 N150 L151 A163 D164 L167	L144-H148 WeakPolarHBondContact O-CB 3.44Å; L144-H148 PolarHBondContact O-N 2.86Å; L145-H148 PolarHBondContact O-N 3.01Å; D146-H148 VanDerWaalsContact C-N 3.28Å; D146-H148 PolarHBondContact O-N 3.36Å; H148-N150 PolarHBondContact O-N 3.34Å; H148-L151 HydrophobicContact CB-CD1 4.48Å; H148-L151 WeakPolarHBondContact O-CB 3.36Å; H148-L151 WeakPolarHBondContact O-CD1 3.42Å; H148-L151 VanDerWaalsContact O-CG 3.22Å; H148-L151 WeakPolarHBondContact O-CG 3.02Å; H148-L151 PolarHBondContact O-N 3.4Å; H148-A163 PolarHBondContact ND1-O 3.31Å; H148-A163 VanDerWaalsContact ND1-O 3.11Å; H148-D164 IonicContact CE1-OD1 3.55Å; H148-D164 PolarHBondContact CE1-OD1 3.46Å; H148-D164 VanDerWaalsContact CE1-OD1 3.25Å; H148-D164 IonicContact NE2-OD1 2.6Å; H148-L167 HydrophobicContact CB-CD2 4.15Å
149	L	96.1	Very high	95.6	Very high	128 Å²	128	93.3 Å²	93.3	67%	0.67	48%	0.475	S	S	*	.	H	α-helix	trans	-63.4	-27.4	178.4	-69	171.4	0	0	0	112.8	L145 D146 L151	L145-L149 HydrophobicContact CD1-CD1 4.06Å; L145-L149 HydrophobicContact CD1-CG 4.14Å; L145-L149 HydrophobicContact CG-CD1 3.97Å; L145-L149 HydrophobicContact CG-CG 4.45Å; L145-L149 WeakPolarHBondContact O-CB 3.35Å; L145-L149 VanDerWaalsContact O-CG 3.29Å; L145-L149 WeakPolarHBondContact O-CG 3.44Å; L145-L149 PolarHBondContact O-N 3.39Å; D146-L149 PolarHBondContact O-N 2.87Å; L149-L151 VanDerWaalsContact C-N 3.3Å
150	N	95.6	Very high	95.4	Very high	117 Å²	117	88.1 Å²	88.1	63%	0.626	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	7.2	172.9	-73.1	-71.2	0	0	0	114.1	D146 H148	D146-N150 WeakPolarHBondContact O-CB 3.04Å; D146-N150 PolarHBondContact O-N 3Å; D146-N150 PolarHBondContact O-ND2 3.47Å; D146-N150 PolarHBondContact OD1-ND2 3.11Å; H148-N150 PolarHBondContact O-N 3.34Å
151	L	95.1	Very high	95.3	Very high	45 Å²	45	89.2 Å²	89.2	24%	0.236	46%	0.458	C	S	.	.	S	Bend	trans	-70.6	133.4	172.5	-69.2	169.8	0	0	0	111.2	H148 L149 A153 K155 L160 A163	H148-L151 HydrophobicContact CB-CD1 4.48Å; H148-L151 WeakPolarHBondContact O-CB 3.36Å; H148-L151 WeakPolarHBondContact O-CD1 3.42Å; H148-L151 VanDerWaalsContact O-CG 3.22Å; H148-L151 WeakPolarHBondContact O-CG 3.02Å; H148-L151 PolarHBondContact O-N 3.4Å; L149-L151 VanDerWaalsContact C-N 3.3Å; L151-A153 PolarHBondContact O-N 3.12Å; L151-K155 HydrophobicContact CD2-CD 4.04Å; L151-L160 HydrophobicContact CB-CD2 4.46Å; L151-A163 HydrophobicContact CD1-CB 3.47Å; L151-A163 VanDerWaalsContact CD1-CB 3.47Å
152	S	94.1	Very high	95.2	Very high	72 Å²	72	94.6 Å²	94.6	50%	0.503	48%	0.484	S	S	.	.			trans	-71.8	123.3	172	-171.4	0	0	0	0	110.8	K154 K155	S152-K154 PolarHBondContact O-N 3.02Å; S152-K154 PolarHBondContact OG-N 2.73Å; S152-K155 WeakPolarHBondContact O-CB 3.37Å; S152-K155 PolarHBondContact O-N 3.4Å
153	A	92.2	Very high	95.1	Very high	94 Å²	94	90.9 Å²	90.9	78%	0.777	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	6.9	170.7	0	0	0	0	0	114.9	L151	L151-A153 PolarHBondContact O-N 3.12Å
154	K	93.4	Very high	95.1	Very high	197 Å²	197	91 Å²	91	86%	0.857	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	3.8	169.3	-63.2	-177.5	-179.3	-179.1	0	113.3	S152	S152-K154 PolarHBondContact O-N 3.02Å; S152-K154 PolarHBondContact OG-N 2.73Å
155	K	93.7	Very high	95	Very high	96 Å²	96	93.4 Å²	93.4	42%	0.417	48%	0.483	S	S	.	.	S	Bend	trans	-66.2	166.2	169.9	-81.4	-169.9	171.6	-170.3	0	111	L151 S152 Q159 L160	L151-K155 HydrophobicContact CD2-CD 4.04Å; S152-K155 WeakPolarHBondContact O-CB 3.37Å; S152-K155 PolarHBondContact O-N 3.4Å; K155-Q159 HydrophobicContact CD-CB 4.43Å; K155-L160 HydrophobicContact CB-CD2 4.02Å; K155-L160 HydrophobicContact CB-CG 4.26Å
156	K	94.6	Very high	95	Very high	151 Å²	151	94.7 Å²	94.7	66%	0.657	49%	0.49	S	S	*	.			trans	-67.3	141.2	170.9	-64.9	-176.6	177.9	-176.2	0	109.6	S158 Q159 L160	K156-S158 PolarHBondContact O-N 3.31Å; K156-S158 VanDerWaalsContact O-N 3.15Å; K156-Q159 HydrophobicContact CB-CG 4.35Å; K156-Q159 WeakPolarHBondContact O-CA 3.43Å; K156-Q159 WeakPolarHBondContact O-CB 3.19Å; K156-Q159 PolarHBondContact O-N 3.08Å; K156-L160 PolarHBondContact O-N 3.48Å
157	E	94.1	Very high	95	Very high	149 Å²	149	90.7 Å²	90.7	70%	0.696	47%	0.468	S	S	*	.	H	α-helix	trans	-47.7	-45.1	178.5	-160.2	68.8	-178.6	0	0	113.1	Q159 L160 Q161	E157-Q159 PolarHBondContact O-N 3.19Å; E157-Q159 VanDerWaalsContact O-N 3.14Å; E157-L160 WeakPolarHBondContact O-CB 3.34Å; E157-L160 PolarHBondContact O-N 3.05Å; E157-Q161 PolarHBondContact O-N 3.24Å
158	S	93.3	Very high	95	Very high	82 Å²	82	88.2 Å²	88.2	57%	0.573	46%	0.461	S	S	*	.	H	α-helix	trans	-61.2	-24.5	178.8	67.2	0	0	0	0	114.3	K156 E162	K156-S158 PolarHBondContact O-N 3.31Å; K156-S158 VanDerWaalsContact O-N 3.15Å; S158-E162 VanDerWaalsContact O-CB 3.3Å; S158-E162 WeakPolarHBondContact O-CB 3.49Å; S158-E162 PolarHBondContact O-N 2.92Å
159	Q	92	Very high	95	Very high	88 Å²	88	93.4 Å²	93.4	41%	0.411	48%	0.479	S	S	.	.	H	α-helix	trans	-91.6	-11.7	176.7	-62	-175.8	-40.8	0	0	113	K155 K156 E157	K155-Q159 HydrophobicContact CD-CB 4.43Å; K156-Q159 HydrophobicContact CB-CG 4.35Å; K156-Q159 WeakPolarHBondContact O-CA 3.43Å; K156-Q159 WeakPolarHBondContact O-CB 3.19Å; K156-Q159 PolarHBondContact O-N 3.08Å; E157-Q159 PolarHBondContact O-N 3.19Å; E157-Q159 VanDerWaalsContact O-N 3.14Å
160	L	93.5	Very high	95.1	Very high	36 Å²	36	88.9 Å²	88.9	19%	0.188	45%	0.454	C	S	.	.	H	α-helix	trans	-83.3	-53.8	167.7	-62	176.6	0	0	0	107.9	L151 K155 K156 E157 E162 A163 D164	L151-L160 HydrophobicContact CB-CD2 4.46Å; K155-L160 HydrophobicContact CB-CD2 4.02Å; K155-L160 HydrophobicContact CB-CG 4.26Å; K156-L160 PolarHBondContact O-N 3.48Å; E157-L160 WeakPolarHBondContact O-CB 3.34Å; E157-L160 PolarHBondContact O-N 3.05Å; L160-E162 VanDerWaalsContact C-N 3.31Å; L160-E162 PolarHBondContact O-N 3.03Å; L160-A163 CarbonylContact O-C 3.56Å; L160-A163 VanDerWaalsContact O-CA 3.32Å; L160-A163 WeakPolarHBondContact O-CA 3.32Å; L160-A163 WeakPolarHBondContact O-CB 3.39Å; L160-A163 PolarHBondContact O-N 3.31Å; L160-D164 VanDerWaalsContact C-OD2 3.25Å; L160-D164 PolarHBondContact O-N 2.64Å
161	Q	95.1	Very high	95.1	Very high	102 Å²	102	87.1 Å²	87.1	48%	0.477	44%	0.439	S	S	.	.	H	α-helix	trans	-54	-41.9	175.4	-170.9	68.7	64.6	0	0	113.2	E157 A163 D164 D165	E157-Q161 PolarHBondContact O-N 3.24Å; Q161-A163 PolarHBondContact O-N 3.02Å; Q161-D164 PolarHBondContact O-N 2.86Å; Q161-D165 PolarHBondContact NE2-OD1 3.17Å; Q161-D165 WeakPolarHBondContact O-CB 3.13Å; Q161-D165 PolarHBondContact O-N 2.81Å
162	E	95.3	Very high	95.2	Very high	136 Å²	136	89.2 Å²	89.2	64%	0.636	45%	0.453	S	S	*	.	H	α-helix	trans	-61	-31.6	174.6	-178	179.9	-165.2	0	0	112.6	S158 L160 L166	S158-E162 VanDerWaalsContact O-CB 3.3Å; S158-E162 WeakPolarHBondContact O-CB 3.49Å; S158-E162 PolarHBondContact O-N 2.92Å; L160-E162 VanDerWaalsContact C-N 3.31Å; L160-E162 PolarHBondContact O-N 3.03Å; E162-L166 VanDerWaalsContact O-CB 3.27Å; E162-L166 WeakPolarHBondContact O-CB 3.43Å; E162-L166 PolarHBondContact O-N 3.27Å
163	A	95.9	Very high	95.3	Very high	21 Å²	21	88.1 Å²	88.1	17%	0.174	44%	0.441	C	S	.	.	H	α-helix	trans	-85.5	-25.9	177	0	0	0	0	0	113.5	H148 L151 L160 Q161 L167	H148-A163 PolarHBondContact ND1-O 3.31Å; H148-A163 VanDerWaalsContact ND1-O 3.11Å; L151-A163 HydrophobicContact CD1-CB 3.47Å; L151-A163 VanDerWaalsContact CD1-CB 3.47Å; L160-A163 CarbonylContact O-C 3.56Å; L160-A163 VanDerWaalsContact O-CA 3.32Å; L160-A163 WeakPolarHBondContact O-CA 3.32Å; L160-A163 WeakPolarHBondContact O-CB 3.39Å; L160-A163 PolarHBondContact O-N 3.31Å; Q161-A163 PolarHBondContact O-N 3.02Å; A163-L167 VanDerWaalsContact O-CB 3.26Å; A163-L167 WeakPolarHBondContact O-CB 3.3Å; A163-L167 PolarHBondContact O-N 3.45Å; A163-L167 VanDerWaalsContact O-N 3.11Å
164	D	97	Very high	95.6	Very high	64 Å²	64	83.7 Å²	83.7	34%	0.342	41%	0.405	S	S	.	.	H	α-helix	trans	-66.4	-55.5	166.5	-68.5	-63.8	0	0	0	110.1	H148 L160 Q161 L166 L167 D168	H148-D164 IonicContact CE1-OD1 3.55Å; H148-D164 PolarHBondContact CE1-OD1 3.46Å; H148-D164 VanDerWaalsContact CE1-OD1 3.25Å; H148-D164 IonicContact NE2-OD1 2.6Å; L160-D164 VanDerWaalsContact C-OD2 3.25Å; L160-D164 PolarHBondContact O-N 2.64Å; Q161-D164 PolarHBondContact O-N 2.86Å; D164-L166 PolarHBondContact O-N 3.28Å; D164-L166 VanDerWaalsContact O-N 3.15Å; D164-L167 PolarHBondContact O-N 3.18Å; D164-D168 WeakPolarHBondContact O-CB 3.44Å; D164-D168 PolarHBondContact O-N 3.01Å
165	D	97	Very high	95.7	Very high	85 Å²	85	76.7 Å²	76.7	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-57.3	-32	179.9	-70.8	1.5	0	0	0	112.8	Q161 R169	Q161-D165 PolarHBondContact NE2-OD1 3.17Å; Q161-D165 WeakPolarHBondContact O-CB 3.13Å; Q161-D165 PolarHBondContact O-N 2.81Å; D165-R169 WeakPolarHBondContact O-CB 3.28Å; D165-R169 PolarHBondContact O-N 3.05Å
166	L	96.3	Very high	95.9	Very high	69 Å²	69	77 Å²	77	36%	0.361	38%	0.376	S	S	.	.	H	α-helix	trans	-79.4	-40.2	176.2	-173.9	63.6	0	0	0	112.1	L144 E162 D164 R169 E170	L144-L166 HydrophobicContact CD1-CD2 4.23Å; L144-L166 HydrophobicContact CD2-CD2 4.47Å; L144-L166 HydrophobicContact CD2-CG 3.97Å; E162-L166 VanDerWaalsContact O-CB 3.27Å; E162-L166 WeakPolarHBondContact O-CB 3.43Å; E162-L166 PolarHBondContact O-N 3.27Å; D164-L166 PolarHBondContact O-N 3.28Å; D164-L166 VanDerWaalsContact O-N 3.15Å; L166-R169 PolarHBondContact O-N 3.13Å; L166-E170 PolarHBondContact O-N 2.78Å; L166-E170 VanDerWaalsContact O-N 3.15Å
167	L	97.5	Very high	96	Very high	13 Å²	13	69.9 Å²	69.9	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-45	176.3	179	63.3	0	0	0	111.1	Y141 L144 L145 H148 A163 D164 R169 E170 R171	Y141-L167 HydrophobicContact CD2-CD1 4.04Å; Y141-L167 HydrophobicContact CE2-CD1 3.7Å; Y141-L167 HydrophobicContact CE2-CG 4.48Å; L144-L167 HydrophobicContact CD2-CD1 4.36Å; L144-L167 HydrophobicContact CG-CD1 4.21Å; L145-L167 HydrophobicContact CB-CD1 4Å; L145-L167 HydrophobicContact CD1-CD1 4.11Å; L145-L167 HydrophobicContact CD1-CD2 3.79Å; H148-L167 HydrophobicContact CB-CD2 4.15Å; A163-L167 VanDerWaalsContact O-CB 3.26Å; A163-L167 WeakPolarHBondContact O-CB 3.3Å; A163-L167 PolarHBondContact O-N 3.45Å; A163-L167 VanDerWaalsContact O-N 3.11Å; D164-L167 PolarHBondContact O-N 3.18Å; L167-R169 VanDerWaalsContact C-N 3.27Å; L167-R169 PolarHBondContact O-N 3.37Å; L167-E170 PolarHBondContact O-N 3.11Å; L167-R171 VanDerWaalsContact O-CB 3.29Å; L167-R171 WeakPolarHBondContact O-CB 3.4Å; L167-R171 PolarHBondContact O-N 2.99Å
168	D	96.9	Very high	96.2	Very high	70 Å²	70	62.8 Å²	62.8	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-61.8	-35.8	177.8	-95.1	30.2	0	0	0	111.9	D164 R171 V172	D164-D168 WeakPolarHBondContact O-CB 3.44Å; D164-D168 PolarHBondContact O-N 3.01Å; D168-R171 WeakPolarHBondContact O-CB 3.45Å; D168-R171 PolarHBondContact O-N 3.16Å; D168-R171 IonicContact OD1-CZ 3.79Å; D168-R171 IonicContact OD1-NH1 3.86Å; D168-R171 PolarHBondContact OD1-NH1 3.2Å; D168-R171 IonicContact OD1-NH2 2.65Å; D168-R171 PolarHBondContact OD1-NH2 3.03Å; D168-R171 IonicContact OD2-CZ 2.82Å; D168-R171 IonicContact OD2-NH1 3.3Å; D168-R171 IonicContact OD2-NH2 3.38Å; D168-R171 PolarHBondContact OD2-NH2 3.09Å; D168-V172 WeakPolarHBondContact O-CG2 3.26Å; D168-V172 PolarHBondContact O-N 3.44Å
169	R	96.9	Very high	96.4	Very high	147 Å²	147	60.8 Å²	60.8	56%	0.555	30%	0.297	S	S	*	.	H	α-helix	trans	-65.3	-51.1	174.5	-170.8	-175.6	-51.5	158.8	11.7	112.5	D165 L166 L167 R171 V172 N173	D165-R169 WeakPolarHBondContact O-CB 3.28Å; D165-R169 PolarHBondContact O-N 3.05Å; L166-R169 PolarHBondContact O-N 3.13Å; L167-R169 VanDerWaalsContact C-N 3.27Å; L167-R169 PolarHBondContact O-N 3.37Å; R169-R171 VanDerWaalsContact C-N 3.28Å; R169-R171 PolarHBondContact O-N 3.13Å; R169-V172 PolarHBondContact O-N 3.34Å; R169-N173 PolarHBondContact O-N 2.82Å; R169-N173 PolarHBondContact O-OD1 3.11Å
170	E	97.4	Very high	96.7	Very high	33 Å²	33	59.4 Å²	59.4	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-70.3	-26.2	178.2	-61.4	-56.6	125.2	0	0	112	K140 L144 L166 L167 N173 F174	K140-E170 IonicContact NZ-OE2 3.88Å; K140-E170 PolarHBondContact NZ-OE2 3.42Å; L144-E170 HydrophobicContact CD2-CB 3.99Å; L144-E170 HydrophobicContact CD2-CG 3.73Å; L166-E170 PolarHBondContact O-N 2.78Å; L166-E170 VanDerWaalsContact O-N 3.15Å; L167-E170 PolarHBondContact O-N 3.11Å; E170-N173 PolarHBondContact O-N 3.44Å; E170-N173 PolarHBondContact OE1-ND2 3.2Å; E170-N173 PolarHBondContact OE2-ND2 2.82Å; E170-N173 VanDerWaalsContact OE2-ND2 3.08Å; E170-F174 WeakPolarHBondContact O-CB 3.43Å; E170-F174 PolarHBondContact O-N 3.04Å
171	R	96.4	Very high	96.9	Very high	80 Å²	80	57.9 Å²	57.9	30%	0.302	28%	0.282	S	S	.	.	H	α-helix	trans	-61	-43.9	169.3	-170.8	176.1	71.4	-142.7	-6	111.5	Y141 L167 D168 R169 F174 Y175	Y141-R171 HydrophobicContact CD2-CB 4.01Å; Y141-R171 HydrophobicContact CE2-CB 3.53Å; Y141-R171 HydrophobicContact CE2-CG 3.78Å; L167-R171 VanDerWaalsContact O-CB 3.29Å; L167-R171 WeakPolarHBondContact O-CB 3.4Å; L167-R171 PolarHBondContact O-N 2.99Å; D168-R171 WeakPolarHBondContact O-CB 3.45Å; D168-R171 PolarHBondContact O-N 3.16Å; D168-R171 IonicContact OD1-CZ 3.79Å; D168-R171 IonicContact OD1-NH1 3.86Å; D168-R171 PolarHBondContact OD1-NH1 3.2Å; D168-R171 IonicContact OD1-NH2 2.65Å; D168-R171 PolarHBondContact OD1-NH2 3.03Å; D168-R171 IonicContact OD2-CZ 2.82Å; D168-R171 IonicContact OD2-NH1 3.3Å; D168-R171 IonicContact OD2-NH2 3.38Å; D168-R171 PolarHBondContact OD2-NH2 3.09Å; R169-R171 VanDerWaalsContact C-N 3.28Å; R169-R171 PolarHBondContact O-N 3.13Å; R171-F174 PolarHBondContact O-N 3.27Å; R171-Y175 HydrophobicContact CG-CD2 3.96Å; R171-Y175 HydrophobicContact CG-CE2 3.43Å; R171-Y175 VanDerWaalsContact CG-CE2 3.43Å; R171-Y175 WeakPolarHBondContact O-CD2 3.18Å; R171-Y175 PolarHBondContact O-N 2.9Å
172	V	96.7	Very high	97	Very high	88 Å²	88	53 Å²	53	53%	0.533	26%	0.259	S	S	.	.	H	α-helix	trans	-65.5	-45	174.4	171.3	0	0	0	0	111.3	D168 R169 F174 Y175 E176	D168-V172 WeakPolarHBondContact O-CG2 3.26Å; D168-V172 PolarHBondContact O-N 3.44Å; R169-V172 PolarHBondContact O-N 3.34Å; V172-F174 VanDerWaalsContact C-N 3.28Å; V172-F174 PolarHBondContact O-N 3.03Å; V172-Y175 PolarHBondContact O-N 3.14Å; V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 PolarHBondContact O-N 2.82Å
173	N	96.8	Very high	97	Very high	49 Å²	49	52.5 Å²	52.5	26%	0.262	25%	0.252	S	S	.	.	H	α-helix	trans	-56	-43.8	175.3	-64.2	-17.8	0	0	0	111.8	R169 E170 S177	R169-N173 PolarHBondContact O-N 2.82Å; R169-N173 PolarHBondContact O-OD1 3.11Å; E170-N173 PolarHBondContact O-N 3.44Å; E170-N173 PolarHBondContact OE1-ND2 3.2Å; E170-N173 PolarHBondContact OE2-ND2 2.82Å; E170-N173 VanDerWaalsContact OE2-ND2 3.08Å; N173-S177 WeakPolarHBondContact O-CB 3.45Å; N173-S177 PolarHBondContact O-N 2.74Å; N173-S177 PolarHBondContact O-OG 2.8Å
174	F	97.6	Very high	97	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-53.5	177.1	168.2	-115.9	0	0	0	111.7	D14 F134 S138 Y141 E170 R171 V172 E176 S177 S178	D14-F174 HydrophobicContact CB-CE1 4.23Å; D14-F174 HydrophobicContact CB-CZ 4.06Å; D14-F174 WeakPolarHBondContact OD2-CZ 3.36Å; F134-F174 HydrophobicContact CD2-CE2 4.06Å; F134-F174 HydrophobicContact CE2-CD2 4.37Å; F134-F174 AromaticContact CE2-CE2 3.52Å; F134-F174 HydrophobicContact CE2-CE2 3.52Å; F134-F174 HydrophobicContact CE2-CZ 4.13Å; F134-F174 HydrophobicContact CZ-CE2 4.37Å; S138-F174 WeakPolarHBondContact OG-CE2 3.32Å; Y141-F174 HydrophobicContact CD1-CB 4.3Å; Y141-F174 AromaticContact CD1-CD1 3.64Å; Y141-F174 HydrophobicContact CD1-CD1 3.64Å; Y141-F174 HydrophobicContact CD1-CE1 4.19Å; Y141-F174 AromaticContact CD1-CG 3.98Å; Y141-F174 HydrophobicContact CD1-CG 3.98Å; Y141-F174 HydrophobicContact CE1-CD1 4.03Å; Y141-F174 HydrophobicContact CE1-CE1 4.4Å; Y141-F174 HydrophobicContact CG-CB 4.11Å; Y141-F174 HydrophobicContact CG-CD1 4.29Å; Y141-F174 HydrophobicContact CG-CG 4.28Å; E170-F174 WeakPolarHBondContact O-CB 3.43Å; E170-F174 PolarHBondContact O-N 3.04Å; R171-F174 PolarHBondContact O-N 3.27Å; V172-F174 VanDerWaalsContact C-N 3.28Å; V172-F174 PolarHBondContact O-N 3.03Å; F174-E176 PolarHBondContact O-N 3.44Å; F174-S177 PolarHBondContact O-N 2.7Å; F174-S177 VanDerWaalsContact O-N 3.17Å; F174-S177 PolarHBondContact O-OG 2.83Å; F174-S178 PolarHBondContact O-N 3.42Å
175	Y	96.1	Very high	97	Very high	50 Å²	50	49.6 Å²	49.6	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-40.9	179.8	-66.2	-31.8	0	0	0	112.9	C11 Y12 R171 V172 S177 S178 V179	C11-Y175 WeakPolarHBondContact O-CD1 3.21Å; Y12-Y175 HydrophobicContact CD1-CD1 4.2Å; Y12-Y175 AromaticContact CD1-CD2 3.65Å; Y12-Y175 HydrophobicContact CD1-CD2 3.65Å; Y12-Y175 HydrophobicContact CD1-CE1 4.48Å; Y12-Y175 AromaticContact CD1-CE2 3.94Å; Y12-Y175 HydrophobicContact CD1-CE2 3.94Å; Y12-Y175 AromaticContact CD1-CG 3.78Å; Y12-Y175 HydrophobicContact CD1-CG 3.78Å; Y12-Y175 HydrophobicContact CE1-CD2 4.06Å; Y12-Y175 HydrophobicContact CE1-CG 4.16Å; Y12-Y175 VanDerWaalsContact O-CE1 3.23Å; Y12-Y175 WeakPolarHBondContact O-CE1 3.11Å; Y12-Y175 PolarHBondContact O-OH 3.48Å; R171-Y175 HydrophobicContact CG-CD2 3.96Å; R171-Y175 HydrophobicContact CG-CE2 3.43Å; R171-Y175 VanDerWaalsContact CG-CE2 3.43Å; R171-Y175 WeakPolarHBondContact O-CD2 3.18Å; R171-Y175 PolarHBondContact O-N 2.9Å; V172-Y175 PolarHBondContact O-N 3.14Å; Y175-S177 PolarHBondContact O-N 3.24Å; Y175-S178 WeakPolarHBondContact O-CB 3.2Å; Y175-S178 PolarHBondContact O-N 3.08Å; Y175-V179 WeakPolarHBondContact O-CG2 3.41Å; Y175-V179 PolarHBondContact O-N 2.84Å
176	E	96.9	Very high	96.9	Very high	104 Å²	104	48.1 Å²	48.1	49%	0.486	22%	0.223	S	C	.	.	H	α-helix	trans	-57.5	-49.7	173.1	-170.7	-151.2	-140.8	0	0	110.4	K133 V172 F174 S178 V179 E180	K133-E176 IonicContact NZ-OE2 3.89Å; K133-E176 PolarHBondContact NZ-OE2 3.16Å; V172-E176 WeakPolarHBondContact O-CB 3.38Å; V172-E176 PolarHBondContact O-N 2.82Å; F174-E176 PolarHBondContact O-N 3.44Å; E176-S178 VanDerWaalsContact C-N 3.28Å; E176-S178 PolarHBondContact O-N 3.12Å; E176-V179 PolarHBondContact O-N 3.33Å; E176-E180 HydrophobicContact CG-CG 4.47Å; E176-E180 WeakPolarHBondContact O-CB 3.27Å; E176-E180 WeakPolarHBondContact O-CG 3.12Å; E176-E180 PolarHBondContact O-N 2.81Å
177	S	98.1	Very high	96.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-33.8	179.3	78	0	0	0	0	113.4	N173 F174 Y175 Y181	N173-S177 WeakPolarHBondContact O-CB 3.45Å; N173-S177 PolarHBondContact O-N 2.74Å; N173-S177 PolarHBondContact O-OG 2.8Å; F174-S177 PolarHBondContact O-N 2.7Å; F174-S177 VanDerWaalsContact O-N 3.17Å; F174-S177 PolarHBondContact O-OG 2.83Å; Y175-S177 PolarHBondContact O-N 3.24Å; S177-Y181 VanDerWaalsContact O-CB 3.25Å; S177-Y181 WeakPolarHBondContact O-CB 3.45Å; S177-Y181 PolarHBondContact O-N 2.73Å
178	S	97.8	Very high	96.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-49.1	176.8	-168.2	0	0	0	0	111.5	C11 F134 F174 Y175 E176 Y181 V182	C11-S178 WeakPolarHBondContact CB-OG 3.29Å; F134-S178 WeakPolarHBondContact CE2-OG 3.46Å; F174-S178 PolarHBondContact O-N 3.42Å; Y175-S178 WeakPolarHBondContact O-CB 3.2Å; Y175-S178 PolarHBondContact O-N 3.08Å; E176-S178 VanDerWaalsContact C-N 3.28Å; E176-S178 PolarHBondContact O-N 3.12Å; S178-Y181 PolarHBondContact O-N 3.48Å; S178-V182 PolarHBondContact O-N 3.38Å
179	V	97.4	Very high	96.4	Very high	40 Å²	40	44.7 Å²	44.7	24%	0.242	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-42.5	178.3	172.3	0	0	0	0	111.3	F8 C11 Y175 E176 Y181 Y183	F8-V179 HydrophobicContact CD1-CG1 3.87Å; F8-V179 HydrophobicContact CE1-CG1 4.09Å; C11-V179 HydrophobicContact CB-CG2 3.82Å; Y175-V179 WeakPolarHBondContact O-CG2 3.41Å; Y175-V179 PolarHBondContact O-N 2.84Å; E176-V179 PolarHBondContact O-N 3.33Å; V179-Y181 VanDerWaalsContact C-N 3.28Å; V179-Y181 PolarHBondContact O-N 2.88Å; V179-Y183 VanDerWaalsContact O-CB 3.25Å; V179-Y183 WeakPolarHBondContact O-CB 3.36Å; V179-Y183 PolarHBondContact O-N 3.33Å
180	E	97.1	Very high	96.2	Very high	58 Å²	58	41.8 Å²	41.8	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-57.4	-41.3	171.9	-77.8	-160.9	117.9	0	0	112.1	K130 K133 E176 Q184	K130-E180 HydrophobicContact CD-CB 4.43Å; K130-E180 IonicContact NZ-OE1 3.62Å; K130-E180 PolarHBondContact NZ-OE1 3.34Å; K130-E180 IonicContact NZ-OE2 3.02Å; K130-E180 PolarHBondContact NZ-OE2 2.81Å; K133-E180 IonicContact NZ-OE2 2.71Å; K133-E180 PolarHBondContact NZ-OE2 3.49Å; E176-E180 HydrophobicContact CG-CG 4.47Å; E176-E180 WeakPolarHBondContact O-CB 3.27Å; E176-E180 WeakPolarHBondContact O-CG 3.12Å; E176-E180 PolarHBondContact O-N 2.81Å; E180-Q184 WeakPolarHBondContact O-CB 3.5Å; E180-Q184 PolarHBondContact O-N 3.1Å
181	Y	97.9	Very high	96.1	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-71.6	-46.4	-177.4	-178.8	-139.5	0	0	0	111.9	L22 E26 T127 K130 K131 F134 S177 S178 V179 Y183 Q184 I185	L22-Y181 HydrophobicContact CD1-CD1 4.27Å; L22-Y181 HydrophobicContact CD1-CE1 3.96Å; L22-Y181 HydrophobicContact CD2-CD1 4.36Å; L22-Y181 HydrophobicContact CD2-CE1 4.07Å; L22-Y181 HydrophobicContact CG-CE1 4.22Å; E26-Y181 WeakPolarHBondContact CG-OH 2.91Å; E26-Y181 PolarHBondContact OE1-OH 3.22Å; T127-Y181 HydrophobicContact CG2-CD2 4.4Å; T127-Y181 HydrophobicContact CG2-CE2 3.78Å; T127-Y181 WeakPolarHBondContact O-CE2 3.28Å; K130-Y181 HydrophobicContact CB-CD2 3.87Å; K131-Y181 HydrophobicContact CB-CD2 4.33Å; K131-Y181 HydrophobicContact CB-CE1 4.15Å; K131-Y181 HydrophobicContact CB-CE2 3.62Å; K131-Y181 HydrophobicContact CG-CE1 4.09Å; K131-Y181 HydrophobicContact CG-CE2 4.37Å; F134-Y181 HydrophobicContact CB-CD1 4.03Å; F134-Y181 HydrophobicContact CB-CG 4.26Å; F134-Y181 AromaticContact CD1-CD1 3.52Å; F134-Y181 HydrophobicContact CD1-CD1 3.52Å; F134-Y181 AromaticContact CD1-CE1 3.93Å; F134-Y181 HydrophobicContact CD1-CE1 3.93Å; F134-Y181 HydrophobicContact CE1-CD1 4.13Å; F134-Y181 HydrophobicContact CE1-CE1 4.41Å; F134-Y181 AromaticContact CG-CD1 3.88Å; F134-Y181 HydrophobicContact CG-CD1 3.88Å; S177-Y181 VanDerWaalsContact O-CB 3.25Å; S177-Y181 WeakPolarHBondContact O-CB 3.45Å; S177-Y181 PolarHBondContact O-N 2.73Å; S178-Y181 PolarHBondContact O-N 3.48Å; V179-Y181 VanDerWaalsContact C-N 3.28Å; V179-Y181 PolarHBondContact O-N 2.88Å; Y181-Y183 PolarHBondContact O-N 2.83Å; Y181-Q184 PolarHBondContact O-N 2.73Å; Y181-I185 HydrophobicContact CD1-CD1 4.47Å; Y181-I185 HydrophobicContact CD2-CD1 4.36Å; Y181-I185 HydrophobicContact CD2-CG1 4.33Å; Y181-I185 HydrophobicContact CE1-CD1 4.07Å; Y181-I185 HydrophobicContact CE2-CD1 3.92Å; Y181-I185 HydrophobicContact CE2-CG1 3.97Å; Y181-I185 WeakPolarHBondContact O-CG1 3.43Å; Y181-I185 PolarHBondContact O-N 2.87Å
182	V	97.3	Very high	96	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.3	-42.7	174.7	168.7	0	0	0	0	111.5	L6 F8 F18 L22 S178 Q184 I185 H186	L6-V182 HydrophobicContact CB-CG1 3.61Å; L6-V182 HydrophobicContact CB-CG2 4.42Å; L6-V182 HydrophobicContact CD1-CG1 4.45Å; L6-V182 HydrophobicContact CD1-CG2 4.48Å; L6-V182 WeakPolarHBondContact O-CG1 3.45Å; F8-V182 HydrophobicContact CD1-CB 4.42Å; F8-V182 HydrophobicContact CD1-CG1 4Å; F8-V182 HydrophobicContact CE1-CB 4.24Å; F8-V182 HydrophobicContact CE1-CG1 3.83Å; F18-V182 HydrophobicContact CE2-CG2 3.93Å; F18-V182 HydrophobicContact CZ-CG2 3.86Å; L22-V182 HydrophobicContact CD1-CG2 4.22Å; S178-V182 PolarHBondContact O-N 3.38Å; V182-Q184 VanDerWaalsContact C-N 3.33Å; V182-Q184 PolarHBondContact O-N 2.88Å; V182-I185 PolarHBondContact O-N 3.25Å; V182-H186 PolarHBondContact O-N 3Å
183	Y	95.6	Very high	95.9	Very high	125 Å²	125	44.8 Å²	44.8	49%	0.49	20%	0.204	S	C	.	.	H	α-helix	trans	-57.7	-45.4	173.5	172.2	-95	0	0	0	111.5	F8 V179 Y181 I185 H186 Q187	F8-Y183 HydrophobicContact CZ-CD2 4.39Å; V179-Y183 VanDerWaalsContact O-CB 3.25Å; V179-Y183 WeakPolarHBondContact O-CB 3.36Å; V179-Y183 PolarHBondContact O-N 3.33Å; Y181-Y183 PolarHBondContact O-N 2.83Å; Y183-I185 VanDerWaalsContact C-N 3.32Å; Y183-I185 PolarHBondContact O-N 3.1Å; Y183-H186 PolarHBondContact O-N 2.82Å; Y183-Q187 WeakPolarHBondContact O-CB 3.14Å; Y183-Q187 PolarHBondContact O-N 3.31Å; Y183-Q187 PolarHBondContact OH-NE2 2.65Å; Y183-Q187 VanDerWaalsContact OH-NE2 3.17Å
184	Q	96.4	Very high	95.8	Very high	24 Å²	24	46.6 Å²	46.6	11%	0.112	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-29.8	179	-165.1	60.3	54.1	0	0	112.7	T127 K130 E180 Y181 V182 V188	T127-Q184 HydrophobicContact CG2-CG 4.44Å; K130-Q184 HydrophobicContact CG-CB 4.25Å; K130-Q184 HydrophobicContact CG-CG 4.22Å; E180-Q184 WeakPolarHBondContact O-CB 3.5Å; E180-Q184 PolarHBondContact O-N 3.1Å; Y181-Q184 PolarHBondContact O-N 2.73Å; V182-Q184 VanDerWaalsContact C-N 3.33Å; V182-Q184 PolarHBondContact O-N 2.88Å; Q184-V188 WeakPolarHBondContact O-CG2 3.48Å; Q184-V188 PolarHBondContact O-N 3.39Å
185	I	96.4	Very high	95.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-53.9	169.8	-68.3	171.1	0	0	0	109.8	L6 L22 Y25 L29 T127 Y181 V182 Y183 Q187 V188 Q189	L6-I185 HydrophobicContact CD1-CB 4.46Å; L6-I185 HydrophobicContact CD1-CD1 4.08Å; L6-I185 HydrophobicContact CD1-CG2 3.98Å; L22-I185 HydrophobicContact CD1-CD1 3.4Å; L22-I185 VanDerWaalsContact CD1-CD1 3.4Å; Y25-I185 HydrophobicContact CD1-CG2 3.67Å; Y25-I185 HydrophobicContact CG-CG2 3.98Å; L29-I185 HydrophobicContact CD1-CG1 4.14Å; T127-I185 HydrophobicContact CG2-CG1 3.93Å; Y181-I185 HydrophobicContact CD1-CD1 4.47Å; Y181-I185 HydrophobicContact CD2-CD1 4.36Å; Y181-I185 HydrophobicContact CD2-CG1 4.33Å; Y181-I185 HydrophobicContact CE1-CD1 4.07Å; Y181-I185 HydrophobicContact CE2-CD1 3.92Å; Y181-I185 HydrophobicContact CE2-CG1 3.97Å; Y181-I185 WeakPolarHBondContact O-CG1 3.43Å; Y181-I185 PolarHBondContact O-N 2.87Å; V182-I185 PolarHBondContact O-N 3.25Å; Y183-I185 VanDerWaalsContact C-N 3.32Å; Y183-I185 PolarHBondContact O-N 3.1Å; I185-Q187 VanDerWaalsContact C-N 3.31Å; I185-Q187 PolarHBondContact O-N 3.29Å; I185-V188 PolarHBondContact O-N 2.97Å; I185-V188 VanDerWaalsContact O-N 3.07Å; I185-Q189 HydrophobicContact CG2-CG 4.17Å; I185-Q189 WeakPolarHBondContact O-CG 3.42Å; I185-Q189 PolarHBondContact O-N 3.43Å
186	H	94.6	Very high	95.7	Very high	54 Å²	54	46.6 Å²	46.6	25%	0.25	21%	0.213	C	C	.	.	H	α-helix	trans	-56.6	-43.9	179.2	-75.9	171.8	0	0	0	112.3	L6 V182 Y183 V188 Q189 D190	L6-H186 PolarHBondContact O-CE1 2.92Å; V182-H186 PolarHBondContact O-N 3Å; Y183-H186 PolarHBondContact O-N 2.82Å; H186-V188 VanDerWaalsContact C-N 3.3Å; H186-V188 PolarHBondContact O-N 3.49Å; H186-Q189 PolarHBondContact O-N 2.9Å; H186-Q189 VanDerWaalsContact O-N 3.1Å; H186-D190 PolarHBondContact O-N 3.44Å
187	Q	94.2	Very high	95.7	Very high	52 Å²	52	45.5 Å²	45.5	24%	0.243	21%	0.214	C	C	.	.	H	α-helix	trans	-55.3	-43.8	175.4	-168.7	-174.6	94.9	0	0	111.9	Y183 I185 R191	Y183-Q187 WeakPolarHBondContact O-CB 3.14Å; Y183-Q187 PolarHBondContact O-N 3.31Å; Y183-Q187 PolarHBondContact OH-NE2 2.65Å; Y183-Q187 VanDerWaalsContact OH-NE2 3.17Å; I185-Q187 VanDerWaalsContact C-N 3.31Å; I185-Q187 PolarHBondContact O-N 3.29Å; Q187-R191 HydrophobicContact CG-CG 4.33Å; Q187-R191 WeakPolarHBondContact O-CB 3.23Å; Q187-R191 WeakPolarHBondContact O-CG 3.42Å; Q187-R191 PolarHBondContact O-N 2.8Å
188	V	95.7	Very high	95.6	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-35.4	177.3	177.3	0	0	0	0	112.5	L29 F119 Q123 I124 T127 Q184 I185 H186 D190 K192	L29-V188 HydrophobicContact CD2-CB 4.14Å; L29-V188 HydrophobicContact CD2-CG1 3.5Å; L29-V188 VanDerWaalsContact CD2-CG1 3.5Å; F119-V188 HydrophobicContact CE1-CG1 4.33Å; F119-V188 HydrophobicContact CZ-CG1 3.82Å; Q123-V188 HydrophobicContact CB-CG2 4.09Å; I124-V188 HydrophobicContact CG1-CG1 4.09Å; T127-V188 WeakPolarHBondContact OG1-CG2 3.15Å; Q184-V188 WeakPolarHBondContact O-CG2 3.48Å; Q184-V188 PolarHBondContact O-N 3.39Å; I185-V188 PolarHBondContact O-N 2.97Å; I185-V188 VanDerWaalsContact O-N 3.07Å; H186-V188 VanDerWaalsContact C-N 3.3Å; H186-V188 PolarHBondContact O-N 3.49Å; V188-D190 VanDerWaalsContact C-N 3.33Å; V188-D190 PolarHBondContact O-N 3.06Å; V188-K192 WeakPolarHBondContact O-CB 3.34Å; V188-K192 PolarHBondContact O-N 3.28Å
189	Q	92.1	Very high	95.5	Very high	28 Å²	28	51.5 Å²	51.5	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-34	176.9	-67.8	-61	-29.1	0	0	113.1	Y25 E28 I185 H186 K193	Y25-Q189 HydrophobicContact CD1-CG 3.93Å; Y25-Q189 HydrophobicContact CE1-CG 3.97Å; E28-Q189 PolarHBondContact OE2-NE2 3.09Å; E28-Q189 PolarHBondContact OE2-OE1 3.46Å; I185-Q189 HydrophobicContact CG2-CG 4.17Å; I185-Q189 WeakPolarHBondContact O-CG 3.42Å; I185-Q189 PolarHBondContact O-N 3.43Å; H186-Q189 PolarHBondContact O-N 2.9Å; H186-Q189 VanDerWaalsContact O-N 3.1Å; Q189-K193 WeakPolarHBondContact O-CE 3.32Å
190	D	92.6	Very high	95.4	Very high	86 Å²	86	51.7 Å²	51.7	46%	0.46	24%	0.243	S	C	.	.	H	α-helix	trans	-82	-48.3	173.3	-77	-38.7	0	0	0	112.2	H186 V188 K192 K193	H186-D190 PolarHBondContact O-N 3.44Å; V188-D190 VanDerWaalsContact C-N 3.33Å; V188-D190 PolarHBondContact O-N 3.06Å; D190-K192 VanDerWaalsContact C-N 3.29Å; D190-K192 PolarHBondContact O-N 3.39Å; D190-K193 VanDerWaalsContact O-CB 3.22Å; D190-K193 WeakPolarHBondContact O-CB 3.5Å; D190-K193 VanDerWaalsContact O-CG 3.28Å; D190-K193 WeakPolarHBondContact O-CG 3.33Å; D190-K193 PolarHBondContact O-N 3.25Å; D190-K193 WeakPolarHBondContact OD1-CE 3.37Å; D190-K193 IonicContact OD1-NZ 3.92Å; D190-K193 PolarHBondContact OD1-NZ 3.32Å
191	R	95.1	Very high	95.3	Very high	83 Å²	83	54.2 Å²	54.2	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-35.8	-177.7	-74.4	-172.7	68.5	129.8	19.5	113.5	F119 Q123 Q187 K193 F194 D195	F119-R191 HydrophobicContact CE2-CB 3.82Å; Q123-R191 VanDerWaalsContact OE1-CD 3.26Å; Q187-R191 HydrophobicContact CG-CG 4.33Å; Q187-R191 WeakPolarHBondContact O-CB 3.23Å; Q187-R191 WeakPolarHBondContact O-CG 3.42Å; Q187-R191 PolarHBondContact O-N 2.8Å; R191-K193 PolarHBondContact O-N 2.87Å; R191-F194 HydrophobicContact CB-CZ 4.19Å; R191-F194 HydrophobicContact CG-CE1 4.47Å; R191-F194 HydrophobicContact CG-CE2 4.48Å; R191-F194 HydrophobicContact CG-CZ 3.86Å; R191-F194 PolarHBondContact O-N 2.98Å; R191-F194 VanDerWaalsContact O-N 3.11Å; R191-D195 IonicContact CZ-OD2 2.8Å; R191-D195 IonicContact NE-OD2 3.33Å; R191-D195 PolarHBondContact NE-OD2 3.02Å; R191-D195 IonicContact NH2-OD1 2.68Å; R191-D195 PolarHBondContact NH2-OD1 3.39Å; R191-D195 IonicContact NH2-OD2 3.41Å; R191-D195 PolarHBondContact NH2-OD2 2.96Å; R191-D195 WeakPolarHBondContact O-CB 3.22Å; R191-D195 PolarHBondContact O-N 2.8Å
192	K	94.1	Very high	95.1	Very high	48 Å²	48	55.9 Å²	55.9	21%	0.209	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.7	177.7	80.2	-171.7	-172.3	-175.5	0	113.8	E28 F119 V188 D190 F194 V196	E28-K192 IonicContact OE1-NZ 2.97Å; E28-K192 PolarHBondContact OE1-NZ 3.02Å; E28-K192 IonicContact OE2-NZ 3.84Å; E28-K192 PolarHBondContact OE2-NZ 3.5Å; F119-K192 HydrophobicContact CE1-CB 3.97Å; F119-K192 HydrophobicContact CE2-CB 4.46Å; F119-K192 HydrophobicContact CZ-CB 3.58Å; V188-K192 WeakPolarHBondContact O-CB 3.34Å; V188-K192 PolarHBondContact O-N 3.28Å; D190-K192 VanDerWaalsContact C-N 3.29Å; D190-K192 PolarHBondContact O-N 3.39Å; K192-F194 VanDerWaalsContact C-N 3.29Å; K192-F194 PolarHBondContact O-N 3.18Å; K192-V196 HydrophobicContact CB-CG2 4.29Å; K192-V196 WeakPolarHBondContact O-CB 3.39Å
193	K	93.1	Very high	94.8	Very high	134 Å²	134	56.9 Å²	56.9	58%	0.583	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.4	179	-59.5	169.7	-177	171.7	0	112.5	Q189 D190 R191 V197	Q189-K193 WeakPolarHBondContact O-CE 3.32Å; D190-K193 VanDerWaalsContact O-CB 3.22Å; D190-K193 WeakPolarHBondContact O-CB 3.5Å; D190-K193 VanDerWaalsContact O-CG 3.28Å; D190-K193 WeakPolarHBondContact O-CG 3.33Å; D190-K193 PolarHBondContact O-N 3.25Å; D190-K193 WeakPolarHBondContact OD1-CE 3.37Å; D190-K193 IonicContact OD1-NZ 3.92Å; D190-K193 PolarHBondContact OD1-NZ 3.32Å; R191-K193 PolarHBondContact O-N 2.87Å; K193-V197 VanDerWaalsContact O-CG2 3.25Å; K193-V197 WeakPolarHBondContact O-CG2 3.38Å
194	F	95.6	Very high	94.6	Very high	86 Å²	86	55.3 Å²	55.3	38%	0.377	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-50.2	179.3	54.8	-93.2	0	0	0	112.7	R191 K192 V196 V197 E198	R191-F194 HydrophobicContact CB-CZ 4.19Å; R191-F194 HydrophobicContact CG-CE1 4.47Å; R191-F194 HydrophobicContact CG-CE2 4.48Å; R191-F194 HydrophobicContact CG-CZ 3.86Å; R191-F194 PolarHBondContact O-N 2.98Å; R191-F194 VanDerWaalsContact O-N 3.11Å; K192-F194 VanDerWaalsContact C-N 3.29Å; K192-F194 PolarHBondContact O-N 3.18Å; F194-V196 PolarHBondContact O-N 3.5Å; F194-V197 PolarHBondContact O-N 3.39Å; F194-E198 HydrophobicContact CB-CG 4.36Å; F194-E198 PolarHBondContact O-N 3.28Å
195	D	96.1	Very high	94.4	Very high	34 Å²	34	59 Å²	59	18%	0.182	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-17.9	-178.1	-78.6	-25.1	0	0	0	114	F119 R191 P199	F119-D195 HydrophobicContact CD2-CB 3.39Å; F119-D195 WeakPolarHBondContact CD2-OD2 3.44Å; F119-D195 HydrophobicContact CE2-CB 3.85Å; F119-D195 HydrophobicContact CG-CB 4.17Å; R191-D195 IonicContact CZ-OD2 2.8Å; R191-D195 IonicContact NE-OD2 3.33Å; R191-D195 PolarHBondContact NE-OD2 3.02Å; R191-D195 IonicContact NH2-OD1 2.68Å; R191-D195 PolarHBondContact NH2-OD1 3.39Å; R191-D195 IonicContact NH2-OD2 3.41Å; R191-D195 PolarHBondContact NH2-OD2 2.96Å; R191-D195 WeakPolarHBondContact O-CB 3.22Å; R191-D195 PolarHBondContact O-N 2.8Å; D195-P199 WeakPolarHBondContact O-CG 3.46Å
196	V	95.9	Very high	94.1	Very high	18 Å²	18	59.7 Å²	59.7	11%	0.109	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-31.8	174.8	176.8	0	0	0	0	112.5	L36 L116 F119 K192 F194 V200	L36-V196 HydrophobicContact CD1-CG2 4.38Å; L36-V196 HydrophobicContact CD2-CB 4.47Å; L36-V196 HydrophobicContact CD2-CG1 3.69Å; L36-V196 HydrophobicContact CD2-CG2 3.93Å; L116-V196 HydrophobicContact CD2-CB 4.2Å; L116-V196 HydrophobicContact CD2-CG1 3.94Å; L116-V196 HydrophobicContact CD2-CG2 4.38Å; F119-V196 HydrophobicContact CD1-CG2 3.7Å; F119-V196 HydrophobicContact CE1-CG2 3.88Å; F119-V196 HydrophobicContact CG-CG2 4.15Å; F119-V196 HydrophobicContact CZ-CG2 4.47Å; K192-V196 HydrophobicContact CB-CG2 4.29Å; K192-V196 WeakPolarHBondContact O-CB 3.39Å; F194-V196 PolarHBondContact O-N 3.5Å; V196-V200 WeakPolarHBondContact O-CG2 3.38Å
197	V	96	Very high	93.7	Very high	81 Å²	81	59.5 Å²	59.5	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-85.3	-41.3	-172.9	-179.3	0	0	0	0	111.6	K193 F194 V200 L201	K193-V197 VanDerWaalsContact O-CG2 3.25Å; K193-V197 WeakPolarHBondContact O-CG2 3.38Å; F194-V197 PolarHBondContact O-N 3.39Å; V197-V200 PolarHBondContact O-N 2.7Å; V197-L201 WeakPolarHBondContact O-CB 3.27Å; V197-L201 PolarHBondContact O-N 3.48Å
198	E	96.5	Very high	93.5	Very high	116 Å²	116	62 Å²	62	54%	0.542	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-43.4	179.9	-64.7	172.9	170.3	0	0	112.8	F194 V200 L201 A202	F194-E198 HydrophobicContact CB-CG 4.36Å; F194-E198 PolarHBondContact O-N 3.28Å; E198-V200 VanDerWaalsContact C-N 3.31Å; E198-V200 PolarHBondContact O-N 2.88Å; E198-L201 PolarHBondContact O-N 3.24Å; E198-A202 WeakPolarHBondContact O-CB 3.37Å; E198-A202 PolarHBondContact O-N 2.74Å
199	P	96.7	Very high	93.2	Very high	10 Å²	10	65.1 Å²	65.1	7%	0.065	33%	0.332	C	S	.	.	H	α-helix	trans	-57.4	-40.1	172.7	-29.1	38.7	0	0	0	113.9	L111 L112 P115 L116 D195 F203	L111-P199 WeakPolarHBondContact O-CA 3.33Å; L111-P199 VanDerWaalsContact O-CB 3.3Å; L111-P199 WeakPolarHBondContact O-CB 3.44Å; L112-P199 HydrophobicContact CD1-CB 4.41Å; P115-P199 HydrophobicContact CB-CB 4.06Å; P115-P199 HydrophobicContact CB-CG 3.52Å; P115-P199 HydrophobicContact CG-CB 4.47Å; P115-P199 HydrophobicContact CG-CG 4.27Å; L116-P199 HydrophobicContact CD2-CB 4.23Å; L116-P199 HydrophobicContact CD2-CG 4.33Å; L116-P199 HydrophobicContact CG-CB 4.21Å; D195-P199 WeakPolarHBondContact O-CG 3.46Å; P199-F203 WeakPolarHBondContact O-CB 3.5Å; P199-F203 PolarHBondContact O-N 3.31Å; P199-F203 VanDerWaalsContact O-N 3.15Å
200	V	95.1	Very high	92.9	Very high	44 Å²	44	64.5 Å²	64.5	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-71	-43.3	178.8	175.5	0	0	0	0	110.5	L39 L112 L116 V196 V197 E198 F203 L204	L39-V200 HydrophobicContact CD2-CG2 4.21Å; L112-V200 HydrophobicContact CD1-CB 4.46Å; L112-V200 HydrophobicContact CD1-CG2 3.85Å; L116-V200 HydrophobicContact CD1-CG2 4.46Å; V196-V200 WeakPolarHBondContact O-CG2 3.38Å; V197-V200 PolarHBondContact O-N 2.7Å; E198-V200 VanDerWaalsContact C-N 3.31Å; E198-V200 PolarHBondContact O-N 2.88Å; V200-F203 PolarHBondContact O-N 3.46Å; V200-L204 HydrophobicContact CG1-CD1 3.98Å; V200-L204 HydrophobicContact CG1-CG 4.47Å; V200-L204 WeakPolarHBondContact O-CB 3.34Å; V200-L204 VanDerWaalsContact O-CG 3.32Å; V200-L204 WeakPolarHBondContact O-CG 3.29Å; V200-L204 PolarHBondContact O-N 2.91Å
201	L	94.6	Very high	92.6	Very high	112 Å²	112	64.4 Å²	64.4	59%	0.586	33%	0.329	S	S	*	.	H	α-helix	trans	-63.3	-45.1	177.1	-179.5	60.3	0	0	0	111.8	V197 E198 F203 L204 H205	V197-L201 WeakPolarHBondContact O-CB 3.27Å; V197-L201 PolarHBondContact O-N 3.48Å; E198-L201 PolarHBondContact O-N 3.24Å; L201-F203 VanDerWaalsContact C-N 3.34Å; L201-F203 PolarHBondContact O-N 2.71Å; L201-L204 PolarHBondContact O-N 3.14Å; L201-H205 WeakPolarHBondContact O-CB 3.34Å; L201-H205 PolarHBondContact O-N 3.05Å
202	A	92.9	Very high	92.3	Very high	38 Å²	38	65 Å²	65	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-40.1	177.3	0	0	0	0	0	112.2	E198 S206	E198-A202 WeakPolarHBondContact O-CB 3.37Å; E198-A202 PolarHBondContact O-N 2.74Å; A202-S206 WeakPolarHBondContact O-CB 3.44Å; A202-S206 PolarHBondContact O-N 3.48Å; A202-S206 PolarHBondContact O-OG 3.46Å
203	F	92.6	Very high	92	Very high	21 Å²	21	64.2 Å²	64.2	9%	0.092	34%	0.337	C	S	.	.	H	α-helix	trans	-68.9	-41.2	175.4	178.7	-113.2	0	0	0	113	V46 I47 A108 L112 P199 V200 L201 S206 I207	V46-F203 HydrophobicContact CG1-CE1 4.5Å; V46-F203 HydrophobicContact CG1-CZ 4.04Å; I47-F203 HydrophobicContact CG1-CE2 4.23Å; I47-F203 HydrophobicContact CG1-CZ 4.39Å; A108-F203 HydrophobicContact CB-CD2 3.89Å; A108-F203 HydrophobicContact CB-CE2 3.71Å; L112-F203 HydrophobicContact CB-CB 4.11Å; L112-F203 HydrophobicContact CB-CD2 4.43Å; L112-F203 HydrophobicContact CB-CG 4.2Å; L112-F203 HydrophobicContact CD1-CB 4.24Å; L112-F203 HydrophobicContact CD2-CD1 3.77Å; L112-F203 HydrophobicContact CD2-CD2 4.48Å; L112-F203 HydrophobicContact CD2-CE1 3.99Å; L112-F203 HydrophobicContact CD2-CG 4.02Å; L112-F203 HydrophobicContact CD2-CZ 4.44Å; L112-F203 HydrophobicContact CG-CG 4.49Å; P199-F203 WeakPolarHBondContact O-CB 3.5Å; P199-F203 PolarHBondContact O-N 3.31Å; P199-F203 VanDerWaalsContact O-N 3.15Å; V200-F203 PolarHBondContact O-N 3.46Å; L201-F203 VanDerWaalsContact C-N 3.34Å; L201-F203 PolarHBondContact O-N 2.71Å; F203-S206 WeakPolarHBondContact O-CB 3.28Å; F203-S206 PolarHBondContact O-N 2.78Å; F203-I207 HydrophobicContact CD1-CD1 4.18Å; F203-I207 HydrophobicContact CE1-CD1 3.68Å; F203-I207 HydrophobicContact CE2-CD1 4.1Å; F203-I207 HydrophobicContact CZ-CD1 3.64Å; F203-I207 PolarHBondContact O-N 3.04Å; F203-I207 VanDerWaalsContact O-N 3.13Å
204	L	91.3	Very high	91.8	Very high	93 Å²	93	59.4 Å²	59.4	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-65.4	-44.4	174.8	-72.4	172.1	0	0	0	111.8	V200 L201 S206 I207 L208	V200-L204 HydrophobicContact CG1-CD1 3.98Å; V200-L204 HydrophobicContact CG1-CG 4.47Å; V200-L204 WeakPolarHBondContact O-CB 3.34Å; V200-L204 VanDerWaalsContact O-CG 3.32Å; V200-L204 WeakPolarHBondContact O-CG 3.29Å; V200-L204 PolarHBondContact O-N 2.91Å; L201-L204 PolarHBondContact O-N 3.14Å; L204-S206 VanDerWaalsContact C-N 3.32Å; L204-S206 PolarHBondContact O-N 3.26Å; L204-I207 PolarHBondContact O-N 2.95Å; L204-L208 WeakPolarHBondContact O-CG 3.34Å; L204-L208 PolarHBondContact O-N 3.08Å
205	H	91	Very high	91.5	Very high	102 Å²	102	59.6 Å²	59.6	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-59.6	-43.5	174.8	-179.8	71.3	0	0	0	111.3	L201 I207 L208 T209	L201-H205 WeakPolarHBondContact O-CB 3.34Å; L201-H205 PolarHBondContact O-N 3.05Å; H205-I207 PolarHBondContact O-N 3.21Å; H205-L208 PolarHBondContact O-N 3.44Å; H205-L208 VanDerWaalsContact O-N 3.17Å; H205-T209 PolarHBondContact NE2-OG1 2.8Å; H205-T209 PolarHBondContact O-N 3.09Å; H205-T209 PolarHBondContact O-OG1 3.27Å
206	S	89.6	Confident	91.3	Very high	14 Å²	14	63.3 Å²	63.3	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-52.6	-51.7	173.7	-64.7	0	0	0	0	111.8	L104 A202 F203 L204 L208 T209 L210	L104-S206 WeakPolarHBondContact CD2-O 3.33Å; A202-S206 WeakPolarHBondContact O-CB 3.44Å; A202-S206 PolarHBondContact O-N 3.48Å; A202-S206 PolarHBondContact O-OG 3.46Å; F203-S206 WeakPolarHBondContact O-CB 3.28Å; F203-S206 PolarHBondContact O-N 2.78Å; L204-S206 VanDerWaalsContact C-N 3.32Å; L204-S206 PolarHBondContact O-N 3.26Å; S206-L208 VanDerWaalsContact C-N 3.33Å; S206-L208 PolarHBondContact O-N 3.11Å; S206-T209 PolarHBondContact O-N 3.22Å; S206-L210 PolarHBondContact O-N 3.3Å
207	I	86.5	Confident	90.9	Very high	49 Å²	49	62.8 Å²	62.8	25%	0.251	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-39.5	179.2	-68.9	169.8	0	0	0	111.8	F203 L204 H205 N211	F203-I207 HydrophobicContact CD1-CD1 4.18Å; F203-I207 HydrophobicContact CE1-CD1 3.68Å; F203-I207 HydrophobicContact CE2-CD1 4.1Å; F203-I207 HydrophobicContact CZ-CD1 3.64Å; F203-I207 PolarHBondContact O-N 3.04Å; F203-I207 VanDerWaalsContact O-N 3.13Å; L204-I207 PolarHBondContact O-N 2.95Å; H205-I207 PolarHBondContact O-N 3.21Å; I207-N211 VanDerWaalsContact O-CG 3.28Å; I207-N211 PolarHBondContact O-N 3.39Å; I207-N211 VanDerWaalsContact O-N 3.15Å; I207-N211 PolarHBondContact O-ND2 3.3Å
208	L	90	Very high	90.5	Very high	104 Å²	104	61.9 Å²	61.9	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-67.2	-43.5	178.4	-67.7	171.5	0	0	0	111.9	L204 H205 S206 L210 N211 N212	L204-L208 WeakPolarHBondContact O-CG 3.34Å; L204-L208 PolarHBondContact O-N 3.08Å; H205-L208 PolarHBondContact O-N 3.44Å; H205-L208 VanDerWaalsContact O-N 3.17Å; S206-L208 VanDerWaalsContact C-N 3.33Å; S206-L208 PolarHBondContact O-N 3.11Å; L208-L210 VanDerWaalsContact C-N 3.33Å; L208-L210 PolarHBondContact O-N 3.47Å; L208-N211 PolarHBondContact O-N 2.94Å; L208-N211 VanDerWaalsContact O-N 3.17Å; L208-N212 PolarHBondContact O-N 2.66Å
209	T	88.9	Confident	90.2	Very high	66 Å²	66	62.9 Å²	62.9	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-39.7	176.6	-63.7	0	0	0	0	111.8	H205 S206 N211 N212 L213	H205-T209 PolarHBondContact NE2-OG1 2.8Å; H205-T209 PolarHBondContact O-N 3.09Å; H205-T209 PolarHBondContact O-OG1 3.27Å; S206-T209 PolarHBondContact O-N 3.22Å; T209-N211 PolarHBondContact O-N 3.29Å; T209-N212 PolarHBondContact O-N 3.04Å; T209-L213 WeakPolarHBondContact O-CB 3.49Å; T209-L213 PolarHBondContact O-N 3.17Å
210	L	85.8	Confident	89.8	Confident	16 Å²	16	65.9 Å²	65.9	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-60.5	-42.2	172.3	170	64.8	0	0	0	113.2	R101 L104 S206 L208 T214	R101-L210 HydrophobicContact CB-CD1 3.76Å; R101-L210 HydrophobicContact CB-CD2 4.4Å; R101-L210 HydrophobicContact CG-CD1 3.99Å; R101-L210 HydrophobicContact CG-CD2 3.68Å; R101-L210 HydrophobicContact CG-CG 4.47Å; L104-L210 HydrophobicContact CD2-CB 3.69Å; L104-L210 HydrophobicContact CD2-CD2 4.22Å; L104-L210 HydrophobicContact CD2-CG 4.45Å; S206-L210 PolarHBondContact O-N 3.3Å; L208-L210 VanDerWaalsContact C-N 3.33Å; L208-L210 PolarHBondContact O-N 3.47Å; L210-T214 WeakPolarHBondContact O-CB 3.45Å; L210-T214 PolarHBondContact O-N 2.84Å; L210-T214 PolarHBondContact O-OG1 3.44Å
211	N	87.4	Confident	89.6	Confident	83 Å²	83	64.7 Å²	64.7	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-42.7	178.7	-69.1	-27.4	0	0	0	110.9	I207 L208 T209 T214 V215	I207-N211 VanDerWaalsContact O-CG 3.28Å; I207-N211 PolarHBondContact O-N 3.39Å; I207-N211 VanDerWaalsContact O-N 3.15Å; I207-N211 PolarHBondContact O-ND2 3.3Å; L208-N211 PolarHBondContact O-N 2.94Å; L208-N211 VanDerWaalsContact O-N 3.17Å; T209-N211 PolarHBondContact O-N 3.29Å; N211-T214 PolarHBondContact O-N 3.23Å; N211-V215 WeakPolarHBondContact O-CG2 3.48Å; N211-V215 PolarHBondContact O-N 3.49Å; N211-V215 VanDerWaalsContact O-N 3.1Å
212	N	89.4	Confident	89.4	Confident	97 Å²	97	63 Å²	63	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-47.8	175.9	-66.4	-11	0	0	0	111.5	L208 T209 T214 V215 E216	L208-N212 PolarHBondContact O-N 2.66Å; T209-N212 PolarHBondContact O-N 3.04Å; N212-T214 VanDerWaalsContact C-N 3.28Å; N212-T214 PolarHBondContact O-N 3.2Å; N212-V215 WeakPolarHBondContact O-CA 3.44Å; N212-V215 WeakPolarHBondContact O-CB 3.47Å; N212-V215 PolarHBondContact O-N 2.88Å; N212-E216 PolarHBondContact O-N 3.29Å
213	L	87.4	Confident	89.4	Confident	30 Å²	30	65.1 Å²	65.1	16%	0.157	35%	0.346	C	S	.	.	H	α-helix	trans	-56.9	-41.6	175.5	178.3	62.2	0	0	0	112	D100 T209 V215 E216 M217 F599	D100-L213 HydrophobicContact CB-CD2 3.93Å; T209-L213 WeakPolarHBondContact O-CB 3.49Å; T209-L213 PolarHBondContact O-N 3.17Å; L213-V215 VanDerWaalsContact C-N 3.3Å; L213-V215 PolarHBondContact O-N 3.41Å; L213-E216 PolarHBondContact O-N 3.36Å; L213-M217 HydrophobicContact CD1-CG 4.21Å; L213-M217 HydrophobicContact CD1-SD 4.13Å; L213-M217 HydrophobicContact CG-SD 4.03Å; L213-M217 WeakPolarHBondContact O-CB 3.45Å; L213-M217 VanDerWaalsContact O-CG 3.26Å; L213-M217 WeakPolarHBondContact O-CG 3.47Å; L213-M217 PolarHBondContact O-N 2.97Å; L213-F599 HydrophobicContact CD2-CZ 4.38Å
214	T	88.1	Confident	89.3	Confident	33 Å²	33	66.1 Å²	66.1	20%	0.202	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-36.9	176.2	-53.8	0	0	0	0	111.5	V97 L210 N211 N212 T218	V97-T214 HydrophobicContact CG1-CG2 4.09Å; L210-T214 WeakPolarHBondContact O-CB 3.45Å; L210-T214 PolarHBondContact O-N 2.84Å; L210-T214 PolarHBondContact O-OG1 3.44Å; N211-T214 PolarHBondContact O-N 3.23Å; N212-T214 VanDerWaalsContact C-N 3.28Å; N212-T214 PolarHBondContact O-N 3.2Å; T214-T218 WeakPolarHBondContact O-CB 3.23Å; T214-T218 PolarHBondContact O-N 2.81Å; T214-T218 VanDerWaalsContact O-N 3.08Å; T214-T218 PolarHBondContact O-OG1 3.46Å
215	V	90.6	Very high	89.2	Confident	91 Å²	91	66.1 Å²	66.1	55%	0.552	35%	0.346	S	S	*	.	H	α-helix	trans	-68.9	-47.1	174.8	172.3	0	0	0	0	111.3	N211 N212 L213 M217 T218 Q219	N211-V215 WeakPolarHBondContact O-CG2 3.48Å; N211-V215 PolarHBondContact O-N 3.49Å; N211-V215 VanDerWaalsContact O-N 3.1Å; N212-V215 WeakPolarHBondContact O-CA 3.44Å; N212-V215 WeakPolarHBondContact O-CB 3.47Å; N212-V215 PolarHBondContact O-N 2.88Å; L213-V215 VanDerWaalsContact C-N 3.3Å; L213-V215 PolarHBondContact O-N 3.41Å; V215-M217 PolarHBondContact O-N 2.84Å; V215-T218 PolarHBondContact O-N 2.87Å; V215-Q219 WeakPolarHBondContact O-CB 3.38Å; V215-Q219 PolarHBondContact O-N 3.22Å
216	E	90.4	Very high	89.2	Confident	112 Å²	112	67.5 Å²	67.5	52%	0.523	35%	0.352	S	S	.	.	H	α-helix	trans	-57.7	-46.4	177.8	-72.3	175.6	-167.8	0	0	111.8	N212 L213 T218 Q219 D220	N212-E216 PolarHBondContact O-N 3.29Å; L213-E216 PolarHBondContact O-N 3.36Å; E216-T218 PolarHBondContact O-N 2.96Å; E216-Q219 PolarHBondContact O-N 2.86Å; E216-Q219 VanDerWaalsContact O-N 3.15Å; E216-D220 PolarHBondContact O-N 3.15Å
217	M	88.1	Confident	89.1	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.03	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-38.6	176.4	-68.4	176.3	67.7	0	0	112.8	L93 E96 V97 L213 V215 Q219 D220 F221	L93-M217 HydrophobicContact CD1-CB 4.31Å; L93-M217 HydrophobicContact CD1-CE 4.4Å; E96-M217 HydrophobicContact CB-CE 3.51Å; E96-M217 HydrophobicContact CG-CE 3.33Å; V97-M217 HydrophobicContact CB-CE 4.38Å; V97-M217 HydrophobicContact CG2-CB 4.39Å; V97-M217 HydrophobicContact CG2-CE 3.5Å; V97-M217 VanDerWaalsContact CG2-CE 3.5Å; V97-M217 HydrophobicContact CG2-SD 3.81Å; L213-M217 HydrophobicContact CD1-CG 4.21Å; L213-M217 HydrophobicContact CD1-SD 4.13Å; L213-M217 HydrophobicContact CG-SD 4.03Å; L213-M217 WeakPolarHBondContact O-CB 3.45Å; L213-M217 VanDerWaalsContact O-CG 3.26Å; L213-M217 WeakPolarHBondContact O-CG 3.47Å; L213-M217 PolarHBondContact O-N 2.97Å; V215-M217 PolarHBondContact O-N 2.84Å; M217-Q219 VanDerWaalsContact C-N 3.25Å; M217-Q219 PolarHBondContact O-N 3.08Å; M217-D220 PolarHBondContact O-N 3.12Å; M217-F221 PolarHBondContact O-N 3.11Å; M217-F221 VanDerWaalsContact O-N 3.16Å
218	T	87.2	Confident	89.2	Confident	63 Å²	63	69 Å²	69	39%	0.387	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-31.2	174.7	-57	0	0	0	0	111.4	T214 V215 E216 M222	T214-T218 WeakPolarHBondContact O-CB 3.23Å; T214-T218 PolarHBondContact O-N 2.81Å; T214-T218 VanDerWaalsContact O-N 3.08Å; T214-T218 PolarHBondContact O-OG1 3.46Å; V215-T218 PolarHBondContact O-N 2.87Å; E216-T218 PolarHBondContact O-N 2.96Å; T218-M222 HydrophobicContact CG2-CE 4.29Å
219	Q	90.3	Very high	89.2	Confident	137 Å²	137	69.5 Å²	69.5	64%	0.64	36%	0.357	S	S	*	.	H	α-helix	trans	-77.3	-41	177.4	-172.6	167.3	-15.6	0	0	112.1	V215 E216 M217 F221 M222	V215-Q219 WeakPolarHBondContact O-CB 3.38Å; V215-Q219 PolarHBondContact O-N 3.22Å; E216-Q219 PolarHBondContact O-N 2.86Å; E216-Q219 VanDerWaalsContact O-N 3.15Å; M217-Q219 VanDerWaalsContact C-N 3.25Å; M217-Q219 PolarHBondContact O-N 3.08Å; Q219-F221 PolarHBondContact O-N 3.02Å; Q219-M222 WeakPolarHBondContact O-CB 3.26Å; Q219-M222 PolarHBondContact O-N 3.21Å; Q219-M222 VanDerWaalsContact O-N 3.13Å
220	D	88.9	Confident	89.1	Confident	72 Å²	72	71.6 Å²	71.6	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-53.5	-34.5	168.6	-96.3	-28.8	0	0	0	111.7	E216 M217 P223 R594 R597	E216-D220 PolarHBondContact O-N 3.15Å; M217-D220 PolarHBondContact O-N 3.12Å; D220-P223 WeakPolarHBondContact O-CD 3.2Å; D220-R594 IonicContact OD1-CZ 2.8Å; D220-R594 IonicContact OD1-NH1 2.66Å; D220-R594 IonicContact OD1-NH2 3.1Å; D220-R594 PolarHBondContact OD1-NH2 3.5Å; D220-R594 IonicContact OD2-CZ 2.67Å; D220-R594 IonicContact OD2-NH1 2.71Å; D220-R594 PolarHBondContact OD2-NH1 3.36Å; D220-R594 IonicContact OD2-NH2 2.97Å; D220-R594 PolarHBondContact OD2-NH2 2.84Å; D220-R594 VanDerWaalsContact OD2-NH2 3.12Å; D220-R597 IonicContact OD2-NH2 2.84Å; D220-R597 PolarHBondContact OD2-NH2 3.19Å
221	F	91.7	Very high	89.1	Confident	20 Å²	20	71.8 Å²	71.8	9%	0.088	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-11	-179.4	-165.6	-102.5	0	0	0	115	E89 F90 L93 M217 Q219 P223 Y224 K225 I591	E89-F221 HydrophobicContact CB-CE2 4.39Å; F90-F221 AromaticContact CD1-CE1 3.85Å; F90-F221 HydrophobicContact CD1-CE1 3.85Å; F90-F221 AromaticContact CD1-CZ 3.6Å; F90-F221 HydrophobicContact CD1-CZ 3.6Å; F90-F221 AromaticContact CE1-CE1 3.84Å; F90-F221 HydrophobicContact CE1-CE1 3.84Å; F90-F221 AromaticContact CE1-CZ 3.85Å; F90-F221 HydrophobicContact CE1-CZ 3.85Å; L93-F221 HydrophobicContact CB-CD2 4.39Å; L93-F221 HydrophobicContact CB-CE2 4.44Å; L93-F221 HydrophobicContact CD1-CB 4.27Å; L93-F221 HydrophobicContact CD1-CD2 4.39Å; L93-F221 HydrophobicContact CD1-CG 4.46Å; L93-F221 HydrophobicContact CD2-CB 4.05Å; L93-F221 HydrophobicContact CD2-CD1 3.83Å; L93-F221 HydrophobicContact CD2-CD2 3.96Å; L93-F221 HydrophobicContact CD2-CE1 4.25Å; L93-F221 HydrophobicContact CD2-CE2 4.36Å; L93-F221 HydrophobicContact CD2-CG 3.68Å; L93-F221 HydrophobicContact CD2-CZ 4.49Å; L93-F221 HydrophobicContact CG-CD2 4.48Å; M217-F221 PolarHBondContact O-N 3.11Å; M217-F221 VanDerWaalsContact O-N 3.16Å; Q219-F221 PolarHBondContact O-N 3.02Å; F221-P223 VanDerWaalsContact C-CD 3.48Å; F221-Y224 HydrophobicContact CE1-CD1 4.02Å; F221-Y224 AromaticContact CE2-CD1 3.68Å; F221-Y224 HydrophobicContact CE2-CD1 3.68Å; F221-Y224 HydrophobicContact CE2-CE1 4.34Å; F221-Y224 HydrophobicContact CE2-CG 4.28Å; F221-Y224 AromaticContact CZ-CD1 3.38Å; F221-Y224 HydrophobicContact CZ-CD1 3.38Å; F221-Y224 AromaticContact CZ-CE1 3.88Å; F221-Y224 HydrophobicContact CZ-CE1 3.88Å; F221-Y224 HydrophobicContact CZ-CG 4.36Å; F221-Y224 PolarHBondContact O-N 3.04Å; F221-K225 HydrophobicContact CD1-CB 4.32Å; F221-K225 HydrophobicContact CE1-CB 4.36Å; F221-K225 PolarHBondContact O-N 3.04Å; F221-K225 VanDerWaalsContact O-N 3.15Å; F221-I591 HydrophobicContact CD2-CD1 4.01Å; F221-I591 HydrophobicContact CE2-CD1 4.08Å
222	M	90.2	Very high	89.1	Confident	75 Å²	75	70.4 Å²	70.4	37%	0.369	36%	0.36	S	S	.	.	H	α-helix	trans	-59.2	-38.1	-176.5	-72.8	-69.9	-179.3	0	0	115.2	T218 Q219 K225 Q226	T218-M222 HydrophobicContact CG2-CE 4.29Å; Q219-M222 WeakPolarHBondContact O-CB 3.26Å; Q219-M222 PolarHBondContact O-N 3.21Å; Q219-M222 VanDerWaalsContact O-N 3.13Å; M222-K225 PolarHBondContact O-N 3.15Å; M222-K225 HydrophobicContact SD-CD 4.11Å; M222-Q226 WeakPolarHBondContact O-CG 3.47Å; M222-Q226 PolarHBondContact O-N 3.04Å
223	P	91.6	Very high	89	Confident	83 Å²	83	69.6 Å²	69.6	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-45.7	178.8	-22.8	34.9	0	0	0	112.6	D220 F221 K225 Q226 E227	D220-P223 WeakPolarHBondContact O-CD 3.2Å; F221-P223 VanDerWaalsContact C-CD 3.48Å; P223-K225 VanDerWaalsContact C-N 3.33Å; P223-K225 PolarHBondContact O-N 3.08Å; P223-Q226 WeakPolarHBondContact O-CB 3.37Å; P223-Q226 PolarHBondContact O-N 3.33Å; P223-Q226 VanDerWaalsContact O-N 3.12Å; P223-E227 PolarHBondContact O-N 3.09Å
224	Y	90.4	Very high	88.8	Confident	42 Å²	42	71.4 Å²	71.4	17%	0.165	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-44.9	176.5	178.3	-91.6	0	0	0	111.1	S86 E89 F221 Q226 E227 L228	S86-Y224 WeakPolarHBondContact CA-OH 3.41Å; S86-Y224 VanDerWaalsContact CB-OH 3.3Å; S86-Y224 WeakPolarHBondContact CB-OH 3.29Å; E89-Y224 HydrophobicContact CB-CE1 4.02Å; E89-Y224 HydrophobicContact CG-CE2 4.2Å; F221-Y224 HydrophobicContact CE1-CD1 4.02Å; F221-Y224 AromaticContact CE2-CD1 3.68Å; F221-Y224 HydrophobicContact CE2-CD1 3.68Å; F221-Y224 HydrophobicContact CE2-CE1 4.34Å; F221-Y224 HydrophobicContact CE2-CG 4.28Å; F221-Y224 AromaticContact CZ-CD1 3.38Å; F221-Y224 HydrophobicContact CZ-CD1 3.38Å; F221-Y224 AromaticContact CZ-CE1 3.88Å; F221-Y224 HydrophobicContact CZ-CE1 3.88Å; F221-Y224 HydrophobicContact CZ-CG 4.36Å; F221-Y224 PolarHBondContact O-N 3.04Å; Y224-Q226 VanDerWaalsContact C-N 3.29Å; Y224-Q226 PolarHBondContact O-N 3.08Å; Y224-E227 PolarHBondContact O-N 3.34Å; Y224-L228 HydrophobicContact CE1-CB 4.36Å; Y224-L228 HydrophobicContact CE1-CD2 4.08Å; Y224-L228 WeakPolarHBondContact O-CB 3.23Å; Y224-L228 PolarHBondContact O-N 3.4Å
225	K	90.3	Very high	88.5	Confident	93 Å²	93	71 Å²	71	40%	0.404	36%	0.361	S	S	.	.	H	α-helix	trans	-56.6	-40.7	174.3	176.3	-174	170.4	-170.9	0	112.3	F221 M222 P223 Q229	F221-K225 HydrophobicContact CD1-CB 4.32Å; F221-K225 HydrophobicContact CE1-CB 4.36Å; F221-K225 PolarHBondContact O-N 3.04Å; F221-K225 VanDerWaalsContact O-N 3.15Å; M222-K225 PolarHBondContact O-N 3.15Å; M222-K225 HydrophobicContact SD-CD 4.11Å; P223-K225 VanDerWaalsContact C-N 3.33Å; P223-K225 PolarHBondContact O-N 3.08Å; K225-Q229 WeakPolarHBondContact O-CB 3.49Å; K225-Q229 VanDerWaalsContact O-CG 3.26Å; K225-Q229 WeakPolarHBondContact O-CG 3.29Å; K225-Q229 PolarHBondContact O-N 2.91Å
226	Q	91.2	Very high	88.3	Confident	131 Å²	131	72.6 Å²	72.6	61%	0.612	36%	0.357	S	S	*	.	H	α-helix	trans	-67.8	-42.2	178.1	-72.7	173	-0.2	0	0	112.2	M222 P223 Y224 Q229 L230	M222-Q226 WeakPolarHBondContact O-CG 3.47Å; M222-Q226 PolarHBondContact O-N 3.04Å; P223-Q226 WeakPolarHBondContact O-CB 3.37Å; P223-Q226 PolarHBondContact O-N 3.33Å; P223-Q226 VanDerWaalsContact O-N 3.12Å; Y224-Q226 VanDerWaalsContact C-N 3.29Å; Y224-Q226 PolarHBondContact O-N 3.08Å; Q226-Q229 PolarHBondContact O-N 3.17Å; Q226-L230 PolarHBondContact O-N 3.22Å; Q226-L230 VanDerWaalsContact O-N 3.14Å
227	E	87.6	Confident	87.9	Confident	82 Å²	82	71 Å²	71	38%	0.383	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-42.7	176.1	-172.4	157.9	-142.2	0	0	111.5	P223 Y224 Q229 L230 S231 R586	P223-E227 PolarHBondContact O-N 3.09Å; Y224-E227 PolarHBondContact O-N 3.34Å; E227-Q229 PolarHBondContact O-N 3.28Å; E227-L230 WeakPolarHBondContact O-CB 3.37Å; E227-L230 PolarHBondContact O-N 3.35Å; E227-S231 PolarHBondContact O-N 3.21Å; E227-R586 IonicContact OE1-NH1 2.73Å
228	L	88.6	Confident	87.6	Confident	14 Å²	14	76.2 Å²	76.2	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-38.5	174	-177.4	65.7	0	0	0	112.7	F90 Y224 L230 S231 L232	F90-L228 HydrophobicContact CE1-CD2 3.98Å; F90-L228 HydrophobicContact CE2-CD2 4.29Å; F90-L228 HydrophobicContact CZ-CD2 3.43Å; F90-L228 VanDerWaalsContact CZ-CD2 3.43Å; Y224-L228 HydrophobicContact CE1-CB 4.36Å; Y224-L228 HydrophobicContact CE1-CD2 4.08Å; Y224-L228 WeakPolarHBondContact O-CB 3.23Å; Y224-L228 PolarHBondContact O-N 3.4Å; L228-L230 VanDerWaalsContact C-N 3.27Å; L228-L230 PolarHBondContact O-N 3.4Å; L228-S231 PolarHBondContact O-N 2.91Å; L228-L232 HydrophobicContact CD1-CD1 4.37Å; L228-L232 HydrophobicContact CD1-CG 4.25Å; L228-L232 HydrophobicContact CG-CD1 4.02Å; L228-L232 HydrophobicContact CG-CG 4.35Å; L228-L232 WeakPolarHBondContact O-CB 3.24Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.45Å; L228-L232 PolarHBondContact O-N 3.45Å
229	Q	89.6	Confident	87.4	Confident	114 Å²	114	80.9 Å²	80.9	53%	0.533	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-33.3	174.7	-77.9	-176.6	-85.2	0	0	112.3	K225 Q226 E227 Q233	K225-Q229 WeakPolarHBondContact O-CB 3.49Å; K225-Q229 VanDerWaalsContact O-CG 3.26Å; K225-Q229 WeakPolarHBondContact O-CG 3.29Å; K225-Q229 PolarHBondContact O-N 2.91Å; Q226-Q229 PolarHBondContact O-N 3.17Å; E227-Q229 PolarHBondContact O-N 3.28Å; Q229-Q233 PolarHBondContact O-N 2.68Å
230	L	87	Confident	87	Confident	109 Å²	109	79.9 Å²	79.9	57%	0.571	38%	0.383	S	S	*	.	H	α-helix	trans	-72.9	-45.6	173.7	-178.9	62.3	0	0	0	111.7	Q226 E227 L228 Q233 N234	Q226-L230 PolarHBondContact O-N 3.22Å; Q226-L230 VanDerWaalsContact O-N 3.14Å; E227-L230 WeakPolarHBondContact O-CB 3.37Å; E227-L230 PolarHBondContact O-N 3.35Å; L228-L230 VanDerWaalsContact C-N 3.27Å; L228-L230 PolarHBondContact O-N 3.4Å; L230-Q233 PolarHBondContact O-N 2.84Å; L230-Q233 VanDerWaalsContact O-N 3.15Å; L230-N234 PolarHBondContact O-N 2.94Å; L230-N234 PolarHBondContact O-ND2 3.27Å
231	S	85.4	Confident	86.6	Confident	21 Å²	21	79.3 Å²	79.3	15%	0.147	39%	0.385	C	S	.	.	H	α-helix	trans	-54.4	-53.7	173.4	163.2	0	0	0	0	111.2	E227 L228 Q233 N234 S235	E227-S231 PolarHBondContact O-N 3.21Å; L228-S231 PolarHBondContact O-N 2.91Å; S231-Q233 PolarHBondContact O-N 3.43Å; S231-Q233 VanDerWaalsContact O-N 3.13Å; S231-N234 WeakPolarHBondContact O-CA 3.43Å; S231-N234 WeakPolarHBondContact O-CB 3.36Å; S231-N234 PolarHBondContact O-N 3.38Å; S231-S235 PolarHBondContact O-N 2.96Å; S231-S235 PolarHBondContact O-OG 3.03Å; S231-S235 VanDerWaalsContact O-OG 3.09Å
232	L	87	Confident	86.1	Confident	54 Å²	54	82.4 Å²	82.4	28%	0.283	41%	0.406	S	S	.	.	H	α-helix	trans	-60.3	-25.6	178.2	-72.4	171.2	0	0	0	113.9	I83 L228 R236	I83-L232 HydrophobicContact CD1-CD2 4Å; I83-L232 HydrophobicContact CG1-CD2 3.98Å; L228-L232 HydrophobicContact CD1-CD1 4.37Å; L228-L232 HydrophobicContact CD1-CG 4.25Å; L228-L232 HydrophobicContact CG-CD1 4.02Å; L228-L232 HydrophobicContact CG-CG 4.35Å; L228-L232 WeakPolarHBondContact O-CB 3.24Å; L228-L232 VanDerWaalsContact O-CG 3.31Å; L228-L232 WeakPolarHBondContact O-CG 3.45Å; L228-L232 PolarHBondContact O-N 3.45Å; L232-R236 WeakPolarHBondContact O-CG 3.42Å; L232-R236 PolarHBondContact O-N 2.97Å; L232-R236 PolarHBondContact O-NH1 3.46Å
233	Q	86.7	Confident	85.9	Confident	79 Å²	79	80.8 Å²	80.8	37%	0.369	40%	0.401	S	S	.	.	H	α-helix	trans	-79.5	-38.5	172.7	-170.3	55.5	43.4	0	0	111.7	Q229 L230 S231 S235 R236 N237	Q229-Q233 PolarHBondContact O-N 2.68Å; L230-Q233 PolarHBondContact O-N 2.84Å; L230-Q233 VanDerWaalsContact O-N 3.15Å; S231-Q233 PolarHBondContact O-N 3.43Å; S231-Q233 VanDerWaalsContact O-N 3.13Å; Q233-S235 VanDerWaalsContact C-N 3.31Å; Q233-S235 PolarHBondContact O-N 3.39Å; Q233-R236 PolarHBondContact O-N 2.86Å; Q233-N237 PolarHBondContact NE2-OD1 2.87Å; Q233-N237 VanDerWaalsContact O-CG 3.27Å; Q233-N237 PolarHBondContact O-N 2.73Å; Q233-N237 VanDerWaalsContact O-N 3.1Å; Q233-N237 PolarHBondContact O-OD1 3.05Å
234	N	83.3	Confident	85.6	Confident	69 Å²	69	83.6 Å²	83.6	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-59.5	-43.2	171.9	-63.3	-23.8	0	0	0	110.8	L230 S231 R236 N237 H238	L230-N234 PolarHBondContact O-N 2.94Å; L230-N234 PolarHBondContact O-ND2 3.27Å; S231-N234 WeakPolarHBondContact O-CA 3.43Å; S231-N234 WeakPolarHBondContact O-CB 3.36Å; S231-N234 PolarHBondContact O-N 3.38Å; N234-R236 VanDerWaalsContact C-N 3.3Å; N234-R236 PolarHBondContact O-N 2.96Å; N234-N237 PolarHBondContact O-N 2.94Å; N234-H238 PolarHBondContact O-N 3.3Å; N234-H238 PolarHBondContact O-ND1 2.61Å
235	S	83.3	Confident	85.3	Confident	23 Å²	23	87.8 Å²	87.8	16%	0.161	43%	0.429	C	S	.	.	H	α-helix	trans	-60	-36.9	177	-47.2	0	0	0	0	113	D79 S231 Q233 Y239	D79-S235 VanDerWaalsContact CG-OG 3.24Å; D79-S235 WeakPolarHBondContact OD2-CA 3.43Å; D79-S235 WeakPolarHBondContact OD2-CB 3.37Å; D79-S235 PolarHBondContact OD2-OG 3.31Å; S231-S235 PolarHBondContact O-N 2.96Å; S231-S235 PolarHBondContact O-OG 3.03Å; S231-S235 VanDerWaalsContact O-OG 3.09Å; Q233-S235 VanDerWaalsContact C-N 3.31Å; Q233-S235 PolarHBondContact O-N 3.39Å; S235-Y239 WeakPolarHBondContact O-CB 3.23Å; S235-Y239 PolarHBondContact O-N 3.44Å
236	R	85.4	Confident	84.9	Confident	125 Å²	125	88.6 Å²	88.6	47%	0.472	44%	0.437	S	S	.	.	H	α-helix	trans	-64.7	-47	173.3	-71.3	178	-163.9	104.8	17.2	111.8	L232 Q233 N234 H238 Y239 E240	L232-R236 WeakPolarHBondContact O-CG 3.42Å; L232-R236 PolarHBondContact O-N 2.97Å; L232-R236 PolarHBondContact O-NH1 3.46Å; Q233-R236 PolarHBondContact O-N 2.86Å; N234-R236 VanDerWaalsContact C-N 3.3Å; N234-R236 PolarHBondContact O-N 2.96Å; R236-H238 VanDerWaalsContact C-N 3.3Å; R236-H238 PolarHBondContact O-N 3.02Å; R236-Y239 WeakPolarHBondContact O-CB 3.46Å; R236-Y239 PolarHBondContact O-N 2.97Å; R236-Y239 VanDerWaalsContact O-N 3.16Å; R236-E240 PolarHBondContact O-N 3.16Å
237	N	82.9	Confident	84.8	Confident	79 Å²	79	87.1 Å²	87.1	42%	0.422	43%	0.43	S	S	.	.	H	α-helix	trans	-62.6	-38.7	179.3	-59.2	5.9	0	0	0	111.3	Q233 N234 S241	Q233-N237 PolarHBondContact NE2-OD1 2.87Å; Q233-N237 VanDerWaalsContact O-CG 3.27Å; Q233-N237 PolarHBondContact O-N 2.73Å; Q233-N237 VanDerWaalsContact O-N 3.1Å; Q233-N237 PolarHBondContact O-OD1 3.05Å; N234-N237 PolarHBondContact O-N 2.94Å; N237-S241 PolarHBondContact O-N 2.93Å
238	H	81.2	Confident	84.8	Confident	116 Å²	116	87.8 Å²	87.8	54%	0.537	43%	0.433	S	S	.	.	H	α-helix	trans	-67.6	-39.5	173.3	-70	104.7	0	0	0	112.3	N234 R236 E240 S241 T242	N234-H238 PolarHBondContact O-N 3.3Å; N234-H238 PolarHBondContact O-ND1 2.61Å; R236-H238 VanDerWaalsContact C-N 3.3Å; R236-H238 PolarHBondContact O-N 3.02Å; H238-E240 VanDerWaalsContact C-N 3.34Å; H238-E240 PolarHBondContact O-N 3.21Å; H238-S241 PolarHBondContact O-N 2.93Å; H238-T242 VanDerWaalsContact O-CB 3.3Å; H238-T242 WeakPolarHBondContact O-CB 3.43Å; H238-T242 PolarHBondContact O-N 3.43Å; H238-T242 PolarHBondContact O-OG1 2.97Å
239	Y	84.1	Confident	84.4	Confident	160 Å²	160	90.5 Å²	90.5	63%	0.627	45%	0.447	S	S	*	.	H	α-helix	trans	-59.2	-44.1	174.7	168.6	-89.5	0	0	0	111.6	S235 R236 T242 C243	S235-Y239 WeakPolarHBondContact O-CB 3.23Å; S235-Y239 PolarHBondContact O-N 3.44Å; R236-Y239 WeakPolarHBondContact O-CB 3.46Å; R236-Y239 PolarHBondContact O-N 2.97Å; R236-Y239 VanDerWaalsContact O-N 3.16Å; Y239-T242 PolarHBondContact O-N 3.15Å; Y239-C243 VanDerWaalsContact CE2-SG 3.58Å; Y239-C243 WeakPolarHBondContact O-CB 3.4Å; Y239-C243 PolarHBondContact O-N 3.22Å; Y239-C243 PolarHBondContact O-SG 3.32Å; Y239-C243 VanDerWaalsContact O-SG 3.36Å
240	E	81.6	Confident	84.1	Confident	116 Å²	116	88.8 Å²	88.8	54%	0.542	44%	0.44	S	S	.	.	H	α-helix	trans	-59.6	-51.4	177.5	-71.4	168.9	178.2	0	0	111.1	R236 H238 T242 C243 E244	R236-E240 PolarHBondContact O-N 3.16Å; H238-E240 VanDerWaalsContact C-N 3.34Å; H238-E240 PolarHBondContact O-N 3.21Å; E240-T242 VanDerWaalsContact C-N 3.33Å; E240-T242 PolarHBondContact O-N 3.1Å; E240-C243 PolarHBondContact O-N 3.16Å; E240-E244 PolarHBondContact O-N 3.38Å
241	S	80.6	Confident	84.1	Confident	60 Å²	60	89.3 Å²	89.3	42%	0.42	44%	0.438	S	S	.	.	H	α-helix	trans	-59	-40.2	174.5	-168.1	0	0	0	0	112.9	N237 H238 C243 E244 E245	N237-S241 PolarHBondContact O-N 2.93Å; H238-S241 PolarHBondContact O-N 2.93Å; S241-C243 VanDerWaalsContact C-N 3.34Å; S241-E244 PolarHBondContact O-N 3.31Å; S241-E245 PolarHBondContact O-N 2.94Å
242	T	81	Confident	83.8	Confident	85 Å²	85	94 Å²	94	52%	0.521	45%	0.452	S	S	.	.	H	α-helix	trans	-69.2	-34.4	179.5	-54.6	0	0	0	0	111.3	H238 Y239 E240 L246	H238-T242 VanDerWaalsContact O-CB 3.3Å; H238-T242 WeakPolarHBondContact O-CB 3.43Å; H238-T242 PolarHBondContact O-N 3.43Å; H238-T242 PolarHBondContact O-OG1 2.97Å; Y239-T242 PolarHBondContact O-N 3.15Å; E240-T242 VanDerWaalsContact C-N 3.33Å; E240-T242 PolarHBondContact O-N 3.1Å; T242-L246 WeakPolarHBondContact O-CB 3.25Å; T242-L246 PolarHBondContact O-N 3.44Å
243	C	84.6	Confident	83.1	Confident	41 Å²	41	96.2 Å²	96.2	28%	0.277	46%	0.462	S	S	.	.	H	α-helix	trans	-68.4	-38.8	173.3	-76.4	0	0	0	0	112.1	Y239 E240 S241 L246 E247	Y239-C243 VanDerWaalsContact CE2-SG 3.58Å; Y239-C243 WeakPolarHBondContact O-CB 3.4Å; Y239-C243 PolarHBondContact O-N 3.22Å; Y239-C243 PolarHBondContact O-SG 3.32Å; Y239-C243 VanDerWaalsContact O-SG 3.36Å; E240-C243 PolarHBondContact O-N 3.16Å; S241-C243 VanDerWaalsContact C-N 3.34Å; C243-L246 PolarHBondContact O-N 2.83Å; C243-E247 VanDerWaalsContact O-CB 3.26Å; C243-E247 WeakPolarHBondContact O-CB 3.11Å; C243-E247 WeakPolarHBondContact O-CG 3.32Å; C243-E247 PolarHBondContact O-N 2.82Å
244	E	86.7	Confident	82.7	Confident	143 Å²	143	99.1 Å²	99.1	67%	0.668	47%	0.474	S	S	*	.	H	α-helix	trans	-63.4	-47.9	174.1	-69.9	-178.9	170.3	0	0	111.4	E240 S241 L246 E247 E248	E240-E244 PolarHBondContact O-N 3.38Å; S241-E244 PolarHBondContact O-N 3.31Å; E244-L246 PolarHBondContact O-N 2.77Å; E244-E247 PolarHBondContact O-N 2.57Å; E244-E248 WeakPolarHBondContact O-CB 3.34Å; E244-E248 PolarHBondContact O-N 3.22Å
245	E	82.9	Confident	82.4	Confident	130 Å²	130	101 Å²	101	61%	0.607	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-42.5	174.9	-74.6	-172.7	-151.9	0	0	112.7	S241 E248 L249	S241-E245 PolarHBondContact O-N 2.94Å; E245-E248 PolarHBondContact O-N 3.29Å; E245-L249 WeakPolarHBondContact O-CB 3.34Å; E245-L249 PolarHBondContact O-N 3.03Å
246	L	82.9	Confident	81.5	Confident	110 Å²	110	103.8 Å²	103.8	58%	0.576	50%	0.498	S	S	*	.	H	α-helix	trans	-68.9	-36.6	177.9	-178.8	60.9	0	0	0	111.8	T242 C243 E244 M250	T242-L246 WeakPolarHBondContact O-CB 3.25Å; T242-L246 PolarHBondContact O-N 3.44Å; C243-L246 PolarHBondContact O-N 2.83Å; E244-L246 PolarHBondContact O-N 2.77Å; L246-M250 WeakPolarHBondContact O-CB 3.43Å; L246-M250 PolarHBondContact O-N 2.96Å
247	E	89.4	Confident	80.4	Confident	99 Å²	99	100.5 Å²	100.5	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-41.8	171.2	-89.3	-153.7	-165.2	0	0	111.7	C243 E244 M250 K251	C243-E247 VanDerWaalsContact O-CB 3.26Å; C243-E247 WeakPolarHBondContact O-CB 3.11Å; C243-E247 WeakPolarHBondContact O-CG 3.32Å; C243-E247 PolarHBondContact O-N 2.82Å; E244-E247 PolarHBondContact O-N 2.57Å; E247-M250 HydrophobicContact CG-CE 4.15Å; E247-M250 PolarHBondContact O-N 3.25Å; E247-K251 WeakPolarHBondContact O-CB 3.37Å; E247-K251 VanDerWaalsContact O-CD 3.27Å; E247-K251 WeakPolarHBondContact O-CD 3.47Å; E247-K251 WeakPolarHBondContact O-CG 3.22Å; E247-K251 PolarHBondContact O-N 2.95Å; E247-K251 WeakPolarHBondContact OE2-CE 3.41Å; E247-K251 IonicContact OE2-NZ 3.78Å; E247-K251 PolarHBondContact OE2-NZ 2.91Å
248	E	86.3	Confident	79.2	Confident	96 Å²	96	100.1 Å²	100.1	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-66.8	-43	177.8	-157	-133.9	107.6	0	0	111.4	E244 E245 M250 K251 R252	E244-E248 WeakPolarHBondContact O-CB 3.34Å; E244-E248 PolarHBondContact O-N 3.22Å; E245-E248 PolarHBondContact O-N 3.29Å; E248-M250 VanDerWaalsContact C-N 3.35Å; E248-M250 PolarHBondContact O-N 3.14Å; E248-K251 PolarHBondContact O-N 3.45Å; E248-R252 WeakPolarHBondContact O-CB 3.49Å; E248-R252 PolarHBondContact O-N 3.3Å; E248-R252 IonicContact OE1-CZ 3.6Å; E248-R252 IonicContact OE1-NE 2.74Å; E248-R252 PolarHBondContact OE1-NE 3.44Å; E248-R252 IonicContact OE1-NH2 2.69Å; E248-R252 PolarHBondContact OE1-NH2 3.37Å; E248-R252 IonicContact OE2-NH2 2.92Å
249	L	80.4	Confident	78.1	Confident	71 Å²	71	99 Å²	99	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-60.5	-42.4	171	179.7	61.2	0	0	0	111.6	E245 R252 M253	E245-L249 WeakPolarHBondContact O-CB 3.34Å; E245-L249 PolarHBondContact O-N 3.03Å; L249-R252 PolarHBondContact O-N 3.27Å; L249-M253 HydrophobicContact CD1-CE 4.16Å; L249-M253 HydrophobicContact CD1-CG 4.22Å; L249-M253 HydrophobicContact CG-CG 4.45Å; L249-M253 WeakPolarHBondContact O-CB 3.3Å; L249-M253 VanDerWaalsContact O-CG 3.28Å; L249-M253 WeakPolarHBondContact O-CG 3.27Å; L249-M253 PolarHBondContact O-N 3.43Å
250	M	83.9	Confident	76.8	Confident	78 Å²	78	94.9 Å²	94.9	38%	0.384	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-42.6	174.4	176.6	-171.9	58.4	0	0	111.5	L246 E247 E248 R252 M253 K254	L246-M250 WeakPolarHBondContact O-CB 3.43Å; L246-M250 PolarHBondContact O-N 2.96Å; E247-M250 HydrophobicContact CG-CE 4.15Å; E247-M250 PolarHBondContact O-N 3.25Å; E248-M250 VanDerWaalsContact C-N 3.35Å; E248-M250 PolarHBondContact O-N 3.14Å; M250-R252 VanDerWaalsContact C-N 3.35Å; M250-M253 PolarHBondContact O-N 2.91Å; M250-K254 HydrophobicContact CG-CD 3.92Å; M250-K254 HydrophobicContact CG-CG 4.49Å; M250-K254 WeakPolarHBondContact O-CB 3.27Å; M250-K254 VanDerWaalsContact O-CG 3.28Å; M250-K254 WeakPolarHBondContact O-CG 3.49Å; M250-K254 PolarHBondContact O-N 2.9Å; M250-K254 PolarHBondContact SD-NZ 3.04Å
251	K	85.9	Confident	75.7	Confident	121 Å²	121	94.9 Å²	94.9	53%	0.526	48%	0.479	S	S	.	.	H	α-helix	trans	-62.5	-42	176.3	-71.2	156.5	-165.6	165	0	110.4	E247 E248 H255	E247-K251 WeakPolarHBondContact O-CB 3.37Å; E247-K251 VanDerWaalsContact O-CD 3.27Å; E247-K251 WeakPolarHBondContact O-CD 3.47Å; E247-K251 WeakPolarHBondContact O-CG 3.22Å; E247-K251 PolarHBondContact O-N 2.95Å; E247-K251 WeakPolarHBondContact OE2-CE 3.41Å; E247-K251 IonicContact OE2-NZ 3.78Å; E247-K251 PolarHBondContact OE2-NZ 2.91Å; E248-K251 PolarHBondContact O-N 3.45Å; K251-H255 PolarHBondContact O-N 2.79Å
252	R	80.6	Confident	74.5	Confident	118 Å²	118	98.4 Å²	98.4	45%	0.445	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-50.2	171.5	-79.5	-172.4	-93.1	141	-11.6	112.7	E248 L249 M250 K254 H255 Q258	E248-R252 WeakPolarHBondContact O-CB 3.49Å; E248-R252 PolarHBondContact O-N 3.3Å; E248-R252 IonicContact OE1-CZ 3.6Å; E248-R252 IonicContact OE1-NE 2.74Å; E248-R252 PolarHBondContact OE1-NE 3.44Å; E248-R252 IonicContact OE1-NH2 2.69Å; E248-R252 PolarHBondContact OE1-NH2 3.37Å; E248-R252 IonicContact OE2-NH2 2.92Å; L249-R252 PolarHBondContact O-N 3.27Å; M250-R252 VanDerWaalsContact C-N 3.35Å; R252-K254 VanDerWaalsContact C-N 3.27Å; R252-K254 PolarHBondContact O-N 3.04Å; R252-H255 WeakPolarHBondContact O-CB 3.28Å; R252-H255 PolarHBondContact O-N 3.03Å; R252-Q258 WeakPolarHBondContact O-CG 3.49Å
253	M	71.9	Confident	73.2	Confident	102 Å²	102	98.4 Å²	98.4	50%	0.502	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-28.4	-179.1	-73.9	-67.1	-170.1	0	0	113.2	L249 M250 H255 M262	L249-M253 HydrophobicContact CD1-CE 4.16Å; L249-M253 HydrophobicContact CD1-CG 4.22Å; L249-M253 HydrophobicContact CG-CG 4.45Å; L249-M253 WeakPolarHBondContact O-CB 3.3Å; L249-M253 VanDerWaalsContact O-CG 3.28Å; L249-M253 WeakPolarHBondContact O-CG 3.27Å; L249-M253 PolarHBondContact O-N 3.43Å; M250-M253 PolarHBondContact O-N 2.91Å; M253-H255 VanDerWaalsContact C-N 3.28Å; M253-M262 HydrophobicContact SD-SD 4.43Å
254	K	77.4	Confident	71.8	Confident	140 Å²	140	100.2 Å²	100.2	61%	0.609	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-8	172.6	-74	172.9	177.6	173.8	0	113.7	M250 R252	M250-K254 HydrophobicContact CG-CD 3.92Å; M250-K254 HydrophobicContact CG-CG 4.49Å; M250-K254 WeakPolarHBondContact O-CB 3.27Å; M250-K254 VanDerWaalsContact O-CG 3.28Å; M250-K254 WeakPolarHBondContact O-CG 3.49Å; M250-K254 PolarHBondContact O-N 2.9Å; M250-K254 PolarHBondContact SD-NZ 3.04Å; R252-K254 VanDerWaalsContact C-N 3.27Å; R252-K254 PolarHBondContact O-N 3.04Å
255	H	77.2	Confident	70.4	Confident	107 Å²	107	100.1 Å²	100.1	50%	0.495	50%	0.495	S	S	.	.	S	Bend	trans	-74.4	127.5	-178.7	-161	-92.9	0	0	0	110.8	K251 R252 M253 S257 Q258 I259	K251-H255 PolarHBondContact O-N 2.79Å; R252-H255 WeakPolarHBondContact O-CB 3.28Å; R252-H255 PolarHBondContact O-N 3.03Å; M253-H255 VanDerWaalsContact C-N 3.28Å; H255-S257 VanDerWaalsContact C-N 3.26Å; H255-S257 PolarHBondContact CE1-OG 2.94Å; H255-S257 PolarHBondContact ND1-OG 3.36Å; H255-S257 PolarHBondContact O-N 3.25Å; H255-S257 VanDerWaalsContact O-N 3.11Å; H255-Q258 HydrophobicContact CB-CG 4.48Å; H255-Q258 PolarHBondContact O-N 2.93Å; H255-I259 PolarHBondContact O-N 2.83Å
256	P	63.8	Low	69.2	Low	82 Å²	82	99.1 Å²	99.1	53%	0.532	49%	0.494	S	S	.	.	H	α-helix	trans	-54.1	-38.3	-173.5	-29.4	35.7	0	0	0	114.4	Q258 I259 S260	P256-Q258 VanDerWaalsContact C-N 3.28Å; P256-Q258 PolarHBondContact O-N 2.99Å; P256-I259 WeakPolarHBondContact O-CB 3.4Å; P256-I259 PolarHBondContact O-N 3.49Å; P256-S260 PolarHBondContact O-N 2.97Å; P256-S260 PolarHBondContact O-OG 3.36Å
257	S	62.8	Low	68.4	Low	56 Å²	56	96.2 Å²	96.2	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-68.7	-20	178.8	65.5	0	0	0	0	114.6	H255 K261	H255-S257 VanDerWaalsContact C-N 3.26Å; H255-S257 PolarHBondContact CE1-OG 2.94Å; H255-S257 PolarHBondContact ND1-OG 3.36Å; H255-S257 PolarHBondContact O-N 3.25Å; H255-S257 VanDerWaalsContact O-N 3.11Å; S257-K261 WeakPolarHBondContact O-CB 3.44Å; S257-K261 WeakPolarHBondContact O-CD 3.47Å; S257-K261 WeakPolarHBondContact O-CG 3.27Å; S257-K261 PolarHBondContact O-N 3.36Å
258	Q	57.5	Low	68.1	Low	72 Å²	72	92.2 Å²	92.2	34%	0.336	46%	0.463	S	S	.	.	H	α-helix	trans	-79.1	-38.3	170.7	-70.2	-75.1	51.9	0	0	111.1	R252 H255 P256 S260 K261 M262	R252-Q258 WeakPolarHBondContact O-CG 3.49Å; H255-Q258 HydrophobicContact CB-CG 4.48Å; H255-Q258 PolarHBondContact O-N 2.93Å; P256-Q258 VanDerWaalsContact C-N 3.28Å; P256-Q258 PolarHBondContact O-N 2.99Å; Q258-S260 PolarHBondContact O-N 3.24Å; Q258-K261 PolarHBondContact O-N 3.19Å; Q258-M262 WeakPolarHBondContact O-CG 3.47Å; Q258-M262 PolarHBondContact O-N 2.68Å
259	I	58.9	Low	68.3	Low	92 Å²	92	91.9 Å²	91.9	47%	0.472	46%	0.462	S	S	.	.	H	α-helix	trans	-59.5	-49	174.9	-58.2	174.1	0	0	0	109.9	H255 P256 K261 M262 Q263	H255-I259 PolarHBondContact O-N 2.83Å; P256-I259 WeakPolarHBondContact O-CB 3.4Å; P256-I259 PolarHBondContact O-N 3.49Å; I259-K261 VanDerWaalsContact C-N 3.32Å; I259-K261 PolarHBondContact O-N 3.49Å; I259-M262 PolarHBondContact O-N 3.01Å; I259-Q263 PolarHBondContact O-N 3.41Å
260	S	56.6	Low	68.7	Low	73 Å²	73	89.2 Å²	89.2	51%	0.51	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-33.9	176.5	-53	0	0	0	0	113.1	P256 Q258 Q263	P256-S260 PolarHBondContact O-N 2.97Å; P256-S260 PolarHBondContact O-OG 3.36Å; Q258-S260 PolarHBondContact O-N 3.24Å; S260-Q263 PolarHBondContact O-N 2.86Å
261	K	57.8	Low	69.1	Low	116 Å²	116	90.1 Å²	90.1	50%	0.504	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-36.3	174	-79.6	172.5	-179.2	-176.4	0	112.6	S257 Q258 I259 Q263 S264 F265	S257-K261 WeakPolarHBondContact O-CB 3.44Å; S257-K261 WeakPolarHBondContact O-CD 3.47Å; S257-K261 WeakPolarHBondContact O-CG 3.27Å; S257-K261 PolarHBondContact O-N 3.36Å; Q258-K261 PolarHBondContact O-N 3.19Å; I259-K261 VanDerWaalsContact C-N 3.32Å; I259-K261 PolarHBondContact O-N 3.49Å; K261-Q263 PolarHBondContact O-N 3.35Å; K261-S264 PolarHBondContact O-N 3.23Å; K261-S264 VanDerWaalsContact O-N 3.12Å; K261-S264 PolarHBondContact O-OG 3.09Å; K261-F265 WeakPolarHBondContact O-CD2 3.44Å; K261-F265 WeakPolarHBondContact O-CE2 3.36Å
262	M	55.7	Low	69.4	Low	135 Å²	135	84.4 Å²	84.4	67%	0.665	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-27.6	174.9	-71.1	-169.4	76.5	0	0	112.4	M253 Q258 I259 S264	M253-M262 HydrophobicContact SD-SD 4.43Å; Q258-M262 WeakPolarHBondContact O-CG 3.47Å; Q258-M262 PolarHBondContact O-N 2.68Å; I259-M262 PolarHBondContact O-N 3.01Å; M262-S264 VanDerWaalsContact C-N 3.3Å; M262-S264 PolarHBondContact O-N 3.3Å
263	Q	54.8	Low	70	Confident	84 Å²	84	82.6 Å²	82.6	39%	0.393	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-10.2	175.3	-64	-178.8	-66.2	0	0	114.3	I259 S260 K261 D355 L358	I259-Q263 PolarHBondContact O-N 3.41Å; S260-Q263 PolarHBondContact O-N 2.86Å; K261-Q263 PolarHBondContact O-N 3.35Å; Q263-D355 PolarHBondContact NE2-OD1 3.15Å; Q263-D355 VanDerWaalsContact NE2-OD1 3.11Å; Q263-L358 HydrophobicContact CB-CD1 4.18Å
264	S	55	Low	71	Confident	79 Å²	79	77.8 Å²	77.8	55%	0.552	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	8.7	-173.8	61.5	0	0	0	0	115.8	K261 M262	K261-S264 PolarHBondContact O-N 3.23Å; K261-S264 VanDerWaalsContact O-N 3.12Å; K261-S264 PolarHBondContact O-OG 3.09Å; M262-S264 VanDerWaalsContact C-N 3.3Å; M262-S264 PolarHBondContact O-N 3.3Å
265	F	57.4	Low	71.6	Confident	141 Å²	141	73.8 Å²	73.8	62%	0.618	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-98.7	147	179.4	-69.3	-79.6	0	0	0	112.9	K261	K261-F265 WeakPolarHBondContact O-CD2 3.44Å; K261-F265 WeakPolarHBondContact O-CE2 3.36Å
266	L	57.8	Low	72.1	Confident	110 Å²	110	71.2 Å²	71.2	58%	0.576	37%	0.368	S	S	*	.	S	Bend	trans	-97.7	145.4	169.3	-70.4	173.8	0	0	0	110.1	L268 A362	L266-L268 HydrophobicContact CD2-CB 4.18Å; L266-A362 HydrophobicContact CD2-CB 4.26Å
267	P	64.9	Low	72.9	Confident	49 Å²	49	76.5 Å²	76.5	32%	0.318	38%	0.383	S	S	.	.	S	Bend	cis	-66.1	140.4	-2.2	29.2	-35.7	0	0	0	112.2	E269 K290 Y291	P267-E269 PolarHBondContact O-N 2.58Å; P267-K290 HydrophobicContact CB-CG 4.46Å; P267-Y291 WeakPolarHBondContact CA-O 3.34Å; P267-Y291 WeakPolarHBondContact CB-O 3.34Å
268	L	84.3	Confident	73.5	Confident	15 Å²	15	80.3 Å²	80.3	8%	0.079	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	124.9	-177.4	-175.7	63.1	0	0	0	109.6	L266 K290 Y291 L358 W359 A362	L266-L268 HydrophobicContact CD2-CB 4.18Å; L268-K290 WeakPolarHBondContact O-CA 3.45Å; L268-Y291 PolarHBondContact N-O 2.78Å; L268-Y291 PolarHBondContact O-N 3.02Å; L268-L358 HydrophobicContact CD2-CB 4.45Å; L268-W359 HydrophobicContact CD2-CB 4.43Å; L268-W359 HydrophobicContact CD2-CD2 3.59Å; L268-W359 HydrophobicContact CD2-CE3 3.69Å; L268-W359 HydrophobicContact CD2-CG 3.94Å; L268-W359 HydrophobicContact CD2-CZ2 4.44Å; L268-W359 HydrophobicContact CD2-CZ3 4.17Å; L268-W359 HydrophobicContact CG-CD2 4.25Å; L268-W359 HydrophobicContact CG-CE3 4.27Å; L268-W359 HydrophobicContact CG-CH2 4.24Å; L268-W359 HydrophobicContact CG-CZ2 4.21Å; L268-W359 HydrophobicContact CG-CZ3 4.27Å; L268-A362 HydrophobicContact CB-CB 4.24Å; L268-A362 HydrophobicContact CD2-CB 3.73Å
269	E	89.6	Confident	74.1	Confident	88 Å²	88	82.1 Å²	82.1	41%	0.411	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.8	-175.9	-72.7	-174.4	-127	0	0	111.5	P267 F288 C289 K290	P267-E269 PolarHBondContact O-N 2.58Å; E269-F288 HydrophobicContact CB-CE1 4.37Å; E269-F288 HydrophobicContact CB-CZ 4Å; E269-C289 WeakPolarHBondContact CA-O 3.27Å; E269-K290 HydrophobicContact CG-CB 3.85Å; E269-K290 HydrophobicContact CG-CD 3.92Å; E269-K290 HydrophobicContact CG-CG 3.62Å; E269-K290 WeakPolarHBondContact OE1-CD 2.96Å; E269-K290 WeakPolarHBondContact OE1-CE 3.22Å; E269-K290 IonicContact OE1-NZ 2.75Å; E269-K290 PolarHBondContact OE1-NZ 2.9Å; E269-K290 IonicContact OE2-NZ 2.89Å
270	G	89	Confident	74.6	Confident	16 Å²	16	86.4 Å²	86.4	17%	0.165	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.5	179.1	179.9	0	0	0	0	0	114.1	C289	G270-C289 PolarHBondContact N-O 3.1Å; G270-C289 PolarHBondContact O-N 3.24Å
271	Y	92	Very high	75.5	Confident	97 Å²	97	85 Å²	85	38%	0.38	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.3	179.2	-66.2	-77.1	0	0	0	112.1	K286 Y287 F288	Y271-K286 HydrophobicContact CD1-CD 4.23Å; Y271-K286 HydrophobicContact CD1-CG 4.27Å; Y271-Y287 WeakPolarHBondContact CA-O 3.27Å; Y271-F288 HydrophobicContact CD1-CB 4.17Å; Y271-F288 HydrophobicContact CD1-CD2 4.01Å; Y271-F288 HydrophobicContact CD2-CD2 4.37Å; Y271-F288 HydrophobicContact CE1-CB 3.99Å; Y271-F288 AromaticContact CE1-CD2 3.78Å; Y271-F288 HydrophobicContact CE1-CD2 3.78Å; Y271-F288 HydrophobicContact CE1-CG 4.38Å; Y271-F288 HydrophobicContact CE2-CD2 4.14Å; Y271-F288 HydrophobicContact CG-CD2 4.31Å; Y271-F288 AromaticContact CZ-CD2 3.84Å
272	L	93.3	Very high	76.5	Confident	1 Å²	1	82.2 Å²	82.2	1%	0.005	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	147.1	168.2	-66	174.9	0	0	0	109.8	Y287 C289 F335 F348 A350 W359	L272-Y287 PolarHBondContact N-O 2.81Å; L272-Y287 VanDerWaalsContact N-O 3.07Å; L272-Y287 PolarHBondContact O-N 2.94Å; L272-C289 HydrophobicContact CD1-CB 4.14Å; L272-C289 HydrophobicContact CG-CB 4.4Å; L272-F335 HydrophobicContact CD1-CZ 3.92Å; L272-F335 HydrophobicContact CD2-CE1 3.99Å; L272-F335 HydrophobicContact CD2-CZ 4.01Å; L272-F348 HydrophobicContact CB-CD1 3.94Å; L272-F348 HydrophobicContact CD1-CB 4.49Å; L272-F348 HydrophobicContact CD1-CD1 3.98Å; L272-F348 HydrophobicContact CD1-CE1 4.48Å; L272-F348 HydrophobicContact CD1-CG 4.31Å; L272-A350 HydrophobicContact CD2-CB 4.15Å; L272-W359 HydrophobicContact CD1-CD2 3.95Å; L272-W359 HydrophobicContact CD1-CE3 4.1Å; L272-W359 HydrophobicContact CD1-CH2 4.31Å; L272-W359 HydrophobicContact CD1-CZ2 4.16Å; L272-W359 HydrophobicContact CD1-CZ3 4.26Å; L272-W359 HydrophobicContact CD2-CD2 4.27Å; L272-W359 HydrophobicContact CD2-CG 4.16Å; L272-W359 HydrophobicContact CG-CD2 4.37Å; L272-W359 HydrophobicContact CG-CZ2 4.19Å
273	Y	92.9	Very high	78	Confident	79 Å²	79	77 Å²	77	31%	0.31	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.9	166.5	-69	-93.4	0	0	0	109.2	V285 K286 F348 Q349 L351	Y273-V285 WeakPolarHBondContact CA-O 3.42Å; Y273-K286 HydrophobicContact CD1-CB 3.89Å; Y273-K286 HydrophobicContact CD1-CG 4.24Å; Y273-K286 HydrophobicContact CE1-CB 3.58Å; Y273-K286 HydrophobicContact CE1-CD 4.24Å; Y273-K286 HydrophobicContact CE1-CG 3.78Å; Y273-K286 HydrophobicContact CE2-CG 4.35Å; Y273-F348 CarbonylContact O-C 3.58Å; Y273-F348 WeakPolarHBondContact O-CA 3.23Å; Y273-Q349 PolarHBondContact N-O 2.95Å; Y273-Q349 PolarHBondContact O-N 2.6Å; Y273-L351 HydrophobicContact CD2-CD2 4.39Å; Y273-L351 HydrophobicContact CE2-CD2 3.93Å
274	C	92.4	Very high	79.6	Confident	1 Å²	1	76 Å²	76	1%	0.007	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	135.5	177	177.1	0	0	0	0	109.9	E276 W284 V285 Y287 M300 V346 F348	C274-E276 PolarHBondContact O-N 3.45Å; C274-W284 WeakPolarHBondContact O-CA 3.36Å; C274-V285 PolarHBondContact N-O 3.35Å; C274-V285 PolarHBondContact O-N 3.45Å; C274-Y287 HydrophobicContact CB-CD2 3.75Å; C274-Y287 HydrophobicContact CB-CE2 3.75Å; C274-M300 HydrophobicContact CB-CE 3.97Å; C274-V346 WeakPolarHBondContact SG-CG1 3.45Å; C274-F348 HydrophobicContact CB-CD1 4.11Å; C274-F348 HydrophobicContact CB-CE1 3.86Å
275	Q	90.4	Very high	81.3	Confident	57 Å²	57	72.5 Å²	72.5	27%	0.266	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	103.5	173.8	-166.1	178.1	31.8	0	0	110.7	A282 W284 T347	Q275-A282 HydrophobicContact CG-CB 3.95Å; Q275-W284 HydrophobicContact CB-CD2 4.3Å; Q275-W284 HydrophobicContact CB-CE3 4.04Å; Q275-W284 HydrophobicContact CB-CH2 3.92Å; Q275-W284 HydrophobicContact CB-CZ2 4.13Å; Q275-W284 HydrophobicContact CB-CZ3 3.85Å; Q275-W284 HydrophobicContact CG-CH2 4.42Å; Q275-W284 HydrophobicContact CG-CZ2 4.15Å; Q275-T347 PolarHBondContact N-O 2.93Å
276	E	87.4	Confident	83	Confident	52 Å²	52	68.6 Å²	68.6	24%	0.243	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	142.7	172.2	-61.8	-159.1	125.5	0	0	111.7	C274 R278 A282 S283 V285 Y287	C274-E276 PolarHBondContact O-N 3.45Å; E276-R278 IonicContact OE2-CZ 2.65Å; E276-R278 IonicContact OE2-NE 3.99Å; E276-R278 IonicContact OE2-NH2 3.6Å; E276-R278 PolarHBondContact OE2-NH2 3.25Å; E276-A282 CarbonylContact O-C 3.59Å; E276-A282 VanDerWaalsContact O-CA 3.28Å; E276-A282 WeakPolarHBondContact O-CA 3.39Å; E276-S283 PolarHBondContact N-O 3.1Å; E276-S283 PolarHBondContact O-N 2.92Å; E276-V285 HydrophobicContact CG-CB 4.4Å; E276-V285 HydrophobicContact CG-CG2 4.02Å; E276-V285 WeakPolarHBondContact OE2-CG2 3.4Å; E276-Y287 PolarHBondContact OE1-OH 3.1Å
277	K	79.4	Confident	84.6	Confident	194 Å²	194	64.2 Å²	64.2	84%	0.843	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.5	168.7	-66.9	-177.4	179.6	179.9	0	109.5
278	R	76.1	Confident	85.9	Confident	135 Å²	135	65.4 Å²	65.4	51%	0.509	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	167.1	172.5	-62.9	-173.8	179.1	170.6	6.3	109.6	E276 L280 G281 S283 V285	E276-R278 IonicContact OE2-CZ 2.65Å; E276-R278 IonicContact OE2-NE 3.99Å; E276-R278 IonicContact OE2-NH2 3.6Å; E276-R278 PolarHBondContact OE2-NH2 3.25Å; R278-L280 PolarHBondContact O-N 3.16Å; R278-G281 CarbonylContact C-O 3.58Å; R278-G281 WeakPolarHBondContact CA-O 3.44Å; R278-G281 PolarHBondContact N-O 2.92Å; R278-G281 PolarHBondContact O-N 3.41Å; R278-G281 VanDerWaalsContact O-N 3.11Å; R278-G281 VanDerWaalsContact O-O 3.04Å; R278-S283 VanDerWaalsContact CD-OG 3.24Å; R278-S283 WeakPolarHBondContact CD-OG 3.45Å; R278-S283 PolarHBondContact NE-OG 3.18Å; R278-V285 VanDerWaalsContact NH2-CG2 3.26Å
279	A	70.4	Confident	86.3	Confident	110 Å²	110	64.7 Å²	64.7	91%	0.909	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.5	-174.3	0	0	0	0	0	115
280	L	68.6	Low	86.4	Confident	183 Å²	183	63.5 Å²	63.5	96%	0.958	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	26.5	179.5	-64.8	173.2	0	0	0	112.8	R278	R278-L280 PolarHBondContact O-N 3.16Å
281	G	75.5	Confident	86.5	Confident	44 Å²	44	62.8 Å²	62.8	45%	0.454	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.5	-168.3	175.2	0	0	0	0	0	114.2	R278	R278-G281 CarbonylContact C-O 3.58Å; R278-G281 WeakPolarHBondContact CA-O 3.44Å; R278-G281 PolarHBondContact N-O 2.92Å; R278-G281 PolarHBondContact O-N 3.41Å; R278-G281 VanDerWaalsContact O-N 3.11Å; R278-G281 VanDerWaalsContact O-O 3.04Å
282	A	80.5	Confident	86.4	Confident	57 Å²	57	61 Å²	61	47%	0.471	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.7	-179.3	0	0	0	0	0	112	Q275 E276	Q275-A282 HydrophobicContact CG-CB 3.95Å; E276-A282 CarbonylContact O-C 3.59Å; E276-A282 VanDerWaalsContact O-CA 3.28Å; E276-A282 WeakPolarHBondContact O-CA 3.39Å
283	S	86.6	Confident	85.9	Confident	26 Å²	26	64.8 Å²	64.8	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.3	176.1	57.4	0	0	0	0	111	E276 R278	E276-S283 PolarHBondContact N-O 3.1Å; E276-S283 PolarHBondContact O-N 2.92Å; R278-S283 VanDerWaalsContact CD-OG 3.24Å; R278-S283 WeakPolarHBondContact CD-OG 3.45Å; R278-S283 PolarHBondContact NE-OG 3.18Å
284	W	88.5	Confident	85.3	Confident	62 Å²	62	67.9 Å²	67.9	24%	0.235	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.9	174.6	-66.8	91.3	0	0	0	110.1	C274 Q275 I329 K331 T347 Q349	C274-W284 WeakPolarHBondContact O-CA 3.36Å; Q275-W284 HydrophobicContact CB-CD2 4.3Å; Q275-W284 HydrophobicContact CB-CE3 4.04Å; Q275-W284 HydrophobicContact CB-CH2 3.92Å; Q275-W284 HydrophobicContact CB-CZ2 4.13Å; Q275-W284 HydrophobicContact CB-CZ3 3.85Å; Q275-W284 HydrophobicContact CG-CH2 4.42Å; Q275-W284 HydrophobicContact CG-CZ2 4.15Å; W284-I329 HydrophobicContact CH2-CD1 4.09Å; W284-I329 HydrophobicContact CZ2-CD1 3.77Å; W284-K331 HydrophobicContact CZ2-CB 4.25Å; W284-K331 HydrophobicContact CZ2-CG 3.71Å; W284-T347 HydrophobicContact CH2-CG2 3.9Å; W284-Q349 HydrophobicContact CE3-CB 4.16Å; W284-Q349 HydrophobicContact CH2-CB 4.14Å; W284-Q349 HydrophobicContact CZ3-CB 3.63Å
285	V	90.3	Very high	84.8	Confident	5 Å²	5	70.4 Å²	70.4	3%	0.03	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.3	-179.3	179.5	0	0	0	0	109.8	Y273 C274 E276 R278 Y287	Y273-V285 WeakPolarHBondContact CA-O 3.42Å; C274-V285 PolarHBondContact N-O 3.35Å; C274-V285 PolarHBondContact O-N 3.45Å; E276-V285 HydrophobicContact CG-CB 4.4Å; E276-V285 HydrophobicContact CG-CG2 4.02Å; E276-V285 WeakPolarHBondContact OE2-CG2 3.4Å; R278-V285 VanDerWaalsContact NH2-CG2 3.26Å; V285-Y287 HydrophobicContact CB-CE2 3.76Å; V285-Y287 HydrophobicContact CG1-CD2 4.29Å; V285-Y287 HydrophobicContact CG1-CE2 3.58Å; V285-Y287 WeakPolarHBondContact O-CD2 3.47Å
286	K	92.1	Very high	84.7	Confident	59 Å²	59	72.4 Å²	72.4	26%	0.257	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.6	-176.5	-163.6	-171.5	-176.2	-159.8	0	111.2	Y271 Y273 C303	Y271-K286 HydrophobicContact CD1-CD 4.23Å; Y271-K286 HydrophobicContact CD1-CG 4.27Å; Y273-K286 HydrophobicContact CD1-CB 3.89Å; Y273-K286 HydrophobicContact CD1-CG 4.24Å; Y273-K286 HydrophobicContact CE1-CB 3.58Å; Y273-K286 HydrophobicContact CE1-CD 4.24Å; Y273-K286 HydrophobicContact CE1-CG 3.78Å; Y273-K286 HydrophobicContact CE2-CG 4.35Å; K286-C303 HydrophobicContact CB-CB 4.38Å; K286-C303 HydrophobicContact CD-CB 4.49Å; K286-C303 WeakPolarHBondContact O-CB 3.48Å; K286-C303 PolarHBondContact O-N 2.89Å; K286-C303 VanDerWaalsContact O-N 3.17Å
287	Y	92.4	Very high	84.9	Confident	18 Å²	18	73.7 Å²	73.7	7%	0.071	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	146.4	172.5	-66.3	-92.4	0	0	0	110.5	Y271 L272 C274 E276 V285 M300 V301	Y271-Y287 WeakPolarHBondContact CA-O 3.27Å; L272-Y287 PolarHBondContact N-O 2.81Å; L272-Y287 VanDerWaalsContact N-O 3.07Å; L272-Y287 PolarHBondContact O-N 2.94Å; C274-Y287 HydrophobicContact CB-CD2 3.75Å; C274-Y287 HydrophobicContact CB-CE2 3.75Å; E276-Y287 PolarHBondContact OE1-OH 3.1Å; V285-Y287 HydrophobicContact CB-CE2 3.76Å; V285-Y287 HydrophobicContact CG1-CD2 4.29Å; V285-Y287 HydrophobicContact CG1-CE2 3.58Å; V285-Y287 WeakPolarHBondContact O-CD2 3.47Å; Y287-M300 HydrophobicContact CD1-CB 3.83Å; Y287-M300 HydrophobicContact CD1-CE 3.84Å; Y287-M300 HydrophobicContact CD2-CE 3.46Å; Y287-M300 VanDerWaalsContact CD2-CE 3.46Å; Y287-M300 HydrophobicContact CE1-CE 4.2Å; Y287-M300 HydrophobicContact CE2-CE 3.84Å; Y287-M300 HydrophobicContact CG-CB 4.19Å; Y287-M300 HydrophobicContact CG-CE 3.47Å; Y287-M300 VanDerWaalsContact CG-CE 3.47Å; Y287-V301 CarbonylContact C-O 3.58Å; Y287-V301 VanDerWaalsContact CA-O 3.3Å; Y287-V301 WeakPolarHBondContact CA-O 3.4Å
288	F	92.2	Very high	85.5	Confident	75 Å²	75	64.6 Å²	64.6	33%	0.329	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.4	155	-170.6	-98.2	0	0	0	107.5	E269 Y271 V301	E269-F288 HydrophobicContact CB-CE1 4.37Å; E269-F288 HydrophobicContact CB-CZ 4Å; Y271-F288 HydrophobicContact CD1-CB 4.17Å; Y271-F288 HydrophobicContact CD1-CD2 4.01Å; Y271-F288 HydrophobicContact CD2-CD2 4.37Å; Y271-F288 HydrophobicContact CE1-CB 3.99Å; Y271-F288 AromaticContact CE1-CD2 3.78Å; Y271-F288 HydrophobicContact CE1-CD2 3.78Å; Y271-F288 HydrophobicContact CE1-CG 4.38Å; Y271-F288 HydrophobicContact CE2-CD2 4.14Å; Y271-F288 HydrophobicContact CG-CD2 4.31Å; Y271-F288 AromaticContact CZ-CD2 3.84Å; F288-V301 PolarHBondContact N-O 3.16Å; F288-V301 PolarHBondContact O-N 3.06Å
289	C	92.4	Very high	86.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.3	-171.4	-67.4	0	0	0	0	110.2	E269 G270 L272 L298 I299 W359	E269-C289 WeakPolarHBondContact CA-O 3.27Å; G270-C289 PolarHBondContact N-O 3.1Å; G270-C289 PolarHBondContact O-N 3.24Å; L272-C289 HydrophobicContact CD1-CB 4.14Å; L272-C289 HydrophobicContact CG-CB 4.4Å; C289-L298 HydrophobicContact CB-CD1 4.08Å; C289-I299 CarbonylContact C-O 3.57Å; C289-I299 VanDerWaalsContact CA-O 3.32Å; C289-I299 WeakPolarHBondContact CA-O 3.43Å; C289-W359 HydrophobicContact CB-CH2 3.77Å; C289-W359 HydrophobicContact CB-CZ2 4.22Å
290	K	92	Very high	87.3	Confident	63 Å²	63	55.3 Å²	55.3	27%	0.274	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.5	175.4	177.1	165.4	-173.1	143	0	109.2	P267 L268 E269 H292 I299	P267-K290 HydrophobicContact CB-CG 4.46Å; L268-K290 WeakPolarHBondContact O-CA 3.45Å; E269-K290 HydrophobicContact CG-CB 3.85Å; E269-K290 HydrophobicContact CG-CD 3.92Å; E269-K290 HydrophobicContact CG-CG 3.62Å; E269-K290 WeakPolarHBondContact OE1-CD 2.96Å; E269-K290 WeakPolarHBondContact OE1-CE 3.22Å; E269-K290 IonicContact OE1-NZ 2.75Å; E269-K290 PolarHBondContact OE1-NZ 2.9Å; E269-K290 IonicContact OE2-NZ 2.89Å; K290-H292 VanDerWaalsContact CE-NE2 3.27Å; K290-H292 WeakPolarHBondContact CE-NE2 3.46Å; K290-I299 PolarHBondContact N-O 3.43Å; K290-I299 PolarHBondContact O-N 2.98Å
291	Y	90.9	Very high	88.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	119.4	-179.6	178.1	-102.3	0	0	0	112.3	P267 L268 K293 M297 L298 L318 A362 M363	P267-Y291 WeakPolarHBondContact CA-O 3.34Å; P267-Y291 WeakPolarHBondContact CB-O 3.34Å; L268-Y291 PolarHBondContact N-O 2.78Å; L268-Y291 PolarHBondContact O-N 3.02Å; Y291-K293 HydrophobicContact CE1-CB 3.94Å; Y291-K293 HydrophobicContact CE1-CG 4.32Å; Y291-M297 WeakPolarHBondContact CA-O 3.4Å; Y291-L298 HydrophobicContact CD2-CB 4.28Å; Y291-L298 HydrophobicContact CD2-CD1 4.49Å; Y291-L318 HydrophobicContact CE2-CB 4.25Å; Y291-L318 HydrophobicContact CE2-CD1 4.39Å; Y291-A362 HydrophobicContact CD1-CB 4.28Å; Y291-A362 WeakPolarHBondContact CE1-O 3.36Å; Y291-M363 HydrophobicContact CD2-CE 4.16Å; Y291-M363 HydrophobicContact CD2-CG 4.39Å; Y291-M363 HydrophobicContact CE1-CG 4.4Å; Y291-M363 HydrophobicContact CE2-CG 4.26Å; Y291-M363 HydrophobicContact CG-CE 4.43Å; Y291-M363 HydrophobicContact CG-CG 4.49Å
292	H	89.4	Confident	88.9	Confident	61 Å²	61	48.6 Å²	48.6	28%	0.282	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	112.6	170.9	-68.6	-95	0	0	0	108.9	K290 D294 R296 M297	K290-H292 VanDerWaalsContact CE-NE2 3.27Å; K290-H292 WeakPolarHBondContact CE-NE2 3.46Å; H292-D294 VanDerWaalsContact C-N 3.29Å; H292-D294 PolarHBondContact O-N 2.75Å; H292-R296 CarbonylContact O-C 3.3Å; H292-R296 VanDerWaalsContact O-CA 3.31Å; H292-R296 WeakPolarHBondContact O-CA 3.37Å; H292-R296 PolarHBondContact O-N 2.91Å; H292-M297 PolarHBondContact N-O 3.46Å; H292-M297 PolarHBondContact O-N 2.79Å
293	K	83.8	Confident	88.7	Confident	80 Å²	80	49.1 Å²	49.1	35%	0.348	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-38.9	176.8	-168.7	159.2	-171.5	148.5	0	111	Y291 G295 R296 D364	Y291-K293 HydrophobicContact CE1-CB 3.94Å; Y291-K293 HydrophobicContact CE1-CG 4.32Å; K293-G295 PolarHBondContact O-N 3.4Å; K293-R296 PolarHBondContact O-N 3.34Å; K293-D364 WeakPolarHBondContact CE-OD1 3.2Å; K293-D364 IonicContact NZ-OD1 2.61Å; K293-D364 PolarHBondContact NZ-OD1 3.45Å; K293-D364 IonicContact NZ-OD2 2.72Å
294	D	79.4	Confident	87.9	Confident	143 Å²	143	53.9 Å²	53.9	77%	0.765	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.3	113.7	167.7	-54.7	-53.8	0	0	0	110.1	H292 R296	H292-D294 VanDerWaalsContact C-N 3.29Å; H292-D294 PolarHBondContact O-N 2.75Å; D294-R296 VanDerWaalsContact C-N 3.28Å; D294-R296 PolarHBondContact O-N 3.34Å
295	G	81.8	Confident	86.5	Confident	54 Å²	54	58.1 Å²	58.1	56%	0.557	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	80.1	-2.1	-173	0	0	0	0	0	115.4	K293 M297	K293-G295 PolarHBondContact O-N 3.4Å; G295-M297 VanDerWaalsContact C-N 3.27Å; G295-M297 PolarHBondContact O-N 3.01Å
296	R	89.7	Confident	84.9	Confident	100 Å²	100	65.8 Å²	65.8	38%	0.377	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	54.3	36.6	178	-64.2	-175.4	163.3	-160.7	-11	114.3	H292 K293 D294 L318 D364	H292-R296 CarbonylContact O-C 3.3Å; H292-R296 VanDerWaalsContact O-CA 3.31Å; H292-R296 WeakPolarHBondContact O-CA 3.37Å; H292-R296 PolarHBondContact O-N 2.91Å; K293-R296 PolarHBondContact O-N 3.34Å; D294-R296 VanDerWaalsContact C-N 3.28Å; D294-R296 PolarHBondContact O-N 3.34Å; R296-L318 HydrophobicContact CB-CB 4.16Å; R296-L318 WeakPolarHBondContact O-CB 3.27Å; R296-L318 PolarHBondContact O-N 2.86Å; R296-D364 IonicContact CZ-OD2 3.84Å; R296-D364 IonicContact NH2-OD2 2.97Å; R296-D364 PolarHBondContact NH2-OD2 2.9Å
297	M	91.5	Very high	82.9	Confident	79 Å²	79	69.8 Å²	69.8	39%	0.389	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.2	-174.2	-66.2	-179.4	-70.5	0	0	111.9	Y291 H292 G295	Y291-M297 WeakPolarHBondContact CA-O 3.4Å; H292-M297 PolarHBondContact N-O 3.46Å; H292-M297 PolarHBondContact O-N 2.79Å; G295-M297 VanDerWaalsContact C-N 3.27Å; G295-M297 PolarHBondContact O-N 3.01Å
298	L	92.1	Very high	80.8	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114	169	-177.3	67.2	0	0	0	109.5	C289 Y291 M300 I315 L316 F348 W359 M363	C289-L298 HydrophobicContact CB-CD1 4.08Å; Y291-L298 HydrophobicContact CD2-CB 4.28Å; Y291-L298 HydrophobicContact CD2-CD1 4.49Å; L298-M300 HydrophobicContact CD2-CG 4.25Å; L298-M300 HydrophobicContact CD2-SD 4.15Å; L298-M300 HydrophobicContact CG-CG 4.06Å; L298-I315 WeakPolarHBondContact O-CA 3.42Å; L298-L316 HydrophobicContact CB-CB 4.49Å; L298-L316 PolarHBondContact N-O 3.36Å; L298-L316 PolarHBondContact O-N 3.48Å; L298-F348 HydrophobicContact CD2-CE1 4.42Å; L298-F348 HydrophobicContact CD2-CE2 4.04Å; L298-F348 HydrophobicContact CD2-CZ 3.69Å; L298-W359 HydrophobicContact CD1-CZ3 4.11Å; L298-M363 HydrophobicContact CD1-CE 3.76Å; L298-M363 HydrophobicContact CD2-CE 4.01Å; L298-M363 HydrophobicContact CG-CE 4.37Å
299	I	92.5	Very high	78.9	Confident	47 Å²	47	74.5 Å²	74.5	24%	0.241	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.5	175.3	-53.8	175.9	0	0	0	108.3	C289 K290 P313 I315	C289-I299 CarbonylContact C-O 3.57Å; C289-I299 VanDerWaalsContact CA-O 3.32Å; C289-I299 WeakPolarHBondContact CA-O 3.43Å; K290-I299 PolarHBondContact N-O 3.43Å; K290-I299 PolarHBondContact O-N 2.98Å; I299-P313 HydrophobicContact CG2-CB 3.98Å; I299-I315 HydrophobicContact CG1-CG1 4.41Å; I299-I315 HydrophobicContact CG2-CG1 4.48Å
300	M	92.2	Very high	77.2	Confident	4 Å²	4	84.5 Å²	84.5	2%	0.02	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122.4	-175.4	-58.7	175.3	54.5	0	0	111.2	C274 Y287 L298 P313 T314 L316 F348	C274-M300 HydrophobicContact CB-CE 3.97Å; Y287-M300 HydrophobicContact CD1-CB 3.83Å; Y287-M300 HydrophobicContact CD1-CE 3.84Å; Y287-M300 HydrophobicContact CD2-CE 3.46Å; Y287-M300 VanDerWaalsContact CD2-CE 3.46Å; Y287-M300 HydrophobicContact CE1-CE 4.2Å; Y287-M300 HydrophobicContact CE2-CE 3.84Å; Y287-M300 HydrophobicContact CG-CB 4.19Å; Y287-M300 HydrophobicContact CG-CE 3.47Å; Y287-M300 VanDerWaalsContact CG-CE 3.47Å; L298-M300 HydrophobicContact CD2-CG 4.25Å; L298-M300 HydrophobicContact CD2-SD 4.15Å; L298-M300 HydrophobicContact CG-CG 4.06Å; M300-P313 WeakPolarHBondContact O-CA 3.46Å; M300-T314 PolarHBondContact N-O 3.15Å; M300-T314 PolarHBondContact O-N 3.09Å; M300-L316 HydrophobicContact SD-CD1 3.62Å; M300-F348 HydrophobicContact CE-CE1 3.69Å; M300-F348 HydrophobicContact CE-CZ 4.03Å; M300-F348 HydrophobicContact SD-CE1 3.96Å; M300-F348 HydrophobicContact SD-CZ 3.75Å
301	V	91	Very high	75.8	Confident	66 Å²	66	88.3 Å²	88.3	40%	0.4	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.7	176.8	-175.8	0	0	0	0	109.5	Y287 F288 P313	Y287-V301 CarbonylContact C-O 3.58Å; Y287-V301 VanDerWaalsContact CA-O 3.3Å; Y287-V301 WeakPolarHBondContact CA-O 3.4Å; F288-V301 PolarHBondContact N-O 3.16Å; F288-V301 PolarHBondContact O-N 3.06Å; V301-P313 HydrophobicContact CG2-CB 4.28Å
302	S	85.8	Confident	75	Confident	20 Å²	20	92.2 Å²	92.2	14%	0.14	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.1	179.1	-177.5	0	0	0	0	111.4	E304	S302-E304 PolarHBondContact OG-N 3.06Å
303	C	76.7	Confident	74.9	Confident	67 Å²	67	92.7 Å²	92.7	45%	0.453	51%	0.512	S	S	.	.	S	Bend	trans	-80.8	-22.4	175.4	-164.5	0	0	0	0	112.4	K286 Q305	K286-C303 HydrophobicContact CB-CB 4.38Å; K286-C303 HydrophobicContact CD-CB 4.49Å; K286-C303 WeakPolarHBondContact O-CB 3.48Å; K286-C303 PolarHBondContact O-N 2.89Å; K286-C303 VanDerWaalsContact O-N 3.17Å; C303-Q305 VanDerWaalsContact C-N 3.32Å; C303-Q305 PolarHBondContact O-N 2.97Å
304	E	70.1	Confident	75.1	Confident	127 Å²	127	91.2 Å²	91.2	59%	0.593	51%	0.509	S	S	*	.			trans	-83.3	65.1	-178	-68	-174.5	-168.9	0	0	112.7	S302 K306	S302-E304 PolarHBondContact OG-N 3.06Å; E304-K306 PolarHBondContact O-N 3.25Å
305	Q	58.3	Low	75.7	Confident	151 Å²	151	88.7 Å²	88.7	71%	0.706	50%	0.495	S	S	*	.			trans	-75.4	93.3	177.4	-63.8	-170.7	19.4	0	0	111.9	C303	C303-Q305 VanDerWaalsContact C-N 3.32Å; C303-Q305 PolarHBondContact O-N 2.97Å
306	K	56.4	Low	76.1	Confident	166 Å²	166	86.3 Å²	86.3	72%	0.722	47%	0.47	S	S	*	.			trans	-67.6	132.5	160.7	-71.1	-174.6	178.7	-179.5	0	109.1	E304 A308 T309	E304-K306 PolarHBondContact O-N 3.25Å; K306-A308 PolarHBondContact O-N 3.49Å; K306-T309 PolarHBondContact O-N 3.13Å
307	P	51.5	Low	76.2	Confident	143 Å²	143	83.9 Å²	83.9	93%	0.929	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-4	-161.6	24.9	-35.6	0	0	0	116.4
308	A	46.5	Very low	76.2	Confident	95 Å²	95	80.5 Å²	80.5	79%	0.785	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.5	-175.5	0	0	0	0	0	115.2	K306	K306-A308 PolarHBondContact O-N 3.49Å
309	T	53.7	Low	76.1	Confident	97 Å²	97	85.5 Å²	85.5	60%	0.595	47%	0.471	S	S	*	.			trans	-146.2	110.9	-177.1	42.8	0	0	0	0	112.2	K306 Q311	K306-T309 PolarHBondContact O-N 3.13Å; T309-Q311 PolarHBondContact O-N 3.42Å
310	K	55.3	Low	76	Confident	210 Å²	210	84.8 Å²	84.8	91%	0.913	47%	0.47	S	S	*	.			trans	-69.2	97.7	163.8	-71	-175.6	177.4	-178.6	0	109
311	Q	63.9	Low	76	Confident	143 Å²	143	84.9 Å²	84.9	67%	0.668	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-63.9	135.6	168.9	-69.9	-177.9	-16.5	0	0	109.4	T309	T309-Q311 PolarHBondContact O-N 3.42Å
312	A	74.6	Confident	75.9	Confident	82 Å²	82	85.5 Å²	85.5	68%	0.678	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-64.9	148.9	175.1	0	0	0	0	0	110.8	T314	A312-T314 PolarHBondContact O-N 3.22Å
313	P	85.6	Confident	75.9	Confident	70 Å²	70	87.2 Å²	87.2	46%	0.455	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-58.9	134.1	172.7	26	-34.3	0	0	0	110.1	I299 M300 V301	I299-P313 HydrophobicContact CG2-CB 3.98Å; M300-P313 WeakPolarHBondContact O-CA 3.46Å; V301-P313 HydrophobicContact CG2-CB 4.28Å
314	T	89.2	Confident	76.3	Confident	49 Å²	49	86.9 Å²	86.9	30%	0.301	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	125.2	172.1	-61.8	0	0	0	0	108.1	M300 A312 L316	M300-T314 PolarHBondContact N-O 3.15Å; M300-T314 PolarHBondContact O-N 3.09Å; A312-T314 PolarHBondContact O-N 3.22Å; T314-L316 HydrophobicContact CG2-CD2 4.23Å; T314-L316 HydrophobicContact CG2-CG 4.15Å
315	I	90.9	Very high	76.6	Confident	91 Å²	91	85.6 Å²	85.6	47%	0.467	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.6	178.1	-54.2	177.8	0	0	0	107.8	L298 I299	L298-I315 WeakPolarHBondContact O-CA 3.42Å; I299-I315 HydrophobicContact CG1-CG1 4.41Å; I299-I315 HydrophobicContact CG2-CG1 4.48Å
316	L	90.7	Very high	77.2	Confident	4 Å²	4	84 Å²	84	2%	0.021	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.5	-178.8	-60.9	172.5	0	0	0	110.5	L298 M300 T314 T339 E341	L298-L316 HydrophobicContact CB-CB 4.49Å; L298-L316 PolarHBondContact N-O 3.36Å; L298-L316 PolarHBondContact O-N 3.48Å; M300-L316 HydrophobicContact SD-CD1 3.62Å; T314-L316 HydrophobicContact CG2-CD2 4.23Å; T314-L316 HydrophobicContact CG2-CG 4.15Å; L316-T339 HydrophobicContact CB-CG2 3.97Å; L316-T339 HydrophobicContact CD1-CG2 4.21Å; L316-T339 HydrophobicContact CD2-CG2 4.48Å; L316-T339 HydrophobicContact CG-CG2 4.44Å; L316-E341 WeakPolarHBondContact CA-OE2 3.29Å; L316-E341 HydrophobicContact CD2-CB 4.27Å; L316-E341 HydrophobicContact CD2-CG 4.43Å
317	T	91.9	Very high	78	Confident	48 Å²	48	81.9 Å²	81.9	29%	0.294	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.5	-179	-44.3	0	0	0	0	109.7	T339 V340 E341	T317-T339 CarbonylContact O-C 3.56Å; T317-T339 WeakPolarHBondContact O-CA 3.26Å; T317-T339 WeakPolarHBondContact O-CB 3.36Å; T317-V340 HydrophobicContact CG2-CG2 3.99Å; T317-V340 PolarHBondContact O-N 3.18Å; T317-E341 WeakPolarHBondContact CB-OE1 3.23Å; T317-E341 VanDerWaalsContact N-CD 3.28Å; T317-E341 PolarHBondContact N-OE1 3.34Å; T317-E341 PolarHBondContact N-OE2 3.04Å; T317-E341 VanDerWaalsContact N-OE2 3.08Å; T317-E341 PolarHBondContact OG1-OE1 3.43Å
318	L	91.6	Very high	79.3	Confident	8 Å²	8	78.4 Å²	78.4	4%	0.042	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	122.3	-168.4	-161.3	119	0	0	0	112.8	Y291 R296 C321 V337 M363	Y291-L318 HydrophobicContact CE2-CB 4.25Å; Y291-L318 HydrophobicContact CE2-CD1 4.39Å; R296-L318 HydrophobicContact CB-CB 4.16Å; R296-L318 WeakPolarHBondContact O-CB 3.27Å; R296-L318 PolarHBondContact O-N 2.86Å; L318-C321 HydrophobicContact CD2-CB 4.39Å; L318-V337 HydrophobicContact CD1-CB 4.41Å; L318-V337 HydrophobicContact CD1-CG1 3.48Å; L318-V337 VanDerWaalsContact CD1-CG1 3.48Å; L318-V337 HydrophobicContact CD1-CG2 4.1Å; L318-V337 HydrophobicContact CG-CG1 4.22Å; L318-M363 HydrophobicContact CD1-CB 4.19Å; L318-M363 HydrophobicContact CD1-CE 3.94Å; L318-M363 HydrophobicContact CD1-CG 3.87Å; L318-M363 HydrophobicContact CD1-SD 3.53Å; L318-M363 VanDerWaalsContact CD1-SD 3.53Å; L318-M363 HydrophobicContact CD2-CB 3.94Å; L318-M363 HydrophobicContact CD2-CG 4.41Å; L318-M363 WeakPolarHBondContact CD2-O 3.41Å
319	K	90.1	Very high	81	Confident	108 Å²	108	75.2 Å²	75.2	47%	0.47	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-54.8	169.7	-70.3	174.4	176	146.1	0	111.2	E338 T339 V340	K319-E338 HydrophobicContact CB-CB 4.04Å; K319-E338 WeakPolarHBondContact CB-O 3.32Å; K319-E338 PolarHBondContact N-O 3.36Å; K319-T339 WeakPolarHBondContact CD-O 3.27Å; K319-T339 VanDerWaalsContact CE-O 3.25Å; K319-T339 WeakPolarHBondContact CE-O 3.43Å; K319-T339 PolarHBondContact NZ-O 2.95Å; K319-V340 HydrophobicContact CG-CG2 4.21Å
320	S	89.4	Confident	82.4	Confident	32 Å²	32	77.4 Å²	77.4	22%	0.224	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	160.4	-176.3	87.5	0	0	0	0	111.5	E338	S320-E338 WeakPolarHBondContact CB-OE2 3.43Å; S320-E338 PolarHBondContact N-O 2.91Å; S320-E338 PolarHBondContact O-N 2.97Å; S320-E338 VanDerWaalsContact OG-CD 3.25Å; S320-E338 WeakPolarHBondContact OG-CG 3.39Å; S320-E338 PolarHBondContact OG-OE2 3.47Å
321	C	92	Very high	83.9	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.034	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	129.9	177	-172.9	0	0	0	0	109.7	L318 D336 M363 G365 K366	L318-C321 HydrophobicContact CD2-CB 4.39Å; C321-D336 CarbonylContact C-O 3.48Å; C321-D336 WeakPolarHBondContact CA-O 3.42Å; C321-M363 HydrophobicContact CB-CB 3.69Å; C321-M363 HydrophobicContact CB-SD 4.5Å; C321-G365 CarbonylContact O-C 3.55Å; C321-G365 WeakPolarHBondContact O-CA 3.45Å; C321-K366 PolarHBondContact O-N 2.86Å
322	I	89.8	Confident	85.2	Confident	79 Å²	79	73 Å²	73	41%	0.405	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	132.7	-171	-53.6	-179.4	0	0	0	110	R324 F335 D336	I322-R324 PolarHBondContact O-N 2.97Å; I322-F335 CarbonylContact O-C 3.54Å; I322-F335 WeakPolarHBondContact O-CA 3.41Å; I322-D336 PolarHBondContact N-O 2.88Å; I322-D336 PolarHBondContact O-N 2.89Å
323	R	86.8	Confident	86	Confident	57 Å²	57	71 Å²	71	22%	0.215	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	120.7	172.8	178.3	-173.4	-167.3	148.9	9.6	109.6	E353 M360 K366 E367 P368	R323-E353 IonicContact CZ-OE1 2.82Å; R323-E353 IonicContact NH1-OE1 2.74Å; R323-E353 PolarHBondContact NH1-OE1 2.89Å; R323-E353 IonicContact NH2-OE1 3.41Å; R323-E353 PolarHBondContact NH2-OE1 3.36Å; R323-E353 IonicContact NH2-OE2 3.73Å; R323-M360 HydrophobicContact CB-CE 4.06Å; R323-M360 HydrophobicContact CB-SD 4.44Å; R323-M360 VanDerWaalsContact N-CE 3.29Å; R323-K366 PolarHBondContact N-O 2.96Å; R323-E367 WeakPolarHBondContact CD-OE1 3.48Å; R323-E367 IonicContact CZ-OE1 3.51Å; R323-E367 IonicContact NE-OE1 3.07Å; R323-E367 IonicContact NH1-OE1 3.47Å; R323-E367 PolarHBondContact NH1-OE1 3.48Å; R323-E367 IonicContact NH1-OE2 3.54Å; R323-E367 PolarHBondContact NH1-OE2 3.15Å; R323-E367 VanDerWaalsContact NH1-OE2 3.07Å; R323-P368 HydrophobicContact CB-CG 4.45Å
324	R	85.1	Confident	86.3	Confident	60 Å²	60	68 Å²	68	23%	0.226	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72.2	138	172.3	-178.4	164.9	-77.3	-176.4	-0.2	109.3	I322 S328 I329 C334 D336 T347	I322-R324 PolarHBondContact O-N 2.97Å; R324-S328 WeakPolarHBondContact CG-OG 3.3Å; R324-I329 HydrophobicContact CG-CG2 3.94Å; R324-C334 HydrophobicContact CB-CB 4.23Å; R324-C334 PolarHBondContact N-O 2.71Å; R324-D336 IonicContact CZ-OD1 3.14Å; R324-D336 IonicContact CZ-OD2 3.14Å; R324-D336 IonicContact NE-OD1 3.32Å; R324-D336 PolarHBondContact NE-OD1 3.42Å; R324-D336 IonicContact NE-OD2 2.75Å; R324-D336 PolarHBondContact NE-OD2 3.5Å; R324-D336 IonicContact NH1-OD1 3.94Å; R324-D336 IonicContact NH2-OD1 2.79Å; R324-D336 PolarHBondContact NH2-OD1 3.17Å; R324-D336 IonicContact NH2-OD2 2.77Å; R324-D336 PolarHBondContact NH2-OD2 2.92Å; R324-T347 PolarHBondContact NH1-OG1 3.38Å; R324-T347 PolarHBondContact NH2-OG1 3.45Å
325	K	76.4	Confident	86.5	Confident	100 Å²	100	65.7 Å²	65.7	44%	0.435	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-72.4	145.3	-179.3	-59.9	-175.1	178.1	-173.4	0	111.3	D327 S328	K325-D327 VanDerWaalsContact C-N 3.28Å; K325-D327 WeakPolarHBondContact CB-OD1 3.42Å; K325-D327 PolarHBondContact O-N 3.46Å; K325-S328 PolarHBondContact O-N 3.28Å; K325-S328 VanDerWaalsContact O-N 3.1Å; K325-S328 PolarHBondContact O-OG 3.13Å
326	T	70.4	Confident	86.6	Confident	117 Å²	117	62.5 Å²	62.5	72%	0.718	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.9	-176.3	-39.5	0	0	0	0	114
327	D	73.6	Confident	86.7	Confident	122 Å²	122	62.3 Å²	62.3	65%	0.652	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-27.1	174.5	56.9	-6.5	0	0	0	113	K325	K325-D327 VanDerWaalsContact C-N 3.28Å; K325-D327 WeakPolarHBondContact CB-OD1 3.42Å; K325-D327 PolarHBondContact O-N 3.46Å
328	S	78.4	Confident	86.7	Confident	69 Å²	69	63.9 Å²	63.9	48%	0.483	31%	0.313	S	S	.	.	S	Bend	trans	-85.8	-7.7	-174.4	69.5	0	0	0	0	115.4	R324 K325	R324-S328 WeakPolarHBondContact CG-OG 3.3Å; K325-S328 PolarHBondContact O-N 3.28Å; K325-S328 VanDerWaalsContact O-N 3.1Å; K325-S328 PolarHBondContact O-OG 3.13Å
329	I	81	Confident	86.7	Confident	28 Å²	28	63.6 Å²	63.6	14%	0.144	31%	0.312	C	S	.	.			trans	-156.6	132.9	177	-164.1	167.5	0	0	0	112.7	W284 R324 K331 C334 T347	W284-I329 HydrophobicContact CH2-CD1 4.09Å; W284-I329 HydrophobicContact CZ2-CD1 3.77Å; R324-I329 HydrophobicContact CG-CG2 3.94Å; I329-K331 HydrophobicContact CG1-CB 4.28Å; I329-K331 PolarHBondContact O-N 3.15Å; I329-C334 HydrophobicContact CG2-CB 3.99Å; I329-T347 HydrophobicContact CD1-CG2 4.17Å
330	D	84.3	Confident	86.7	Confident	144 Å²	144	62.5 Å²	62.5	77%	0.77	31%	0.314	S	S	*	.	S	Bend	trans	-77	53.7	173.1	-178.7	39.2	0	0	0	112.4
331	K	86.8	Confident	86.6	Confident	84 Å²	84	65.1 Å²	65.1	37%	0.365	32%	0.323	S	S	.	.	S	Bend	trans	-149.4	125.6	173.9	-71.5	-65.1	159.1	-96.9	0	110.3	W284 I329 C334	W284-K331 HydrophobicContact CZ2-CB 4.25Å; W284-K331 HydrophobicContact CZ2-CG 3.71Å; I329-K331 HydrophobicContact CG1-CB 4.28Å; I329-K331 PolarHBondContact O-N 3.15Å; K331-C334 WeakPolarHBondContact CB-SG 3.22Å; K331-C334 PolarHBondContact O-SG 3.04Å
332	R	89.8	Confident	86.3	Confident	175 Å²	175	69.3 Å²	69.3	66%	0.66	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	155	174.9	-67.8	176.7	63.6	159	3.5	111.4	C334 Q349	R332-C334 VanDerWaalsContact C-N 3.28Å; R332-C334 PolarHBondContact O-N 2.87Å; R332-Q349 PolarHBondContact O-NE2 3.45Å
333	F	91.9	Very high	85.8	Confident	42 Å²	42	73.8 Å²	73.8	18%	0.184	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	27.5	169.1	-38	-50.2	0	0	0	115.6	A350 L351 E353 R356	F333-A350 HydrophobicContact CB-CB 4.3Å; F333-A350 PolarHBondContact O-N 3Å; F333-A350 VanDerWaalsContact O-N 3.17Å; F333-L351 WeakPolarHBondContact CD2-O 3.2Å; F333-L351 VanDerWaalsContact CE2-O 3.26Å; F333-L351 WeakPolarHBondContact CE2-O 3.47Å; F333-E353 HydrophobicContact CD1-CB 3.85Å; F333-E353 VanDerWaalsContact CD1-N 3.29Å; F333-E353 HydrophobicContact CE1-CB 3.74Å; F333-E353 VanDerWaalsContact CE1-N 3.32Å; F333-R356 HydrophobicContact CB-CB 4.33Å
334	C	92.5	Very high	85.7	Confident	6 Å²	6	73.7 Å²	73.7	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	147.5	-179	-67.5	0	0	0	0	113.7	R324 I329 K331 R332 T347 F348	R324-C334 HydrophobicContact CB-CB 4.23Å; R324-C334 PolarHBondContact N-O 2.71Å; I329-C334 HydrophobicContact CG2-CB 3.99Å; K331-C334 WeakPolarHBondContact CB-SG 3.22Å; K331-C334 PolarHBondContact O-SG 3.04Å; R332-C334 VanDerWaalsContact C-N 3.28Å; R332-C334 PolarHBondContact O-N 2.87Å; C334-T347 HydrophobicContact CB-CG2 4.36Å; C334-F348 CarbonylContact C-O 3.56Å; C334-F348 VanDerWaalsContact CA-O 3.25Å; C334-F348 WeakPolarHBondContact CA-O 3.33Å
335	F	93.1	Very high	85.8	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.5	171.3	62.9	-80.2	0	0	0	110.3	L272 I322 V337 T347 F348 A350 R356 W359 M360 M363	L272-F335 HydrophobicContact CD1-CZ 3.92Å; L272-F335 HydrophobicContact CD2-CE1 3.99Å; L272-F335 HydrophobicContact CD2-CZ 4.01Å; I322-F335 CarbonylContact O-C 3.54Å; I322-F335 WeakPolarHBondContact O-CA 3.41Å; F335-V337 HydrophobicContact CD2-CG2 3.86Å; F335-V337 HydrophobicContact CE2-CG2 3.75Å; F335-T347 WeakPolarHBondContact O-CA 3.43Å; F335-F348 HydrophobicContact CD1-CB 4.18Å; F335-F348 HydrophobicContact CD2-CB 4.3Å; F335-F348 HydrophobicContact CE1-CB 3.73Å; F335-F348 HydrophobicContact CE2-CB 3.87Å; F335-F348 HydrophobicContact CE2-CD2 4.29Å; F335-F348 HydrophobicContact CE2-CG 4.37Å; F335-F348 HydrophobicContact CG-CB 4.46Å; F335-F348 HydrophobicContact CZ-CB 3.57Å; F335-F348 HydrophobicContact CZ-CG 4.28Å; F335-F348 PolarHBondContact N-O 2.59Å; F335-F348 PolarHBondContact O-N 2.91Å; F335-A350 HydrophobicContact CE1-CB 4.25Å; F335-R356 HydrophobicContact CD1-CG 4.13Å; F335-W359 HydrophobicContact CE1-CB 4.24Å; F335-W359 HydrophobicContact CE2-CB 4.5Å; F335-W359 HydrophobicContact CZ-CB 3.87Å; F335-W359 HydrophobicContact CZ-CG 4.32Å; F335-M360 HydrophobicContact CB-CG 4.47Å; F335-M360 HydrophobicContact CB-SD 3.68Å; F335-M360 HydrophobicContact CD2-SD 4.36Å; F335-M360 HydrophobicContact CG-SD 4.22Å; F335-M363 HydrophobicContact CE2-SD 3.98Å
336	D	92.4	Very high	86.5	Confident	24 Å²	24	69.3 Å²	69.3	13%	0.128	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.8	179.7	-74.5	-39.5	0	0	0	110.7	C321 I322 R324 P345 T347	C321-D336 CarbonylContact C-O 3.48Å; C321-D336 WeakPolarHBondContact CA-O 3.42Å; I322-D336 PolarHBondContact N-O 2.88Å; I322-D336 PolarHBondContact O-N 2.89Å; R324-D336 IonicContact CZ-OD1 3.14Å; R324-D336 IonicContact CZ-OD2 3.14Å; R324-D336 IonicContact NE-OD1 3.32Å; R324-D336 PolarHBondContact NE-OD1 3.42Å; R324-D336 IonicContact NE-OD2 2.75Å; R324-D336 PolarHBondContact NE-OD2 3.5Å; R324-D336 IonicContact NH1-OD1 3.94Å; R324-D336 IonicContact NH2-OD1 2.79Å; R324-D336 PolarHBondContact NH2-OD1 3.17Å; R324-D336 IonicContact NH2-OD2 2.77Å; R324-D336 PolarHBondContact NH2-OD2 2.92Å; D336-P345 HydrophobicContact CB-CB 4.1Å; D336-T347 WeakPolarHBondContact OD1-CA 3.34Å; D336-T347 VanDerWaalsContact OD1-CB 3.3Å; D336-T347 WeakPolarHBondContact OD1-CB 3.22Å; D336-T347 WeakPolarHBondContact OD1-CG2 3.42Å; D336-T347 PolarHBondContact OD1-OG1 2.81Å
337	V	93.1	Very high	87.5	Confident	1 Å²	1	64 Å²	64	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	119	179	164.6	0	0	0	0	109.1	L318 F335 T339 P345 V346 F348 M363	L318-V337 HydrophobicContact CD1-CB 4.41Å; L318-V337 HydrophobicContact CD1-CG1 3.48Å; L318-V337 VanDerWaalsContact CD1-CG1 3.48Å; L318-V337 HydrophobicContact CD1-CG2 4.1Å; L318-V337 HydrophobicContact CG-CG1 4.22Å; F335-V337 HydrophobicContact CD2-CG2 3.86Å; F335-V337 HydrophobicContact CE2-CG2 3.75Å; V337-T339 HydrophobicContact CG1-CG2 3.77Å; V337-P345 WeakPolarHBondContact O-CA 3.39Å; V337-V346 PolarHBondContact N-O 3.43Å; V337-V346 PolarHBondContact O-N 3.17Å; V337-F348 HydrophobicContact CB-CD2 3.9Å; V337-F348 HydrophobicContact CB-CE2 3.82Å; V337-F348 HydrophobicContact CG1-CE2 4.19Å; V337-F348 HydrophobicContact CG2-CD2 3.74Å; V337-F348 HydrophobicContact CG2-CE2 4Å; V337-M363 HydrophobicContact CG2-SD 3.86Å
338	E	91.9	Very high	88.5	Confident	81 Å²	81	58.2 Å²	58.2	38%	0.379	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.5	169.6	-66.1	-179.5	147.6	0	0	109.3	K319 S320 P345	K319-E338 HydrophobicContact CB-CB 4.04Å; K319-E338 WeakPolarHBondContact CB-O 3.32Å; K319-E338 PolarHBondContact N-O 3.36Å; S320-E338 WeakPolarHBondContact CB-OE2 3.43Å; S320-E338 PolarHBondContact N-O 2.91Å; S320-E338 PolarHBondContact O-N 2.97Å; S320-E338 VanDerWaalsContact OG-CD 3.25Å; S320-E338 WeakPolarHBondContact OG-CG 3.39Å; S320-E338 PolarHBondContact OG-OE2 3.47Å; E338-P345 HydrophobicContact CG-CB 4.32Å; E338-P345 HydrophobicContact CG-CG 4.11Å
339	T	91.5	Very high	89.3	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	166.6	-179	92.2	0	0	0	0	112.2	L316 T317 K319 V337 E341 R342 V346	L316-T339 HydrophobicContact CB-CG2 3.97Å; L316-T339 HydrophobicContact CD1-CG2 4.21Å; L316-T339 HydrophobicContact CD2-CG2 4.48Å; L316-T339 HydrophobicContact CG-CG2 4.44Å; T317-T339 CarbonylContact O-C 3.56Å; T317-T339 WeakPolarHBondContact O-CA 3.26Å; T317-T339 WeakPolarHBondContact O-CB 3.36Å; K319-T339 WeakPolarHBondContact CD-O 3.27Å; K319-T339 VanDerWaalsContact CE-O 3.25Å; K319-T339 WeakPolarHBondContact CE-O 3.43Å; K319-T339 PolarHBondContact NZ-O 2.95Å; V337-T339 HydrophobicContact CG1-CG2 3.77Å; T339-E341 WeakPolarHBondContact CB-OE2 3.23Å; T339-E341 PolarHBondContact OG1-N 3.47Å; T339-E341 PolarHBondContact OG1-OE2 3.4Å; T339-R342 PolarHBondContact OG1-N 3.01Å; T339-V346 HydrophobicContact CG2-CG2 4.35Å
340	V	89.9	Confident	89.9	Confident	85 Å²	85	55.3 Å²	55.3	52%	0.515	28%	0.278	S	S	.	.	S	Bend	trans	-68	-37.4	174.9	179.1	0	0	0	0	111.5	T317 K319	T317-V340 HydrophobicContact CG2-CG2 3.99Å; T317-V340 PolarHBondContact O-N 3.18Å; K319-V340 HydrophobicContact CG-CG2 4.21Å
341	E	88.6	Confident	90.2	Very high	87 Å²	87	53 Å²	53	41%	0.407	27%	0.266	S	S	.	.	S	Bend	trans	-84.9	-12.5	-169.2	-47.9	73.8	-161.3	0	0	114.1	L316 T317 T339	L316-E341 WeakPolarHBondContact CA-OE2 3.29Å; L316-E341 HydrophobicContact CD2-CB 4.27Å; L316-E341 HydrophobicContact CD2-CG 4.43Å; T317-E341 WeakPolarHBondContact CB-OE1 3.23Å; T317-E341 VanDerWaalsContact N-CD 3.28Å; T317-E341 PolarHBondContact N-OE1 3.34Å; T317-E341 PolarHBondContact N-OE2 3.04Å; T317-E341 VanDerWaalsContact N-OE2 3.08Å; T317-E341 PolarHBondContact OG1-OE1 3.43Å; T339-E341 WeakPolarHBondContact CB-OE2 3.23Å; T339-E341 PolarHBondContact OG1-N 3.47Å; T339-E341 PolarHBondContact OG1-OE2 3.4Å
342	R	85.1	Confident	90.2	Very high	94 Å²	94	51 Å²	51	36%	0.355	26%	0.262	S	S	.	.			trans	-127.6	129.8	-174.2	-66	-176.1	177.3	-161.4	1.2	112	T339 A344 V346	T339-R342 PolarHBondContact OG1-N 3.01Å; R342-A344 PolarHBondContact O-N 3.32Å; R342-V346 VanDerWaalsContact CD-CG2 3.47Å
343	N	78.9	Confident	90	Very high	173 Å²	173	45.5 Å²	45.5	93%	0.925	24%	0.244	S	C	*	.	S	Bend	trans	-78.2	8.6	-179.1	-65.1	-7.7	0	0	0	114.3
344	A	84.6	Confident	89.5	Confident	54 Å²	54	45.4 Å²	45.4	45%	0.446	25%	0.254	S	S	.	.	S	Bend	trans	-147.4	148.1	176.9	0	0	0	0	0	109.4	R342 V346	R342-A344 PolarHBondContact O-N 3.32Å; A344-V346 PolarHBondContact O-N 3.1Å
345	P	87.1	Confident	89.2	Confident	63 Å²	63	46.3 Å²	46.3	41%	0.409	26%	0.259	S	S	.	.			trans	-58.1	138.3	177.3	-21.3	31.1	0	0	0	112.1	D336 V337 E338	D336-P345 HydrophobicContact CB-CB 4.1Å; V337-P345 WeakPolarHBondContact O-CA 3.39Å; E338-P345 HydrophobicContact CG-CB 4.32Å; E338-P345 HydrophobicContact CG-CG 4.11Å
346	V	91.7	Very high	89.1	Confident	6 Å²	6	46.4 Å²	46.4	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	115.7	172.5	-174.6	0	0	0	0	108.1	C274 V337 T339 R342 A344 F348	C274-V346 WeakPolarHBondContact SG-CG1 3.45Å; V337-V346 PolarHBondContact N-O 3.43Å; V337-V346 PolarHBondContact O-N 3.17Å; T339-V346 HydrophobicContact CG2-CG2 4.35Å; R342-V346 VanDerWaalsContact CD-CG2 3.47Å; A344-V346 PolarHBondContact O-N 3.1Å; V346-F348 HydrophobicContact CB-CD2 4.42Å; V346-F348 HydrophobicContact CB-CE2 3.86Å; V346-F348 HydrophobicContact CB-CZ 4.43Å; V346-F348 HydrophobicContact CG1-CD2 4.08Å; V346-F348 HydrophobicContact CG1-CE1 4.36Å; V346-F348 HydrophobicContact CG1-CE2 3.51Å; V346-F348 HydrophobicContact CG1-CZ 3.67Å
347	T	92.3	Very high	88.7	Confident	5 Å²	5	50.6 Å²	50.6	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.6	176.5	-51.4	0	0	0	0	110.1	Q275 W284 R324 I329 C334 F335 D336	Q275-T347 PolarHBondContact N-O 2.93Å; W284-T347 HydrophobicContact CH2-CG2 3.9Å; R324-T347 PolarHBondContact NH1-OG1 3.38Å; R324-T347 PolarHBondContact NH2-OG1 3.45Å; I329-T347 HydrophobicContact CD1-CG2 4.17Å; C334-T347 HydrophobicContact CB-CG2 4.36Å; F335-T347 WeakPolarHBondContact O-CA 3.43Å; D336-T347 WeakPolarHBondContact OD1-CA 3.34Å; D336-T347 VanDerWaalsContact OD1-CB 3.3Å; D336-T347 WeakPolarHBondContact OD1-CB 3.22Å; D336-T347 WeakPolarHBondContact OD1-CG2 3.42Å; D336-T347 PolarHBondContact OD1-OG1 2.81Å
348	F	94.4	Very high	88.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.4	174.1	-71.4	-80.3	0	0	0	110.9	L272 Y273 C274 L298 M300 C334 F335 V337 V346	L272-F348 HydrophobicContact CB-CD1 3.94Å; L272-F348 HydrophobicContact CD1-CB 4.49Å; L272-F348 HydrophobicContact CD1-CD1 3.98Å; L272-F348 HydrophobicContact CD1-CE1 4.48Å; L272-F348 HydrophobicContact CD1-CG 4.31Å; Y273-F348 CarbonylContact O-C 3.58Å; Y273-F348 WeakPolarHBondContact O-CA 3.23Å; C274-F348 HydrophobicContact CB-CD1 4.11Å; C274-F348 HydrophobicContact CB-CE1 3.86Å; L298-F348 HydrophobicContact CD2-CE1 4.42Å; L298-F348 HydrophobicContact CD2-CE2 4.04Å; L298-F348 HydrophobicContact CD2-CZ 3.69Å; M300-F348 HydrophobicContact CE-CE1 3.69Å; M300-F348 HydrophobicContact CE-CZ 4.03Å; M300-F348 HydrophobicContact SD-CE1 3.96Å; M300-F348 HydrophobicContact SD-CZ 3.75Å; C334-F348 CarbonylContact C-O 3.56Å; C334-F348 VanDerWaalsContact CA-O 3.25Å; C334-F348 WeakPolarHBondContact CA-O 3.33Å; F335-F348 HydrophobicContact CD1-CB 4.18Å; F335-F348 HydrophobicContact CD2-CB 4.3Å; F335-F348 HydrophobicContact CE1-CB 3.73Å; F335-F348 HydrophobicContact CE2-CB 3.87Å; F335-F348 HydrophobicContact CE2-CD2 4.29Å; F335-F348 HydrophobicContact CE2-CG 4.37Å; F335-F348 HydrophobicContact CG-CB 4.46Å; F335-F348 HydrophobicContact CZ-CB 3.57Å; F335-F348 HydrophobicContact CZ-CG 4.28Å; F335-F348 PolarHBondContact N-O 2.59Å; F335-F348 PolarHBondContact O-N 2.91Å; V337-F348 HydrophobicContact CB-CD2 3.9Å; V337-F348 HydrophobicContact CB-CE2 3.82Å; V337-F348 HydrophobicContact CG1-CE2 4.19Å; V337-F348 HydrophobicContact CG2-CD2 3.74Å; V337-F348 HydrophobicContact CG2-CE2 4Å; V346-F348 HydrophobicContact CB-CD2 4.42Å; V346-F348 HydrophobicContact CB-CE2 3.86Å; V346-F348 HydrophobicContact CB-CZ 4.43Å; V346-F348 HydrophobicContact CG1-CD2 4.08Å; V346-F348 HydrophobicContact CG1-CE1 4.36Å; V346-F348 HydrophobicContact CG1-CE2 3.51Å; V346-F348 HydrophobicContact CG1-CZ 3.67Å
349	Q	94.3	Very high	88.3	Confident	35 Å²	35	49.7 Å²	49.7	16%	0.164	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	170.3	168.2	169.6	52.8	0	0	109.3	Y273 W284 R332	Y273-Q349 PolarHBondContact N-O 2.95Å; Y273-Q349 PolarHBondContact O-N 2.6Å; W284-Q349 HydrophobicContact CE3-CB 4.16Å; W284-Q349 HydrophobicContact CH2-CB 4.14Å; W284-Q349 HydrophobicContact CZ3-CB 3.63Å; R332-Q349 PolarHBondContact O-NE2 3.45Å
350	A	93.1	Very high	88.1	Confident	2 Å²	2	50 Å²	50	2%	0.017	27%	0.274	C	S	.	.			trans	-83.9	166.7	171.2	0	0	0	0	0	111.8	L272 F333 F335 D355 R356	L272-A350 HydrophobicContact CD2-CB 4.15Å; F333-A350 HydrophobicContact CB-CB 4.3Å; F333-A350 PolarHBondContact O-N 3Å; F333-A350 VanDerWaalsContact O-N 3.17Å; F335-A350 HydrophobicContact CE1-CB 4.25Å; A350-D355 HydrophobicContact CB-CB 3.97Å; A350-R356 HydrophobicContact CB-CB 3.98Å
351	L	90.5	Very high	88	Confident	96 Å²	96	52.7 Å²	52.7	50%	0.503	28%	0.281	S	S	.	.	S	Bend	trans	-77.8	-33.8	-178	-54.3	-178.7	0	0	0	112.8	Y273 F333	Y273-L351 HydrophobicContact CD2-CD2 4.39Å; Y273-L351 HydrophobicContact CE2-CD2 3.93Å; F333-L351 WeakPolarHBondContact CD2-O 3.2Å; F333-L351 VanDerWaalsContact CE2-O 3.26Å; F333-L351 WeakPolarHBondContact CE2-O 3.47Å
352	S	87.4	Confident	87.9	Confident	42 Å²	42	49 Å²	49	29%	0.294	27%	0.266	S	S	.	.	S	Bend	trans	-139	172.9	176.1	75.5	0	0	0	0	112.6	G354 D355 R356	S352-G354 VanDerWaalsContact C-N 3.26Å; S352-G354 PolarHBondContact O-N 3.17Å; S352-G354 PolarHBondContact OG-N 2.98Å; S352-D355 VanDerWaalsContact CB-OD2 3.24Å; S352-D355 WeakPolarHBondContact CB-OD2 3.15Å; S352-D355 PolarHBondContact N-OD2 2.99Å; S352-D355 PolarHBondContact O-N 2.91Å; S352-D355 VanDerWaalsContact OG-CG 3.27Å; S352-D355 PolarHBondContact OG-N 3.39Å; S352-D355 PolarHBondContact OG-OD2 3.41Å; S352-R356 WeakPolarHBondContact O-CB 3.12Å; S352-R356 PolarHBondContact O-N 3.23Å
353	E	85.3	Confident	88.1	Confident	59 Å²	59	44.6 Å²	44.6	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-68.2	-27.4	171.5	-178.7	66.8	178.1	0	0	111.9	R323 F333 R356 K357	R323-E353 IonicContact CZ-OE1 2.82Å; R323-E353 IonicContact NH1-OE1 2.74Å; R323-E353 PolarHBondContact NH1-OE1 2.89Å; R323-E353 IonicContact NH2-OE1 3.41Å; R323-E353 PolarHBondContact NH2-OE1 3.36Å; R323-E353 IonicContact NH2-OE2 3.73Å; F333-E353 HydrophobicContact CD1-CB 3.85Å; F333-E353 VanDerWaalsContact CD1-N 3.29Å; F333-E353 HydrophobicContact CE1-CB 3.74Å; F333-E353 VanDerWaalsContact CE1-N 3.32Å; E353-R356 IonicContact OE1-CZ 2.79Å; E353-R356 IonicContact OE1-NE 2.98Å; E353-R356 IonicContact OE1-NH2 3.17Å; E353-R356 PolarHBondContact OE1-NH2 3.42Å; E353-R356 IonicContact OE2-CZ 2.74Å; E353-R356 IonicContact OE2-NE 3.74Å; E353-R356 PolarHBondContact OE2-NE 2.94Å; E353-R356 IonicContact OE2-NH2 2.67Å; E353-K357 WeakPolarHBondContact O-CG 3.31Å; E353-K357 PolarHBondContact O-N 3.32Å; E353-K357 VanDerWaalsContact O-N 3.09Å
354	G	82.6	Confident	88.5	Confident	39 Å²	39	40 Å²	40	40%	0.402	23%	0.225	S	C	.	.	H	α-helix	trans	-67.8	-51.4	172.3	0	0	0	0	0	111	S352 R356 K357 L358	S352-G354 VanDerWaalsContact C-N 3.26Å; S352-G354 PolarHBondContact O-N 3.17Å; S352-G354 PolarHBondContact OG-N 2.98Å; G354-R356 VanDerWaalsContact C-N 3.3Å; G354-R356 PolarHBondContact O-N 3.44Å; G354-K357 PolarHBondContact O-N 3.12Å; G354-K357 VanDerWaalsContact O-N 3.07Å; G354-L358 PolarHBondContact O-N 3.49Å
355	D	85.9	Confident	88.5	Confident	26 Å²	26	38.6 Å²	38.6	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-43.8	174.7	-57.7	-65.6	0	0	0	110.9	Q263 A350 S352 K357 L358 W359	Q263-D355 PolarHBondContact NE2-OD1 3.15Å; Q263-D355 VanDerWaalsContact NE2-OD1 3.11Å; A350-D355 HydrophobicContact CB-CB 3.97Å; S352-D355 VanDerWaalsContact CB-OD2 3.24Å; S352-D355 WeakPolarHBondContact CB-OD2 3.15Å; S352-D355 PolarHBondContact N-OD2 2.99Å; S352-D355 PolarHBondContact O-N 2.91Å; S352-D355 VanDerWaalsContact OG-CG 3.27Å; S352-D355 PolarHBondContact OG-N 3.39Å; S352-D355 PolarHBondContact OG-OD2 3.41Å; D355-K357 VanDerWaalsContact C-N 3.29Å; D355-K357 PolarHBondContact O-N 3.24Å; D355-L358 PolarHBondContact O-N 3.03Å; D355-W359 WeakPolarHBondContact O-CB 3.44Å; D355-W359 PolarHBondContact O-N 3.33Å
356	R	89.4	Confident	88.3	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-57.2	-43.6	176.2	-170.5	-161.5	60.2	77.7	2.7	111.2	F333 F335 A350 S352 E353 G354 M360 E367	F333-R356 HydrophobicContact CB-CB 4.33Å; F335-R356 HydrophobicContact CD1-CG 4.13Å; A350-R356 HydrophobicContact CB-CB 3.98Å; S352-R356 WeakPolarHBondContact O-CB 3.12Å; S352-R356 PolarHBondContact O-N 3.23Å; E353-R356 IonicContact OE1-CZ 2.79Å; E353-R356 IonicContact OE1-NE 2.98Å; E353-R356 IonicContact OE1-NH2 3.17Å; E353-R356 PolarHBondContact OE1-NH2 3.42Å; E353-R356 IonicContact OE2-CZ 2.74Å; E353-R356 IonicContact OE2-NE 3.74Å; E353-R356 PolarHBondContact OE2-NE 2.94Å; E353-R356 IonicContact OE2-NH2 2.67Å; G354-R356 VanDerWaalsContact C-N 3.3Å; G354-R356 PolarHBondContact O-N 3.44Å; R356-M360 HydrophobicContact CG-CG 4.34Å; R356-M360 VanDerWaalsContact O-CB 3.26Å; R356-M360 WeakPolarHBondContact O-CB 3.37Å; R356-M360 WeakPolarHBondContact O-CG 3.45Å; R356-M360 PolarHBondContact O-N 3.4Å; R356-E367 IonicContact CZ-OE1 2.98Å; R356-E367 VanDerWaalsContact CZ-OE1 3.28Å; R356-E367 IonicContact NH1-OE1 3.93Å; R356-E367 PolarHBondContact NH1-OE1 3.34Å; R356-E367 IonicContact NH2-OE1 2.72Å; R356-E367 PolarHBondContact NH2-OE1 3.44Å
357	K	85.6	Confident	87.3	Confident	111 Å²	111	47.6 Å²	47.6	48%	0.483	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-46.5	177.8	-76.3	-180	175.6	-169.6	0	111.8	E353 G354 D355 W359 M360 E361	E353-K357 WeakPolarHBondContact O-CG 3.31Å; E353-K357 PolarHBondContact O-N 3.32Å; E353-K357 VanDerWaalsContact O-N 3.09Å; G354-K357 PolarHBondContact O-N 3.12Å; G354-K357 VanDerWaalsContact O-N 3.07Å; D355-K357 VanDerWaalsContact C-N 3.29Å; D355-K357 PolarHBondContact O-N 3.24Å; K357-W359 PolarHBondContact O-N 3.03Å; K357-M360 WeakPolarHBondContact O-CB 3.41Å; K357-M360 PolarHBondContact O-N 3.04Å; K357-E361 VanDerWaalsContact O-CB 3.29Å; K357-E361 WeakPolarHBondContact O-CB 3.47Å; K357-E361 PolarHBondContact O-N 2.82Å
358	L	86.3	Confident	85.5	Confident	55 Å²	55	49.5 Å²	49.5	29%	0.288	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-44.4	177.3	-68	171.2	0	0	0	112.4	Q263 L268 G354 D355 E361 A362	Q263-L358 HydrophobicContact CB-CD1 4.18Å; L268-L358 HydrophobicContact CD2-CB 4.45Å; G354-L358 PolarHBondContact O-N 3.49Å; D355-L358 PolarHBondContact O-N 3.03Å; L358-E361 PolarHBondContact O-N 3.24Å; L358-A362 WeakPolarHBondContact O-CB 3.5Å; L358-A362 PolarHBondContact O-N 3.14Å
359	W	89.2	Confident	82.8	Confident	9 Å²	9	56.8 Å²	56.8	3%	0.034	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-41.4	175.7	-81.4	106.7	0	0	0	112.5	L268 L272 C289 L298 F335 D355 K357 M363	L268-W359 HydrophobicContact CD2-CB 4.43Å; L268-W359 HydrophobicContact CD2-CD2 3.59Å; L268-W359 HydrophobicContact CD2-CE3 3.69Å; L268-W359 HydrophobicContact CD2-CG 3.94Å; L268-W359 HydrophobicContact CD2-CZ2 4.44Å; L268-W359 HydrophobicContact CD2-CZ3 4.17Å; L268-W359 HydrophobicContact CG-CD2 4.25Å; L268-W359 HydrophobicContact CG-CE3 4.27Å; L268-W359 HydrophobicContact CG-CH2 4.24Å; L268-W359 HydrophobicContact CG-CZ2 4.21Å; L268-W359 HydrophobicContact CG-CZ3 4.27Å; L272-W359 HydrophobicContact CD1-CD2 3.95Å; L272-W359 HydrophobicContact CD1-CE3 4.1Å; L272-W359 HydrophobicContact CD1-CH2 4.31Å; L272-W359 HydrophobicContact CD1-CZ2 4.16Å; L272-W359 HydrophobicContact CD1-CZ3 4.26Å; L272-W359 HydrophobicContact CD2-CD2 4.27Å; L272-W359 HydrophobicContact CD2-CG 4.16Å; L272-W359 HydrophobicContact CG-CD2 4.37Å; L272-W359 HydrophobicContact CG-CZ2 4.19Å; C289-W359 HydrophobicContact CB-CH2 3.77Å; C289-W359 HydrophobicContact CB-CZ2 4.22Å; L298-W359 HydrophobicContact CD1-CZ3 4.11Å; F335-W359 HydrophobicContact CE1-CB 4.24Å; F335-W359 HydrophobicContact CE2-CB 4.5Å; F335-W359 HydrophobicContact CZ-CB 3.87Å; F335-W359 HydrophobicContact CZ-CG 4.32Å; D355-W359 WeakPolarHBondContact O-CB 3.44Å; D355-W359 PolarHBondContact O-N 3.33Å; K357-W359 PolarHBondContact O-N 3.03Å; W359-M363 HydrophobicContact CE3-CE 3.81Å; W359-M363 HydrophobicContact CZ3-CE 4.02Å; W359-M363 VanDerWaalsContact O-CB 3.3Å; W359-M363 WeakPolarHBondContact O-CB 3.3Å; W359-M363 WeakPolarHBondContact O-CG 3.44Å; W359-M363 PolarHBondContact O-N 2.75Å
360	M	88.6	Confident	80	Confident	7 Å²	7	63 Å²	63	3%	0.034	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-45.9	173.5	-75.2	-76.2	-56.4	0	0	111.8	R323 F335 R356 K357 M363 D364 G365 K366	R323-M360 HydrophobicContact CB-CE 4.06Å; R323-M360 HydrophobicContact CB-SD 4.44Å; R323-M360 VanDerWaalsContact N-CE 3.29Å; F335-M360 HydrophobicContact CB-CG 4.47Å; F335-M360 HydrophobicContact CB-SD 3.68Å; F335-M360 HydrophobicContact CD2-SD 4.36Å; F335-M360 HydrophobicContact CG-SD 4.22Å; R356-M360 HydrophobicContact CG-CG 4.34Å; R356-M360 VanDerWaalsContact O-CB 3.26Å; R356-M360 WeakPolarHBondContact O-CB 3.37Å; R356-M360 WeakPolarHBondContact O-CG 3.45Å; R356-M360 PolarHBondContact O-N 3.4Å; K357-M360 WeakPolarHBondContact O-CB 3.41Å; K357-M360 PolarHBondContact O-N 3.04Å; M360-M363 CarbonylContact O-C 3.56Å; M360-M363 PolarHBondContact O-N 3.18Å; M360-D364 PolarHBondContact O-N 3.21Å; M360-G365 VanDerWaalsContact CE-C 3.48Å; M360-G365 WeakPolarHBondContact O-CA 3.26Å; M360-G365 PolarHBondContact O-N 3.31Å; M360-K366 VanDerWaalsContact CE-N 3.32Å; M360-K366 WeakPolarHBondContact CE-O 3.36Å
361	E	86.4	Confident	77.2	Confident	141 Å²	141	71.6 Å²	71.6	66%	0.659	36%	0.362	S	S	*	.	H	α-helix	trans	-66.4	-45.7	-178.1	-176.3	176.6	173.4	0	0	112.1	K357 L358 M363 D364	K357-E361 VanDerWaalsContact O-CB 3.29Å; K357-E361 WeakPolarHBondContact O-CB 3.47Å; K357-E361 PolarHBondContact O-N 2.82Å; L358-E361 PolarHBondContact O-N 3.24Å; E361-M363 PolarHBondContact O-N 2.94Å; E361-D364 PolarHBondContact O-N 3.05Å
362	A	86.6	Confident	74.2	Confident	10 Å²	10	72.3 Å²	72.3	8%	0.083	38%	0.375	C	S	.	.	H	α-helix	trans	-57.9	-37.5	174.2	0	0	0	0	0	111.9	L266 L268 Y291 L358	L266-A362 HydrophobicContact CD2-CB 4.26Å; L268-A362 HydrophobicContact CB-CB 4.24Å; L268-A362 HydrophobicContact CD2-CB 3.73Å; Y291-A362 HydrophobicContact CD1-CB 4.28Å; Y291-A362 WeakPolarHBondContact CE1-O 3.36Å; L358-A362 WeakPolarHBondContact O-CB 3.5Å; L358-A362 PolarHBondContact O-N 3.14Å
363	M	90.3	Very high	71.9	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.01	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	14.7	-179.7	-64.9	-178.2	168.5	0	0	114.9	Y291 L298 L318 C321 F335 V337 W359 M360 E361 G365	Y291-M363 HydrophobicContact CD2-CE 4.16Å; Y291-M363 HydrophobicContact CD2-CG 4.39Å; Y291-M363 HydrophobicContact CE1-CG 4.4Å; Y291-M363 HydrophobicContact CE2-CG 4.26Å; Y291-M363 HydrophobicContact CG-CE 4.43Å; Y291-M363 HydrophobicContact CG-CG 4.49Å; L298-M363 HydrophobicContact CD1-CE 3.76Å; L298-M363 HydrophobicContact CD2-CE 4.01Å; L298-M363 HydrophobicContact CG-CE 4.37Å; L318-M363 HydrophobicContact CD1-CB 4.19Å; L318-M363 HydrophobicContact CD1-CE 3.94Å; L318-M363 HydrophobicContact CD1-CG 3.87Å; L318-M363 HydrophobicContact CD1-SD 3.53Å; L318-M363 VanDerWaalsContact CD1-SD 3.53Å; L318-M363 HydrophobicContact CD2-CB 3.94Å; L318-M363 HydrophobicContact CD2-CG 4.41Å; L318-M363 WeakPolarHBondContact CD2-O 3.41Å; C321-M363 HydrophobicContact CB-CB 3.69Å; C321-M363 HydrophobicContact CB-SD 4.5Å; F335-M363 HydrophobicContact CE2-SD 3.98Å; V337-M363 HydrophobicContact CG2-SD 3.86Å; W359-M363 HydrophobicContact CE3-CE 3.81Å; W359-M363 HydrophobicContact CZ3-CE 4.02Å; W359-M363 VanDerWaalsContact O-CB 3.3Å; W359-M363 WeakPolarHBondContact O-CB 3.3Å; W359-M363 WeakPolarHBondContact O-CG 3.44Å; W359-M363 PolarHBondContact O-N 2.75Å; M360-M363 CarbonylContact O-C 3.56Å; M360-M363 PolarHBondContact O-N 3.18Å; E361-M363 PolarHBondContact O-N 2.94Å; M363-G365 PolarHBondContact O-N 3.35Å
364	D	86.9	Confident	69.6	Low	76 Å²	76	80.6 Å²	80.6	41%	0.406	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	32.5	-179.5	-55	-40.7	0	0	0	114	K293 R296 M360 E361	K293-D364 WeakPolarHBondContact CE-OD1 3.2Å; K293-D364 IonicContact NZ-OD1 2.61Å; K293-D364 PolarHBondContact NZ-OD1 3.45Å; K293-D364 IonicContact NZ-OD2 2.72Å; R296-D364 IonicContact CZ-OD2 3.84Å; R296-D364 IonicContact NH2-OD2 2.97Å; R296-D364 PolarHBondContact NH2-OD2 2.9Å; M360-D364 PolarHBondContact O-N 3.21Å; E361-D364 PolarHBondContact O-N 3.05Å
365	G	84.1	Confident	67.7	Low	24 Å²	24	87.7 Å²	87.7	25%	0.247	45%	0.445	C	S	.	.			trans	-85	161	-167.9	0	0	0	0	0	116.3	C321 M360 M363	C321-G365 CarbonylContact O-C 3.55Å; C321-G365 WeakPolarHBondContact O-CA 3.45Å; M360-G365 VanDerWaalsContact CE-C 3.48Å; M360-G365 WeakPolarHBondContact O-CA 3.26Å; M360-G365 PolarHBondContact O-N 3.31Å; M363-G365 PolarHBondContact O-N 3.35Å
366	K	83.1	Confident	65.5	Low	158 Å²	158	96 Å²	96	69%	0.687	48%	0.48	S	S	*	.	B	Isolated β-bridge	trans	-109.6	139.2	-171.2	-60.4	-179.8	-178	178.4	0	114.3	C321 R323 M360	C321-K366 PolarHBondContact O-N 2.86Å; R323-K366 PolarHBondContact N-O 2.96Å; M360-K366 VanDerWaalsContact CE-N 3.32Å; M360-K366 WeakPolarHBondContact CE-O 3.36Å
367	E	70.1	Confident	63.3	Low	100 Å²	100	103.1 Å²	103.1	47%	0.467	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-91.9	150.3	171.9	-67.4	-110.8	121.5	0	0	111.8	R323 R356	R323-E367 WeakPolarHBondContact CD-OE1 3.48Å; R323-E367 IonicContact CZ-OE1 3.51Å; R323-E367 IonicContact NE-OE1 3.07Å; R323-E367 IonicContact NH1-OE1 3.47Å; R323-E367 PolarHBondContact NH1-OE1 3.48Å; R323-E367 IonicContact NH1-OE2 3.54Å; R323-E367 PolarHBondContact NH1-OE2 3.15Å; R323-E367 VanDerWaalsContact NH1-OE2 3.07Å; R356-E367 IonicContact CZ-OE1 2.98Å; R356-E367 VanDerWaalsContact CZ-OE1 3.28Å; R356-E367 IonicContact NH1-OE1 3.93Å; R356-E367 PolarHBondContact NH1-OE1 3.34Å; R356-E367 IonicContact NH2-OE1 2.72Å; R356-E367 PolarHBondContact NH2-OE1 3.44Å
368	P	55.3	Low	61.4	Low	45 Å²	45	100.8 Å²	100.8	29%	0.292	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-84.8	134.1	173.4	-2.1	23	0	0	0	110.7	R323 Y370	R323-P368 HydrophobicContact CB-CG 4.45Å; P368-Y370 HydrophobicContact CB-CE2 4.28Å; P368-Y370 PolarHBondContact O-N 3.34Å
369	I	38.1	Very low	59.8	Low	153 Å²	153	104.3 Å²	104.3	79%	0.785	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-69.8	128.3	-176.6	-57.2	170	0	0	0	111
370	Y	35	Very low	58.5	Low	167 Å²	167	107.4 Å²	107.4	66%	0.655	55%	0.545	S	S	*	.			trans	-139.8	143	167.9	-79.4	-88.8	0	0	0	110.4	P368	P368-Y370 HydrophobicContact CB-CE2 4.28Å; P368-Y370 PolarHBondContact O-N 3.34Å
371	H	33.5	Very low	57.5	Low	182 Å²	182	111.6 Å²	111.6	84%	0.843	57%	0.565	S	S	*	*			trans	-90.8	144.8	175.1	-48.7	-64.5	0	0	0	110.6
372	S	27.5	Very low	57.4	Low	111 Å²	111	106.5 Å²	106.5	78%	0.776	54%	0.542	S	S	*	.			trans	-150.3	139.3	173.9	-167.8	0	0	0	0	110.5
373	P	39.2	Very low	57.3	Low	125 Å²	125	108.6 Å²	108.6	81%	0.812	55%	0.552	S	S	*	*			trans	-87.5	148.2	-173.2	34	-34.3	0	0	0	113.7
374	I	38.5	Very low	57	Low	150 Å²	150	114 Å²	114	77%	0.769	58%	0.577	S	S	*	*			trans	-107.1	123.8	178.7	-60.8	169.1	0	0	0	109.5
375	H	41.6	Very low	56.9	Low	188 Å²	188	112.7 Å²	112.7	87%	0.87	57%	0.572	S	S	*	*			trans	-168.9	111.7	153.2	-95.9	-51.2	0	0	0	111.6
376	K	39.2	Very low	57.1	Low	199 Å²	199	111.5 Å²	111.5	87%	0.865	56%	0.56	S	S	*	*	S	Bend	trans	-175.5	7.2	145.3	-111.4	178.5	-179.7	-172.9	0	118.3
377	Q	44.5	Very low	57.5	Low	152 Å²	152	104 Å²	104	71%	0.71	53%	0.527	S	S	*	.	S	Bend	trans	-93.3	-23.6	-174.3	-81.9	170.5	-65.8	0	0	116.7	E379	Q377-E379 PolarHBondContact O-N 2.99Å
378	A	45.1	Very low	58.5	Low	63 Å²	63	104.1 Å²	104.1	52%	0.521	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	5.4	-167.1	0	0	0	0	0	116.7
379	E	52.5	Low	60.2	Low	128 Å²	128	102 Å²	102	60%	0.598	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-1.7	-174.9	-66.8	-178.7	160.9	0	0	113.1	Q377 R427	Q377-E379 PolarHBondContact O-N 2.99Å; E379-R427 IonicContact OE1-CZ 2.71Å; E379-R427 IonicContact OE1-NE 3.49Å; E379-R427 IonicContact OE1-NH2 3.31Å; E379-R427 PolarHBondContact OE1-NH2 2.99Å
380	M	61.8	Low	62.8	Low	74 Å²	74	94.7 Å²	94.7	37%	0.365	48%	0.475	S	S	.	.	S	Bend	trans	-130.1	27.8	-177.9	-43	-155.3	80.8	0	0	112.8	N455 L456 S457	M380-N455 WeakPolarHBondContact CB-O 3.37Å; M380-N455 HydrophobicContact CE-CB 3.42Å; M380-N455 VanDerWaalsContact CE-CB 3.42Å; M380-N455 WeakPolarHBondContact CE-O 3.23Å; M380-N455 HydrophobicContact SD-CB 4.11Å; M380-L456 CarbonylContact O-C 3.44Å; M380-L456 VanDerWaalsContact O-CA 3.32Å; M380-L456 WeakPolarHBondContact O-CA 3.26Å; M380-S457 PolarHBondContact O-N 3.09Å; M380-S457 PolarHBondContact O-OG 2.92Å
381	E	69.1	Low	65.6	Low	95 Å²	95	91.7 Å²	91.7	44%	0.444	46%	0.463	S	S	.	.	S	Bend	trans	-89.4	154.4	177.4	-67.1	174.8	-165.8	0	0	112.3	N383	E381-N383 PolarHBondContact O-N 3.19Å; E381-N383 PolarHBondContact O-ND2 3.27Å
382	L	82.7	Confident	68.4	Low	34 Å²	34	86 Å²	86	18%	0.178	44%	0.436	C	S	.	.	S	Bend	trans	-76.4	80	-176.1	-169.3	63.9	0	0	0	112.1	F387 L456 L460 K495 N496 M499	L382-F387 HydrophobicContact CD1-CE2 4.26Å; L382-F387 HydrophobicContact CG-CE2 4.09Å; L382-L456 HydrophobicContact CD1-CD1 4.34Å; L382-L456 HydrophobicContact CD1-CD2 4.43Å; L382-L460 HydrophobicContact CD1-CD1 4.49Å; L382-L460 HydrophobicContact CD2-CD1 4.23Å; L382-K495 HydrophobicContact CD2-CB 3.84Å; L382-K495 HydrophobicContact CG-CB 4.34Å; L382-N496 HydrophobicContact CD2-CB 4.33Å; L382-N496 VanDerWaalsContact CD2-OD1 3.29Å; L382-N496 WeakPolarHBondContact CD2-OD1 3.48Å; L382-M499 HydrophobicContact CD1-CB 4.44Å; L382-M499 HydrophobicContact CD1-CE 3.58Å; L382-M499 HydrophobicContact CD1-SD 3.48Å; L382-M499 WeakPolarHBondContact CD1-SD 3.25Å
383	N	84.6	Confident	71.5	Confident	54 Å²	54	80.8 Å²	80.8	29%	0.289	40%	0.399	S	S	.	.			trans	-117.4	170.8	-172	67.9	47.7	0	0	0	114	E381 T385 G386 F387	E381-N383 PolarHBondContact O-N 3.19Å; E381-N383 PolarHBondContact O-ND2 3.27Å; N383-T385 VanDerWaalsContact C-N 3.28Å; N383-T385 PolarHBondContact O-N 3.2Å; N383-T385 WeakPolarHBondContact OD1-CB 3.26Å; N383-T385 PolarHBondContact OD1-N 3.14Å; N383-T385 VanDerWaalsContact OD1-N 3.1Å; N383-G386 VanDerWaalsContact O-CA 3.31Å; N383-G386 WeakPolarHBondContact O-CA 3.43Å; N383-G386 PolarHBondContact O-N 3.44Å; N383-G386 PolarHBondContact OD1-N 3.4Å; N383-F387 WeakPolarHBondContact O-CD2 3.49Å; N383-F387 PolarHBondContact O-N 3.13Å
384	E	85.2	Confident	74.2	Confident	116 Å²	116	75.4 Å²	75.4	54%	0.542	36%	0.363	S	S	.	.	H	α-helix	trans	-55.7	-36.5	-177.9	-69.6	-56	144.9	0	0	114.3	G386 F387 K388	E384-G386 VanDerWaalsContact C-N 3.28Å; E384-G386 PolarHBondContact O-N 2.89Å; E384-F387 PolarHBondContact O-N 3.12Å; E384-K388 WeakPolarHBondContact O-CB 3.42Å; E384-K388 PolarHBondContact O-N 3.49Å
385	T	85.3	Confident	76.8	Confident	48 Å²	48	72.9 Å²	72.9	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-39.9	175.6	-49.7	0	0	0	0	110.3	N383 K388 F389 F424 F425	N383-T385 VanDerWaalsContact C-N 3.28Å; N383-T385 PolarHBondContact O-N 3.2Å; N383-T385 WeakPolarHBondContact OD1-CB 3.26Å; N383-T385 PolarHBondContact OD1-N 3.14Å; N383-T385 VanDerWaalsContact OD1-N 3.1Å; T385-K388 PolarHBondContact O-N 3.15Å; T385-F389 WeakPolarHBondContact O-CB 3.37Å; T385-F389 PolarHBondContact O-N 3.11Å; T385-F424 HydrophobicContact CG2-CD1 4.46Å; T385-F424 HydrophobicContact CG2-CE1 4.4Å; T385-F425 HydrophobicContact CG2-CD1 3.71Å; T385-F425 HydrophobicContact CG2-CE1 3.84Å
386	G	88.4	Confident	79.3	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-47.4	171.6	0	0	0	0	0	113.6	N383 E384 K388 F389 V390 Y452	N383-G386 VanDerWaalsContact O-CA 3.31Å; N383-G386 WeakPolarHBondContact O-CA 3.43Å; N383-G386 PolarHBondContact O-N 3.44Å; N383-G386 PolarHBondContact OD1-N 3.4Å; E384-G386 VanDerWaalsContact C-N 3.28Å; E384-G386 PolarHBondContact O-N 2.89Å; G386-K388 VanDerWaalsContact C-N 3.32Å; G386-K388 PolarHBondContact O-N 3.41Å; G386-F389 WeakPolarHBondContact O-CB 3.35Å; G386-F389 PolarHBondContact O-N 2.92Å; G386-V390 WeakPolarHBondContact O-CG2 3.37Å; G386-V390 PolarHBondContact O-N 2.96Å; G386-Y452 VanDerWaalsContact CA-OH 3.26Å; G386-Y452 WeakPolarHBondContact CA-OH 3.4Å
387	F	91.4	Very high	82	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-41.5	173.1	-83.9	-93	0	0	0	112.3	L382 N383 E384 V390 R391 K495 E498 M499 M502	L382-F387 HydrophobicContact CD1-CE2 4.26Å; L382-F387 HydrophobicContact CG-CE2 4.09Å; N383-F387 WeakPolarHBondContact O-CD2 3.49Å; N383-F387 PolarHBondContact O-N 3.13Å; E384-F387 PolarHBondContact O-N 3.12Å; F387-V390 PolarHBondContact O-N 2.77Å; F387-R391 WeakPolarHBondContact O-CB 3.5Å; F387-R391 VanDerWaalsContact O-CG 3.3Å; F387-R391 WeakPolarHBondContact O-CG 3.37Å; F387-R391 PolarHBondContact O-N 3.08Å; F387-K495 HydrophobicContact CE2-CB 4.18Å; F387-K495 HydrophobicContact CE2-CD 4.45Å; F387-K495 HydrophobicContact CZ-CB 4.08Å; F387-K495 WeakPolarHBondContact CZ-O 3.48Å; F387-E498 HydrophobicContact CE1-CB 4.05Å; F387-E498 HydrophobicContact CE1-CG 3.89Å; F387-E498 VanDerWaalsContact CE1-OE1 3.32Å; F387-E498 WeakPolarHBondContact CE1-OE1 3.47Å; F387-E498 WeakPolarHBondContact CE1-OE2 3.48Å; F387-E498 HydrophobicContact CZ-CB 4.29Å; F387-M499 HydrophobicContact CB-CE 4.28Å; F387-M499 HydrophobicContact CD1-CE 3.83Å; F387-M499 HydrophobicContact CD2-CE 3.71Å; F387-M499 HydrophobicContact CE1-CB 3.76Å; F387-M499 HydrophobicContact CE1-CE 4.06Å; F387-M499 HydrophobicContact CE2-CE 3.96Å; F387-M499 HydrophobicContact CG-CE 3.65Å; F387-M499 HydrophobicContact CZ-CB 3.88Å; F387-M499 HydrophobicContact CZ-CE 4.14Å; F387-M502 HydrophobicContact CD1-CE 3.53Å; F387-M502 HydrophobicContact CE1-CE 3.96Å
388	K	89.6	Confident	84.3	Confident	103 Å²	103	51.3 Å²	51.3	45%	0.448	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-34.1	176.6	-171.9	173.8	175.4	-173.5	0	112.5	E384 T385 G386 K392 A431	E384-K388 WeakPolarHBondContact O-CB 3.42Å; E384-K388 PolarHBondContact O-N 3.49Å; T385-K388 PolarHBondContact O-N 3.15Å; G386-K388 VanDerWaalsContact C-N 3.32Å; G386-K388 PolarHBondContact O-N 3.41Å; K388-K392 WeakPolarHBondContact O-CB 3.5Å; K388-K392 PolarHBondContact O-N 3.33Å; K388-K392 VanDerWaalsContact O-N 3.15Å; K388-A431 HydrophobicContact CD-CB 3.6Å; K388-A431 HydrophobicContact CG-CB 4.17Å
389	F	90.8	Very high	86.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-54.4	171.4	177.4	-113.7	0	0	0	111.3	T385 G386 R391 K392 C393 L421 F424 F425 A448 Y452	T385-F389 WeakPolarHBondContact O-CB 3.37Å; T385-F389 PolarHBondContact O-N 3.11Å; G386-F389 WeakPolarHBondContact O-CB 3.35Å; G386-F389 PolarHBondContact O-N 2.92Å; F389-R391 PolarHBondContact O-N 3.33Å; F389-K392 PolarHBondContact O-N 3.42Å; F389-C393 PolarHBondContact O-N 3.18Å; F389-C393 PolarHBondContact O-SG 3.3Å; F389-L421 HydrophobicContact CE1-CD2 3.93Å; F389-L421 HydrophobicContact CE2-CD2 4.34Å; F389-L421 HydrophobicContact CZ-CD2 3.68Å; F389-F424 VanDerWaalsContact CA-CZ 3.48Å; F389-F424 HydrophobicContact CB-CD1 3.82Å; F389-F424 HydrophobicContact CB-CE1 3.48Å; F389-F424 VanDerWaalsContact CB-CE1 3.48Å; F389-F424 HydrophobicContact CB-CZ 3.95Å; F389-F424 HydrophobicContact CD2-CB 4.25Å; F389-F424 AromaticContact CD2-CD1 3.75Å; F389-F424 HydrophobicContact CD2-CD1 3.75Å; F389-F424 AromaticContact CD2-CD2 3.76Å; F389-F424 HydrophobicContact CD2-CD2 3.76Å; F389-F424 HydrophobicContact CD2-CE1 4.01Å; F389-F424 AromaticContact CD2-CE2 3.99Å; F389-F424 HydrophobicContact CD2-CE2 3.99Å; F389-F424 AromaticContact CD2-CG 3.63Å; F389-F424 HydrophobicContact CD2-CG 3.63Å; F389-F424 HydrophobicContact CD2-CZ 4.12Å; F389-F424 HydrophobicContact CE2-CD2 4.37Å; F389-F424 HydrophobicContact CE2-CG 4.33Å; F389-F424 HydrophobicContact CG-CD1 4.17Å; F389-F424 HydrophobicContact CG-CE1 4.23Å; F389-F424 HydrophobicContact CG-CG 4.48Å; F389-F425 HydrophobicContact CB-CE2 4.27Å; F389-F425 HydrophobicContact CB-CZ 3.81Å; F389-F425 HydrophobicContact CD1-CE2 4.08Å; F389-F425 HydrophobicContact CD1-CZ 4.09Å; F389-F425 HydrophobicContact CD2-CE2 4.31Å; F389-F425 AromaticContact CG-CE2 3.96Å; F389-F425 HydrophobicContact CG-CE2 3.96Å; F389-F425 AromaticContact CG-CZ 3.95Å; F389-F425 HydrophobicContact CG-CZ 3.95Å; F389-A448 HydrophobicContact CZ-CB 3.96Å; F389-Y452 HydrophobicContact CD1-CD1 4.08Å; F389-Y452 HydrophobicContact CD1-CD2 4.4Å; F389-Y452 AromaticContact CD1-CG 3.89Å; F389-Y452 HydrophobicContact CD1-CG 3.89Å; F389-Y452 HydrophobicContact CE1-CD1 4.45Å; F389-Y452 HydrophobicContact CE1-CG 4.02Å
390	V	93.8	Very high	88.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-46.8	-179.2	171.6	0	0	0	0	111.3	G386 F387 K392 C393 F394 L449 Y452 M499 M502	G386-V390 WeakPolarHBondContact O-CG2 3.37Å; G386-V390 PolarHBondContact O-N 2.96Å; F387-V390 PolarHBondContact O-N 2.77Å; V390-K392 PolarHBondContact O-N 2.88Å; V390-C393 PolarHBondContact O-N 3.49Å; V390-C393 VanDerWaalsContact O-N 3.16Å; V390-F394 HydrophobicContact CG1-CD2 4.03Å; V390-F394 HydrophobicContact CG1-CE1 3.92Å; V390-F394 HydrophobicContact CG1-CE2 3.33Å; V390-F394 HydrophobicContact CG1-CZ 3.25Å; V390-F394 WeakPolarHBondContact O-CG 3.14Å; V390-F394 PolarHBondContact O-N 2.69Å; V390-L449 HydrophobicContact CB-CD1 4.38Å; V390-L449 HydrophobicContact CG1-CD1 4.24Å; V390-L449 HydrophobicContact CG2-CD1 3.87Å; V390-Y452 HydrophobicContact CG2-CD1 3.84Å; V390-Y452 HydrophobicContact CG2-CE1 3.82Å; V390-M499 HydrophobicContact CB-CE 4.34Å; V390-M499 HydrophobicContact CG2-CE 3.99Å; V390-M499 HydrophobicContact CG2-SD 4.02Å; V390-M502 HydrophobicContact CG1-CE 4.37Å
391	R	93.5	Very high	89.5	Confident	103 Å²	103	48.1 Å²	48.1	39%	0.389	23%	0.231	S	C	.	.	H	α-helix	trans	-61.5	-36.8	176.5	-72.4	-170.9	-94.5	-112.4	12.9	113	F387 F389 N395 E498 M502	F387-R391 WeakPolarHBondContact O-CB 3.5Å; F387-R391 VanDerWaalsContact O-CG 3.3Å; F387-R391 WeakPolarHBondContact O-CG 3.37Å; F387-R391 PolarHBondContact O-N 3.08Å; F389-R391 PolarHBondContact O-N 3.33Å; R391-N395 PolarHBondContact O-N 3.41Å; R391-E498 IonicContact CZ-OE1 2.64Å; R391-E498 IonicContact NH1-OE1 2.69Å; R391-E498 PolarHBondContact NH1-OE1 2.88Å; R391-E498 IonicContact NH2-OE1 3.64Å; R391-M502 HydrophobicContact CG-CE 3.85Å; R391-M502 HydrophobicContact CG-SD 3.65Å; R391-M502 PolarHBondContact NH1-SD 2.95Å
392	K	91.6	Very high	90.6	Very high	64 Å²	64	44 Å²	44	28%	0.278	21%	0.213	S	C	.	.	H	α-helix	trans	-67.4	-41.8	172.5	-90.1	-174.2	165.2	-177.3	0	112.2	K388 F389 V390 Y396 F424 A431 V433 L435	K388-K392 WeakPolarHBondContact O-CB 3.5Å; K388-K392 PolarHBondContact O-N 3.33Å; K388-K392 VanDerWaalsContact O-N 3.15Å; F389-K392 PolarHBondContact O-N 3.42Å; V390-K392 PolarHBondContact O-N 2.88Å; K392-Y396 PolarHBondContact O-N 3.15Å; K392-F424 HydrophobicContact CD-CE2 3.78Å; K392-F424 HydrophobicContact CD-CZ 3.99Å; K392-A431 PolarHBondContact NZ-O 3.19Å; K392-V433 PolarHBondContact NZ-O 3.5Å; K392-L435 HydrophobicContact CB-CD1 3.91Å
393	C	93.8	Very high	90.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-46	179.1	-65.5	0	0	0	0	112	F389 V390 Y396 I397 I445 L449	F389-C393 PolarHBondContact O-N 3.18Å; F389-C393 PolarHBondContact O-SG 3.3Å; V390-C393 PolarHBondContact O-N 3.49Å; V390-C393 VanDerWaalsContact O-N 3.16Å; C393-Y396 PolarHBondContact O-N 3.16Å; C393-I397 WeakPolarHBondContact O-CD1 3.42Å; C393-I397 VanDerWaalsContact O-CG1 3.23Å; C393-I397 WeakPolarHBondContact O-CG1 3.35Å; C393-I397 PolarHBondContact O-N 3.48Å; C393-I445 HydrophobicContact CB-CG2 4.24Å; C393-L449 HydrophobicContact CB-CB 4.22Å; C393-L449 HydrophobicContact CB-CD1 4.43Å; C393-L449 HydrophobicContact CB-CD2 3.86Å; C393-L449 HydrophobicContact CB-CG 4.4Å
394	F	95.6	Very high	91.3	Very high	12 Å²	12	47.1 Å²	47.1	5%	0.053	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-51.3	176.8	-62.8	-21.8	0	0	0	111.6	V390 Y396 I397 E398 L449 M502 L503 H506	V390-F394 HydrophobicContact CG1-CD2 4.03Å; V390-F394 HydrophobicContact CG1-CE1 3.92Å; V390-F394 HydrophobicContact CG1-CE2 3.33Å; V390-F394 HydrophobicContact CG1-CZ 3.25Å; V390-F394 WeakPolarHBondContact O-CG 3.14Å; V390-F394 PolarHBondContact O-N 2.69Å; F394-Y396 VanDerWaalsContact C-N 3.32Å; F394-Y396 PolarHBondContact O-N 3.12Å; F394-I397 PolarHBondContact O-N 2.72Å; F394-E398 WeakPolarHBondContact O-CB 3.37Å; F394-E398 VanDerWaalsContact O-CG 3.26Å; F394-E398 WeakPolarHBondContact O-CG 3.3Å; F394-E398 PolarHBondContact O-N 3.25Å; F394-L449 HydrophobicContact CD1-CD2 3.85Å; F394-L449 HydrophobicContact CE1-CD1 4.3Å; F394-L449 HydrophobicContact CE1-CD2 3.65Å; F394-M502 HydrophobicContact CE2-CB 3.96Å; F394-M502 WeakPolarHBondContact CE2-O 3.37Å; F394-L503 HydrophobicContact CE1-CD1 3.66Å; F394-L503 HydrophobicContact CZ-CB 3.89Å; F394-L503 HydrophobicContact CZ-CD1 3.58Å; F394-L503 HydrophobicContact CZ-CG 4.35Å; F394-H506 HydrophobicContact CB-CB 4.49Å; F394-H506 HydrophobicContact CD1-CB 3.91Å; F394-H506 AromaticContact CD1-CD2 3.18Å; F394-H506 WeakPolarHBondContact CD1-CD2 3.34Å; F394-H506 AromaticContact CD1-CG 3.41Å; F394-H506 VanDerWaalsContact CD1-CG 3.41Å; F394-H506 AromaticContact CD1-NE2 3.71Å; F394-H506 HydrophobicContact CD2-CB 4Å; F394-H506 HydrophobicContact CE1-CB 4.05Å; F394-H506 AromaticContact CE1-CD2 3.45Å; F394-H506 VanDerWaalsContact CE1-CD2 3.45Å; F394-H506 WeakPolarHBondContact CE1-CD2 3.38Å; F394-H506 AromaticContact CE1-CG 3.85Å; F394-H506 HydrophobicContact CE2-CB 4.16Å; F394-H506 HydrophobicContact CG-CB 3.9Å; F394-H506 AromaticContact CG-CD2 3.94Å; F394-H506 AromaticContact CG-CG 3.67Å; F394-H506 HydrophobicContact CZ-CB 4.19Å
395	N	93.3	Very high	91.6	Very high	97 Å²	97	46.6 Å²	46.6	52%	0.519	23%	0.227	S	C	.	.	H	α-helix	trans	-55.9	-43.9	-179.3	-175.9	-73.6	0	0	0	112.6	R391 T399	R391-N395 PolarHBondContact O-N 3.41Å; N395-T399 WeakPolarHBondContact O-CB 3.26Å; N395-T399 WeakPolarHBondContact O-CG2 3.47Å; N395-T399 PolarHBondContact O-N 2.85Å; N395-T399 VanDerWaalsContact O-N 3.14Å; N395-T399 PolarHBondContact O-OG1 3.13Å
396	Y	93.8	Very high	91.7	Very high	16 Å²	16	44.3 Å²	44.3	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-49.2	174.2	179.4	-80	0	0	0	111.7	K392 C393 F394 E398 T399 K400 L435 D442 I445	K392-Y396 PolarHBondContact O-N 3.15Å; C393-Y396 PolarHBondContact O-N 3.16Å; F394-Y396 VanDerWaalsContact C-N 3.32Å; F394-Y396 PolarHBondContact O-N 3.12Å; Y396-E398 PolarHBondContact O-N 2.93Å; Y396-T399 PolarHBondContact O-N 3.11Å; Y396-T399 PolarHBondContact O-OG1 3.4Å; Y396-K400 HydrophobicContact CD2-CD 4.04Å; Y396-K400 HydrophobicContact CE1-CB 4.44Å; Y396-K400 HydrophobicContact CE2-CD 3.77Å; Y396-K400 WeakPolarHBondContact O-CB 3.46Å; Y396-K400 PolarHBondContact O-N 3.02Å; Y396-L435 HydrophobicContact CD2-CB 3.92Å; Y396-L435 WeakPolarHBondContact CD2-O 3.43Å; Y396-L435 WeakPolarHBondContact CE2-O 3.4Å; Y396-L435 HydrophobicContact CG-CB 4.39Å; Y396-D442 WeakPolarHBondContact CE1-OD1 3.16Å; Y396-D442 PolarHBondContact OH-OD1 3.12Å; Y396-I445 HydrophobicContact CD1-CD1 3.72Å; Y396-I445 HydrophobicContact CD1-CG2 4.25Å; Y396-I445 HydrophobicContact CD2-CD1 3.96Å; Y396-I445 HydrophobicContact CE1-CD1 3.46Å; Y396-I445 VanDerWaalsContact CE1-CD1 3.46Å; Y396-I445 HydrophobicContact CE2-CD1 3.68Å; Y396-I445 HydrophobicContact CG-CD1 3.96Å; Y396-I445 VanDerWaalsContact CZ-CD1 3.4Å
397	I	94.9	Very high	91.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-65	-43	-175.8	-66.8	164	0	0	0	110.4	C393 F394 T399 A401 A402 V407 Y408 I445 T446 L449 V510	C393-I397 WeakPolarHBondContact O-CD1 3.42Å; C393-I397 VanDerWaalsContact O-CG1 3.23Å; C393-I397 WeakPolarHBondContact O-CG1 3.35Å; C393-I397 PolarHBondContact O-N 3.48Å; F394-I397 PolarHBondContact O-N 2.72Å; I397-T399 VanDerWaalsContact C-N 3.31Å; I397-T399 PolarHBondContact O-N 2.85Å; I397-A401 HydrophobicContact CG2-CB 4.35Å; I397-A401 CarbonylContact O-C 3.54Å; I397-A401 VanDerWaalsContact O-C 3.3Å; I397-A401 WeakPolarHBondContact O-CA 3.34Å; I397-A401 PolarHBondContact O-N 2.61Å; I397-A402 PolarHBondContact O-N 3.37Å; I397-V407 HydrophobicContact CG2-CG2 4.11Å; I397-Y408 HydrophobicContact CD1-CE1 4.22Å; I397-Y408 HydrophobicContact CD1-CE2 4.37Å; I397-Y408 VanDerWaalsContact CD1-OH 3.28Å; I397-Y408 WeakPolarHBondContact CD1-OH 3.41Å; I397-Y408 HydrophobicContact CG2-CE2 4.18Å; I397-I445 HydrophobicContact CD1-CG2 4.28Å; I397-I445 HydrophobicContact CG1-CG2 4.33Å; I397-T446 HydrophobicContact CD1-CG2 3.62Å; I397-T446 HydrophobicContact CG1-CG2 4.04Å; I397-L449 HydrophobicContact CD1-CD2 4.13Å; I397-V510 HydrophobicContact CG2-CG2 4.45Å
398	E	93.5	Very high	92	Very high	70 Å²	70	44.7 Å²	44.7	33%	0.327	22%	0.215	S	C	.	.	I	π-helix	trans	-67.1	-28.1	179.1	-66.1	178.7	145.7	0	0	113.4	F394 Y396 H506 N509	F394-E398 WeakPolarHBondContact O-CB 3.37Å; F394-E398 VanDerWaalsContact O-CG 3.26Å; F394-E398 WeakPolarHBondContact O-CG 3.3Å; F394-E398 PolarHBondContact O-N 3.25Å; Y396-E398 PolarHBondContact O-N 2.93Å; E398-H506 VanDerWaalsContact CD-ND1 3.27Å; E398-H506 VanDerWaalsContact CG-CE1 3.45Å; E398-H506 WeakPolarHBondContact CG-CE1 3.34Å; E398-H506 WeakPolarHBondContact CG-ND1 3.29Å; E398-H506 IonicContact OE1-CE1 3.75Å; E398-H506 IonicContact OE1-CG 2.63Å; E398-H506 IonicContact OE1-ND1 3.86Å; E398-H506 PolarHBondContact OE1-ND1 3.1Å; E398-N509 WeakPolarHBondContact CG-ND2 3.3Å; E398-N509 PolarHBondContact OE1-ND2 2.97Å
399	T	91.1	Very high	92.1	Very high	92 Å²	92	46.2 Å²	46.2	56%	0.564	22%	0.218	S	C	*	.	I	π-helix	trans	-96.7	-19.8	-178.6	55.6	0	0	0	0	114.5	N395 Y396 I397	N395-T399 WeakPolarHBondContact O-CB 3.26Å; N395-T399 WeakPolarHBondContact O-CG2 3.47Å; N395-T399 PolarHBondContact O-N 2.85Å; N395-T399 VanDerWaalsContact O-N 3.14Å; N395-T399 PolarHBondContact O-OG1 3.13Å; Y396-T399 PolarHBondContact O-N 3.11Å; Y396-T399 PolarHBondContact O-OG1 3.4Å; I397-T399 VanDerWaalsContact C-N 3.31Å; I397-T399 PolarHBondContact O-N 2.85Å
400	K	88.6	Confident	92	Very high	106 Å²	106	48.6 Å²	48.6	46%	0.461	23%	0.233	S	C	.	.	I	π-helix	trans	-130.5	-27.8	-173.8	-70.8	178.8	167.5	175.1	0	116	Y396 N436	Y396-K400 HydrophobicContact CD2-CD 4.04Å; Y396-K400 HydrophobicContact CE1-CB 4.44Å; Y396-K400 HydrophobicContact CE2-CD 3.77Å; Y396-K400 WeakPolarHBondContact O-CB 3.46Å; Y396-K400 PolarHBondContact O-N 3.02Å; K400-N436 WeakPolarHBondContact CE-OD1 3.48Å; K400-N436 PolarHBondContact NZ-OD1 3.32Å
401	A	90.1	Very high	91.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-123.2	6.1	-171	0	0	0	0	0	114.1	I397 T403 Q404 D442	I397-A401 HydrophobicContact CG2-CB 4.35Å; I397-A401 CarbonylContact O-C 3.54Å; I397-A401 VanDerWaalsContact O-C 3.3Å; I397-A401 WeakPolarHBondContact O-CA 3.34Å; I397-A401 PolarHBondContact O-N 2.61Å; A401-T403 VanDerWaalsContact C-N 3.3Å; A401-T403 PolarHBondContact O-N 2.81Å; A401-Q404 HydrophobicContact CB-CB 4.4Å; A401-Q404 WeakPolarHBondContact O-CB 3.27Å; A401-Q404 PolarHBondContact O-N 3.01Å; A401-Q404 VanDerWaalsContact O-N 3.16Å; A401-D442 HydrophobicContact CB-CB 3.94Å
402	A	90.4	Very high	91.2	Very high	9 Å²	9	48.9 Å²	48.9	7%	0.074	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.1	-174.7	0	0	0	0	0	112.8	I397 N517	I397-A402 PolarHBondContact O-N 3.37Å; A402-N517 WeakPolarHBondContact O-CB 3.49Å; A402-N517 PolarHBondContact O-ND2 3.41Å
403	T	90.8	Very high	91	Very high	62 Å²	62	48.3 Å²	48.3	38%	0.38	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0.6	178.7	53.4	0	0	0	0	113.6	A401 E405 H513 E516	A401-T403 VanDerWaalsContact C-N 3.3Å; A401-T403 PolarHBondContact O-N 2.81Å; T403-E405 PolarHBondContact O-N 2.96Å; T403-H513 HydrophobicContact CG2-CB 4.32Å; T403-E516 VanDerWaalsContact CB-OE2 3.27Å; T403-E516 WeakPolarHBondContact CB-OE2 3.4Å; T403-E516 HydrophobicContact CG2-CB 4.21Å; T403-E516 VanDerWaalsContact CG2-OE2 3.23Å; T403-E516 WeakPolarHBondContact CG2-OE2 3.31Å
404	Q	92.3	Very high	90.4	Very high	91 Å²	91	53.7 Å²	53.7	43%	0.425	28%	0.281	S	S	.	.	S	Bend	trans	-69.5	122.5	-176.4	175.5	53.2	54.5	0	0	111.4	A401 G406 V407 N517	A401-Q404 HydrophobicContact CB-CB 4.4Å; A401-Q404 WeakPolarHBondContact O-CB 3.27Å; A401-Q404 PolarHBondContact O-N 3.01Å; A401-Q404 VanDerWaalsContact O-N 3.16Å; Q404-G406 PolarHBondContact O-N 3.5Å; Q404-V407 WeakPolarHBondContact O-CB 3.34Å; Q404-V407 PolarHBondContact O-N 2.92Å; Q404-N517 WeakPolarHBondContact O-CB 3.46Å
405	E	91.2	Very high	89.7	Confident	105 Å²	105	59.8 Å²	59.8	49%	0.491	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	125.3	-179.9	-161	-142.3	129.7	0	0	111.4	T403 V407 R409 L518	T403-E405 PolarHBondContact O-N 2.96Å; E405-V407 VanDerWaalsContact C-N 3.31Å; E405-V407 PolarHBondContact O-N 3.3Å; E405-R409 IonicContact OE1-NH2 4Å; E405-L518 HydrophobicContact CG-CD1 3.76Å; E405-L518 HydrophobicContact CG-CG 4.1Å
406	G	88.3	Confident	89.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.01	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	30.6	-179.5	0	0	0	0	0	114	Q404 R409 T410 N517	Q404-G406 PolarHBondContact O-N 3.5Å; G406-R409 WeakPolarHBondContact O-CB 3.5Å; G406-R409 PolarHBondContact O-N 3.12Å; G406-T410 PolarHBondContact O-N 3.45Å; G406-T410 PolarHBondContact O-OG1 2.86Å; G406-T410 VanDerWaalsContact O-OG1 3.1Å; G406-N517 PolarHBondContact N-O 3.43Å
407	V	91.6	Very high	88.8	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.036	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	137.8	165.1	66.5	0	0	0	0	109.8	I397 Q404 E405 R409 T446 V510 N517 M519	I397-V407 HydrophobicContact CG2-CG2 4.11Å; Q404-V407 WeakPolarHBondContact O-CB 3.34Å; Q404-V407 PolarHBondContact O-N 2.92Å; E405-V407 VanDerWaalsContact C-N 3.31Å; E405-V407 PolarHBondContact O-N 3.3Å; V407-R409 PolarHBondContact O-N 2.95Å; V407-T446 HydrophobicContact CG2-CG2 4.01Å; V407-V510 HydrophobicContact CG1-CG1 3.67Å; V407-N517 HydrophobicContact CG1-CB 4.02Å; V407-M519 HydrophobicContact CG1-CG 3.94Å; V407-M519 WeakPolarHBondContact O-CG 3.34Å
408	Y	94.4	Very high	88.2	Confident	1 Å²	1	61 Å²	61	0%	0.004	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-26.9	-166.3	-65.3	-79	0	0	0	117.6	I397 T446 L449 K450 H506 V510 M524 F528	I397-Y408 HydrophobicContact CD1-CE1 4.22Å; I397-Y408 HydrophobicContact CD1-CE2 4.37Å; I397-Y408 VanDerWaalsContact CD1-OH 3.28Å; I397-Y408 WeakPolarHBondContact CD1-OH 3.41Å; I397-Y408 HydrophobicContact CG2-CE2 4.18Å; Y408-T446 HydrophobicContact CD1-CG2 3.9Å; Y408-T446 HydrophobicContact CD2-CG2 4.35Å; Y408-T446 HydrophobicContact CE1-CG2 3.93Å; Y408-T446 HydrophobicContact CE2-CG2 4.4Å; Y408-T446 HydrophobicContact CG-CG2 4.13Å; Y408-L449 HydrophobicContact CE1-CD2 3.84Å; Y408-L449 HydrophobicContact CE1-CG 4.46Å; Y408-L449 WeakPolarHBondContact OH-CD2 3.39Å; Y408-K450 HydrophobicContact CD1-CD 4.13Å; Y408-K450 HydrophobicContact CD1-CG 4.1Å; Y408-K450 PolarHBondContact O-NZ 3.5Å; Y408-H506 AromaticContact CE2-NE2 3.6Å; Y408-H506 AromaticContact CZ-NE2 3.59Å; Y408-H506 PolarHBondContact OH-CD2 2.92Å; Y408-H506 PolarHBondContact OH-NE2 3.19Å; Y408-V510 HydrophobicContact CE2-CG2 4.41Å; Y408-M524 HydrophobicContact CD2-CE 3.64Å; Y408-M524 HydrophobicContact CD2-SD 4.36Å; Y408-M524 HydrophobicContact CE2-CE 4.15Å; Y408-M524 HydrophobicContact CG-CE 4.24Å; Y408-F528 AromaticContact CD1-CE2 3.83Å; Y408-F528 HydrophobicContact CD1-CE2 3.83Å; Y408-F528 AromaticContact CD1-CZ 3.68Å; Y408-F528 HydrophobicContact CD1-CZ 3.68Å; Y408-F528 HydrophobicContact CD2-CE2 4.36Å; Y408-F528 HydrophobicContact CE1-CE2 4.14Å; Y408-F528 AromaticContact CE1-CZ 3.63Å; Y408-F528 HydrophobicContact CE1-CZ 3.63Å; Y408-F528 AromaticContact CG-CE2 3.92Å; Y408-F528 HydrophobicContact CG-CE2 3.92Å; Y408-F528 HydrophobicContact CG-CZ 4.24Å
409	R	92	Very high	87.8	Confident	135 Å²	135	62.9 Å²	62.9	51%	0.509	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-39.6	174.5	-164.4	179.6	81.6	-156.5	-1.4	111.3	E405 G406 V407 M519 I527	E405-R409 IonicContact OE1-NH2 4Å; G406-R409 WeakPolarHBondContact O-CB 3.5Å; G406-R409 PolarHBondContact O-N 3.12Å; V407-R409 PolarHBondContact O-N 2.95Å; R409-M519 HydrophobicContact CB-CE 4.1Å; R409-M519 HydrophobicContact CB-SD 3.91Å; R409-I527 HydrophobicContact CB-CD1 4.1Å
410	T	88	Confident	87.5	Confident	51 Å²	51	58.5 Å²	58.5	31%	0.313	30%	0.296	S	S	.	.	S	Bend	trans	-74.3	147.7	178.9	-49.3	0	0	0	0	111.3	G406 K443 K450	G406-T410 PolarHBondContact O-N 3.45Å; G406-T410 PolarHBondContact O-OG1 2.86Å; G406-T410 VanDerWaalsContact O-OG1 3.1Å; T410-K443 HydrophobicContact CG2-CB 4.5Å; T410-K443 HydrophobicContact CG2-CD 3.65Å; T410-K443 HydrophobicContact CG2-CG 3.82Å; T410-K450 PolarHBondContact O-NZ 2.99Å
411	V	86.4	Confident	87.4	Confident	99 Å²	99	54 Å²	54	60%	0.6	28%	0.277	S	S	*	.			trans	-108.9	130.4	-177.7	-176.8	0	0	0	0	109.8
412	G	84.6	Confident	87.1	Confident	9 Å²	9	59.1 Å²	59.1	9%	0.093	30%	0.304	C	S	.	.			trans	-83.3	171.7	174.2	0	0	0	0	0	112.7	N414 K443 S447	G412-N414 PolarHBondContact O-N 3.4Å; G412-K443 WeakPolarHBondContact CA-O 3.46Å; G412-K443 PolarHBondContact N-O 3.41Å; G412-S447 PolarHBondContact N-OG 3.34Å
413	S	86.6	Confident	86.7	Confident	52 Å²	52	61.2 Å²	61.2	36%	0.364	32%	0.318	S	S	.	.			trans	-64.2	122.7	178.3	179.7	0	0	0	0	111	I415 Q416 V417	S413-I415 PolarHBondContact O-N 3.15Å; S413-I415 VanDerWaalsContact O-N 3.09Å; S413-Q416 PolarHBondContact O-N 3.17Å; S413-V417 WeakPolarHBondContact O-CG2 3.47Å; S413-V417 PolarHBondContact O-N 3.49Å
414	N	80.1	Confident	86.3	Confident	113 Å²	113	58.3 Å²	58.3	60%	0.604	30%	0.3	S	S	*	.	H	α-helix	trans	-53.7	-33.2	176.7	-77.5	-52.9	0	0	0	112.4	G412 V417 Q418	G412-N414 PolarHBondContact O-N 3.4Å; N414-V417 PolarHBondContact O-N 3.33Å; N414-Q418 WeakPolarHBondContact O-CG 3.42Å; N414-Q418 PolarHBondContact O-N 3.04Å
415	I	81.3	Confident	85.7	Confident	140 Å²	140	56.7 Å²	56.7	72%	0.718	29%	0.292	S	S	*	.	H	α-helix	trans	-69.4	-44.1	178.5	-59.4	175.6	0	0	0	110.8	S413 K419	S413-I415 PolarHBondContact O-N 3.15Å; S413-I415 VanDerWaalsContact O-N 3.09Å; I415-K419 WeakPolarHBondContact O-CB 3.38Å; I415-K419 PolarHBondContact O-N 3.38Å
416	Q	83.8	Confident	85	Confident	67 Å²	67	55.5 Å²	55.5	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-68.3	-36.2	175.6	-69.7	165.5	-93.8	0	0	111.5	S413 K419 L420 D441 T444	S413-Q416 PolarHBondContact O-N 3.17Å; Q416-K419 PolarHBondContact O-N 3.03Å; Q416-L420 WeakPolarHBondContact O-CB 3.21Å; Q416-L420 PolarHBondContact O-N 2.9Å; Q416-D441 PolarHBondContact NE2-OD2 3.05Å; Q416-T444 HydrophobicContact CB-CG2 3.72Å
417	V	85.6	Confident	83.8	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-49	174.5	167.1	0	0	0	0	111.6	S413 N414 L420 L421 T444 A448 F451	S413-V417 WeakPolarHBondContact O-CG2 3.47Å; S413-V417 PolarHBondContact O-N 3.49Å; N414-V417 PolarHBondContact O-N 3.33Å; V417-L420 PolarHBondContact O-N 3.01Å; V417-L421 HydrophobicContact CG1-CD1 3.92Å; V417-L421 WeakPolarHBondContact O-CG 3.21Å; V417-L421 PolarHBondContact O-N 3.1Å; V417-T444 HydrophobicContact CG2-CG2 4.19Å; V417-A448 HydrophobicContact CG1-CB 4.1Å; V417-F451 HydrophobicContact CG1-CB 4.16Å; V417-F451 HydrophobicContact CG1-CG 4.38Å
418	Q	82.7	Confident	82.3	Confident	71 Å²	71	68.4 Å²	68.4	33%	0.332	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-38.1	176.5	-65.9	-56.9	-57.5	0	0	111.7	N414 N422	N414-Q418 WeakPolarHBondContact O-CG 3.42Å; N414-Q418 PolarHBondContact O-N 3.04Å; Q418-N422 VanDerWaalsContact O-CB 3.3Å; Q418-N422 WeakPolarHBondContact O-CB 3.47Å; Q418-N422 PolarHBondContact O-N 2.93Å; Q418-N422 PolarHBondContact O-ND2 3.43Å
419	K	83.9	Confident	80.5	Confident	109 Å²	109	73 Å²	73	47%	0.474	38%	0.375	S	S	.	.	H	α-helix	trans	-59.1	-48.6	173.5	-170.8	-164.7	173.3	-158.6	0	111.2	I415 Q416 N422 S423 W440	I415-K419 WeakPolarHBondContact O-CB 3.38Å; I415-K419 PolarHBondContact O-N 3.38Å; Q416-K419 PolarHBondContact O-N 3.03Å; K419-N422 PolarHBondContact O-N 2.97Å; K419-S423 WeakPolarHBondContact O-CB 3.42Å; K419-S423 PolarHBondContact O-N 3.44Å; K419-S423 PolarHBondContact O-OG 3.18Å; K419-W440 HydrophobicContact CB-CH2 4.4Å; K419-W440 HydrophobicContact CB-CZ3 4.31Å; K419-W440 HydrophobicContact CD-CH2 3.84Å; K419-W440 HydrophobicContact CD-CZ3 4.04Å; K419-W440 HydrophobicContact CG-CH2 3.99Å; K419-W440 HydrophobicContact CG-CZ3 4.31Å
420	L	85.8	Confident	78.7	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.4	-47.6	-179.9	178.1	53.8	0	0	0	111.9	Q416 V417 S423 F424 V433 L435 W440 T444 I445 A448	Q416-L420 WeakPolarHBondContact O-CB 3.21Å; Q416-L420 PolarHBondContact O-N 2.9Å; V417-L420 PolarHBondContact O-N 3.01Å; L420-S423 PolarHBondContact O-N 2.72Å; L420-F424 WeakPolarHBondContact O-CB 3.36Å; L420-F424 PolarHBondContact O-N 2.84Å; L420-V433 HydrophobicContact CD1-CG1 4.11Å; L420-L435 HydrophobicContact CD1-CD2 3.8Å; L420-L435 HydrophobicContact CD2-CD2 4.44Å; L420-W440 HydrophobicContact CB-CE3 3.88Å; L420-W440 HydrophobicContact CB-CH2 3.99Å; L420-W440 HydrophobicContact CB-CZ3 3.59Å; L420-W440 HydrophobicContact CD1-CD2 3.97Å; L420-W440 HydrophobicContact CD1-CE3 4.21Å; L420-W440 HydrophobicContact CD1-CH2 4.23Å; L420-W440 HydrophobicContact CD1-CZ2 4.02Å; L420-W440 HydrophobicContact CD1-CZ3 4.34Å; L420-W440 HydrophobicContact CD2-CE3 4.37Å; L420-W440 HydrophobicContact CG-CE3 4.37Å; L420-W440 HydrophobicContact CG-CZ3 4.46Å; L420-T444 HydrophobicContact CD2-CG2 4.22Å; L420-I445 HydrophobicContact CD2-CG1 4.07Å; L420-A448 HydrophobicContact CD2-CB 3.83Å; L420-A448 HydrophobicContact CG-CB 4.36Å
421	L	85.9	Confident	77.1	Confident	12 Å²	12	68 Å²	68	6%	0.063	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-49.7	178.5	-70.2	166.6	0	0	0	111.3	F389 V417 S423 F424 F425 A448 F451	F389-L421 HydrophobicContact CE1-CD2 3.93Å; F389-L421 HydrophobicContact CE2-CD2 4.34Å; F389-L421 HydrophobicContact CZ-CD2 3.68Å; V417-L421 HydrophobicContact CG1-CD1 3.92Å; V417-L421 WeakPolarHBondContact O-CG 3.21Å; V417-L421 PolarHBondContact O-N 3.1Å; L421-S423 VanDerWaalsContact C-N 3.34Å; L421-S423 PolarHBondContact O-N 3.32Å; L421-F424 PolarHBondContact O-N 3.34Å; L421-F424 VanDerWaalsContact O-N 3.1Å; L421-F425 HydrophobicContact CD2-CD2 4.38Å; L421-F425 HydrophobicContact CD2-CE2 4.02Å; L421-F425 WeakPolarHBondContact O-CD2 3.34Å; L421-F425 PolarHBondContact O-N 3.43Å; L421-A448 HydrophobicContact CD2-CB 4.27Å; L421-A448 HydrophobicContact CG-CB 4.18Å; L421-F451 HydrophobicContact CD1-CB 4.17Å; L421-F451 HydrophobicContact CD1-CD1 3.33Å; L421-F451 HydrophobicContact CD1-CE1 3.98Å; L421-F451 HydrophobicContact CD1-CG 3.96Å
422	N	83.8	Confident	76	Confident	106 Å²	106	69.2 Å²	69.2	57%	0.567	37%	0.365	S	S	*	.	H	α-helix	trans	-60.1	-43.9	178.4	-68.2	-12.3	0	0	0	111.5	Q418 K419 F424 D426	Q418-N422 VanDerWaalsContact O-CB 3.3Å; Q418-N422 WeakPolarHBondContact O-CB 3.47Å; Q418-N422 PolarHBondContact O-N 2.93Å; Q418-N422 PolarHBondContact O-ND2 3.43Å; K419-N422 PolarHBondContact O-N 2.97Å; N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 PolarHBondContact O-N 2.84Å; N422-D426 WeakPolarHBondContact O-CB 3.47Å; N422-D426 PolarHBondContact O-N 3.06Å
423	S	82.8	Confident	75.4	Confident	54 Å²	54	70 Å²	70	38%	0.378	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-23	176.4	-67.9	0	0	0	0	114.3	K419 L420 L421 V433	K419-S423 WeakPolarHBondContact O-CB 3.42Å; K419-S423 PolarHBondContact O-N 3.44Å; K419-S423 PolarHBondContact O-OG 3.18Å; L420-S423 PolarHBondContact O-N 2.72Å; L421-S423 VanDerWaalsContact C-N 3.34Å; L421-S423 PolarHBondContact O-N 3.32Å; S423-V433 VanDerWaalsContact O-CG2 3.23Å; S423-V433 WeakPolarHBondContact O-CG2 3.4Å
424	F	81.2	Confident	75	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-87.4	-37.7	178.7	-158.9	-78.2	0	0	0	112.9	T385 F389 K392 L420 L421 N422 A431 V433	T385-F424 HydrophobicContact CG2-CD1 4.46Å; T385-F424 HydrophobicContact CG2-CE1 4.4Å; F389-F424 VanDerWaalsContact CA-CZ 3.48Å; F389-F424 HydrophobicContact CB-CD1 3.82Å; F389-F424 HydrophobicContact CB-CE1 3.48Å; F389-F424 VanDerWaalsContact CB-CE1 3.48Å; F389-F424 HydrophobicContact CB-CZ 3.95Å; F389-F424 HydrophobicContact CD2-CB 4.25Å; F389-F424 AromaticContact CD2-CD1 3.75Å; F389-F424 HydrophobicContact CD2-CD1 3.75Å; F389-F424 AromaticContact CD2-CD2 3.76Å; F389-F424 HydrophobicContact CD2-CD2 3.76Å; F389-F424 HydrophobicContact CD2-CE1 4.01Å; F389-F424 AromaticContact CD2-CE2 3.99Å; F389-F424 HydrophobicContact CD2-CE2 3.99Å; F389-F424 AromaticContact CD2-CG 3.63Å; F389-F424 HydrophobicContact CD2-CG 3.63Å; F389-F424 HydrophobicContact CD2-CZ 4.12Å; F389-F424 HydrophobicContact CE2-CD2 4.37Å; F389-F424 HydrophobicContact CE2-CG 4.33Å; F389-F424 HydrophobicContact CG-CD1 4.17Å; F389-F424 HydrophobicContact CG-CE1 4.23Å; F389-F424 HydrophobicContact CG-CG 4.48Å; K392-F424 HydrophobicContact CD-CE2 3.78Å; K392-F424 HydrophobicContact CD-CZ 3.99Å; L420-F424 WeakPolarHBondContact O-CB 3.36Å; L420-F424 PolarHBondContact O-N 2.84Å; L421-F424 PolarHBondContact O-N 3.34Å; L421-F424 VanDerWaalsContact O-N 3.1Å; N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 PolarHBondContact O-N 2.84Å; F424-A431 HydrophobicContact CD1-CB 4.27Å; F424-A431 HydrophobicContact CE1-CB 3.52Å; F424-A431 HydrophobicContact CE2-CB 4.4Å; F424-A431 HydrophobicContact CZ-CB 3.6Å; F424-A431 PolarHBondContact O-N 3.43Å; F424-V433 HydrophobicContact CB-CG2 4.45Å; F424-V433 HydrophobicContact CD2-CB 3.93Å; F424-V433 HydrophobicContact CD2-CG2 4.19Å; F424-V433 HydrophobicContact CE2-CB 4.45Å
425	F	80.8	Confident	75.1	Confident	57 Å²	57	66.2 Å²	66.2	25%	0.25	34%	0.344	C	S	.	.	H	α-helix	trans	-97.7	-1.6	-175.7	-70.1	-79.7	0	0	0	114.3	T385 F389 L421 R427 Y452	T385-F425 HydrophobicContact CG2-CD1 3.71Å; T385-F425 HydrophobicContact CG2-CE1 3.84Å; F389-F425 HydrophobicContact CB-CE2 4.27Å; F389-F425 HydrophobicContact CB-CZ 3.81Å; F389-F425 HydrophobicContact CD1-CE2 4.08Å; F389-F425 HydrophobicContact CD1-CZ 4.09Å; F389-F425 HydrophobicContact CD2-CE2 4.31Å; F389-F425 AromaticContact CG-CE2 3.96Å; F389-F425 HydrophobicContact CG-CE2 3.96Å; F389-F425 AromaticContact CG-CZ 3.95Å; F389-F425 HydrophobicContact CG-CZ 3.95Å; L421-F425 HydrophobicContact CD2-CD2 4.38Å; L421-F425 HydrophobicContact CD2-CE2 4.02Å; L421-F425 WeakPolarHBondContact O-CD2 3.34Å; L421-F425 PolarHBondContact O-N 3.43Å; F425-R427 PolarHBondContact O-N 2.94Å; F425-Y452 HydrophobicContact CE1-CD2 4.48Å; F425-Y452 HydrophobicContact CE1-CE2 4.03Å; F425-Y452 AromaticContact CE2-CD2 3.91Å; F425-Y452 HydrophobicContact CE2-CD2 3.91Å; F425-Y452 HydrophobicContact CE2-CE2 4.28Å; F425-Y452 AromaticContact CZ-CD2 3.59Å; F425-Y452 HydrophobicContact CZ-CD2 3.59Å; F425-Y452 AromaticContact CZ-CE2 3.51Å; F425-Y452 HydrophobicContact CZ-CE2 3.51Å; F425-Y452 HydrophobicContact CZ-CG 4.47Å
426	D	76.5	Confident	74.7	Confident	81 Å²	81	63.3 Å²	63.3	43%	0.433	33%	0.329	S	S	.	.			trans	-58.3	129.3	171.2	-177.6	8.1	0	0	0	111.3	N422 S428 N429	N422-D426 WeakPolarHBondContact O-CB 3.47Å; N422-D426 PolarHBondContact O-N 3.06Å; D426-S428 VanDerWaalsContact CG-OG 3.23Å; D426-S428 PolarHBondContact O-N 2.89Å; D426-S428 PolarHBondContact OD1-N 3.45Å; D426-S428 WeakPolarHBondContact OD2-CB 3.42Å; D426-S428 PolarHBondContact OD2-OG 3.35Å; D426-N429 PolarHBondContact O-N 2.9Å
427	R	62.4	Low	74.2	Confident	185 Å²	185	62 Å²	62	70%	0.698	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.7	177.9	-53.9	-176.6	-168	-146.2	1.8	112.4	E379 F425	E379-R427 IonicContact OE1-CZ 2.71Å; E379-R427 IonicContact OE1-NE 3.49Å; E379-R427 IonicContact OE1-NH2 3.31Å; E379-R427 PolarHBondContact OE1-NH2 2.99Å; F425-R427 PolarHBondContact O-N 2.94Å
428	S	59.4	Low	73.4	Confident	92 Å²	92	67.8 Å²	67.8	64%	0.643	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-28.8	179.4	83.8	0	0	0	0	114	D426	D426-S428 VanDerWaalsContact CG-OG 3.23Å; D426-S428 PolarHBondContact O-N 2.89Å; D426-S428 PolarHBondContact OD1-N 3.45Å; D426-S428 WeakPolarHBondContact OD2-CB 3.42Å; D426-S428 PolarHBondContact OD2-OG 3.35Å
429	N	57.2	Low	73.1	Confident	97 Å²	97	68.9 Å²	68.9	52%	0.519	38%	0.377	S	S	.	.	S	Bend	trans	-154.5	63.3	-176	-164.3	-1.5	0	0	0	113	D426 A431	D426-N429 PolarHBondContact O-N 2.9Å; N429-A431 PolarHBondContact O-N 2.8Å
430	P	53.6	Low	73.1	Confident	78 Å²	78	64.6 Å²	64.6	51%	0.506	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	119.4	-166.1	22	-33.5	0	0	0	114.4	N432	P430-N432 VanDerWaalsContact C-N 3.34Å; P430-N432 PolarHBondContact O-N 2.83Å
431	A	56	Low	73.2	Confident	3 Å²	3	67.2 Å²	67.2	3%	0.025	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	21.6	168.6	0	0	0	0	0	117.8	K388 K392 F424 N429 V433	K388-A431 HydrophobicContact CD-CB 3.6Å; K388-A431 HydrophobicContact CG-CB 4.17Å; K392-A431 PolarHBondContact NZ-O 3.19Å; F424-A431 HydrophobicContact CD1-CB 4.27Å; F424-A431 HydrophobicContact CE1-CB 3.52Å; F424-A431 HydrophobicContact CE2-CB 4.4Å; F424-A431 HydrophobicContact CZ-CB 3.6Å; F424-A431 PolarHBondContact O-N 3.43Å; N429-A431 PolarHBondContact O-N 2.8Å; A431-V433 VanDerWaalsContact C-N 3.31Å
432	N	62.7	Low	73.4	Confident	126 Å²	126	68.7 Å²	68.7	67%	0.674	38%	0.379	S	S	*	.			trans	-86.9	7.1	170.1	-153.1	24.6	0	0	0	114.2	P430 D434	P430-N432 VanDerWaalsContact C-N 3.34Å; P430-N432 PolarHBondContact O-N 2.83Å; N432-D434 PolarHBondContact O-N 2.88Å
433	V	71.3	Confident	73.8	Confident	26 Å²	26	68.3 Å²	68.3	16%	0.158	37%	0.372	C	S	.	.			trans	-64.7	125.8	171.1	-176.8	0	0	0	0	110	K392 L420 S423 F424 A431 L435	K392-V433 PolarHBondContact NZ-O 3.5Å; L420-V433 HydrophobicContact CD1-CG1 4.11Å; S423-V433 VanDerWaalsContact O-CG2 3.23Å; S423-V433 WeakPolarHBondContact O-CG2 3.4Å; F424-V433 HydrophobicContact CB-CG2 4.45Å; F424-V433 HydrophobicContact CD2-CB 3.93Å; F424-V433 HydrophobicContact CD2-CG2 4.19Å; F424-V433 HydrophobicContact CE2-CB 4.45Å; A431-V433 VanDerWaalsContact C-N 3.31Å; V433-L435 HydrophobicContact CG1-CD2 4.32Å
434	D	78.1	Confident	74.2	Confident	82 Å²	82	65.7 Å²	65.7	44%	0.439	36%	0.355	S	S	.	.			trans	-91.1	119.7	167.6	178.6	29.2	0	0	0	110.6	N432 N436 S437	N432-D434 PolarHBondContact O-N 2.88Å; D434-N436 PolarHBondContact O-N 3.43Å; D434-N436 WeakPolarHBondContact OD1-CB 3.47Å; D434-N436 PolarHBondContact OD1-N 2.96Å; D434-N436 PolarHBondContact OD1-ND2 3.32Å; D434-N436 WeakPolarHBondContact OD2-CB 3.41Å; D434-S437 PolarHBondContact O-OG 2.94Å
435	L	81.8	Confident	74.8	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.016	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.1	176.4	-58.1	-173.5	0	0	0	112.2	K392 Y396 L420 V433 S437 I445	K392-L435 HydrophobicContact CB-CD1 3.91Å; Y396-L435 HydrophobicContact CD2-CB 3.92Å; Y396-L435 WeakPolarHBondContact CD2-O 3.43Å; Y396-L435 WeakPolarHBondContact CE2-O 3.4Å; Y396-L435 HydrophobicContact CG-CB 4.39Å; L420-L435 HydrophobicContact CD1-CD2 3.8Å; L420-L435 HydrophobicContact CD2-CD2 4.44Å; V433-L435 HydrophobicContact CG1-CD2 4.32Å; L435-S437 VanDerWaalsContact C-N 3.26Å; L435-S437 PolarHBondContact O-N 3.15Å; L435-I445 HydrophobicContact CB-CD1 4.1Å; L435-I445 HydrophobicContact CD1-CG2 4.28Å
436	N	72.8	Confident	75.4	Confident	78 Å²	78	63.1 Å²	63.1	42%	0.417	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.7	178.8	-61.9	-77	0	0	0	114.3	K400 D434	K400-N436 WeakPolarHBondContact CE-OD1 3.48Å; K400-N436 PolarHBondContact NZ-OD1 3.32Å; D434-N436 PolarHBondContact O-N 3.43Å; D434-N436 WeakPolarHBondContact OD1-CB 3.47Å; D434-N436 PolarHBondContact OD1-N 2.96Å; D434-N436 PolarHBondContact OD1-ND2 3.32Å; D434-N436 WeakPolarHBondContact OD2-CB 3.41Å
437	S	74.4	Confident	76.2	Confident	39 Å²	39	59.8 Å²	59.8	27%	0.273	33%	0.327	S	S	.	.	S	Bend	trans	-63.4	151.4	172.4	58.5	0	0	0	0	111.9	D434 L435 D439 W440	D434-S437 PolarHBondContact O-OG 2.94Å; L435-S437 VanDerWaalsContact C-N 3.26Å; L435-S437 PolarHBondContact O-N 3.15Å; S437-D439 PolarHBondContact O-N 3.4Å; S437-W440 VanDerWaalsContact OG-CD1 3.28Å; S437-W440 PolarHBondContact OG-NE1 3.45Å
438	S	69.3	Low	77.5	Confident	125 Å²	125	51 Å²	51	87%	0.874	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.2	179.1	50.2	0	0	0	0	114.9	W440	S438-W440 VanDerWaalsContact C-N 3.29Å; S438-W440 PolarHBondContact O-N 3.13Å
439	D	75.4	Confident	79.2	Confident	94 Å²	94	46.6 Å²	46.6	50%	0.503	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.3	-176.1	-71.6	6.8	0	0	0	113.1	S437	S437-D439 PolarHBondContact O-N 3.4Å
440	W	83.4	Confident	80.9	Confident	19 Å²	19	43.3 Å²	43.3	7%	0.072	24%	0.244	C	C	.	.			trans	-132.3	126.4	-171.7	-41.3	106.2	0	0	0	111.5	K419 L420 S437 S438 T444 I445	K419-W440 HydrophobicContact CB-CH2 4.4Å; K419-W440 HydrophobicContact CB-CZ3 4.31Å; K419-W440 HydrophobicContact CD-CH2 3.84Å; K419-W440 HydrophobicContact CD-CZ3 4.04Å; K419-W440 HydrophobicContact CG-CH2 3.99Å; K419-W440 HydrophobicContact CG-CZ3 4.31Å; L420-W440 HydrophobicContact CB-CE3 3.88Å; L420-W440 HydrophobicContact CB-CH2 3.99Å; L420-W440 HydrophobicContact CB-CZ3 3.59Å; L420-W440 HydrophobicContact CD1-CD2 3.97Å; L420-W440 HydrophobicContact CD1-CE3 4.21Å; L420-W440 HydrophobicContact CD1-CH2 4.23Å; L420-W440 HydrophobicContact CD1-CZ2 4.02Å; L420-W440 HydrophobicContact CD1-CZ3 4.34Å; L420-W440 HydrophobicContact CD2-CE3 4.37Å; L420-W440 HydrophobicContact CG-CE3 4.37Å; L420-W440 HydrophobicContact CG-CZ3 4.46Å; S437-W440 VanDerWaalsContact OG-CD1 3.28Å; S437-W440 PolarHBondContact OG-NE1 3.45Å; S438-W440 VanDerWaalsContact C-N 3.29Å; S438-W440 PolarHBondContact O-N 3.13Å; W440-T444 HydrophobicContact CE3-CG2 4.24Å; W440-I445 HydrophobicContact CB-CD1 3.92Å; W440-I445 HydrophobicContact CB-CG1 4.07Å
441	D	87.8	Confident	82.7	Confident	54 Å²	54	41.7 Å²	41.7	29%	0.289	23%	0.229	S	C	.	.			trans	-90.1	160.3	170.6	59.3	73.4	0	0	0	112.3	Q416 K443 T444 I445	Q416-D441 PolarHBondContact NE2-OD2 3.05Å; D441-K443 PolarHBondContact O-N 3.4Å; D441-K443 WeakPolarHBondContact OD1-CB 3.3Å; D441-K443 PolarHBondContact OD1-N 2.71Å; D441-T444 VanDerWaalsContact CG-OG1 3.29Å; D441-T444 WeakPolarHBondContact O-CB 3.47Å; D441-T444 PolarHBondContact O-N 3.45Å; D441-T444 WeakPolarHBondContact OD1-CB 3.25Å; D441-T444 PolarHBondContact OD1-N 2.95Å; D441-T444 PolarHBondContact OD1-OG1 3.25Å; D441-T444 PolarHBondContact OD2-OG1 3.17Å; D441-T444 VanDerWaalsContact OD2-OG1 3.08Å; D441-I445 PolarHBondContact O-N 3.38Å
442	D	90.6	Very high	84.4	Confident	44 Å²	44	42 Å²	42	24%	0.235	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-33.1	-177.2	-36.4	-83.1	0	0	0	112.1	Y396 A401 T444 I445 T446	Y396-D442 WeakPolarHBondContact CE1-OD1 3.16Å; Y396-D442 PolarHBondContact OH-OD1 3.12Å; A401-D442 HydrophobicContact CB-CB 3.94Å; D442-T444 VanDerWaalsContact C-N 3.35Å; D442-I445 PolarHBondContact O-N 2.91Å; D442-T446 WeakPolarHBondContact O-CB 3.41Å; D442-T446 VanDerWaalsContact O-CG2 3.28Å; D442-T446 WeakPolarHBondContact O-CG2 3.23Å; D442-T446 PolarHBondContact O-N 3.17Å; D442-T446 PolarHBondContact O-OG1 3.25Å
443	K	92.6	Very high	85.7	Confident	97 Å²	97	36 Å²	36	42%	0.422	20%	0.197	S	C	.	.	H	α-helix	trans	-70.2	-36.7	-179	-55.5	163.5	-176.5	174.1	0	109.8	T410 G412 D441 T446 S447	T410-K443 HydrophobicContact CG2-CB 4.5Å; T410-K443 HydrophobicContact CG2-CD 3.65Å; T410-K443 HydrophobicContact CG2-CG 3.82Å; G412-K443 WeakPolarHBondContact CA-O 3.46Å; G412-K443 PolarHBondContact N-O 3.41Å; D441-K443 PolarHBondContact O-N 3.4Å; D441-K443 WeakPolarHBondContact OD1-CB 3.3Å; D441-K443 PolarHBondContact OD1-N 2.71Å; K443-T446 WeakPolarHBondContact CA-OG1 3.35Å; K443-T446 PolarHBondContact O-OG1 2.84Å; K443-S447 WeakPolarHBondContact O-CB 3.26Å; K443-S447 PolarHBondContact O-N 2.74Å; K443-S447 PolarHBondContact O-OG 3.21Å
444	T	91.7	Very high	86.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.1	-46.3	173.2	-66.4	0	0	0	0	111.1	Q416 V417 L420 W440 D441 D442 S447 A448	Q416-T444 HydrophobicContact CB-CG2 3.72Å; V417-T444 HydrophobicContact CG2-CG2 4.19Å; L420-T444 HydrophobicContact CD2-CG2 4.22Å; W440-T444 HydrophobicContact CE3-CG2 4.24Å; D441-T444 VanDerWaalsContact CG-OG1 3.29Å; D441-T444 WeakPolarHBondContact O-CB 3.47Å; D441-T444 PolarHBondContact O-N 3.45Å; D441-T444 WeakPolarHBondContact OD1-CB 3.25Å; D441-T444 PolarHBondContact OD1-N 2.95Å; D441-T444 PolarHBondContact OD1-OG1 3.25Å; D441-T444 PolarHBondContact OD2-OG1 3.17Å; D441-T444 VanDerWaalsContact OD2-OG1 3.08Å; D442-T444 VanDerWaalsContact C-N 3.35Å; T444-S447 PolarHBondContact O-N 2.67Å; T444-A448 WeakPolarHBondContact O-CB 3.33Å; T444-A448 PolarHBondContact O-N 2.89Å
445	I	92.6	Very high	87	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-50	179.7	-68.5	164	0	0	0	111.1	C393 Y396 I397 L420 L435 W440 D441 D442 S447 A448 L449	C393-I445 HydrophobicContact CB-CG2 4.24Å; Y396-I445 HydrophobicContact CD1-CD1 3.72Å; Y396-I445 HydrophobicContact CD1-CG2 4.25Å; Y396-I445 HydrophobicContact CD2-CD1 3.96Å; Y396-I445 HydrophobicContact CE1-CD1 3.46Å; Y396-I445 VanDerWaalsContact CE1-CD1 3.46Å; Y396-I445 HydrophobicContact CE2-CD1 3.68Å; Y396-I445 HydrophobicContact CG-CD1 3.96Å; Y396-I445 VanDerWaalsContact CZ-CD1 3.4Å; I397-I445 HydrophobicContact CD1-CG2 4.28Å; I397-I445 HydrophobicContact CG1-CG2 4.33Å; L420-I445 HydrophobicContact CD2-CG1 4.07Å; L435-I445 HydrophobicContact CB-CD1 4.1Å; L435-I445 HydrophobicContact CD1-CG2 4.28Å; W440-I445 HydrophobicContact CB-CD1 3.92Å; W440-I445 HydrophobicContact CB-CG1 4.07Å; D441-I445 PolarHBondContact O-N 3.38Å; D442-I445 PolarHBondContact O-N 2.91Å; I445-S447 VanDerWaalsContact C-N 3.26Å; I445-S447 PolarHBondContact O-N 3.27Å; I445-A448 PolarHBondContact O-N 3.45Å; I445-L449 WeakPolarHBondContact O-CB 3.34Å; I445-L449 PolarHBondContact O-N 3.31Å
446	T	94.6	Very high	87.3	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-35.4	174.2	53	0	0	0	0	112.3	I397 V407 Y408 D442 K443 K450	I397-T446 HydrophobicContact CD1-CG2 3.62Å; I397-T446 HydrophobicContact CG1-CG2 4.04Å; V407-T446 HydrophobicContact CG2-CG2 4.01Å; Y408-T446 HydrophobicContact CD1-CG2 3.9Å; Y408-T446 HydrophobicContact CD2-CG2 4.35Å; Y408-T446 HydrophobicContact CE1-CG2 3.93Å; Y408-T446 HydrophobicContact CE2-CG2 4.4Å; Y408-T446 HydrophobicContact CG-CG2 4.13Å; D442-T446 WeakPolarHBondContact O-CB 3.41Å; D442-T446 VanDerWaalsContact O-CG2 3.28Å; D442-T446 WeakPolarHBondContact O-CG2 3.23Å; D442-T446 PolarHBondContact O-N 3.17Å; D442-T446 PolarHBondContact O-OG1 3.25Å; K443-T446 WeakPolarHBondContact CA-OG1 3.35Å; K443-T446 PolarHBondContact O-OG1 2.84Å; T446-K450 WeakPolarHBondContact O-CE 3.46Å; T446-K450 WeakPolarHBondContact O-CG 3.27Å; T446-K450 PolarHBondContact O-N 3.22Å; T446-K450 VanDerWaalsContact O-N 3.11Å
447	S	92.6	Very high	87.7	Confident	11 Å²	11	39.2 Å²	39.2	8%	0.077	21%	0.209	C	C	.	.	H	α-helix	trans	-76.9	-33.1	177.9	-60.4	0	0	0	0	113.8	G412 K443 T444 I445 F451	G412-S447 PolarHBondContact N-OG 3.34Å; K443-S447 WeakPolarHBondContact O-CB 3.26Å; K443-S447 PolarHBondContact O-N 2.74Å; K443-S447 PolarHBondContact O-OG 3.21Å; T444-S447 PolarHBondContact O-N 2.67Å; I445-S447 VanDerWaalsContact C-N 3.26Å; I445-S447 PolarHBondContact O-N 3.27Å; S447-F451 VanDerWaalsContact O-CB 3.24Å; S447-F451 WeakPolarHBondContact O-CB 3.23Å; S447-F451 PolarHBondContact O-N 3.06Å
448	A	90.8	Very high	88.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.9	-38.9	173.2	0	0	0	0	0	111.9	F389 V417 L420 L421 T444 I445 F451 Y452	F389-A448 HydrophobicContact CZ-CB 3.96Å; V417-A448 HydrophobicContact CG1-CB 4.1Å; L420-A448 HydrophobicContact CD2-CB 3.83Å; L420-A448 HydrophobicContact CG-CB 4.36Å; L421-A448 HydrophobicContact CD2-CB 4.27Å; L421-A448 HydrophobicContact CG-CB 4.18Å; T444-A448 WeakPolarHBondContact O-CB 3.33Å; T444-A448 PolarHBondContact O-N 2.89Å; I445-A448 PolarHBondContact O-N 3.45Å; A448-F451 PolarHBondContact O-N 3.39Å; A448-Y452 WeakPolarHBondContact O-CB 2.82Å; A448-Y452 PolarHBondContact O-N 3.17Å
449	L	93.9	Very high	89.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-50.6	171.8	173.6	56.6	0	0	0	112.2	V390 C393 F394 I397 Y408 I445 F451 Y452 L453	V390-L449 HydrophobicContact CB-CD1 4.38Å; V390-L449 HydrophobicContact CG1-CD1 4.24Å; V390-L449 HydrophobicContact CG2-CD1 3.87Å; C393-L449 HydrophobicContact CB-CB 4.22Å; C393-L449 HydrophobicContact CB-CD1 4.43Å; C393-L449 HydrophobicContact CB-CD2 3.86Å; C393-L449 HydrophobicContact CB-CG 4.4Å; F394-L449 HydrophobicContact CD1-CD2 3.85Å; F394-L449 HydrophobicContact CE1-CD1 4.3Å; F394-L449 HydrophobicContact CE1-CD2 3.65Å; I397-L449 HydrophobicContact CD1-CD2 4.13Å; Y408-L449 HydrophobicContact CE1-CD2 3.84Å; Y408-L449 HydrophobicContact CE1-CG 4.46Å; Y408-L449 WeakPolarHBondContact OH-CD2 3.39Å; I445-L449 WeakPolarHBondContact O-CB 3.34Å; I445-L449 PolarHBondContact O-N 3.31Å; L449-F451 VanDerWaalsContact C-N 3.3Å; L449-F451 PolarHBondContact O-N 3.29Å; L449-Y452 PolarHBondContact O-N 3.03Å; L449-L453 HydrophobicContact CD1-CD1 3.87Å; L449-L453 HydrophobicContact CD1-CG 4.27Å; L449-L453 HydrophobicContact CG-CD1 4.34Å; L449-L453 WeakPolarHBondContact O-CG 3.43Å; L449-L453 PolarHBondContact O-N 3.3Å; L449-L453 VanDerWaalsContact O-N 3.15Å
450	K	93.8	Very high	90	Very high	27 Å²	27	30 Å²	30	12%	0.117	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-43.9	172.6	-73.2	175.7	-62.6	-178.8	0	111.5	Y408 T410 T446 R454 I527 F528	Y408-K450 HydrophobicContact CD1-CD 4.13Å; Y408-K450 HydrophobicContact CD1-CG 4.1Å; Y408-K450 PolarHBondContact O-NZ 3.5Å; T410-K450 PolarHBondContact O-NZ 2.99Å; T446-K450 WeakPolarHBondContact O-CE 3.46Å; T446-K450 WeakPolarHBondContact O-CG 3.27Å; T446-K450 PolarHBondContact O-N 3.22Å; T446-K450 VanDerWaalsContact O-N 3.11Å; K450-R454 WeakPolarHBondContact O-CB 3.3Å; K450-R454 PolarHBondContact O-N 3.38Å; K450-I527 HydrophobicContact CD-CG2 3.63Å; K450-I527 HydrophobicContact CG-CG2 4.45Å; K450-F528 HydrophobicContact CG-CZ 4.29Å
451	F	90.3	Very high	90.4	Very high	45 Å²	45	29 Å²	29	20%	0.197	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-44.6	-179.7	-171.5	-79.5	0	0	0	111.9	V417 L421 S447 A448 L449 R454 N455	V417-F451 HydrophobicContact CG1-CB 4.16Å; V417-F451 HydrophobicContact CG1-CG 4.38Å; L421-F451 HydrophobicContact CD1-CB 4.17Å; L421-F451 HydrophobicContact CD1-CD1 3.33Å; L421-F451 HydrophobicContact CD1-CE1 3.98Å; L421-F451 HydrophobicContact CD1-CG 3.96Å; S447-F451 VanDerWaalsContact O-CB 3.24Å; S447-F451 WeakPolarHBondContact O-CB 3.23Å; S447-F451 PolarHBondContact O-N 3.06Å; A448-F451 PolarHBondContact O-N 3.39Å; L449-F451 VanDerWaalsContact C-N 3.3Å; L449-F451 PolarHBondContact O-N 3.29Å; F451-R454 PolarHBondContact O-N 3.23Å; F451-N455 HydrophobicContact CD1-CB 4.47Å; F451-N455 VanDerWaalsContact CD1-ND2 3.34Å; F451-N455 WeakPolarHBondContact CD1-ND2 3.46Å; F451-N455 HydrophobicContact CE1-CB 4.17Å; F451-N455 VanDerWaalsContact CE1-ND2 3.31Å; F451-N455 WeakPolarHBondContact CE1-ND2 3.42Å; F451-N455 WeakPolarHBondContact CE2-ND2 3.22Å; F451-N455 WeakPolarHBondContact CG-ND2 3.49Å; F451-N455 WeakPolarHBondContact CZ-ND2 3.37Å; F451-N455 WeakPolarHBondContact O-CB 3.39Å; F451-N455 PolarHBondContact O-N 2.91Å; F451-N455 PolarHBondContact O-ND2 3.03Å
452	Y	91.3	Very high	90.6	Very high	10 Å²	10	26.9 Å²	26.9	4%	0.039	13%	0.13	C	C	.	.	H	α-helix	trans	-56.5	-55.6	176.5	172.1	-102	0	0	0	111	G386 F389 V390 F425 A448 L449 R454 N455 L456 M499	G386-Y452 VanDerWaalsContact CA-OH 3.26Å; G386-Y452 WeakPolarHBondContact CA-OH 3.4Å; F389-Y452 HydrophobicContact CD1-CD1 4.08Å; F389-Y452 HydrophobicContact CD1-CD2 4.4Å; F389-Y452 AromaticContact CD1-CG 3.89Å; F389-Y452 HydrophobicContact CD1-CG 3.89Å; F389-Y452 HydrophobicContact CE1-CD1 4.45Å; F389-Y452 HydrophobicContact CE1-CG 4.02Å; V390-Y452 HydrophobicContact CG2-CD1 3.84Å; V390-Y452 HydrophobicContact CG2-CE1 3.82Å; F425-Y452 HydrophobicContact CE1-CD2 4.48Å; F425-Y452 HydrophobicContact CE1-CE2 4.03Å; F425-Y452 AromaticContact CE2-CD2 3.91Å; F425-Y452 HydrophobicContact CE2-CD2 3.91Å; F425-Y452 HydrophobicContact CE2-CE2 4.28Å; F425-Y452 AromaticContact CZ-CD2 3.59Å; F425-Y452 HydrophobicContact CZ-CD2 3.59Å; F425-Y452 AromaticContact CZ-CE2 3.51Å; F425-Y452 HydrophobicContact CZ-CE2 3.51Å; F425-Y452 HydrophobicContact CZ-CG 4.47Å; A448-Y452 WeakPolarHBondContact O-CB 2.82Å; A448-Y452 PolarHBondContact O-N 3.17Å; L449-Y452 PolarHBondContact O-N 3.03Å; Y452-R454 VanDerWaalsContact C-N 3.29Å; Y452-R454 PolarHBondContact O-N 3.38Å; Y452-N455 PolarHBondContact O-N 3.11Å; Y452-N455 VanDerWaalsContact O-N 3.11Å; Y452-L456 HydrophobicContact CE1-CD2 4.13Å; Y452-L456 HydrophobicContact CE2-CD2 4.11Å; Y452-L456 PolarHBondContact O-N 2.93Å; Y452-L456 WeakPolarHBondContact OH-CD2 3.27Å; Y452-M499 HydrophobicContact CE1-CE 4.46Å; Y452-M499 HydrophobicContact CE1-SD 4.24Å
453	L	91.8	Very high	90.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60	-37.3	-179.9	-65.3	169.7	0	0	0	112.7	L449 M499 L503 F528 T531 L532 R534	L449-L453 HydrophobicContact CD1-CD1 3.87Å; L449-L453 HydrophobicContact CD1-CG 4.27Å; L449-L453 HydrophobicContact CG-CD1 4.34Å; L449-L453 WeakPolarHBondContact O-CG 3.43Å; L449-L453 PolarHBondContact O-N 3.3Å; L449-L453 VanDerWaalsContact O-N 3.15Å; L453-M499 HydrophobicContact CD2-SD 3.79Å; L453-L503 HydrophobicContact CD1-CD1 4.3Å; L453-L503 HydrophobicContact CD1-CD2 3.89Å; L453-F528 HydrophobicContact CD1-CE1 4.15Å; L453-T531 HydrophobicContact CB-CG2 3.84Å; L453-L532 HydrophobicContact CB-CD2 4.4Å; L453-L532 HydrophobicContact CD1-CD2 4.36Å; L453-R534 PolarHBondContact O-NH1 2.93Å
454	R	89.7	Confident	90.3	Very high	124 Å²	124	29 Å²	29	47%	0.468	14%	0.142	S	C	.	.	H	α-helix	trans	-75.2	-18.3	178.8	-159.2	-176.3	70.8	179.4	2.2	114.1	K450 F451 Y452 T531 R534	K450-R454 WeakPolarHBondContact O-CB 3.3Å; K450-R454 PolarHBondContact O-N 3.38Å; F451-R454 PolarHBondContact O-N 3.23Å; Y452-R454 VanDerWaalsContact C-N 3.29Å; Y452-R454 PolarHBondContact O-N 3.38Å; R454-T531 HydrophobicContact CB-CG2 4.21Å; R454-R534 WeakPolarHBondContact O-CD 3.35Å; R454-R534 PolarHBondContact O-NE 3.37Å; R454-R534 PolarHBondContact O-NH1 3.31Å
455	N	86.3	Confident	90.2	Very high	52 Å²	52	29.9 Å²	29.9	28%	0.278	15%	0.147	S	C	.	.	H	α-helix	trans	-115	9.9	-177.3	-64.9	-92.7	0	0	0	113.6	M380 F451 Y452	M380-N455 WeakPolarHBondContact CB-O 3.37Å; M380-N455 HydrophobicContact CE-CB 3.42Å; M380-N455 VanDerWaalsContact CE-CB 3.42Å; M380-N455 WeakPolarHBondContact CE-O 3.23Å; M380-N455 HydrophobicContact SD-CB 4.11Å; F451-N455 HydrophobicContact CD1-CB 4.47Å; F451-N455 VanDerWaalsContact CD1-ND2 3.34Å; F451-N455 WeakPolarHBondContact CD1-ND2 3.46Å; F451-N455 HydrophobicContact CE1-CB 4.17Å; F451-N455 VanDerWaalsContact CE1-ND2 3.31Å; F451-N455 WeakPolarHBondContact CE1-ND2 3.42Å; F451-N455 WeakPolarHBondContact CE2-ND2 3.22Å; F451-N455 WeakPolarHBondContact CG-ND2 3.49Å; F451-N455 WeakPolarHBondContact CZ-ND2 3.37Å; F451-N455 WeakPolarHBondContact O-CB 3.39Å; F451-N455 PolarHBondContact O-N 2.91Å; F451-N455 PolarHBondContact O-ND2 3.03Å; Y452-N455 PolarHBondContact O-N 3.11Å; Y452-N455 VanDerWaalsContact O-N 3.11Å
456	L	87.3	Confident	90	Very high	11 Å²	11	31 Å²	31	6%	0.058	15%	0.152	C	C	.	.	S	Bend	trans	-49.9	148.7	165.2	-71.2	171.6	0	0	0	111.3	M380 L382 Y452 E458 R534	M380-L456 CarbonylContact O-C 3.44Å; M380-L456 VanDerWaalsContact O-CA 3.32Å; M380-L456 WeakPolarHBondContact O-CA 3.26Å; L382-L456 HydrophobicContact CD1-CD1 4.34Å; L382-L456 HydrophobicContact CD1-CD2 4.43Å; Y452-L456 HydrophobicContact CE1-CD2 4.13Å; Y452-L456 HydrophobicContact CE2-CD2 4.11Å; Y452-L456 PolarHBondContact O-N 2.93Å; Y452-L456 WeakPolarHBondContact OH-CD2 3.27Å; L456-E458 WeakPolarHBondContact CB-O 3.44Å; L456-E458 PolarHBondContact O-N 2.79Å; L456-E458 VanDerWaalsContact O-N 3.12Å; L456-R534 PolarHBondContact O-NH2 3.3Å
457	S	81.6	Confident	89.6	Confident	68 Å²	68	33.2 Å²	33.2	48%	0.476	18%	0.175	S	C	.	.	S	Bend	trans	-56.9	-26.9	177.7	51.5	0	0	0	0	113.4	M380	M380-S457 PolarHBondContact O-N 3.09Å; M380-S457 PolarHBondContact O-OG 2.92Å
458	E	84.8	Confident	89.5	Confident	64 Å²	64	36.7 Å²	36.7	30%	0.299	19%	0.19	S	C	.	.	S	Bend	trans	-131.4	148.2	167.7	-165.8	175	-167.8	0	0	109.7	L456 T462 Y463 R534	L456-E458 WeakPolarHBondContact CB-O 3.44Å; L456-E458 PolarHBondContact O-N 2.79Å; L456-E458 VanDerWaalsContact O-N 3.12Å; E458-T462 VanDerWaalsContact OE1-CA 3.31Å; E458-T462 WeakPolarHBondContact OE1-CA 3.08Å; E458-T462 VanDerWaalsContact OE1-CB 3.29Å; E458-T462 WeakPolarHBondContact OE1-CB 3.32Å; E458-Y463 HydrophobicContact CG-CD2 3.69Å; E458-Y463 HydrophobicContact CG-CE2 4.09Å; E458-Y463 HydrophobicContact CG-CG 4.29Å; E458-Y463 PolarHBondContact OE1-N 2.71Å; E458-R534 PolarHBondContact O-NH2 3Å; E458-R534 VanDerWaalsContact O-NH2 3.07Å
459	P	90.8	Very high	89.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.			trans	-54.2	149.2	165.2	21.4	-34.4	0	0	0	112.4	M461 T462 Y463 L532 R534	P459-M461 PolarHBondContact O-N 3.31Å; P459-T462 WeakPolarHBondContact O-CA 3.5Å; P459-T462 PolarHBondContact O-N 3.24Å; P459-Y463 VanDerWaalsContact CD-CE2 3.49Å; P459-Y463 HydrophobicContact CG-CD1 3.59Å; P459-Y463 HydrophobicContact CG-CD2 4.4Å; P459-Y463 HydrophobicContact CG-CE1 3.61Å; P459-Y463 HydrophobicContact CG-CE2 4.41Å; P459-Y463 HydrophobicContact CG-CG 3.99Å; P459-L532 VanDerWaalsContact CB-O 3.25Å; P459-L532 WeakPolarHBondContact CB-O 3.43Å; P459-R534 HydrophobicContact CB-CB 4.18Å; P459-R534 HydrophobicContact CG-CB 4.45Å
460	L	92.6	Very high	89.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-34.7	-177.6	-171.5	62.9	0	0	0	111.8	L382 T462 N496 M499 L500 L503 L532	L382-L460 HydrophobicContact CD1-CD1 4.49Å; L382-L460 HydrophobicContact CD2-CD1 4.23Å; L460-T462 PolarHBondContact O-N 2.85Å; L460-N496 HydrophobicContact CD1-CB 4.27Å; L460-N496 WeakPolarHBondContact O-CB 3.37Å; L460-N496 PolarHBondContact O-ND2 3.46Å; L460-M499 HydrophobicContact CD1-CB 4.06Å; L460-M499 HydrophobicContact CD1-CG 4.24Å; L460-M499 HydrophobicContact CD1-SD 4.48Å; L460-M499 HydrophobicContact CD2-CG 4.26Å; L460-L500 HydrophobicContact CD2-CB 4.03Å; L460-L500 HydrophobicContact CD2-CD1 4.12Å; L460-L500 HydrophobicContact CG-CB 4.39Å; L460-L503 HydrophobicContact CD2-CD2 4.41Å; L460-L532 HydrophobicContact CB-CD2 4.08Å; L460-L532 HydrophobicContact CD2-CD2 3.92Å; L460-L532 PolarHBondContact N-O 3.35Å
461	M	92.1	Very high	89	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	8.1	175	-57.1	-56.5	-72.1	0	0	114.3	P459 L469 I489 L492 L500 L532 M533 M556	P459-M461 PolarHBondContact O-N 3.31Å; M461-L469 HydrophobicContact CB-CD1 4.03Å; M461-L469 HydrophobicContact CE-CD1 3.69Å; M461-L469 HydrophobicContact CE-CD2 4.28Å; M461-I489 HydrophobicContact CE-CG1 4.17Å; M461-L492 HydrophobicContact CE-CD1 4.15Å; M461-L492 HydrophobicContact SD-CD1 4.22Å; M461-L500 HydrophobicContact CE-CD2 3.94Å; M461-L500 HydrophobicContact SD-CD1 3.6Å; M461-L500 VanDerWaalsContact SD-CD1 3.6Å; M461-L500 HydrophobicContact SD-CD2 3.47Å; M461-L500 WeakPolarHBondContact SD-CD2 3.44Å; M461-L500 HydrophobicContact SD-CG 4.15Å; M461-L532 HydrophobicContact CG-CB 4.27Å; M461-L532 PolarHBondContact N-O 3.19Å; M461-M533 HydrophobicContact CB-CE 4.27Å; M461-M533 HydrophobicContact CB-CG 4.14Å; M461-M533 HydrophobicContact CG-CE 4.32Å; M461-M533 HydrophobicContact CG-CG 3.66Å; M461-M533 HydrophobicContact CG-SD 4.32Å; M461-M556 HydrophobicContact CE-CE 4.22Å; M461-M556 HydrophobicContact CE-SD 4.03Å; M461-M556 HydrophobicContact SD-CE 4.31Å; M461-M556 HydrophobicContact SD-SD 4.47Å
462	T	91.1	Very high	89	Confident	8 Å²	8	37.6 Å²	37.6	5%	0.049	21%	0.205	C	C	.	.			trans	62.2	158.5	-170.3	71.1	0	0	0	0	114.8	E458 P459 L460 L465 L492 P493	E458-T462 VanDerWaalsContact OE1-CA 3.31Å; E458-T462 WeakPolarHBondContact OE1-CA 3.08Å; E458-T462 VanDerWaalsContact OE1-CB 3.29Å; E458-T462 WeakPolarHBondContact OE1-CB 3.32Å; P459-T462 WeakPolarHBondContact O-CA 3.5Å; P459-T462 PolarHBondContact O-N 3.24Å; L460-T462 PolarHBondContact O-N 2.85Å; T462-L465 WeakPolarHBondContact OG1-CB 3.33Å; T462-L465 PolarHBondContact OG1-N 2.91Å; T462-L465 VanDerWaalsContact OG1-N 3.16Å; T462-L492 HydrophobicContact CG2-CD2 3.96Å; T462-P493 HydrophobicContact CG2-CG 4.04Å
463	Y	87.7	Confident	88.9	Confident	65 Å²	65	37.2 Å²	37.2	26%	0.255	20%	0.204	S	C	.	.	S	Bend	trans	-77	-29.7	168.4	-74.1	-54.4	0	0	0	111.7	E458 P459 H466 R534 K536	E458-Y463 HydrophobicContact CG-CD2 3.69Å; E458-Y463 HydrophobicContact CG-CE2 4.09Å; E458-Y463 HydrophobicContact CG-CG 4.29Å; E458-Y463 PolarHBondContact OE1-N 2.71Å; P459-Y463 VanDerWaalsContact CD-CE2 3.49Å; P459-Y463 HydrophobicContact CG-CD1 3.59Å; P459-Y463 HydrophobicContact CG-CD2 4.4Å; P459-Y463 HydrophobicContact CG-CE1 3.61Å; P459-Y463 HydrophobicContact CG-CE2 4.41Å; P459-Y463 HydrophobicContact CG-CG 3.99Å; Y463-H466 VanDerWaalsContact O-CB 3.31Å; Y463-H466 WeakPolarHBondContact O-CB 3.42Å; Y463-R534 WeakPolarHBondContact CE1-O 3.34Å; Y463-K536 HydrophobicContact CD1-CB 3.67Å; Y463-K536 HydrophobicContact CD1-CD 4.48Å; Y463-K536 HydrophobicContact CD1-CG 3.91Å; Y463-K536 HydrophobicContact CD2-CD 4.49Å; Y463-K536 HydrophobicContact CD2-CG 4.24Å; Y463-K536 HydrophobicContact CE1-CB 3.99Å; Y463-K536 HydrophobicContact CE1-CG 4.2Å; Y463-K536 HydrophobicContact CG-CB 4.17Å; Y463-K536 HydrophobicContact CG-CD 4.12Å; Y463-K536 HydrophobicContact CG-CG 3.95Å
464	D	88.8	Confident	88.8	Confident	122 Å²	122	41.5 Å²	41.5	65%	0.652	22%	0.222	S	C	*	.	S	Bend	trans	-77.2	-42.2	-171.6	-66.5	-11.4	0	0	0	111.5	H466 K536	D464-H466 VanDerWaalsContact C-N 3.28Å; D464-H466 PolarHBondContact O-N 3.28Å; D464-K536 IonicContact OD1-NZ 2.99Å
465	L	90.1	Very high	88.7	Confident	18 Å²	18	36.8 Å²	36.8	9%	0.094	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-6.9	173.9	-61.4	175.5	0	0	0	113.9	T462 G467 E468 L469 L488 K491 L492	T462-L465 WeakPolarHBondContact OG1-CB 3.33Å; T462-L465 PolarHBondContact OG1-N 2.91Å; T462-L465 VanDerWaalsContact OG1-N 3.16Å; L465-G467 VanDerWaalsContact C-N 3.3Å; L465-G467 PolarHBondContact O-N 2.69Å; L465-E468 PolarHBondContact O-N 3.19Å; L465-L469 HydrophobicContact CB-CD1 4.12Å; L465-L469 WeakPolarHBondContact O-CB 3.44Å; L465-L469 WeakPolarHBondContact O-CG 3.41Å; L465-L469 PolarHBondContact O-N 3.07Å; L465-L488 HydrophobicContact CD2-CD2 4.26Å; L465-K491 HydrophobicContact CD1-CB 3.95Å; L465-K491 HydrophobicContact CD2-CB 4.13Å; L465-K491 HydrophobicContact CD2-CD 4.14Å; L465-L492 HydrophobicContact CD1-CD2 3.79Å; L465-L492 HydrophobicContact CD1-CG 3.99Å
466	H	88.6	Confident	88.5	Confident	24 Å²	24	42.2 Å²	42.2	11%	0.111	24%	0.237	C	C	.	.	H	α-helix	trans	-55.7	-44.5	-177.9	-171.6	-86.9	0	0	0	112.1	Y463 D464 L469 M470 M533	Y463-H466 VanDerWaalsContact O-CB 3.31Å; Y463-H466 WeakPolarHBondContact O-CB 3.42Å; D464-H466 VanDerWaalsContact C-N 3.28Å; D464-H466 PolarHBondContact O-N 3.28Å; H466-L469 PolarHBondContact O-N 2.87Å; H466-M470 WeakPolarHBondContact O-CB 3.33Å; H466-M470 VanDerWaalsContact O-CG 3.26Å; H466-M470 WeakPolarHBondContact O-CG 3.32Å; H466-M470 PolarHBondContact O-N 3.36Å; H466-M533 PolarHBondContact CD2-O 2.96Å; H466-M533 PolarHBondContact NE2-O 3.45Å
467	G	86.8	Confident	88.6	Confident	48 Å²	48	45.9 Å²	45.9	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-43.1	179.7	0	0	0	0	0	113.5	L465 M470 S471	L465-G467 VanDerWaalsContact C-N 3.3Å; L465-G467 PolarHBondContact O-N 2.69Å; G467-M470 PolarHBondContact O-N 3.49Å; G467-S471 WeakPolarHBondContact O-CB 3.48Å; G467-S471 PolarHBondContact O-N 3.4Å
468	E	89.3	Confident	88.7	Confident	84 Å²	84	47.9 Å²	47.9	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-46.1	176.8	-72	174.6	-121.4	0	0	110.9	L465 M470 S471 A472 L488 K491	L465-E468 PolarHBondContact O-N 3.19Å; E468-M470 PolarHBondContact O-N 3.45Å; E468-S471 WeakPolarHBondContact O-CB 3.29Å; E468-S471 PolarHBondContact O-N 3.22Å; E468-S471 VanDerWaalsContact O-N 3.1Å; E468-A472 PolarHBondContact O-N 2.69Å; E468-L488 HydrophobicContact CB-CD1 3.94Å; E468-L488 HydrophobicContact CB-CD2 3.48Å; E468-L488 VanDerWaalsContact CB-CD2 3.48Å; E468-L488 HydrophobicContact CB-CG 4.4Å; E468-L488 HydrophobicContact CG-CD2 4.22Å; E468-L488 WeakPolarHBondContact OE2-CD2 3.3Å; E468-K491 IonicContact OE2-NZ 3.53Å; E468-K491 PolarHBondContact OE2-NZ 3.44Å
469	L	90.1	Very high	88.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-39.2	177.8	-70.2	162.1	0	0	0	112.4	M461 L465 H466 S471 A473 L488 M533 V552	M461-L469 HydrophobicContact CB-CD1 4.03Å; M461-L469 HydrophobicContact CE-CD1 3.69Å; M461-L469 HydrophobicContact CE-CD2 4.28Å; L465-L469 HydrophobicContact CB-CD1 4.12Å; L465-L469 WeakPolarHBondContact O-CB 3.44Å; L465-L469 WeakPolarHBondContact O-CG 3.41Å; L465-L469 PolarHBondContact O-N 3.07Å; H466-L469 PolarHBondContact O-N 2.87Å; L469-S471 VanDerWaalsContact C-N 3.33Å; L469-A473 VanDerWaalsContact O-CB 3.32Å; L469-A473 WeakPolarHBondContact O-CB 3.24Å; L469-A473 PolarHBondContact O-N 3.09Å; L469-L488 HydrophobicContact CD2-CB 3.61Å; L469-L488 HydrophobicContact CD2-CD1 3.73Å; L469-L488 HydrophobicContact CD2-CG 4.3Å; L469-L488 HydrophobicContact CG-CB 4.19Å; L469-L488 HydrophobicContact CG-CD1 3.98Å; L469-M533 HydrophobicContact CB-CE 3.65Å; L469-M533 HydrophobicContact CD1-CE 3.73Å; L469-M533 HydrophobicContact CG-CE 4.28Å; L469-V552 HydrophobicContact CD2-CG1 4.25Å
470	M	90.3	Very high	88.5	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-67.6	-33.4	173.5	-71.3	-58.2	93.2	0	0	112.2	H466 G467 E468 K474 M533 D545 F548 Q549 V552	H466-M470 WeakPolarHBondContact O-CB 3.33Å; H466-M470 VanDerWaalsContact O-CG 3.26Å; H466-M470 WeakPolarHBondContact O-CG 3.32Å; H466-M470 PolarHBondContact O-N 3.36Å; G467-M470 PolarHBondContact O-N 3.49Å; E468-M470 PolarHBondContact O-N 3.45Å; M470-K474 WeakPolarHBondContact O-CB 3.48Å; M470-K474 WeakPolarHBondContact O-CD 3.32Å; M470-K474 WeakPolarHBondContact O-CG 3.5Å; M470-K474 PolarHBondContact O-N 3.33Å; M470-M533 HydrophobicContact CE-CE 3.5Å; M470-M533 VanDerWaalsContact CE-CE 3.5Å; M470-M533 HydrophobicContact CE-SD 3.92Å; M470-D545 HydrophobicContact SD-CB 4.2Å; M470-F548 HydrophobicContact CE-CB 4.38Å; M470-F548 HydrophobicContact SD-CB 3.8Å; M470-Q549 HydrophobicContact CE-CB 4.21Å; M470-Q549 HydrophobicContact CE-CG 3.64Å; M470-Q549 HydrophobicContact SD-CG 3.66Å; M470-V552 HydrophobicContact CE-CG2 3.86Å
471	S	88.5	Confident	88.5	Confident	84 Å²	84	58.3 Å²	58.3	59%	0.587	31%	0.311	S	S	*	.	H	α-helix	trans	-69.8	-44.2	175.3	-164.1	0	0	0	0	111.6	G467 E468 L469 K474	G467-S471 WeakPolarHBondContact O-CB 3.48Å; G467-S471 PolarHBondContact O-N 3.4Å; E468-S471 WeakPolarHBondContact O-CB 3.29Å; E468-S471 PolarHBondContact O-N 3.22Å; E468-S471 VanDerWaalsContact O-N 3.1Å; L469-S471 VanDerWaalsContact C-N 3.33Å; S471-K474 PolarHBondContact O-N 3.03Å
472	A	90.5	Very high	88.4	Confident	3 Å²	3	59 Å²	59	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-48	175	0	0	0	0	0	111.2	E468 K474 S475 R481 E484 I485 L488	E468-A472 PolarHBondContact O-N 2.69Å; A472-K474 PolarHBondContact O-N 2.84Å; A472-K474 VanDerWaalsContact O-N 3.15Å; A472-S475 VanDerWaalsContact O-CB 3.27Å; A472-S475 WeakPolarHBondContact O-CB 3.39Å; A472-S475 PolarHBondContact O-N 2.97Å; A472-R481 VanDerWaalsContact O-CG 3.27Å; A472-R481 WeakPolarHBondContact O-CG 3.34Å; A472-E484 HydrophobicContact CB-CB 3.97Å; A472-E484 HydrophobicContact CB-CG 3.83Å; A472-I485 HydrophobicContact CB-CG1 3.93Å; A472-L488 HydrophobicContact CB-CD1 4.12Å
473	A	89.4	Confident	88.2	Confident	2 Å²	2	61.4 Å²	61.4	2%	0.017	33%	0.332	C	S	.	.	H	α-helix	trans	-59.8	-25.7	178.4	0	0	0	0	0	114.5	L469 F548 I551 V552	L469-A473 VanDerWaalsContact O-CB 3.32Å; L469-A473 WeakPolarHBondContact O-CB 3.24Å; L469-A473 PolarHBondContact O-N 3.09Å; A473-F548 HydrophobicContact CB-CB 4Å; A473-I551 HydrophobicContact CB-CG2 4.39Å; A473-V552 HydrophobicContact CB-CG2 3.65Å
474	K	89.1	Confident	88.5	Confident	89 Å²	89	61 Å²	61	39%	0.387	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.1	178.1	-73.8	166.2	-171.4	174.1	0	113.9	M470 S471 A472 D545 F548	M470-K474 WeakPolarHBondContact O-CB 3.48Å; M470-K474 WeakPolarHBondContact O-CD 3.32Å; M470-K474 WeakPolarHBondContact O-CG 3.5Å; M470-K474 PolarHBondContact O-N 3.33Å; S471-K474 PolarHBondContact O-N 3.03Å; A472-K474 PolarHBondContact O-N 2.84Å; A472-K474 VanDerWaalsContact O-N 3.15Å; K474-D545 WeakPolarHBondContact CE-OD1 3.46Å; K474-D545 IonicContact NZ-OD1 3.03Å; K474-D545 PolarHBondContact NZ-OD1 2.84Å; K474-D545 IonicContact NZ-OD2 3.65Å; K474-D545 PolarHBondContact NZ-OD2 3.49Å; K474-F548 HydrophobicContact CB-CE1 4.45Å; K474-F548 HydrophobicContact CD-CD2 4.24Å; K474-F548 HydrophobicContact CD-CE2 4.17Å; K474-F548 HydrophobicContact CD-CZ 4.46Å; K474-F548 VanDerWaalsContact CE-CE2 3.48Å; K474-F548 HydrophobicContact CG-CD1 3.73Å; K474-F548 HydrophobicContact CG-CD2 3.89Å; K474-F548 HydrophobicContact CG-CE1 3.64Å; K474-F548 HydrophobicContact CG-CE2 3.79Å; K474-F548 HydrophobicContact CG-CG 3.86Å; K474-F548 HydrophobicContact CG-CZ 3.67Å
475	S	86.9	Confident	88.7	Confident	25 Å²	25	55.2 Å²	55.2	18%	0.175	30%	0.301	C	S	.	.			trans	-69.3	129.9	174.1	171	0	0	0	0	111.8	A472 N477	A472-S475 VanDerWaalsContact O-CB 3.27Å; A472-S475 WeakPolarHBondContact O-CB 3.39Å; A472-S475 PolarHBondContact O-N 2.97Å; S475-N477 VanDerWaalsContact C-N 3.27Å; S475-N477 PolarHBondContact OG-N 3.46Å; S475-N477 PolarHBondContact OG-O 2.87Å
476	D	83.1	Confident	88.8	Confident	166 Å²	166	55 Å²	55	89%	0.888	30%	0.3	S	S	*	.	S	Bend	trans	-71.9	-20.1	169.1	-62.4	-55.5	0	0	0	112.7
477	N	87.8	Confident	89	Confident	89 Å²	89	55.6 Å²	55.6	48%	0.476	31%	0.307	S	S	.	.			trans	-82.9	115.6	171.6	-179.7	-26.8	0	0	0	109.8	S475 D479 F480 R481	S475-N477 VanDerWaalsContact C-N 3.27Å; S475-N477 PolarHBondContact OG-N 3.46Å; S475-N477 PolarHBondContact OG-O 2.87Å; N477-D479 PolarHBondContact OD1-N 3.33Å; N477-D479 VanDerWaalsContact OD1-N 3.1Å; N477-F480 HydrophobicContact CB-CB 4Å; N477-F480 PolarHBondContact OD1-N 3.47Å; N477-R481 VanDerWaalsContact O-CB 3.27Å; N477-R481 WeakPolarHBondContact O-CB 3.35Å; N477-R481 PolarHBondContact O-N 2.94Å
478	L	83.9	Confident	89.3	Confident	110 Å²	110	53.3 Å²	53.3	58%	0.576	28%	0.283	S	S	*	.	H	α-helix	trans	-69.1	-44.7	-176.5	-59.6	177.7	0	0	0	113.1	R481 L482	L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 2.89Å; L478-L482 WeakPolarHBondContact O-CB 3.42Å; L478-L482 PolarHBondContact O-N 3.15Å
479	D	84.7	Confident	89.5	Confident	122 Å²	122	49.3 Å²	49.3	65%	0.652	26%	0.264	S	S	*	.	H	α-helix	trans	-66.3	-42.2	-179.5	-67.6	-61.3	0	0	0	111.3	N477 L482 S483	N477-D479 PolarHBondContact OD1-N 3.33Å; N477-D479 VanDerWaalsContact OD1-N 3.1Å; D479-L482 PolarHBondContact O-N 3.31Å; D479-S483 WeakPolarHBondContact O-CB 3.38Å; D479-S483 PolarHBondContact O-N 3.33Å
480	F	88.3	Confident	89.6	Confident	107 Å²	107	52.3 Å²	52.3	47%	0.469	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-45.7	173.1	177.9	-99.8	0	0	0	111.5	N477 L482 S483 E484	N477-F480 HydrophobicContact CB-CB 4Å; N477-F480 PolarHBondContact OD1-N 3.47Å; F480-L482 VanDerWaalsContact C-N 3.32Å; F480-L482 PolarHBondContact O-N 3.27Å; F480-S483 PolarHBondContact O-N 2.86Å; F480-E484 HydrophobicContact CE1-CB 4.44Å; F480-E484 HydrophobicContact CZ-CB 4.33Å; F480-E484 HydrophobicContact CZ-CG 4.44Å; F480-E484 WeakPolarHBondContact O-CB 3.45Å; F480-E484 PolarHBondContact O-N 3.2Å
481	R	91.6	Very high	89.7	Confident	53 Å²	53	56.8 Å²	56.8	20%	0.2	30%	0.295	C	S	.	.	H	α-helix	trans	-56.9	-45.4	177.5	178.1	169.8	78.1	178.9	17.6	111.8	A472 N477 L478 I485 I555	A472-R481 VanDerWaalsContact O-CG 3.27Å; A472-R481 WeakPolarHBondContact O-CG 3.34Å; N477-R481 VanDerWaalsContact O-CB 3.27Å; N477-R481 WeakPolarHBondContact O-CB 3.35Å; N477-R481 PolarHBondContact O-N 2.94Å; L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 2.89Å; R481-I485 HydrophobicContact CG-CD1 3.87Å; R481-I485 WeakPolarHBondContact O-CB 3.17Å; R481-I485 WeakPolarHBondContact O-CD1 3.44Å; R481-I485 WeakPolarHBondContact O-CG1 3.42Å; R481-I485 PolarHBondContact O-N 2.73Å; R481-I555 HydrophobicContact CG-CD1 3.88Å; R481-I555 VanDerWaalsContact NE-CD1 3.32Å
482	L	89.6	Confident	89.9	Confident	16 Å²	16	53 Å²	53	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-46.8	177.4	173.5	53.7	0	0	0	112.1	L478 D479 F480 H486 I555 D559 K562 I563	L478-L482 WeakPolarHBondContact O-CB 3.42Å; L478-L482 PolarHBondContact O-N 3.15Å; D479-L482 PolarHBondContact O-N 3.31Å; F480-L482 VanDerWaalsContact C-N 3.32Å; F480-L482 PolarHBondContact O-N 3.27Å; L482-H486 VanDerWaalsContact O-CB 3.29Å; L482-H486 WeakPolarHBondContact O-CB 3.46Å; L482-H486 PolarHBondContact O-N 2.79Å; L482-I555 HydrophobicContact CD1-CG2 3.81Å; L482-D559 HydrophobicContact CD1-CB 3.62Å; L482-D559 WeakPolarHBondContact CD2-OD2 3.45Å; L482-K562 HydrophobicContact CD2-CD 4.05Å; L482-K562 HydrophobicContact CG-CD 4.45Å; L482-I563 HydrophobicContact CD1-CD1 3.86Å; L482-I563 HydrophobicContact CD1-CG1 4Å
483	S	88.3	Confident	90	Very high	58 Å²	58	55.9 Å²	55.9	41%	0.406	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-40.3	178.7	-165.8	0	0	0	0	113	D479 F480 H486 S487	D479-S483 WeakPolarHBondContact O-CB 3.38Å; D479-S483 PolarHBondContact O-N 3.33Å; F480-S483 PolarHBondContact O-N 2.86Å; S483-H486 PolarHBondContact O-N 2.61Å; S483-S487 WeakPolarHBondContact O-CB 3.03Å; S483-S487 PolarHBondContact O-N 3.04Å
484	E	92.1	Very high	90	Very high	56 Å²	56	63.1 Å²	63.1	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-73.7	-41.3	179.9	-169.5	59.7	-151.8	0	0	111.2	A472 F480 H486 S487 L488 K491	A472-E484 HydrophobicContact CB-CB 3.97Å; A472-E484 HydrophobicContact CB-CG 3.83Å; F480-E484 HydrophobicContact CE1-CB 4.44Å; F480-E484 HydrophobicContact CZ-CB 4.33Å; F480-E484 HydrophobicContact CZ-CG 4.44Å; F480-E484 WeakPolarHBondContact O-CB 3.45Å; F480-E484 PolarHBondContact O-N 3.2Å; E484-H486 VanDerWaalsContact C-N 3.3Å; E484-H486 PolarHBondContact O-N 2.8Å; E484-S487 WeakPolarHBondContact O-CB 3.41Å; E484-S487 PolarHBondContact O-N 3.47Å; E484-L488 HydrophobicContact CG-CD1 3.94Å; E484-L488 HydrophobicContact CG-CG 4.38Å; E484-L488 WeakPolarHBondContact O-CB 3.41Å; E484-L488 WeakPolarHBondContact O-CD1 3.48Å; E484-L488 WeakPolarHBondContact O-CG 3.22Å; E484-L488 PolarHBondContact O-N 3.17Å; E484-K491 IonicContact OE1-NZ 3.72Å
485	I	93.8	Very high	90.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-41.7	172.2	-71.6	168.5	0	0	0	110.9	A472 R481 L488 I489 V552 I555	A472-I485 HydrophobicContact CB-CG1 3.93Å; R481-I485 HydrophobicContact CG-CD1 3.87Å; R481-I485 WeakPolarHBondContact O-CB 3.17Å; R481-I485 WeakPolarHBondContact O-CD1 3.44Å; R481-I485 WeakPolarHBondContact O-CG1 3.42Å; R481-I485 PolarHBondContact O-N 2.73Å; I485-L488 PolarHBondContact O-N 3.25Å; I485-I489 HydrophobicContact CG2-CD1 3.69Å; I485-I489 WeakPolarHBondContact O-CD1 3.25Å; I485-I489 VanDerWaalsContact O-CG1 3.27Å; I485-I489 WeakPolarHBondContact O-CG1 3.22Å; I485-I489 PolarHBondContact O-N 3.11Å; I485-V552 HydrophobicContact CD1-CG1 4.47Å; I485-V552 HydrophobicContact CD1-CG2 4.18Å; I485-V552 HydrophobicContact CG2-CG1 4.27Å; I485-I555 HydrophobicContact CD1-CD1 3.81Å; I485-I555 HydrophobicContact CD1-CG2 4.44Å
486	H	93.1	Very high	90.4	Very high	14 Å²	14	63.2 Å²	63.2	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-49.7	175.1	-179.7	-161.7	0	0	0	111.9	L482 S483 E484 L488 I489 Y490 K562 I563 C566	L482-H486 VanDerWaalsContact O-CB 3.29Å; L482-H486 WeakPolarHBondContact O-CB 3.46Å; L482-H486 PolarHBondContact O-N 2.79Å; S483-H486 PolarHBondContact O-N 2.61Å; E484-H486 VanDerWaalsContact C-N 3.3Å; E484-H486 PolarHBondContact O-N 2.8Å; H486-L488 PolarHBondContact O-N 3.02Å; H486-I489 PolarHBondContact O-N 2.92Å; H486-Y490 AromaticContact CD2-CD2 3.87Å; H486-Y490 AromaticContact CD2-CE2 3.73Å; H486-Y490 AromaticContact NE2-CE2 3.57Å; H486-Y490 PolarHBondContact O-N 3.47Å; H486-K562 PolarHBondContact CE1-O 2.85Å; H486-K562 PolarHBondContact NE2-O 3.26Å; H486-I563 HydrophobicContact CB-CG1 4.34Å; H486-I563 PolarHBondContact CD2-O 3.35Å; H486-I563 PolarHBondContact NE2-O 3.24Å; H486-C566 PolarHBondContact CE1-O 3.46Å; H486-C566 PolarHBondContact NE2-O 3.3Å
487	S	91.5	Very high	90.9	Very high	37 Å²	37	58.9 Å²	58.9	26%	0.259	29%	0.29	S	S	.	.	H	α-helix	trans	-55.6	-49.3	173.9	178	0	0	0	0	112.3	S483 E484 I489 Y490 K491	S483-S487 WeakPolarHBondContact O-CB 3.03Å; S483-S487 PolarHBondContact O-N 3.04Å; E484-S487 WeakPolarHBondContact O-CB 3.41Å; E484-S487 PolarHBondContact O-N 3.47Å; S487-I489 VanDerWaalsContact C-N 3.33Å; S487-I489 PolarHBondContact O-N 2.97Å; S487-Y490 PolarHBondContact O-N 3.13Å; S487-Y490 VanDerWaalsContact O-N 3.11Å; S487-K491 PolarHBondContact O-N 3.27Å
488	L	93.1	Very high	91.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-34.9	-178.7	-69.3	167.4	0	0	0	113.3	L465 E468 L469 A472 E484 I485 H486 Y490 K491	L465-L488 HydrophobicContact CD2-CD2 4.26Å; E468-L488 HydrophobicContact CB-CD1 3.94Å; E468-L488 HydrophobicContact CB-CD2 3.48Å; E468-L488 VanDerWaalsContact CB-CD2 3.48Å; E468-L488 HydrophobicContact CB-CG 4.4Å; E468-L488 HydrophobicContact CG-CD2 4.22Å; E468-L488 WeakPolarHBondContact OE2-CD2 3.3Å; L469-L488 HydrophobicContact CD2-CB 3.61Å; L469-L488 HydrophobicContact CD2-CD1 3.73Å; L469-L488 HydrophobicContact CD2-CG 4.3Å; L469-L488 HydrophobicContact CG-CB 4.19Å; L469-L488 HydrophobicContact CG-CD1 3.98Å; A472-L488 HydrophobicContact CB-CD1 4.12Å; E484-L488 HydrophobicContact CG-CD1 3.94Å; E484-L488 HydrophobicContact CG-CG 4.38Å; E484-L488 WeakPolarHBondContact O-CB 3.41Å; E484-L488 WeakPolarHBondContact O-CD1 3.48Å; E484-L488 WeakPolarHBondContact O-CG 3.22Å; E484-L488 PolarHBondContact O-N 3.17Å; I485-L488 PolarHBondContact O-N 3.25Å; H486-L488 PolarHBondContact O-N 3.02Å; L488-Y490 VanDerWaalsContact C-N 3.3Å; L488-Y490 PolarHBondContact O-N 2.93Å; L488-K491 HydrophobicContact CD2-CD 3.99Å; L488-K491 VanDerWaalsContact CD2-NZ 3.3Å; L488-K491 WeakPolarHBondContact O-CB 3.16Å; L488-K491 PolarHBondContact O-N 3.36Å; L488-K491 VanDerWaalsContact O-N 3.16Å
489	I	94	Very high	91.8	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-32.6	176.1	-73.2	162.4	0	0	0	111.5	M461 I485 H486 S487 L492 R497 L500 M556 I563 F564	M461-I489 HydrophobicContact CE-CG1 4.17Å; I485-I489 HydrophobicContact CG2-CD1 3.69Å; I485-I489 WeakPolarHBondContact O-CD1 3.25Å; I485-I489 VanDerWaalsContact O-CG1 3.27Å; I485-I489 WeakPolarHBondContact O-CG1 3.22Å; I485-I489 PolarHBondContact O-N 3.11Å; H486-I489 PolarHBondContact O-N 2.92Å; S487-I489 VanDerWaalsContact C-N 3.33Å; S487-I489 PolarHBondContact O-N 2.97Å; I489-L492 HydrophobicContact CG2-CD1 4.47Å; I489-L492 WeakPolarHBondContact O-CB 3.32Å; I489-L492 PolarHBondContact O-N 3.36Å; I489-R497 HydrophobicContact CG2-CG 4.42Å; I489-R497 WeakPolarHBondContact O-CD 3.15Å; I489-L500 HydrophobicContact CG1-CD2 4.4Å; I489-L500 HydrophobicContact CG2-CD2 4.28Å; I489-M556 HydrophobicContact CD1-CG 3.58Å; I489-M556 HydrophobicContact CD1-SD 3.5Å; I489-M556 WeakPolarHBondContact CD1-SD 3.23Å; I489-M556 HydrophobicContact CG1-SD 4.23Å; I489-I563 HydrophobicContact CB-CG2 4.48Å; I489-I563 HydrophobicContact CD1-CG2 3.47Å; I489-I563 VanDerWaalsContact CD1-CG2 3.47Å; I489-I563 HydrophobicContact CG2-CG2 4.32Å; I489-F564 HydrophobicContact CD1-CZ 4.36Å; I489-F564 HydrophobicContact CG2-CD1 4.34Å; I489-F564 HydrophobicContact CG2-CE1 3.66Å; I489-F564 HydrophobicContact CG2-CZ 3.92Å
490	Y	92.1	Very high	92.4	Very high	63 Å²	63	47.3 Å²	47.3	25%	0.247	23%	0.226	C	C	.	.	H	α-helix	trans	-72.8	-25.6	172.8	-84.9	-92.3	0	0	0	113.4	H486 S487 L488 L492 R497 I563 C566 M567 P568	H486-Y490 AromaticContact CD2-CD2 3.87Å; H486-Y490 AromaticContact CD2-CE2 3.73Å; H486-Y490 AromaticContact NE2-CE2 3.57Å; H486-Y490 PolarHBondContact O-N 3.47Å; S487-Y490 PolarHBondContact O-N 3.13Å; S487-Y490 VanDerWaalsContact O-N 3.11Å; L488-Y490 VanDerWaalsContact C-N 3.3Å; L488-Y490 PolarHBondContact O-N 2.93Å; Y490-L492 VanDerWaalsContact C-N 3.25Å; Y490-L492 PolarHBondContact O-N 3.41Å; Y490-R497 PolarHBondContact O-NH1 2.73Å; Y490-I563 WeakPolarHBondContact CE2-O 3.35Å; Y490-C566 WeakPolarHBondContact CE2-O 3.47Å; Y490-C566 PolarHBondContact OH-O 3.38Å; Y490-C566 VanDerWaalsContact OH-O 3.12Å; Y490-M567 HydrophobicContact CD1-SD 4.31Å; Y490-M567 HydrophobicContact CE1-SD 3.86Å; Y490-P568 HydrophobicContact CD2-CG 3.7Å; Y490-P568 HydrophobicContact CE2-CG 4.33Å; Y490-P568 HydrophobicContact CG-CG 4.06Å
491	K	92.1	Very high	92.7	Very high	99 Å²	99	45.2 Å²	45.2	43%	0.43	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.9	171.9	-55.5	-175.9	-154.9	170.9	0	113.8	L465 E468 E484 S487 L488	L465-K491 HydrophobicContact CD1-CB 3.95Å; L465-K491 HydrophobicContact CD2-CB 4.13Å; L465-K491 HydrophobicContact CD2-CD 4.14Å; E468-K491 IonicContact OE2-NZ 3.53Å; E468-K491 PolarHBondContact OE2-NZ 3.44Å; E484-K491 IonicContact OE1-NZ 3.72Å; S487-K491 PolarHBondContact O-N 3.27Å; L488-K491 HydrophobicContact CD2-CD 3.99Å; L488-K491 VanDerWaalsContact CD2-NZ 3.3Å; L488-K491 WeakPolarHBondContact O-CB 3.16Å; L488-K491 PolarHBondContact O-N 3.36Å; L488-K491 VanDerWaalsContact O-N 3.16Å
492	L	92.8	Very high	92.9	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-62.9	146.9	180	-76	166.2	0	0	0	112.4	M461 T462 L465 I489 Y490 N496 R497 L500	M461-L492 HydrophobicContact CE-CD1 4.15Å; M461-L492 HydrophobicContact SD-CD1 4.22Å; T462-L492 HydrophobicContact CG2-CD2 3.96Å; L465-L492 HydrophobicContact CD1-CD2 3.79Å; L465-L492 HydrophobicContact CD1-CG 3.99Å; I489-L492 HydrophobicContact CG2-CD1 4.47Å; I489-L492 WeakPolarHBondContact O-CB 3.32Å; I489-L492 PolarHBondContact O-N 3.36Å; Y490-L492 VanDerWaalsContact C-N 3.25Å; Y490-L492 PolarHBondContact O-N 3.41Å; L492-N496 HydrophobicContact CB-CB 4.49Å; L492-N496 HydrophobicContact CD2-CB 4.48Å; L492-R497 HydrophobicContact CB-CB 4.1Å; L492-L500 HydrophobicContact CD1-CD2 3.55Å
493	P	92.7	Very high	93.3	Very high	63 Å²	63	42.7 Å²	42.7	41%	0.409	21%	0.208	S	C	.	.			trans	-53.2	143.2	169	-24	33	0	0	0	111.7	T462 K495 N496 R497	T462-P493 HydrophobicContact CG2-CG 4.04Å; P493-K495 VanDerWaalsContact C-N 3.35Å; P493-K495 PolarHBondContact O-N 3.28Å; P493-N496 HydrophobicContact CB-CB 4.28Å; P493-N496 WeakPolarHBondContact O-CA 3.42Å; P493-N496 WeakPolarHBondContact O-CB 3.39Å; P493-N496 PolarHBondContact O-N 3.23Å; P493-R497 PolarHBondContact O-N 3.47Å
494	E	89.8	Confident	93.7	Very high	153 Å²	153	40 Å²	40	72%	0.715	19%	0.189	S	C	*	.	H	α-helix	trans	-50.6	-48.6	-170.3	-176	175.3	-148.3	0	0	113.6	R497 E498	E494-R497 PolarHBondContact O-N 3.04Å; E494-E498 PolarHBondContact O-N 2.65Å
495	K	90.8	Very high	93.9	Very high	96 Å²	96	42.5 Å²	42.5	42%	0.417	20%	0.196	S	C	.	.	H	α-helix	trans	-66.7	-36.4	177.8	-63.5	-166.4	178.5	-159.6	0	113.2	L382 F387 P493 R497 M499	L382-K495 HydrophobicContact CD2-CB 3.84Å; L382-K495 HydrophobicContact CG-CB 4.34Å; F387-K495 HydrophobicContact CE2-CB 4.18Å; F387-K495 HydrophobicContact CE2-CD 4.45Å; F387-K495 HydrophobicContact CZ-CB 4.08Å; F387-K495 WeakPolarHBondContact CZ-O 3.48Å; P493-K495 VanDerWaalsContact C-N 3.35Å; P493-K495 PolarHBondContact O-N 3.28Å; K495-R497 VanDerWaalsContact C-N 3.33Å; K495-M499 PolarHBondContact O-N 2.98Å
496	N	94.2	Very high	94.1	Very high	21 Å²	21	42.6 Å²	42.6	11%	0.112	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-43.8	175.3	-69.4	56.8	0	0	0	110	L382 L460 L492 P493 L500	L382-N496 HydrophobicContact CD2-CB 4.33Å; L382-N496 VanDerWaalsContact CD2-OD1 3.29Å; L382-N496 WeakPolarHBondContact CD2-OD1 3.48Å; L460-N496 HydrophobicContact CD1-CB 4.27Å; L460-N496 WeakPolarHBondContact O-CB 3.37Å; L460-N496 PolarHBondContact O-ND2 3.46Å; L492-N496 HydrophobicContact CB-CB 4.49Å; L492-N496 HydrophobicContact CD2-CB 4.48Å; P493-N496 HydrophobicContact CB-CB 4.28Å; P493-N496 WeakPolarHBondContact O-CA 3.42Å; P493-N496 WeakPolarHBondContact O-CB 3.39Å; P493-N496 PolarHBondContact O-N 3.23Å; N496-L500 WeakPolarHBondContact O-CB 3.28Å; N496-L500 PolarHBondContact O-N 3.12Å
497	R	94	Very high	94.2	Very high	75 Å²	75	42 Å²	42	28%	0.283	19%	0.193	S	C	.	.	H	α-helix	trans	-66.7	-42.3	177.3	-162	175.1	65.7	-136.4	-4.1	112.4	I489 Y490 L492 P493 E494 K495 L500 E501	I489-R497 HydrophobicContact CG2-CG 4.42Å; I489-R497 WeakPolarHBondContact O-CD 3.15Å; Y490-R497 PolarHBondContact O-NH1 2.73Å; L492-R497 HydrophobicContact CB-CB 4.1Å; P493-R497 PolarHBondContact O-N 3.47Å; E494-R497 PolarHBondContact O-N 3.04Å; K495-R497 VanDerWaalsContact C-N 3.33Å; R497-L500 PolarHBondContact O-N 2.91Å; R497-E501 WeakPolarHBondContact O-CB 3.36Å; R497-E501 PolarHBondContact O-N 3.49Å
498	E	94.2	Very high	94.5	Very high	77 Å²	77	42.5 Å²	42.5	36%	0.36	20%	0.195	S	C	.	.	H	α-helix	trans	-60.2	-51.1	175	-171.2	-156.9	148.4	0	0	111.3	F387 R391 E494 L500 E501 M502	F387-E498 HydrophobicContact CE1-CB 4.05Å; F387-E498 HydrophobicContact CE1-CG 3.89Å; F387-E498 VanDerWaalsContact CE1-OE1 3.32Å; F387-E498 WeakPolarHBondContact CE1-OE1 3.47Å; F387-E498 WeakPolarHBondContact CE1-OE2 3.48Å; F387-E498 HydrophobicContact CZ-CB 4.29Å; R391-E498 IonicContact CZ-OE1 2.64Å; R391-E498 IonicContact NH1-OE1 2.69Å; R391-E498 PolarHBondContact NH1-OE1 2.88Å; R391-E498 IonicContact NH2-OE1 3.64Å; E494-E498 PolarHBondContact O-N 2.65Å; E498-L500 VanDerWaalsContact C-N 3.3Å; E498-L500 PolarHBondContact O-N 2.9Å; E498-E501 PolarHBondContact O-N 3.22Å; E498-M502 WeakPolarHBondContact O-CG 3.4Å; E498-M502 PolarHBondContact O-N 2.83Å
499	M	95.4	Very high	94.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.2	-32.8	180	-177.7	167.9	-65.7	0	0	112.1	L382 F387 V390 Y452 L453 L460 K495 L503	L382-M499 HydrophobicContact CD1-CB 4.44Å; L382-M499 HydrophobicContact CD1-CE 3.58Å; L382-M499 HydrophobicContact CD1-SD 3.48Å; L382-M499 WeakPolarHBondContact CD1-SD 3.25Å; F387-M499 HydrophobicContact CB-CE 4.28Å; F387-M499 HydrophobicContact CD1-CE 3.83Å; F387-M499 HydrophobicContact CD2-CE 3.71Å; F387-M499 HydrophobicContact CE1-CB 3.76Å; F387-M499 HydrophobicContact CE1-CE 4.06Å; F387-M499 HydrophobicContact CE2-CE 3.96Å; F387-M499 HydrophobicContact CG-CE 3.65Å; F387-M499 HydrophobicContact CZ-CB 3.88Å; F387-M499 HydrophobicContact CZ-CE 4.14Å; V390-M499 HydrophobicContact CB-CE 4.34Å; V390-M499 HydrophobicContact CG2-CE 3.99Å; V390-M499 HydrophobicContact CG2-SD 4.02Å; Y452-M499 HydrophobicContact CE1-CE 4.46Å; Y452-M499 HydrophobicContact CE1-SD 4.24Å; L453-M499 HydrophobicContact CD2-SD 3.79Å; L460-M499 HydrophobicContact CD1-CB 4.06Å; L460-M499 HydrophobicContact CD1-CG 4.24Å; L460-M499 HydrophobicContact CD1-SD 4.48Å; L460-M499 HydrophobicContact CD2-CG 4.26Å; K495-M499 PolarHBondContact O-N 2.98Å; M499-L503 VanDerWaalsContact O-CB 3.3Å; M499-L503 WeakPolarHBondContact O-CB 3.4Å; M499-L503 PolarHBondContact O-N 3.33Å
500	L	96.4	Very high	94.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-48.9	173.1	-178.3	68.9	0	0	0	111.4	L460 M461 I489 L492 N496 R497 E498 M502 L503 I504 L532 M556 F564	L460-L500 HydrophobicContact CD2-CB 4.03Å; L460-L500 HydrophobicContact CD2-CD1 4.12Å; L460-L500 HydrophobicContact CG-CB 4.39Å; M461-L500 HydrophobicContact CE-CD2 3.94Å; M461-L500 HydrophobicContact SD-CD1 3.6Å; M461-L500 VanDerWaalsContact SD-CD1 3.6Å; M461-L500 HydrophobicContact SD-CD2 3.47Å; M461-L500 WeakPolarHBondContact SD-CD2 3.44Å; M461-L500 HydrophobicContact SD-CG 4.15Å; I489-L500 HydrophobicContact CG1-CD2 4.4Å; I489-L500 HydrophobicContact CG2-CD2 4.28Å; L492-L500 HydrophobicContact CD1-CD2 3.55Å; N496-L500 WeakPolarHBondContact O-CB 3.28Å; N496-L500 PolarHBondContact O-N 3.12Å; R497-L500 PolarHBondContact O-N 2.91Å; E498-L500 VanDerWaalsContact C-N 3.3Å; E498-L500 PolarHBondContact O-N 2.9Å; L500-M502 PolarHBondContact O-N 3.16Å; L500-L503 WeakPolarHBondContact O-CB 3.4Å; L500-L503 PolarHBondContact O-N 2.84Å; L500-L503 VanDerWaalsContact O-N 3.1Å; L500-I504 HydrophobicContact CD1-CD1 4.22Å; L500-I504 HydrophobicContact CD1-CG1 3.92Å; L500-I504 HydrophobicContact CG-CG1 4.17Å; L500-I504 WeakPolarHBondContact O-CG1 3.28Å; L500-I504 PolarHBondContact O-N 3.41Å; L500-L532 HydrophobicContact CD1-CD1 4.29Å; L500-M556 HydrophobicContact CD1-CE 4.16Å; L500-M556 HydrophobicContact CD1-SD 4.13Å; L500-M556 HydrophobicContact CD2-SD 3.94Å; L500-M556 HydrophobicContact CG-SD 4.34Å; L500-F564 HydrophobicContact CD2-CE1 4.18Å; L500-F564 HydrophobicContact CD2-CZ 3.94Å; L500-F564 HydrophobicContact CG-CE1 4.25Å; L500-F564 HydrophobicContact CG-CZ 3.98Å
501	E	95.4	Very high	94.8	Very high	64 Å²	64	42.9 Å²	42.9	30%	0.299	20%	0.202	S	C	.	.	H	α-helix	trans	-58.5	-47.8	178	-173.7	-158.1	123.5	0	0	111.1	R497 E498 L503 I504 R505 Y560 F564	R497-E501 WeakPolarHBondContact O-CB 3.36Å; R497-E501 PolarHBondContact O-N 3.49Å; E498-E501 PolarHBondContact O-N 3.22Å; E501-L503 VanDerWaalsContact C-N 3.26Å; E501-L503 PolarHBondContact O-N 2.67Å; E501-I504 PolarHBondContact O-N 3.14Å; E501-R505 VanDerWaalsContact O-CB 3.23Å; E501-R505 WeakPolarHBondContact O-CB 3.22Å; E501-R505 PolarHBondContact O-N 3.22Å; E501-R505 IonicContact OE1-CZ 3.77Å; E501-R505 IonicContact OE1-NH1 3.49Å; E501-R505 PolarHBondContact OE1-NH1 3.4Å; E501-Y560 HydrophobicContact CG-CE2 4.28Å; E501-F564 HydrophobicContact CB-CD1 3.69Å; E501-F564 HydrophobicContact CB-CE1 3.95Å; E501-F564 HydrophobicContact CB-CG 4.5Å; E501-F564 HydrophobicContact CG-CB 4.12Å; E501-F564 HydrophobicContact CG-CD1 3.71Å; E501-F564 HydrophobicContact CG-CE1 4.43Å; E501-F564 HydrophobicContact CG-CG 4.09Å
502	M	95.6	Very high	95	Very high	16 Å²	16	42.1 Å²	42.1	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-41.4	175.5	-68.9	-159.3	-53.7	0	0	111.8	F387 V390 R391 F394 E498 L500 H506	F387-M502 HydrophobicContact CD1-CE 3.53Å; F387-M502 HydrophobicContact CE1-CE 3.96Å; V390-M502 HydrophobicContact CG1-CE 4.37Å; R391-M502 HydrophobicContact CG-CE 3.85Å; R391-M502 HydrophobicContact CG-SD 3.65Å; R391-M502 PolarHBondContact NH1-SD 2.95Å; F394-M502 HydrophobicContact CE2-CB 3.96Å; F394-M502 WeakPolarHBondContact CE2-O 3.37Å; E498-M502 WeakPolarHBondContact O-CG 3.4Å; E498-M502 PolarHBondContact O-N 2.83Å; L500-M502 PolarHBondContact O-N 3.16Å; M502-H506 WeakPolarHBondContact O-CB 3.43Å; M502-H506 PolarHBondContact O-N 3.42Å; M502-H506 VanDerWaalsContact O-N 3.12Å
503	L	97.4	Very high	95	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.6	-51.6	179.8	176.6	62.9	0	0	0	112	F394 L453 L460 M499 L500 E501 R505 H506 L507 F528 L532	F394-L503 HydrophobicContact CE1-CD1 3.66Å; F394-L503 HydrophobicContact CZ-CB 3.89Å; F394-L503 HydrophobicContact CZ-CD1 3.58Å; F394-L503 HydrophobicContact CZ-CG 4.35Å; L453-L503 HydrophobicContact CD1-CD1 4.3Å; L453-L503 HydrophobicContact CD1-CD2 3.89Å; L460-L503 HydrophobicContact CD2-CD2 4.41Å; M499-L503 VanDerWaalsContact O-CB 3.3Å; M499-L503 WeakPolarHBondContact O-CB 3.4Å; M499-L503 PolarHBondContact O-N 3.33Å; L500-L503 WeakPolarHBondContact O-CB 3.4Å; L500-L503 PolarHBondContact O-N 2.84Å; L500-L503 VanDerWaalsContact O-N 3.1Å; E501-L503 VanDerWaalsContact C-N 3.26Å; E501-L503 PolarHBondContact O-N 2.67Å; L503-R505 VanDerWaalsContact C-N 3.31Å; L503-R505 PolarHBondContact O-N 3.23Å; L503-H506 CarbonylContact O-C 3.5Å; L503-H506 WeakPolarHBondContact O-CA 3.4Å; L503-H506 WeakPolarHBondContact O-CB 3.34Å; L503-H506 PolarHBondContact O-N 3.27Å; L503-H506 VanDerWaalsContact O-N 3.08Å; L503-L507 HydrophobicContact CD1-CD2 3.79Å; L503-L507 HydrophobicContact CD1-CG 4.2Å; L503-L507 HydrophobicContact CG-CD2 4.44Å; L503-L507 HydrophobicContact CG-CG 4.32Å; L503-L507 VanDerWaalsContact O-CG 3.29Å; L503-L507 WeakPolarHBondContact O-CG 3.44Å; L503-L507 PolarHBondContact O-N 3.02Å; L503-F528 HydrophobicContact CD1-CD1 4.46Å; L503-F528 HydrophobicContact CD1-CE1 3.89Å; L503-F528 HydrophobicContact CD1-CZ 4.31Å; L503-F528 HydrophobicContact CD2-CD1 4.15Å; L503-F528 HydrophobicContact CD2-CE1 4.24Å; L503-L532 HydrophobicContact CD2-CD1 3.68Å; L503-L532 HydrophobicContact CD2-CD2 3.56Å; L503-L532 HydrophobicContact CD2-CG 4.19Å
504	I	97.4	Very high	95.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-38.9	-178.5	-59.4	-58.3	0	0	0	110.3	L500 E501 H506 L507 V508 M556 I557 Y560 F564	L500-I504 HydrophobicContact CD1-CD1 4.22Å; L500-I504 HydrophobicContact CD1-CG1 3.92Å; L500-I504 HydrophobicContact CG-CG1 4.17Å; L500-I504 WeakPolarHBondContact O-CG1 3.28Å; L500-I504 PolarHBondContact O-N 3.41Å; E501-I504 PolarHBondContact O-N 3.14Å; I504-H506 VanDerWaalsContact C-N 3.3Å; I504-H506 PolarHBondContact O-N 3.08Å; I504-L507 HydrophobicContact CD1-CD1 4.38Å; I504-L507 PolarHBondContact O-N 3.46Å; I504-L507 VanDerWaalsContact O-N 3.11Å; I504-V508 HydrophobicContact CG2-CG2 4.49Å; I504-V508 VanDerWaalsContact O-CG2 3.32Å; I504-V508 WeakPolarHBondContact O-CG2 3.3Å; I504-V508 PolarHBondContact O-N 2.7Å; I504-M556 HydrophobicContact CD1-CB 4.01Å; I504-M556 HydrophobicContact CD1-CE 3.94Å; I504-M556 HydrophobicContact CD1-SD 4.37Å; I504-M556 HydrophobicContact CG1-CB 4.16Å; I504-M556 HydrophobicContact CG1-CE 4.49Å; I504-M556 HydrophobicContact CG1-SD 4.3Å; I504-M556 HydrophobicContact CG2-CB 4.08Å; I504-M556 WeakPolarHBondContact CG2-O 3.48Å; I504-I557 HydrophobicContact CG2-CG1 4.31Å; I504-Y560 HydrophobicContact CB-CD2 4.25Å; I504-Y560 HydrophobicContact CG2-CD2 3.71Å; I504-Y560 HydrophobicContact CG2-CG 4.46Å; I504-F564 HydrophobicContact CB-CE2 4.16Å; I504-F564 HydrophobicContact CB-CZ 4.44Å; I504-F564 HydrophobicContact CG1-CE2 4.24Å; I504-F564 HydrophobicContact CG1-CZ 4.18Å; I504-F564 HydrophobicContact CG2-CE2 4.07Å
505	R	96.3	Very high	95.2	Very high	110 Å²	110	43.7 Å²	43.7	42%	0.415	22%	0.22	S	C	.	.	H	α-helix	trans	-56.8	-43.2	170.9	-178.1	169.2	59.7	-125.2	4.9	112.2	E501 L503 V508 N509 Y560	E501-R505 VanDerWaalsContact O-CB 3.23Å; E501-R505 WeakPolarHBondContact O-CB 3.22Å; E501-R505 PolarHBondContact O-N 3.22Å; E501-R505 IonicContact OE1-CZ 3.77Å; E501-R505 IonicContact OE1-NH1 3.49Å; E501-R505 PolarHBondContact OE1-NH1 3.4Å; L503-R505 VanDerWaalsContact C-N 3.31Å; L503-R505 PolarHBondContact O-N 3.23Å; R505-V508 PolarHBondContact O-N 3.04Å; R505-N509 PolarHBondContact O-N 2.97Å; R505-Y560 HydrophobicContact CB-CE2 3.81Å
506	H	96.9	Very high	95.3	Very high	2 Å²	2	45 Å²	45	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-41.7	174.2	173.8	59.8	0	0	0	112	F394 E398 Y408 M502 L503 I504 V508 N509 V510	F394-H506 HydrophobicContact CB-CB 4.49Å; F394-H506 HydrophobicContact CD1-CB 3.91Å; F394-H506 AromaticContact CD1-CD2 3.18Å; F394-H506 WeakPolarHBondContact CD1-CD2 3.34Å; F394-H506 AromaticContact CD1-CG 3.41Å; F394-H506 VanDerWaalsContact CD1-CG 3.41Å; F394-H506 AromaticContact CD1-NE2 3.71Å; F394-H506 HydrophobicContact CD2-CB 4Å; F394-H506 HydrophobicContact CE1-CB 4.05Å; F394-H506 AromaticContact CE1-CD2 3.45Å; F394-H506 VanDerWaalsContact CE1-CD2 3.45Å; F394-H506 WeakPolarHBondContact CE1-CD2 3.38Å; F394-H506 AromaticContact CE1-CG 3.85Å; F394-H506 HydrophobicContact CE2-CB 4.16Å; F394-H506 HydrophobicContact CG-CB 3.9Å; F394-H506 AromaticContact CG-CD2 3.94Å; F394-H506 AromaticContact CG-CG 3.67Å; F394-H506 HydrophobicContact CZ-CB 4.19Å; E398-H506 VanDerWaalsContact CD-ND1 3.27Å; E398-H506 VanDerWaalsContact CG-CE1 3.45Å; E398-H506 WeakPolarHBondContact CG-CE1 3.34Å; E398-H506 WeakPolarHBondContact CG-ND1 3.29Å; E398-H506 IonicContact OE1-CE1 3.75Å; E398-H506 IonicContact OE1-CG 2.63Å; E398-H506 IonicContact OE1-ND1 3.86Å; E398-H506 PolarHBondContact OE1-ND1 3.1Å; Y408-H506 AromaticContact CE2-NE2 3.6Å; Y408-H506 AromaticContact CZ-NE2 3.59Å; Y408-H506 PolarHBondContact OH-CD2 2.92Å; Y408-H506 PolarHBondContact OH-NE2 3.19Å; M502-H506 WeakPolarHBondContact O-CB 3.43Å; M502-H506 PolarHBondContact O-N 3.42Å; M502-H506 VanDerWaalsContact O-N 3.12Å; L503-H506 CarbonylContact O-C 3.5Å; L503-H506 WeakPolarHBondContact O-CA 3.4Å; L503-H506 WeakPolarHBondContact O-CB 3.34Å; L503-H506 PolarHBondContact O-N 3.27Å; L503-H506 VanDerWaalsContact O-N 3.08Å; I504-H506 VanDerWaalsContact C-N 3.3Å; I504-H506 PolarHBondContact O-N 3.08Å; H506-V508 VanDerWaalsContact C-N 3.33Å; H506-V508 PolarHBondContact O-N 3.05Å; H506-N509 PolarHBondContact O-N 3.19Å; H506-V510 WeakPolarHBondContact O-CG2 3.39Å; H506-V510 PolarHBondContact O-N 3.4Å
507	L	96.9	Very high	95.3	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-38.2	177.9	-57.5	-157.6	0	0	0	111.6	L503 I504 V510 C511 M524 F528 V553 I557	L503-L507 HydrophobicContact CD1-CD2 3.79Å; L503-L507 HydrophobicContact CD1-CG 4.2Å; L503-L507 HydrophobicContact CG-CD2 4.44Å; L503-L507 HydrophobicContact CG-CG 4.32Å; L503-L507 VanDerWaalsContact O-CG 3.29Å; L503-L507 WeakPolarHBondContact O-CG 3.44Å; L503-L507 PolarHBondContact O-N 3.02Å; I504-L507 HydrophobicContact CD1-CD1 4.38Å; I504-L507 PolarHBondContact O-N 3.46Å; I504-L507 VanDerWaalsContact O-N 3.11Å; L507-V510 PolarHBondContact O-N 3.08Å; L507-C511 WeakPolarHBondContact O-CB 3.11Å; L507-C511 PolarHBondContact O-N 2.98Å; L507-C511 PolarHBondContact O-SG 3.46Å; L507-M524 HydrophobicContact CB-CE 4.47Å; L507-M524 HydrophobicContact CD1-CE 4.41Å; L507-M524 HydrophobicContact CD2-CE 3.68Å; L507-M524 HydrophobicContact CG-CE 4.37Å; L507-F528 HydrophobicContact CD1-CB 4.14Å; L507-F528 HydrophobicContact CD1-CD1 4.39Å; L507-F528 HydrophobicContact CD1-CD2 3.66Å; L507-F528 HydrophobicContact CD1-CE2 4.15Å; L507-F528 HydrophobicContact CD1-CG 3.8Å; L507-F528 HydrophobicContact CD2-CD2 4.17Å; L507-F528 HydrophobicContact CD2-CE2 3.76Å; L507-F528 HydrophobicContact CD2-CZ 3.97Å; L507-V553 HydrophobicContact CD1-CG1 4.49Å; L507-I557 HydrophobicContact CB-CD1 4.02Å; L507-I557 HydrophobicContact CB-CG1 4.03Å; L507-I557 HydrophobicContact CD1-CD1 3.93Å; L507-I557 HydrophobicContact CD1-CG1 4.41Å
508	V	96.7	Very high	95.2	Very high	48 Å²	48	44.5 Å²	44.5	29%	0.291	23%	0.23	S	C	.	.	H	α-helix	trans	-60.5	-44	173.4	169.8	0	0	0	0	111.4	I504 R505 H506 C511 S512 I557 Y560	I504-V508 HydrophobicContact CG2-CG2 4.49Å; I504-V508 VanDerWaalsContact O-CG2 3.32Å; I504-V508 WeakPolarHBondContact O-CG2 3.3Å; I504-V508 PolarHBondContact O-N 2.7Å; R505-V508 PolarHBondContact O-N 3.04Å; H506-V508 VanDerWaalsContact C-N 3.33Å; H506-V508 PolarHBondContact O-N 3.05Å; V508-C511 PolarHBondContact O-N 2.83Å; V508-S512 PolarHBondContact O-N 2.71Å; V508-I557 HydrophobicContact CG2-CB 4.46Å; V508-I557 HydrophobicContact CG2-CG2 3.9Å; V508-I557 WeakPolarHBondContact CG2-O 3.32Å; V508-Y560 HydrophobicContact CG2-CG 4.06Å
509	N	95.6	Very high	95.2	Very high	59 Å²	59	40.9 Å²	40.9	32%	0.316	21%	0.213	S	C	.	.	H	α-helix	trans	-66.1	-34.7	176.6	-172.7	26.7	0	0	0	112.5	E398 R505 H506 S512 H513	E398-N509 WeakPolarHBondContact CG-ND2 3.3Å; E398-N509 PolarHBondContact OE1-ND2 2.97Å; R505-N509 PolarHBondContact O-N 2.97Å; H506-N509 PolarHBondContact O-N 3.19Å; N509-S512 PolarHBondContact O-OG 2.92Å; N509-H513 PolarHBondContact O-CE1 3.37Å; N509-H513 PolarHBondContact O-ND1 2.74Å
510	V	95.6	Very high	95.1	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-69.7	-41.6	171.3	173.5	0	0	0	0	110.9	I397 V407 Y408 H506 L507 S512 H513 N517 M524	I397-V510 HydrophobicContact CG2-CG2 4.45Å; V407-V510 HydrophobicContact CG1-CG1 3.67Å; Y408-V510 HydrophobicContact CE2-CG2 4.41Å; H506-V510 WeakPolarHBondContact O-CG2 3.39Å; H506-V510 PolarHBondContact O-N 3.4Å; L507-V510 PolarHBondContact O-N 3.08Å; V510-S512 VanDerWaalsContact C-N 3.3Å; V510-S512 PolarHBondContact O-N 3.49Å; V510-H513 PolarHBondContact O-N 3.48Å; V510-H513 VanDerWaalsContact O-N 3.14Å; V510-N517 PolarHBondContact O-ND2 3.48Å; V510-M524 HydrophobicContact CG1-CE 4.17Å; V510-M524 HydrophobicContact CG1-SD 4.44Å
511	C	95.3	Very high	95	Very high	12 Å²	12	44.9 Å²	44.9	8%	0.081	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-27.9	178.2	-67.4	0	0	0	0	113.2	L507 V508 H513 S514 P521 I557	L507-C511 WeakPolarHBondContact O-CB 3.11Å; L507-C511 PolarHBondContact O-N 2.98Å; L507-C511 PolarHBondContact O-SG 3.46Å; V508-C511 PolarHBondContact O-N 2.83Å; C511-H513 PolarHBondContact O-N 3.32Å; C511-H513 VanDerWaalsContact O-N 3.15Å; C511-S514 VanDerWaalsContact O-CB 3.23Å; C511-S514 WeakPolarHBondContact O-CB 3.33Å; C511-S514 PolarHBondContact O-N 3.18Å; C511-S514 VanDerWaalsContact O-N 3.09Å; C511-S514 PolarHBondContact O-OG 2.94Å; C511-P521 HydrophobicContact CB-CG 4.31Å; C511-I557 HydrophobicContact CB-CG2 4.45Å
512	S	95.1	Very high	94.8	Very high	83 Å²	83	44.3 Å²	44.3	58%	0.58	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-4	174.5	62.6	0	0	0	0	114.2	V508 N509 V510	V508-S512 PolarHBondContact O-N 2.71Å; N509-S512 PolarHBondContact O-OG 2.92Å; V510-S512 VanDerWaalsContact C-N 3.3Å; V510-S512 PolarHBondContact O-N 3.49Å
513	H	94.3	Very high	94.7	Very high	63 Å²	63	46.8 Å²	46.8	29%	0.292	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	20.4	171.9	-58.5	86.9	0	0	0	111.8	T403 N509 V510 C511 D515 E516 N517	T403-H513 HydrophobicContact CG2-CB 4.32Å; N509-H513 PolarHBondContact O-CE1 3.37Å; N509-H513 PolarHBondContact O-ND1 2.74Å; V510-H513 PolarHBondContact O-N 3.48Å; V510-H513 VanDerWaalsContact O-N 3.14Å; C511-H513 PolarHBondContact O-N 3.32Å; C511-H513 VanDerWaalsContact O-N 3.15Å; H513-D515 PolarHBondContact O-N 2.87Å; H513-D515 VanDerWaalsContact O-N 3.16Å; H513-E516 PolarHBondContact O-N 3.39Å; H513-N517 VanDerWaalsContact O-CG 3.27Å; H513-N517 PolarHBondContact O-N 3.19Å; H513-N517 PolarHBondContact O-ND2 3.07Å; H513-N517 PolarHBondContact O-OD1 3.28Å
514	S	93.6	Very high	94.5	Very high	34 Å²	34	46.8 Å²	46.8	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-24.6	-173.9	59.8	0	0	0	0	115.1	C511 E516 N517 L518	C511-S514 VanDerWaalsContact O-CB 3.23Å; C511-S514 WeakPolarHBondContact O-CB 3.33Å; C511-S514 PolarHBondContact O-N 3.18Å; C511-S514 VanDerWaalsContact O-N 3.09Å; C511-S514 PolarHBondContact O-OG 2.94Å; S514-E516 VanDerWaalsContact C-N 3.25Å; S514-E516 PolarHBondContact O-N 3.03Å; S514-N517 WeakPolarHBondContact CA-OD1 3.24Å; S514-L518 VanDerWaalsContact O-CA 3.26Å; S514-L518 WeakPolarHBondContact O-CA 3.49Å; S514-L518 PolarHBondContact O-N 3.3Å
515	D	92.8	Very high	94.4	Very high	156 Å²	156	46.9 Å²	46.9	83%	0.834	26%	0.255	S	S	*	.	H	α-helix	trans	-68.6	-24.2	177.2	-63.3	-28.2	0	0	0	112.7	H513	H513-D515 PolarHBondContact O-N 2.87Å; H513-D515 VanDerWaalsContact O-N 3.16Å
516	E	93	Very high	94.1	Very high	124 Å²	124	45.5 Å²	45.5	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-101.9	-47.7	175.3	-67.9	-177.4	-130.5	0	0	111.9	T403 H513 S514	T403-E516 VanDerWaalsContact CB-OE2 3.27Å; T403-E516 WeakPolarHBondContact CB-OE2 3.4Å; T403-E516 HydrophobicContact CG2-CB 4.21Å; T403-E516 VanDerWaalsContact CG2-OE2 3.23Å; T403-E516 WeakPolarHBondContact CG2-OE2 3.31Å; H513-E516 PolarHBondContact O-N 3.39Å; S514-E516 VanDerWaalsContact C-N 3.25Å; S514-E516 PolarHBondContact O-N 3.03Å
517	N	93.5	Very high	94	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-85.4	-11.1	-172.8	72.2	28.7	0	0	0	114.6	A402 Q404 G406 V407 V510 H513 S514 M519	A402-N517 WeakPolarHBondContact O-CB 3.49Å; A402-N517 PolarHBondContact O-ND2 3.41Å; Q404-N517 WeakPolarHBondContact O-CB 3.46Å; G406-N517 PolarHBondContact N-O 3.43Å; V407-N517 HydrophobicContact CG1-CB 4.02Å; V510-N517 PolarHBondContact O-ND2 3.48Å; H513-N517 VanDerWaalsContact O-CG 3.27Å; H513-N517 PolarHBondContact O-N 3.19Å; H513-N517 PolarHBondContact O-ND2 3.07Å; H513-N517 PolarHBondContact O-OD1 3.28Å; S514-N517 WeakPolarHBondContact CA-OD1 3.24Å; N517-M519 PolarHBondContact O-N 3.18Å; N517-M519 WeakPolarHBondContact OD1-CA 3.29Å; N517-M519 VanDerWaalsContact OD1-CB 3.27Å; N517-M519 WeakPolarHBondContact OD1-CB 3.37Å; N517-M519 PolarHBondContact OD1-N 2.98Å
518	L	92.3	Very high	93.9	Very high	85 Å²	85	46.8 Å²	46.8	45%	0.445	27%	0.266	S	S	.	.			trans	62	20.7	-177.7	-49.4	-177.3	0	0	0	115.5	E405 S514 N523	E405-L518 HydrophobicContact CG-CD1 3.76Å; E405-L518 HydrophobicContact CG-CG 4.1Å; S514-L518 VanDerWaalsContact O-CA 3.26Å; S514-L518 WeakPolarHBondContact O-CA 3.49Å; S514-L518 PolarHBondContact O-N 3.3Å; L518-N523 PolarHBondContact O-ND2 3.1Å
519	M	94.1	Very high	93.7	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	25%	0.252	C	S	.	.			trans	-109	85.8	-178.1	-60.9	-55.2	-61.7	0	0	111.7	V407 R409 N517 N523 M524 I527	V407-M519 HydrophobicContact CG1-CG 3.94Å; V407-M519 WeakPolarHBondContact O-CG 3.34Å; R409-M519 HydrophobicContact CB-CE 4.1Å; R409-M519 HydrophobicContact CB-SD 3.91Å; N517-M519 PolarHBondContact O-N 3.18Å; N517-M519 WeakPolarHBondContact OD1-CA 3.29Å; N517-M519 VanDerWaalsContact OD1-CB 3.27Å; N517-M519 WeakPolarHBondContact OD1-CB 3.37Å; N517-M519 PolarHBondContact OD1-N 2.98Å; M519-N523 HydrophobicContact CE-CB 3.73Å; M519-N523 HydrophobicContact SD-CB 4.22Å; M519-M524 HydrophobicContact CB-CG 4.01Å; M519-M524 HydrophobicContact CB-SD 3.85Å; M519-M524 HydrophobicContact CE-CG 4.2Å; M519-M524 HydrophobicContact CE-SD 3.55Å; M519-M524 VanDerWaalsContact CE-SD 3.55Å; M519-M524 HydrophobicContact CG-SD 4.27Å; M519-I527 HydrophobicContact CE-CD1 3.39Å
520	T	93.6	Very high	93.4	Very high	56 Å²	56	43.8 Å²	43.8	34%	0.344	25%	0.25	S	S	.	.			trans	-67.6	165	169.5	60.6	0	0	0	0	112.1	S522 N523 M524	T520-S522 PolarHBondContact O-N 3.29Å; T520-N523 PolarHBondContact O-N 3.35Å; T520-N523 PolarHBondContact OG1-N 2.95Å; T520-M524 WeakPolarHBondContact O-CG 3.27Å; T520-M524 PolarHBondContact O-N 3.47Å
521	P	94.1	Very high	93.2	Very high	29 Å²	29	44.2 Å²	44.2	19%	0.188	25%	0.253	C	S	.	.	H	α-helix	trans	-49.3	-43.7	172.6	-30.2	36.9	0	0	0	113.2	C511 M524 A525 I557 E558	C511-P521 HydrophobicContact CB-CG 4.31Å; P521-M524 PolarHBondContact O-N 3.06Å; P521-A525 VanDerWaalsContact O-CB 3.23Å; P521-A525 WeakPolarHBondContact O-CB 3.43Å; P521-A525 PolarHBondContact O-N 2.92Å; P521-I557 HydrophobicContact CB-CB 4.26Å; P521-I557 HydrophobicContact CB-CG2 3.83Å; P521-I557 HydrophobicContact CG-CG2 3.92Å; P521-E558 HydrophobicContact CB-CG 3.96Å; P521-E558 HydrophobicContact CG-CG 4.16Å
522	S	91.4	Very high	93.2	Very high	52 Å²	52	43.7 Å²	43.7	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-47.1	175	-146.6	0	0	0	0	113.3	T520 M524 A525 V526 E554	T520-S522 PolarHBondContact O-N 3.29Å; S522-M524 VanDerWaalsContact C-N 3.29Å; S522-M524 PolarHBondContact O-N 2.88Å; S522-A525 PolarHBondContact O-N 2.98Å; S522-V526 WeakPolarHBondContact O-CG2 3.29Å; S522-V526 PolarHBondContact O-N 3.04Å; S522-V526 VanDerWaalsContact O-N 3.09Å; S522-E554 WeakPolarHBondContact CA-OE1 3.4Å; S522-E554 WeakPolarHBondContact CB-OE1 3.46Å; S522-E554 PolarHBondContact OG-OE1 3.31Å
523	N	92.6	Very high	92.9	Very high	68 Å²	68	39.7 Å²	39.7	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-35.4	178.1	-73.4	-10.4	0	0	0	111.8	L518 M519 T520 I527	L518-N523 PolarHBondContact O-ND2 3.1Å; M519-N523 HydrophobicContact CE-CB 3.73Å; M519-N523 HydrophobicContact SD-CB 4.22Å; T520-N523 PolarHBondContact O-N 3.35Å; T520-N523 PolarHBondContact OG1-N 2.95Å; N523-I527 WeakPolarHBondContact O-CD1 3.36Å
524	M	94.4	Very high	92.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-73.3	-39.8	175.6	-70.1	-62.9	-74.1	0	0	112.1	Y408 L507 V510 M519 T520 P521 S522 V526 I527 F528 I557	Y408-M524 HydrophobicContact CD2-CE 3.64Å; Y408-M524 HydrophobicContact CD2-SD 4.36Å; Y408-M524 HydrophobicContact CE2-CE 4.15Å; Y408-M524 HydrophobicContact CG-CE 4.24Å; L507-M524 HydrophobicContact CB-CE 4.47Å; L507-M524 HydrophobicContact CD1-CE 4.41Å; L507-M524 HydrophobicContact CD2-CE 3.68Å; L507-M524 HydrophobicContact CG-CE 4.37Å; V510-M524 HydrophobicContact CG1-CE 4.17Å; V510-M524 HydrophobicContact CG1-SD 4.44Å; M519-M524 HydrophobicContact CB-CG 4.01Å; M519-M524 HydrophobicContact CB-SD 3.85Å; M519-M524 HydrophobicContact CE-CG 4.2Å; M519-M524 HydrophobicContact CE-SD 3.55Å; M519-M524 VanDerWaalsContact CE-SD 3.55Å; M519-M524 HydrophobicContact CG-SD 4.27Å; T520-M524 WeakPolarHBondContact O-CG 3.27Å; T520-M524 PolarHBondContact O-N 3.47Å; P521-M524 PolarHBondContact O-N 3.06Å; S522-M524 VanDerWaalsContact C-N 3.29Å; S522-M524 PolarHBondContact O-N 2.88Å; M524-V526 VanDerWaalsContact C-N 3.35Å; M524-V526 PolarHBondContact O-N 3.46Å; M524-I527 PolarHBondContact O-N 3.49Å; M524-I527 VanDerWaalsContact O-N 3.08Å; M524-F528 HydrophobicContact CE-CD2 4.17Å; M524-F528 HydrophobicContact CE-CE2 3.82Å; M524-F528 PolarHBondContact O-N 3.41Å; M524-I557 HydrophobicContact CB-CD1 4.06Å
525	A	93.6	Very high	91.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-40.7	176.9	0	0	0	0	0	112.7	P521 S522 I527 F528 G529 N550 V553 E554	P521-A525 VanDerWaalsContact O-CB 3.23Å; P521-A525 WeakPolarHBondContact O-CB 3.43Å; P521-A525 PolarHBondContact O-N 2.92Å; S522-A525 PolarHBondContact O-N 2.98Å; A525-I527 PolarHBondContact O-N 3.48Å; A525-F528 PolarHBondContact O-N 3.35Å; A525-G529 PolarHBondContact O-N 2.79Å; A525-N550 HydrophobicContact CB-CB 4.23Å; A525-N550 WeakPolarHBondContact CB-O 3.29Å; A525-N550 PolarHBondContact O-OD1 3.38Å; A525-V553 HydrophobicContact CB-CB 4.17Å; A525-V553 HydrophobicContact CB-CG1 4.23Å; A525-E554 HydrophobicContact CB-CB 3.8Å
526	V	91.6	Very high	90.6	Very high	82 Å²	82	37.7 Å²	37.7	50%	0.497	21%	0.205	S	C	.	.	H	α-helix	trans	-58.3	-28.9	174.1	171.2	0	0	0	0	113	S522 M524	S522-V526 WeakPolarHBondContact O-CG2 3.29Å; S522-V526 PolarHBondContact O-N 3.04Å; S522-V526 VanDerWaalsContact O-N 3.09Å; M524-V526 VanDerWaalsContact C-N 3.35Å; M524-V526 PolarHBondContact O-N 3.46Å
527	I	93.8	Very high	89.4	Confident	29 Å²	29	38 Å²	38	15%	0.149	21%	0.207	C	C	.	.	H	α-helix	trans	-87.3	-42.7	178.9	-61.7	161.2	0	0	0	110.9	R409 K450 M519 N523 M524 A525 T531	R409-I527 HydrophobicContact CB-CD1 4.1Å; K450-I527 HydrophobicContact CD-CG2 3.63Å; K450-I527 HydrophobicContact CG-CG2 4.45Å; M519-I527 HydrophobicContact CE-CD1 3.39Å; N523-I527 WeakPolarHBondContact O-CD1 3.36Å; M524-I527 PolarHBondContact O-N 3.49Å; M524-I527 VanDerWaalsContact O-N 3.08Å; A525-I527 PolarHBondContact O-N 3.48Å; I527-T531 PolarHBondContact O-OG1 3.47Å
528	F	95.6	Very high	87.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-90	-26.3	-171.1	-82.5	-81.9	0	0	0	114.6	Y408 K450 L453 L503 L507 M524 A525 T531 L532 V553	Y408-F528 AromaticContact CD1-CE2 3.83Å; Y408-F528 HydrophobicContact CD1-CE2 3.83Å; Y408-F528 AromaticContact CD1-CZ 3.68Å; Y408-F528 HydrophobicContact CD1-CZ 3.68Å; Y408-F528 HydrophobicContact CD2-CE2 4.36Å; Y408-F528 HydrophobicContact CE1-CE2 4.14Å; Y408-F528 AromaticContact CE1-CZ 3.63Å; Y408-F528 HydrophobicContact CE1-CZ 3.63Å; Y408-F528 AromaticContact CG-CE2 3.92Å; Y408-F528 HydrophobicContact CG-CE2 3.92Å; Y408-F528 HydrophobicContact CG-CZ 4.24Å; K450-F528 HydrophobicContact CG-CZ 4.29Å; L453-F528 HydrophobicContact CD1-CE1 4.15Å; L503-F528 HydrophobicContact CD1-CD1 4.46Å; L503-F528 HydrophobicContact CD1-CE1 3.89Å; L503-F528 HydrophobicContact CD1-CZ 4.31Å; L503-F528 HydrophobicContact CD2-CD1 4.15Å; L503-F528 HydrophobicContact CD2-CE1 4.24Å; L507-F528 HydrophobicContact CD1-CB 4.14Å; L507-F528 HydrophobicContact CD1-CD1 4.39Å; L507-F528 HydrophobicContact CD1-CD2 3.66Å; L507-F528 HydrophobicContact CD1-CE2 4.15Å; L507-F528 HydrophobicContact CD1-CG 3.8Å; L507-F528 HydrophobicContact CD2-CD2 4.17Å; L507-F528 HydrophobicContact CD2-CE2 3.76Å; L507-F528 HydrophobicContact CD2-CZ 3.97Å; M524-F528 HydrophobicContact CE-CD2 4.17Å; M524-F528 HydrophobicContact CE-CE2 3.82Å; M524-F528 PolarHBondContact O-N 3.41Å; A525-F528 PolarHBondContact O-N 3.35Å; F528-T531 HydrophobicContact CD1-CG2 4.27Å; F528-T531 WeakPolarHBondContact O-CB 3.5Å; F528-T531 PolarHBondContact O-N 3.2Å; F528-T531 VanDerWaalsContact O-N 3.09Å; F528-L532 HydrophobicContact CB-CD1 4.22Å; F528-L532 HydrophobicContact CB-CG 4.5Å; F528-L532 HydrophobicContact CD1-CD1 4.35Å; F528-L532 HydrophobicContact CD1-CG 4.32Å; F528-L532 WeakPolarHBondContact O-CB 3.37Å; F528-L532 VanDerWaalsContact O-CG 3.3Å; F528-L532 WeakPolarHBondContact O-CG 3.39Å; F528-L532 PolarHBondContact O-N 2.82Å; F528-V553 HydrophobicContact CB-CG1 3.95Å
529	G	92.1	Very high	86.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-48.2	-65.7	173	0	0	0	0	0	113.1	A525 T531 L532 M533	A525-G529 PolarHBondContact O-N 2.79Å; G529-T531 PolarHBondContact O-N 2.79Å; G529-L532 PolarHBondContact O-N 3.48Å; G529-M533 VanDerWaalsContact O-CB 3.32Å; G529-M533 WeakPolarHBondContact O-CB 3.47Å; G529-M533 PolarHBondContact O-N 2.86Å
530	P	89.3	Confident	84.7	Confident	44 Å²	44	51.3 Å²	51.3	29%	0.286	28%	0.277	S	S	.	.	H	α-helix	trans	-69	-13	177.7	27.7	-35.3	0	0	0	114.4	I546	P530-I546 HydrophobicContact CB-CG2 4.16Å; P530-I546 HydrophobicContact CG-CG2 4.15Å
531	T	91.4	Very high	82.8	Confident	10 Å²	10	51.6 Å²	51.6	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-76.8	-45.3	173.5	-64.4	0	0	0	0	110.9	L453 R454 I527 F528 G529 R534	L453-T531 HydrophobicContact CB-CG2 3.84Å; R454-T531 HydrophobicContact CB-CG2 4.21Å; I527-T531 PolarHBondContact O-OG1 3.47Å; F528-T531 HydrophobicContact CD1-CG2 4.27Å; F528-T531 WeakPolarHBondContact O-CB 3.5Å; F528-T531 PolarHBondContact O-N 3.2Å; F528-T531 VanDerWaalsContact O-N 3.09Å; G529-T531 PolarHBondContact O-N 2.79Å; T531-R534 PolarHBondContact O-NH1 2.81Å
532	L	94.4	Very high	81.3	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-93.5	-24.5	-172.2	-58.4	178.6	0	0	0	113.9	L453 P459 L460 M461 L500 L503 F528 G529 V553	L453-L532 HydrophobicContact CB-CD2 4.4Å; L453-L532 HydrophobicContact CD1-CD2 4.36Å; P459-L532 VanDerWaalsContact CB-O 3.25Å; P459-L532 WeakPolarHBondContact CB-O 3.43Å; L460-L532 HydrophobicContact CB-CD2 4.08Å; L460-L532 HydrophobicContact CD2-CD2 3.92Å; L460-L532 PolarHBondContact N-O 3.35Å; M461-L532 HydrophobicContact CG-CB 4.27Å; M461-L532 PolarHBondContact N-O 3.19Å; L500-L532 HydrophobicContact CD1-CD1 4.29Å; L503-L532 HydrophobicContact CD2-CD1 3.68Å; L503-L532 HydrophobicContact CD2-CD2 3.56Å; L503-L532 HydrophobicContact CD2-CG 4.19Å; F528-L532 HydrophobicContact CB-CD1 4.22Å; F528-L532 HydrophobicContact CB-CG 4.5Å; F528-L532 HydrophobicContact CD1-CD1 4.35Å; F528-L532 HydrophobicContact CD1-CG 4.32Å; F528-L532 WeakPolarHBondContact O-CB 3.37Å; F528-L532 VanDerWaalsContact O-CG 3.3Å; F528-L532 WeakPolarHBondContact O-CG 3.39Å; F528-L532 PolarHBondContact O-N 2.82Å; G529-L532 PolarHBondContact O-N 3.48Å; L532-V553 HydrophobicContact CD1-CG2 4.3Å
533	M	90.3	Very high	79.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.			trans	-121.1	46.8	-170.4	-54	-163.9	73.8	0	0	112.7	M461 H466 L469 M470 G529 A535 Q549 V552	M461-M533 HydrophobicContact CB-CE 4.27Å; M461-M533 HydrophobicContact CB-CG 4.14Å; M461-M533 HydrophobicContact CG-CE 4.32Å; M461-M533 HydrophobicContact CG-CG 3.66Å; M461-M533 HydrophobicContact CG-SD 4.32Å; H466-M533 PolarHBondContact CD2-O 2.96Å; H466-M533 PolarHBondContact NE2-O 3.45Å; L469-M533 HydrophobicContact CB-CE 3.65Å; L469-M533 HydrophobicContact CD1-CE 3.73Å; L469-M533 HydrophobicContact CG-CE 4.28Å; M470-M533 HydrophobicContact CE-CE 3.5Å; M470-M533 VanDerWaalsContact CE-CE 3.5Å; M470-M533 HydrophobicContact CE-SD 3.92Å; G529-M533 VanDerWaalsContact O-CB 3.32Å; G529-M533 WeakPolarHBondContact O-CB 3.47Å; G529-M533 PolarHBondContact O-N 2.86Å; M533-A535 PolarHBondContact O-N 3.33Å; M533-Q549 HydrophobicContact CB-CB 3.96Å; M533-Q549 HydrophobicContact CB-CG 3.68Å; M533-Q549 HydrophobicContact CG-CB 4.36Å; M533-Q549 HydrophobicContact CG-CG 4.49Å; M533-Q549 VanDerWaalsContact O-CD 3.26Å; M533-Q549 PolarHBondContact O-NE2 3.33Å; M533-Q549 PolarHBondContact O-OE1 3.44Å; M533-Q549 HydrophobicContact SD-CB 4.02Å; M533-Q549 HydrophobicContact SD-CG 4.27Å; M533-V552 HydrophobicContact CE-CB 4.47Å; M533-V552 HydrophobicContact CE-CG1 4.32Å; M533-V552 HydrophobicContact CE-CG2 4.33Å; M533-V552 HydrophobicContact SD-CB 3.83Å; M533-V552 HydrophobicContact SD-CG1 3.96Å; M533-V552 HydrophobicContact SD-CG2 4.18Å
534	R	86	Confident	78.8	Confident	39 Å²	39	56.8 Å²	56.8	15%	0.147	31%	0.307	C	S	.	.			trans	-57.9	127.8	176.4	-60	-174.4	-63.1	-76.9	14.7	110.3	L453 R454 L456 E458 P459 Y463 T531	L453-R534 PolarHBondContact O-NH1 2.93Å; R454-R534 WeakPolarHBondContact O-CD 3.35Å; R454-R534 PolarHBondContact O-NE 3.37Å; R454-R534 PolarHBondContact O-NH1 3.31Å; L456-R534 PolarHBondContact O-NH2 3.3Å; E458-R534 PolarHBondContact O-NH2 3Å; E458-R534 VanDerWaalsContact O-NH2 3.07Å; P459-R534 HydrophobicContact CB-CB 4.18Å; P459-R534 HydrophobicContact CG-CB 4.45Å; Y463-R534 WeakPolarHBondContact CE1-O 3.34Å; T531-R534 PolarHBondContact O-NH1 2.81Å
535	A	72.8	Confident	77.9	Confident	31 Å²	31	58.5 Å²	58.5	26%	0.256	32%	0.316	S	S	.	.			trans	-68.3	151.8	170.3	0	0	0	0	0	110.8	M533 E537 A542	M533-A535 PolarHBondContact O-N 3.33Å; A535-E537 PolarHBondContact O-N 2.87Å; A535-A542 HydrophobicContact CB-CB 3.47Å; A535-A542 VanDerWaalsContact CB-CB 3.47Å
536	K	72.5	Confident	77.3	Confident	140 Å²	140	61.4 Å²	61.4	61%	0.609	33%	0.331	S	S	*	.	S	Bend	trans	-71.3	-18.3	179.2	-154.3	171.9	-163.3	158	0	113.3	Y463 D464	Y463-K536 HydrophobicContact CD1-CB 3.67Å; Y463-K536 HydrophobicContact CD1-CD 4.48Å; Y463-K536 HydrophobicContact CD1-CG 3.91Å; Y463-K536 HydrophobicContact CD2-CD 4.49Å; Y463-K536 HydrophobicContact CD2-CG 4.24Å; Y463-K536 HydrophobicContact CE1-CB 3.99Å; Y463-K536 HydrophobicContact CE1-CG 4.2Å; Y463-K536 HydrophobicContact CG-CB 4.17Å; Y463-K536 HydrophobicContact CG-CD 4.12Å; Y463-K536 HydrophobicContact CG-CG 3.95Å; D464-K536 IonicContact OD1-NZ 2.99Å
537	E	68.6	Low	76.9	Confident	132 Å²	132	63.4 Å²	63.4	62%	0.617	33%	0.333	S	S	*	.	S	Bend	trans	-138.5	131.3	-176.4	-61.4	179.1	-177.4	0	0	110.5	A535 T539 A542	A535-E537 PolarHBondContact O-N 2.87Å; E537-T539 VanDerWaalsContact C-N 3.3Å; E537-T539 HydrophobicContact CB-CG2 3.97Å; E537-T539 PolarHBondContact O-N 3.33Å; E537-A542 WeakPolarHBondContact O-CB 3.39Å
538	E	59.8	Low	76.6	Confident	199 Å²	199	64 Å²	64	93%	0.93	33%	0.334	S	S	*	.			trans	-77.6	74.7	179.8	-64.8	-170.8	159.2	0	0	111.6
539	T	63.8	Low	76.4	Confident	56 Å²	56	64.2 Å²	64.2	34%	0.344	34%	0.335	S	S	.	.			trans	-107.8	159.5	-178.9	67	0	0	0	0	112.8	E537 A541 A542 M543	E537-T539 VanDerWaalsContact C-N 3.3Å; E537-T539 HydrophobicContact CB-CG2 3.97Å; E537-T539 PolarHBondContact O-N 3.33Å; T539-A541 PolarHBondContact O-N 2.68Å; T539-A542 WeakPolarHBondContact O-CB 3.4Å; T539-A542 PolarHBondContact O-N 2.95Å; T539-A542 VanDerWaalsContact O-N 3.1Å; T539-A542 WeakPolarHBondContact OG1-CB 3.43Å; T539-A542 PolarHBondContact OG1-N 3.06Å; T539-A542 VanDerWaalsContact OG1-N 3.08Å; T539-M543 PolarHBondContact O-N 3.28Å
540	V	56.4	Low	76.4	Confident	109 Å²	109	65.4 Å²	65.4	66%	0.661	34%	0.342	S	S	*	.	H	α-helix	trans	-61.1	-31.5	173	-177.7	0	0	0	0	111.5	M543 L544	V540-M543 PolarHBondContact O-N 3.03Å; V540-L544 HydrophobicContact CG1-CD1 4.44Å; V540-L544 WeakPolarHBondContact O-CG 3.25Å; V540-L544 PolarHBondContact O-N 3.05Å
541	A	54.6	Low	76.4	Confident	62 Å²	62	65.1 Å²	65.1	51%	0.512	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-45.4	172.5	0	0	0	0	0	111.6	T539 M543 L544 D545	T539-A541 PolarHBondContact O-N 2.68Å; A541-M543 VanDerWaalsContact C-N 3.28Å; A541-M543 PolarHBondContact O-N 3.38Å; A541-L544 PolarHBondContact O-N 3.22Å; A541-L544 VanDerWaalsContact O-N 3.13Å; A541-D545 PolarHBondContact O-N 3.27Å
542	A	62.5	Low	76.5	Confident	17 Å²	17	64.6 Å²	64.6	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-60.3	-35.5	174.4	0	0	0	0	0	112.9	A535 E537 T539 D545	A535-A542 HydrophobicContact CB-CB 3.47Å; A535-A542 VanDerWaalsContact CB-CB 3.47Å; E537-A542 WeakPolarHBondContact O-CB 3.39Å; T539-A542 WeakPolarHBondContact O-CB 3.4Å; T539-A542 PolarHBondContact O-N 2.95Å; T539-A542 VanDerWaalsContact O-N 3.1Å; T539-A542 WeakPolarHBondContact OG1-CB 3.43Å; T539-A542 PolarHBondContact OG1-N 3.06Å; T539-A542 VanDerWaalsContact OG1-N 3.08Å; A542-D545 PolarHBondContact O-N 3.04Å
543	M	61.1	Low	76.6	Confident	128 Å²	128	64.6 Å²	64.6	63%	0.631	33%	0.334	S	S	*	.	H	α-helix	trans	-67.3	-39.8	173.2	-66.7	-179.2	179.4	0	0	112.7	T539 V540 A541 D545 I546	T539-M543 PolarHBondContact O-N 3.28Å; V540-M543 PolarHBondContact O-N 3.03Å; A541-M543 VanDerWaalsContact C-N 3.28Å; A541-M543 PolarHBondContact O-N 3.38Å; M543-D545 VanDerWaalsContact C-N 3.28Å; M543-D545 PolarHBondContact O-N 3.41Å; M543-I546 WeakPolarHBondContact O-CG1 3.5Å; M543-I546 PolarHBondContact O-N 3.03Å
544	L	70	Confident	76.8	Confident	113 Å²	113	66.7 Å²	66.7	59%	0.592	34%	0.344	S	S	*	.	H	α-helix	trans	-69.4	-25.8	176.4	-71.5	170.8	0	0	0	112.9	V540 A541 K547	V540-L544 HydrophobicContact CG1-CD1 4.44Å; V540-L544 WeakPolarHBondContact O-CG 3.25Å; V540-L544 PolarHBondContact O-N 3.05Å; A541-L544 PolarHBondContact O-N 3.22Å; A541-L544 VanDerWaalsContact O-N 3.13Å; L544-K547 WeakPolarHBondContact O-CG 3.22Å
545	D	76.2	Confident	77.2	Confident	36 Å²	36	65.3 Å²	65.3	19%	0.193	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.8	178.9	-84.7	-6.6	0	0	0	114.5	M470 K474 A541 A542 M543 K547 F548 Q549	M470-D545 HydrophobicContact SD-CB 4.2Å; K474-D545 WeakPolarHBondContact CE-OD1 3.46Å; K474-D545 IonicContact NZ-OD1 3.03Å; K474-D545 PolarHBondContact NZ-OD1 2.84Å; K474-D545 IonicContact NZ-OD2 3.65Å; K474-D545 PolarHBondContact NZ-OD2 3.49Å; A541-D545 PolarHBondContact O-N 3.27Å; A542-D545 PolarHBondContact O-N 3.04Å; M543-D545 VanDerWaalsContact C-N 3.28Å; M543-D545 PolarHBondContact O-N 3.41Å; D545-K547 PolarHBondContact O-N 3.15Å; D545-K547 VanDerWaalsContact O-N 3.16Å; D545-F548 PolarHBondContact O-N 3.4Å; D545-F548 WeakPolarHBondContact OD1-CD2 3.46Å; D545-Q549 PolarHBondContact O-N 3.43Å; D545-Q549 VanDerWaalsContact O-N 3.13Å
546	I	80.6	Confident	78.2	Confident	62 Å²	62	63.9 Å²	63.9	32%	0.318	33%	0.327	S	S	.	.	H	α-helix	trans	-54	-37.6	175.2	-63.2	173.3	0	0	0	111.4	P530 M543 F548 Q549 N550	P530-I546 HydrophobicContact CB-CG2 4.16Å; P530-I546 HydrophobicContact CG-CG2 4.15Å; M543-I546 WeakPolarHBondContact O-CG1 3.5Å; M543-I546 PolarHBondContact O-N 3.03Å; I546-F548 PolarHBondContact O-N 3.34Å; I546-Q549 WeakPolarHBondContact O-CB 3.45Å; I546-Q549 PolarHBondContact O-N 3.15Å; I546-Q549 VanDerWaalsContact O-N 3.14Å; I546-N550 VanDerWaalsContact O-CG 3.27Å; I546-N550 PolarHBondContact O-N 3.02Å; I546-N550 PolarHBondContact O-OD1 3.22Å; I546-N550 VanDerWaalsContact O-OD1 3.11Å
547	K	83.3	Confident	79.4	Confident	124 Å²	124	57.6 Å²	57.6	54%	0.539	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-28.9	176.8	72.8	-171	179.4	171.5	0	113.6	L544 D545 I551	L544-K547 WeakPolarHBondContact O-CG 3.22Å; D545-K547 PolarHBondContact O-N 3.15Å; D545-K547 VanDerWaalsContact O-N 3.16Å; K547-I551 WeakPolarHBondContact O-CG1 3.5Å; K547-I551 PolarHBondContact O-N 3.45Å
548	F	87.7	Confident	80.6	Confident	41 Å²	41	57.4 Å²	57.4	18%	0.18	30%	0.299	C	S	.	.	H	α-helix	trans	-83.3	-30.8	176.1	-62.8	-67.6	0	0	0	111.4	M470 A473 K474 D545 I546 N550 I551 V552	M470-F548 HydrophobicContact CE-CB 4.38Å; M470-F548 HydrophobicContact SD-CB 3.8Å; A473-F548 HydrophobicContact CB-CB 4Å; K474-F548 HydrophobicContact CB-CE1 4.45Å; K474-F548 HydrophobicContact CD-CD2 4.24Å; K474-F548 HydrophobicContact CD-CE2 4.17Å; K474-F548 HydrophobicContact CD-CZ 4.46Å; K474-F548 VanDerWaalsContact CE-CE2 3.48Å; K474-F548 HydrophobicContact CG-CD1 3.73Å; K474-F548 HydrophobicContact CG-CD2 3.89Å; K474-F548 HydrophobicContact CG-CE1 3.64Å; K474-F548 HydrophobicContact CG-CE2 3.79Å; K474-F548 HydrophobicContact CG-CG 3.86Å; K474-F548 HydrophobicContact CG-CZ 3.67Å; D545-F548 PolarHBondContact O-N 3.4Å; D545-F548 WeakPolarHBondContact OD1-CD2 3.46Å; I546-F548 PolarHBondContact O-N 3.34Å; F548-N550 PolarHBondContact O-N 3.37Å; F548-I551 HydrophobicContact CD1-CD1 3.95Å; F548-I551 HydrophobicContact CE1-CD1 4.47Å; F548-I551 PolarHBondContact O-N 3.44Å; F548-I551 VanDerWaalsContact O-N 3.17Å; F548-V552 WeakPolarHBondContact O-CG2 3.18Å; F548-V552 PolarHBondContact O-N 3.45Å
549	Q	90.1	Very high	82.1	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.023	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-38.1	169.2	-58.9	164.7	15.6	0	0	111.1	M470 M533 D545 I546 V552 V553	M470-Q549 HydrophobicContact CE-CB 4.21Å; M470-Q549 HydrophobicContact CE-CG 3.64Å; M470-Q549 HydrophobicContact SD-CG 3.66Å; M533-Q549 HydrophobicContact CB-CB 3.96Å; M533-Q549 HydrophobicContact CB-CG 3.68Å; M533-Q549 HydrophobicContact CG-CB 4.36Å; M533-Q549 HydrophobicContact CG-CG 4.49Å; M533-Q549 VanDerWaalsContact O-CD 3.26Å; M533-Q549 PolarHBondContact O-NE2 3.33Å; M533-Q549 PolarHBondContact O-OE1 3.44Å; M533-Q549 HydrophobicContact SD-CB 4.02Å; M533-Q549 HydrophobicContact SD-CG 4.27Å; D545-Q549 PolarHBondContact O-N 3.43Å; D545-Q549 VanDerWaalsContact O-N 3.13Å; I546-Q549 WeakPolarHBondContact O-CB 3.45Å; I546-Q549 PolarHBondContact O-N 3.15Å; I546-Q549 VanDerWaalsContact O-N 3.14Å; Q549-V552 PolarHBondContact O-N 2.9Å; Q549-V553 PolarHBondContact O-N 3.26Å
550	N	92.2	Very high	83.5	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-61.1	-51.6	171.9	-56	-10.9	0	0	0	110.4	A525 I546 F548 V552 V553 E554	A525-N550 HydrophobicContact CB-CB 4.23Å; A525-N550 WeakPolarHBondContact CB-O 3.29Å; A525-N550 PolarHBondContact O-OD1 3.38Å; I546-N550 VanDerWaalsContact O-CG 3.27Å; I546-N550 PolarHBondContact O-N 3.02Å; I546-N550 PolarHBondContact O-OD1 3.22Å; I546-N550 VanDerWaalsContact O-OD1 3.11Å; F548-N550 PolarHBondContact O-N 3.37Å; N550-V552 VanDerWaalsContact C-N 3.27Å; N550-V552 PolarHBondContact O-N 3.35Å; N550-V553 PolarHBondContact O-N 3.31Å; N550-E554 WeakPolarHBondContact O-CB 3.46Å; N550-E554 PolarHBondContact O-N 3Å
551	I	90.3	Very high	85.1	Confident	38 Å²	38	51.8 Å²	51.8	20%	0.195	26%	0.26	C	S	.	.	H	α-helix	trans	-55	-38.8	179	-69.7	165.5	0	0	0	112.4	A473 K547 F548 I555	A473-I551 HydrophobicContact CB-CG2 4.39Å; K547-I551 WeakPolarHBondContact O-CG1 3.5Å; K547-I551 PolarHBondContact O-N 3.45Å; F548-I551 HydrophobicContact CD1-CD1 3.95Å; F548-I551 HydrophobicContact CE1-CD1 4.47Å; F548-I551 PolarHBondContact O-N 3.44Å; F548-I551 VanDerWaalsContact O-N 3.17Å; I551-I555 HydrophobicContact CG2-CD1 3.73Å; I551-I555 WeakPolarHBondContact O-CB 3.36Å; I551-I555 WeakPolarHBondContact O-CD1 3.41Å; I551-I555 VanDerWaalsContact O-CG1 3.23Å; I551-I555 WeakPolarHBondContact O-CG1 3.26Å; I551-I555 PolarHBondContact O-N 3.43Å; I551-I555 VanDerWaalsContact O-N 3.08Å
552	V	94.2	Very high	86.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-44.6	174.7	-179.1	0	0	0	0	111.5	L469 M470 A473 I485 M533 F548 Q549 N550 M556	L469-V552 HydrophobicContact CD2-CG1 4.25Å; M470-V552 HydrophobicContact CE-CG2 3.86Å; A473-V552 HydrophobicContact CB-CG2 3.65Å; I485-V552 HydrophobicContact CD1-CG1 4.47Å; I485-V552 HydrophobicContact CD1-CG2 4.18Å; I485-V552 HydrophobicContact CG2-CG1 4.27Å; M533-V552 HydrophobicContact CE-CB 4.47Å; M533-V552 HydrophobicContact CE-CG1 4.32Å; M533-V552 HydrophobicContact CE-CG2 4.33Å; M533-V552 HydrophobicContact SD-CB 3.83Å; M533-V552 HydrophobicContact SD-CG1 3.96Å; M533-V552 HydrophobicContact SD-CG2 4.18Å; F548-V552 WeakPolarHBondContact O-CG2 3.18Å; F548-V552 PolarHBondContact O-N 3.45Å; Q549-V552 PolarHBondContact O-N 2.9Å; N550-V552 VanDerWaalsContact C-N 3.27Å; N550-V552 PolarHBondContact O-N 3.35Å; V552-M556 HydrophobicContact CG1-CE 4.16Å; V552-M556 WeakPolarHBondContact O-CG 3.49Å; V552-M556 PolarHBondContact O-N 2.95Å
553	V	95.6	Very high	87.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-36.1	-179.8	176.9	0	0	0	0	112.3	L507 A525 F528 L532 Q549 N550 M556 I557	L507-V553 HydrophobicContact CD1-CG1 4.49Å; A525-V553 HydrophobicContact CB-CB 4.17Å; A525-V553 HydrophobicContact CB-CG1 4.23Å; F528-V553 HydrophobicContact CB-CG1 3.95Å; L532-V553 HydrophobicContact CD1-CG2 4.3Å; Q549-V553 PolarHBondContact O-N 3.26Å; N550-V553 PolarHBondContact O-N 3.31Å; V553-M556 HydrophobicContact CB-CE 4.26Å; V553-M556 HydrophobicContact CG2-CE 3.78Å; V553-M556 PolarHBondContact O-N 3.06Å; V553-I557 HydrophobicContact CG1-CD1 4.03Å; V553-I557 VanDerWaalsContact O-CG1 3.29Å; V553-I557 WeakPolarHBondContact O-CG1 3.48Å; V553-I557 PolarHBondContact O-N 2.93Å; V553-I557 VanDerWaalsContact O-N 3.08Å
554	E	94.9	Very high	89.2	Confident	43 Å²	43	47.3 Å²	47.3	20%	0.201	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-52.3	174.7	-169.1	166.4	-138.2	0	0	110.4	S522 A525 N550 M556 I557 E558	S522-E554 WeakPolarHBondContact CA-OE1 3.4Å; S522-E554 WeakPolarHBondContact CB-OE1 3.46Å; S522-E554 PolarHBondContact OG-OE1 3.31Å; A525-E554 HydrophobicContact CB-CB 3.8Å; N550-E554 WeakPolarHBondContact O-CB 3.46Å; N550-E554 PolarHBondContact O-N 3Å; E554-M556 PolarHBondContact O-N 2.89Å; E554-I557 PolarHBondContact O-N 2.93Å; E554-I557 VanDerWaalsContact O-N 3.09Å; E554-E558 WeakPolarHBondContact O-CG 3.43Å; E554-E558 PolarHBondContact O-N 2.62Å
555	I	93.3	Very high	89.7	Confident	11 Å²	11	46.3 Å²	46.3	6%	0.056	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-41.2	175.8	-67.6	165.9	0	0	0	111.8	R481 L482 I485 I551 I557 E558 D559 I563	R481-I555 HydrophobicContact CG-CD1 3.88Å; R481-I555 VanDerWaalsContact NE-CD1 3.32Å; L482-I555 HydrophobicContact CD1-CG2 3.81Å; I485-I555 HydrophobicContact CD1-CD1 3.81Å; I485-I555 HydrophobicContact CD1-CG2 4.44Å; I551-I555 HydrophobicContact CG2-CD1 3.73Å; I551-I555 WeakPolarHBondContact O-CB 3.36Å; I551-I555 WeakPolarHBondContact O-CD1 3.41Å; I551-I555 VanDerWaalsContact O-CG1 3.23Å; I551-I555 WeakPolarHBondContact O-CG1 3.26Å; I551-I555 PolarHBondContact O-N 3.43Å; I551-I555 VanDerWaalsContact O-N 3.08Å; I555-I557 VanDerWaalsContact C-N 3.26Å; I555-I557 PolarHBondContact O-N 3.13Å; I555-E558 PolarHBondContact O-N 3.17Å; I555-D559 WeakPolarHBondContact O-CB 3.49Å; I555-D559 PolarHBondContact O-N 3.23Å; I555-I563 HydrophobicContact CG2-CD1 3.98Å
556	M	95.6	Very high	89.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-35.5	175.8	-77.8	-169.9	-61.8	0	0	112.8	M461 I489 L500 I504 V552 V553 E554 Y560 F564	M461-M556 HydrophobicContact CE-CE 4.22Å; M461-M556 HydrophobicContact CE-SD 4.03Å; M461-M556 HydrophobicContact SD-CE 4.31Å; M461-M556 HydrophobicContact SD-SD 4.47Å; I489-M556 HydrophobicContact CD1-CG 3.58Å; I489-M556 HydrophobicContact CD1-SD 3.5Å; I489-M556 WeakPolarHBondContact CD1-SD 3.23Å; I489-M556 HydrophobicContact CG1-SD 4.23Å; L500-M556 HydrophobicContact CD1-CE 4.16Å; L500-M556 HydrophobicContact CD1-SD 4.13Å; L500-M556 HydrophobicContact CD2-SD 3.94Å; L500-M556 HydrophobicContact CG-SD 4.34Å; I504-M556 HydrophobicContact CD1-CB 4.01Å; I504-M556 HydrophobicContact CD1-CE 3.94Å; I504-M556 HydrophobicContact CD1-SD 4.37Å; I504-M556 HydrophobicContact CG1-CB 4.16Å; I504-M556 HydrophobicContact CG1-CE 4.49Å; I504-M556 HydrophobicContact CG1-SD 4.3Å; I504-M556 HydrophobicContact CG2-CB 4.08Å; I504-M556 WeakPolarHBondContact CG2-O 3.48Å; V552-M556 HydrophobicContact CG1-CE 4.16Å; V552-M556 WeakPolarHBondContact O-CG 3.49Å; V552-M556 PolarHBondContact O-N 2.95Å; V553-M556 HydrophobicContact CB-CE 4.26Å; V553-M556 HydrophobicContact CG2-CE 3.78Å; V553-M556 PolarHBondContact O-N 3.06Å; E554-M556 PolarHBondContact O-N 2.89Å; M556-Y560 VanDerWaalsContact O-CA 3.25Å; M556-Y560 WeakPolarHBondContact O-CA 3.28Å; M556-Y560 WeakPolarHBondContact O-CB 3.5Å; M556-Y560 PolarHBondContact O-N 2.97Å; M556-F564 HydrophobicContact CB-CE2 4.47Å; M556-F564 HydrophobicContact CG-CE2 4.45Å; M556-F564 HydrophobicContact SD-CZ 4.29Å
557	I	95.7	Very high	89.4	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-74.8	-48.7	177.3	-65.4	164.7	0	0	0	110.4	I504 L507 V508 C511 P521 M524 V553 E554 I555	I504-I557 HydrophobicContact CG2-CG1 4.31Å; L507-I557 HydrophobicContact CB-CD1 4.02Å; L507-I557 HydrophobicContact CB-CG1 4.03Å; L507-I557 HydrophobicContact CD1-CD1 3.93Å; L507-I557 HydrophobicContact CD1-CG1 4.41Å; V508-I557 HydrophobicContact CG2-CB 4.46Å; V508-I557 HydrophobicContact CG2-CG2 3.9Å; V508-I557 WeakPolarHBondContact CG2-O 3.32Å; C511-I557 HydrophobicContact CB-CG2 4.45Å; P521-I557 HydrophobicContact CB-CB 4.26Å; P521-I557 HydrophobicContact CB-CG2 3.83Å; P521-I557 HydrophobicContact CG-CG2 3.92Å; M524-I557 HydrophobicContact CB-CD1 4.06Å; V553-I557 HydrophobicContact CG1-CD1 4.03Å; V553-I557 VanDerWaalsContact O-CG1 3.29Å; V553-I557 WeakPolarHBondContact O-CG1 3.48Å; V553-I557 PolarHBondContact O-N 2.93Å; V553-I557 VanDerWaalsContact O-N 3.08Å; E554-I557 PolarHBondContact O-N 2.93Å; E554-I557 VanDerWaalsContact O-N 3.09Å; I555-I557 VanDerWaalsContact C-N 3.26Å; I555-I557 PolarHBondContact O-N 3.13Å
558	E	94.1	Very high	88.8	Confident	128 Å²	128	47.9 Å²	47.9	60%	0.598	24%	0.24	S	C	*	.	H	α-helix	trans	-67.4	-46.1	-175.6	-67.3	-176.3	151.7	0	0	112.5	P521 E554 I555	P521-E558 HydrophobicContact CB-CG 3.96Å; P521-E558 HydrophobicContact CG-CG 4.16Å; E554-E558 WeakPolarHBondContact O-CG 3.43Å; E554-E558 PolarHBondContact O-N 2.62Å; I555-E558 PolarHBondContact O-N 3.17Å
559	D	92.1	Very high	87.5	Confident	54 Å²	54	54.6 Å²	54.6	29%	0.289	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	16.2	-179.4	-89.2	-72.8	0	0	0	113.6	L482 I555 K561 K562 I563	L482-D559 HydrophobicContact CD1-CB 3.62Å; L482-D559 WeakPolarHBondContact CD2-OD2 3.45Å; I555-D559 WeakPolarHBondContact O-CB 3.49Å; I555-D559 PolarHBondContact O-N 3.23Å; D559-K561 PolarHBondContact O-N 3.07Å; D559-K562 HydrophobicContact CB-CB 4.48Å; D559-K562 WeakPolarHBondContact O-CA 3.3Å; D559-K562 WeakPolarHBondContact O-CB 3.4Å; D559-K562 PolarHBondContact O-N 2.79Å; D559-I563 HydrophobicContact CB-CD1 3.62Å; D559-I563 HydrophobicContact CB-CG1 4.01Å; D559-I563 PolarHBondContact O-N 2.95Å
560	Y	93.2	Very high	85.3	Confident	31 Å²	31	62.5 Å²	62.5	12%	0.122	31%	0.314	C	S	.	.	H	α-helix	trans	-42.6	-45.3	-173.3	167	-97	0	0	0	114.3	E501 I504 R505 V508 M556 I563 F564	E501-Y560 HydrophobicContact CG-CE2 4.28Å; I504-Y560 HydrophobicContact CB-CD2 4.25Å; I504-Y560 HydrophobicContact CG2-CD2 3.71Å; I504-Y560 HydrophobicContact CG2-CG 4.46Å; R505-Y560 HydrophobicContact CB-CE2 3.81Å; V508-Y560 HydrophobicContact CG2-CG 4.06Å; M556-Y560 VanDerWaalsContact O-CA 3.25Å; M556-Y560 WeakPolarHBondContact O-CA 3.28Å; M556-Y560 WeakPolarHBondContact O-CB 3.5Å; M556-Y560 PolarHBondContact O-N 2.97Å; Y560-I563 PolarHBondContact O-N 3.38Å; Y560-F564 HydrophobicContact CD2-CB 4.24Å; Y560-F564 AromaticContact CD2-CD2 3.51Å; Y560-F564 HydrophobicContact CD2-CD2 3.51Å; Y560-F564 HydrophobicContact CD2-CE2 4.18Å; Y560-F564 HydrophobicContact CD2-CG 4.11Å; Y560-F564 HydrophobicContact CE2-CB 3.92Å; Y560-F564 AromaticContact CE2-CD2 3.86Å; Y560-F564 HydrophobicContact CE2-CD2 3.86Å; Y560-F564 AromaticContact CE2-CG 3.99Å; Y560-F564 HydrophobicContact CE2-CG 3.99Å; Y560-F564 HydrophobicContact CG-CD2 4.4Å; Y560-F564 WeakPolarHBondContact O-CB 3.31Å; Y560-F564 PolarHBondContact O-N 3.04Å
561	K	88.9	Confident	82.7	Confident	162 Å²	162	66.6 Å²	66.6	70%	0.704	35%	0.345	S	S	*	.	H	α-helix	trans	-63.4	-47.1	179.5	-68.7	-178.8	-179.3	174.7	0	111.9	D559 I563 T565	D559-K561 PolarHBondContact O-N 3.07Å; K561-I563 VanDerWaalsContact C-N 3.34Å; K561-T565 WeakPolarHBondContact O-CB 3.38Å; K561-T565 PolarHBondContact O-N 3.06Å; K561-T565 PolarHBondContact O-OG1 2.82Å
562	K	87.1	Confident	80.2	Confident	96 Å²	96	68.2 Å²	68.2	42%	0.417	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-41	179.5	-177.4	176.7	174.4	-178	0	111	L482 H486 D559	L482-K562 HydrophobicContact CD2-CD 4.05Å; L482-K562 HydrophobicContact CG-CD 4.45Å; H486-K562 PolarHBondContact CE1-O 2.85Å; H486-K562 PolarHBondContact NE2-O 3.26Å; D559-K562 HydrophobicContact CB-CB 4.48Å; D559-K562 WeakPolarHBondContact O-CA 3.3Å; D559-K562 WeakPolarHBondContact O-CB 3.4Å; D559-K562 PolarHBondContact O-N 2.79Å
563	I	90.3	Very high	77.2	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-76.8	-39.4	-175.3	-67.2	168.3	0	0	0	113	L482 H486 I489 Y490 I555 D559 Y560 K561	L482-I563 HydrophobicContact CD1-CD1 3.86Å; L482-I563 HydrophobicContact CD1-CG1 4Å; H486-I563 HydrophobicContact CB-CG1 4.34Å; H486-I563 PolarHBondContact CD2-O 3.35Å; H486-I563 PolarHBondContact NE2-O 3.24Å; I489-I563 HydrophobicContact CB-CG2 4.48Å; I489-I563 HydrophobicContact CD1-CG2 3.47Å; I489-I563 VanDerWaalsContact CD1-CG2 3.47Å; I489-I563 HydrophobicContact CG2-CG2 4.32Å; Y490-I563 WeakPolarHBondContact CE2-O 3.35Å; I555-I563 HydrophobicContact CG2-CD1 3.98Å; D559-I563 HydrophobicContact CB-CD1 3.62Å; D559-I563 HydrophobicContact CB-CG1 4.01Å; D559-I563 PolarHBondContact O-N 2.95Å; Y560-I563 PolarHBondContact O-N 3.38Å; K561-I563 VanDerWaalsContact C-N 3.34Å
564	F	88.9	Confident	74.6	Confident	16 Å²	16	83 Å²	83	7%	0.07	44%	0.441	C	S	.	.	H	α-helix	trans	-108.8	-10.3	-172.3	-69.1	-86	0	0	0	115	I489 L500 E501 I504 M556 Y560	I489-F564 HydrophobicContact CD1-CZ 4.36Å; I489-F564 HydrophobicContact CG2-CD1 4.34Å; I489-F564 HydrophobicContact CG2-CE1 3.66Å; I489-F564 HydrophobicContact CG2-CZ 3.92Å; L500-F564 HydrophobicContact CD2-CE1 4.18Å; L500-F564 HydrophobicContact CD2-CZ 3.94Å; L500-F564 HydrophobicContact CG-CE1 4.25Å; L500-F564 HydrophobicContact CG-CZ 3.98Å; E501-F564 HydrophobicContact CB-CD1 3.69Å; E501-F564 HydrophobicContact CB-CE1 3.95Å; E501-F564 HydrophobicContact CB-CG 4.5Å; E501-F564 HydrophobicContact CG-CB 4.12Å; E501-F564 HydrophobicContact CG-CD1 3.71Å; E501-F564 HydrophobicContact CG-CE1 4.43Å; E501-F564 HydrophobicContact CG-CG 4.09Å; I504-F564 HydrophobicContact CB-CE2 4.16Å; I504-F564 HydrophobicContact CB-CZ 4.44Å; I504-F564 HydrophobicContact CG1-CE2 4.24Å; I504-F564 HydrophobicContact CG1-CZ 4.18Å; I504-F564 HydrophobicContact CG2-CE2 4.07Å; M556-F564 HydrophobicContact CB-CE2 4.47Å; M556-F564 HydrophobicContact CG-CE2 4.45Å; M556-F564 HydrophobicContact SD-CZ 4.29Å; Y560-F564 HydrophobicContact CD2-CB 4.24Å; Y560-F564 AromaticContact CD2-CD2 3.51Å; Y560-F564 HydrophobicContact CD2-CD2 3.51Å; Y560-F564 HydrophobicContact CD2-CE2 4.18Å; Y560-F564 HydrophobicContact CD2-CG 4.11Å; Y560-F564 HydrophobicContact CE2-CB 3.92Å; Y560-F564 AromaticContact CE2-CD2 3.86Å; Y560-F564 HydrophobicContact CE2-CD2 3.86Å; Y560-F564 AromaticContact CE2-CG 3.99Å; Y560-F564 HydrophobicContact CE2-CG 3.99Å; Y560-F564 HydrophobicContact CG-CD2 4.4Å; Y560-F564 WeakPolarHBondContact O-CB 3.31Å; Y560-F564 PolarHBondContact O-N 3.04Å
565	T	80.3	Confident	71.8	Confident	92 Å²	92	86.9 Å²	86.9	56%	0.564	47%	0.469	S	S	*	.	S	Bend	trans	-113.5	3.1	179.1	76.9	0	0	0	0	114.5	K561	K561-T565 WeakPolarHBondContact O-CB 3.38Å; K561-T565 PolarHBondContact O-N 3.06Å; K561-T565 PolarHBondContact O-OG1 2.82Å
566	C	76.5	Confident	69.2	Low	65 Å²	65	92.9 Å²	92.9	44%	0.439	51%	0.506	S	S	.	.	S	Bend	trans	-131.7	141.6	176.8	-60.1	0	0	0	0	110.5	H486 Y490	H486-C566 PolarHBondContact CE1-O 3.46Å; H486-C566 PolarHBondContact NE2-O 3.3Å; Y490-C566 WeakPolarHBondContact CE2-O 3.47Å; Y490-C566 PolarHBondContact OH-O 3.38Å; Y490-C566 VanDerWaalsContact OH-O 3.12Å
567	M	73.6	Confident	66.7	Low	149 Å²	149	98 Å²	98	73%	0.734	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-70.8	147.1	169.6	-65.8	-83	-84.9	0	0	109.7	Y490	Y490-M567 HydrophobicContact CD1-SD 4.31Å; Y490-M567 HydrophobicContact CE1-SD 3.86Å
568	P	70.7	Confident	63.9	Low	42 Å²	42	103.1 Å²	103.1	27%	0.273	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-63	151	169.6	-19.9	32.5	0	0	0	112.1	Y490	Y490-P568 HydrophobicContact CD2-CG 3.7Å; Y490-P568 HydrophobicContact CE2-CG 4.33Å; Y490-P568 HydrophobicContact CG-CG 4.06Å
569	E	59.2	Low	61.2	Low	181 Å²	181	102.8 Å²	102.8	85%	0.846	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-90.7	131.4	172.4	-65.2	-171.7	152	0	0	111.1	S571	E569-S571 PolarHBondContact O-N 2.97Å
570	D	44.9	Very low	58.6	Low	172 Å²	172	112 Å²	112	92%	0.92	61%	0.612	S	S	*	*			trans	-70.7	91.1	-179.9	-86.2	-40.7	0	0	0	112.1	A572	D570-A572 PolarHBondContact O-N 2.84Å
571	S	37.6	Very low	56	Low	111 Å²	111	118.3 Å²	118.3	78%	0.776	65%	0.647	S	S	*	*			trans	-79.7	77.8	177.5	45.5	0	0	0	0	112.7	E569	E569-S571 PolarHBondContact O-N 2.97Å
572	A	37.4	Very low	53.3	Low	72 Å²	72	116.6 Å²	116.6	60%	0.595	65%	0.65	S	S	*	*			trans	-68.2	147.9	170.5	0	0	0	0	0	112.7	D570	D570-A572 PolarHBondContact O-N 2.84Å
573	F	31	Very low	50.7	Low	196 Å²	196	116.8 Å²	116.8	86%	0.86	67%	0.669	S	S	*	*			trans	76.2	106.7	174.3	-51.3	-74.5	0	0	0	117.9
574	P	41	Very low	48.2	Very low	115 Å²	115	128.2 Å²	128.2	75%	0.747	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-72.6	152.2	159.1	32.2	-34.2	0	0	0	111.2
575	P	36.2	Very low	45.7	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-69.4	138.8	-178.4	28	-34.7	0	0	0	112.8
576	V	38.4	Very low	43.8	Very low	137 Å²	137	141.9 Å²	141.9	83%	0.83	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-76.1	130.7	-179.8	-179.5	0	0	0	0	110.6
577	P	42.8	Very low	41.9	Very low	106 Å²	106	147.2 Å²	147.2	69%	0.688	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71	146.7	176.7	29.2	-35	0	0	0	112
578	P	38.8	Very low	40.3	Very low	116 Å²	116	143.4 Å²	143.4	75%	0.753	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-67.2	152.2	-179.7	28.2	-35.1	0	0	0	112.4	R580	P578-R580 PolarHBondContact O-N 3.14Å
579	P	36.4	Very low	39.1	Very low	121 Å²	121	147 Å²	147	79%	0.786	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-67.1	134.4	-175.7	27.1	-34.7	0	0	0	112.2	I581	P579-I581 PolarHBondContact O-N 3.22Å
580	R	38.6	Very low	38.6	Very low	247 Å²	247	141.6 Å²	141.6	93%	0.932	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.4	117.7	174.3	-71.2	177.8	174	161.1	-3.7	110.4	P578 T582	P578-R580 PolarHBondContact O-N 3.14Å; R580-T582 PolarHBondContact O-N 3.15Å
581	I	36.9	Very low	38.7	Very low	164 Å²	164	137.1 Å²	137.1	84%	0.841	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-66.1	130.3	168.4	-61.9	175.4	0	0	0	108.1	P579	P579-I581 PolarHBondContact O-N 3.22Å
582	T	33.9	Very low	39	Very low	127 Å²	127	136 Å²	136	78%	0.779	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-68.7	132.8	178.7	45.4	0	0	0	0	111.2	R580 R584	R580-T582 PolarHBondContact O-N 3.15Å; T582-R584 PolarHBondContact O-N 2.86Å; T582-R584 VanDerWaalsContact O-N 3.16Å
583	A	32.5	Very low	39.3	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-62.3	117.6	177.9	0	0	0	0	0	110.6	K585	A583-K585 PolarHBondContact O-N 3.11Å; A583-K585 VanDerWaalsContact O-N 3.15Å
584	R	36	Very low	40	Very low	240 Å²	240	139 Å²	139	91%	0.906	72%	0.721	S	S	*	*			trans	-69	107.8	168.3	-85.4	-178	167.1	169.7	-3.9	108.6	T582 R586	T582-R584 PolarHBondContact O-N 2.86Å; T582-R584 VanDerWaalsContact O-N 3.16Å; R584-R586 PolarHBondContact O-N 3.11Å
585	K	36.7	Very low	39.9	Very low	194 Å²	194	139.3 Å²	139.3	84%	0.843	72%	0.723	S	S	*	*			trans	-55.7	108.3	164.4	-70.4	-161.9	172.8	-157.2	0	109.2	A583	A583-K585 PolarHBondContact O-N 3.11Å; A583-K585 VanDerWaalsContact O-N 3.15Å
586	R	40.3	Very low	39.9	Very low	202 Å²	202	137.9 Å²	137.9	76%	0.762	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-73.7	143.2	157.7	-71.8	-175.8	169.7	-138.1	-2.6	107.3	E227 R584	E227-R586 IonicContact OE1-NH1 2.73Å; R584-R586 PolarHBondContact O-N 3.11Å
587	Q	37.6	Very low	40.5	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-81.5	142.3	165.6	-69.3	-170.5	-34.5	0	0	108.7	I589	Q587-I589 PolarHBondContact O-N 3.25Å
588	P	39.3	Very low	40.2	Very low	69 Å²	69	138.5 Å²	138.5	45%	0.448	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-56.2	131.7	172.4	-25.1	34.6	0	0	0	111.2	T590	P588-T590 HydrophobicContact CB-CG2 4.36Å; P588-T590 PolarHBondContact O-N 3.1Å
589	I	45.7	Very low	39.9	Very low	118 Å²	118	138.9 Å²	138.9	61%	0.605	70%	0.7	S	S	*	*			trans	-83.8	73	174.7	-52.2	-177.3	0	0	0	108.2	Q587	Q587-I589 PolarHBondContact O-N 3.25Å
590	T	48.5	Very low	39.8	Very low	67 Å²	67	141.1 Å²	141.1	41%	0.411	70%	0.7	S	S	.	*			trans	-62.9	143.1	174.3	66.4	0	0	0	0	110.4	P588 S592	P588-T590 HydrophobicContact CB-CG2 4.36Å; P588-T590 PolarHBondContact O-N 3.1Å; T590-S592 PolarHBondContact O-N 3.3Å; T590-S592 VanDerWaalsContact O-N 3.1Å; T590-S592 PolarHBondContact OG1-OG 2.71Å
591	I	48.2	Very low	39.5	Very low	78 Å²	78	134.5 Å²	134.5	40%	0.4	69%	0.689	S	S	.	*	S	Bend	trans	-74.3	1.6	177.4	-61.5	-178.2	0	0	0	112.3	E89 F221 K593	E89-I591 PolarHBondContact OE1-N 3.35Å; E89-I591 WeakPolarHBondContact OE2-CB 3.35Å; F221-I591 HydrophobicContact CD2-CD1 4.01Å; F221-I591 HydrophobicContact CE2-CD1 4.08Å; I591-K593 PolarHBondContact O-N 3.49Å
592	S	42.5	Very low	39.5	Very low	88 Å²	88	134.6 Å²	134.6	62%	0.615	69%	0.69	S	S	*	*			trans	-58.5	5.9	-172.7	71.3	0	0	0	0	118.8	T590	T590-S592 PolarHBondContact O-N 3.3Å; T590-S592 VanDerWaalsContact O-N 3.1Å; T590-S592 PolarHBondContact OG1-OG 2.71Å
593	K	43.6	Very low	39.3	Very low	189 Å²	189	133.5 Å²	133.5	82%	0.822	69%	0.688	S	S	*	*			trans	-132.1	56.9	-174.7	-66.6	-174.4	-178.4	174.1	0	114.5	I591	I591-K593 PolarHBondContact O-N 3.49Å
594	R	47.2	Very low	39.9	Very low	142 Å²	142	137.7 Å²	137.7	54%	0.536	69%	0.69	S	S	.	*			trans	-112.5	136.7	156.8	-80.5	-177.6	169.1	-175.2	-3.8	110.4	D220	D220-R594 IonicContact OD1-CZ 2.8Å; D220-R594 IonicContact OD1-NH1 2.66Å; D220-R594 IonicContact OD1-NH2 3.1Å; D220-R594 PolarHBondContact OD1-NH2 3.5Å; D220-R594 IonicContact OD2-CZ 2.67Å; D220-R594 IonicContact OD2-NH1 2.71Å; D220-R594 PolarHBondContact OD2-NH1 3.36Å; D220-R594 IonicContact OD2-NH2 2.97Å; D220-R594 PolarHBondContact OD2-NH2 2.84Å; D220-R594 VanDerWaalsContact OD2-NH2 3.12Å
595	P	38.9	Very low	39.7	Very low	121 Å²	121	134 Å²	134	79%	0.786	68%	0.683	S	S	*	*			trans	-60.8	149.8	163.2	-18.7	31.9	0	0	0	110.5	R597	P595-R597 PolarHBondContact O-N 2.86Å
596	A	36.1	Very low	39.4	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	68%	0.678	S	S	*	*			trans	-60.8	128.4	177.7	0	0	0	0	0	111.2	V598	A596-V598 PolarHBondContact O-N 3.27Å
597	R	49.3	Very low	38.8	Very low	126 Å²	126	129.5 Å²	129.5	48%	0.475	68%	0.683	S	S	.	*			trans	-65.9	114.9	170.5	-73.9	179.6	175.1	160.8	-0.7	108.6	D220 P595 F599	D220-R597 IonicContact OD2-NH2 2.84Å; D220-R597 PolarHBondContact OD2-NH2 3.19Å; P595-R597 PolarHBondContact O-N 2.86Å; R597-F599 PolarHBondContact O-N 2.95Å
598	V	37.2	Very low	38.6	Very low	130 Å²	130	131.2 Å²	131.2	79%	0.788	68%	0.682	S	S	*	*			trans	-73.9	105.7	174.2	178.4	0	0	0	0	108.6	A596 Q600	A596-V598 PolarHBondContact O-N 3.27Å; V598-Q600 PolarHBondContact O-N 2.8Å; V598-Q600 VanDerWaalsContact O-N 3.12Å
599	F	33.6	Very low	38.1	Very low	125 Å²	125	135.6 Å²	135.6	55%	0.548	70%	0.701	S	S	.	*			trans	-66.3	106.4	166.8	-106.1	-86.6	0	0	0	109.1	D100 L213 R597	D100-F599 HydrophobicContact CB-CE2 4.33Å; D100-F599 HydrophobicContact CB-CZ 4.44Å; L213-F599 HydrophobicContact CD2-CZ 4.38Å; R597-F599 PolarHBondContact O-N 2.95Å
600	Q	33.5	Very low	37.3	Very low	168 Å²	168	134.1 Å²	134.1	79%	0.785	71%	0.707	S	S	*	*			trans	-70	124.7	160.7	-76.1	-175.8	-44.3	0	0	108.2	V598	V598-Q600 PolarHBondContact O-N 2.8Å; V598-Q600 VanDerWaalsContact O-N 3.12Å
601	P	31.1	Very low	36.4	Very low	108 Å²	108	139.7 Å²	139.7	70%	0.701	73%	0.728	S	S	*	*			trans	-67.7	145.6	171.7	29.7	-33.9	0	0	0	109.6	S603	P601-S603 PolarHBondContact O-N 3.29Å
602	L	37.2	Very low	35.5	Very low	165 Å²	165	141.9 Å²	141.9	86%	0.864	75%	0.745	S	S	*	*			trans	-73.5	75.4	171.8	-71	170.5	0	0	0	110.3
603	S	31.4	Very low	34.9	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	75%	0.748	S	S	*	*			trans	-77.1	122.8	168.3	50.2	0	0	0	0	110	P601 E605	P601-S603 PolarHBondContact O-N 3.29Å; S603-E605 PolarHBondContact O-N 2.91Å
604	H	43.3	Very low	34.1	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.866	75%	0.751	S	S	*	*			trans	-98.8	81.4	-166	-174.3	-62.9	0	0	0	112.1
605	E	32.4	Very low	33.2	Very low	164 Å²	164	138 Å²	138	77%	0.766	76%	0.756	S	S	*	*			trans	-140.3	158.9	175.7	-78.4	-153.4	158.7	0	0	114.6	S603	S603-E605 PolarHBondContact O-N 2.91Å
606	H	29.9	Very low	32.9	Very low	159 Å²	159	140.4 Å²	140.4	74%	0.736	76%	0.757	S	S	*	*			trans	64.3	82.2	171.2	-70.1	87.5	0	0	0	118.1
607	V	28.9	Very low	32.5	Very low	141 Å²	141	145.9 Å²	145.9	86%	0.855	76%	0.763	S	S	*	*			trans	-115.8	141.5	139.2	174.6	0	0	0	0	106.8
608	R	32.9	Very low	31.7	Very low	213 Å²	213	145.8 Å²	145.8	80%	0.804	77%	0.772	S	S	*	*			trans	94.9	134.7	-156.3	-64.1	171.5	-165.7	-154.5	1.9	111.2
609	D	28.2	Very low	31.3	Very low	160 Å²	160	146.6 Å²	146.6	86%	0.856	78%	0.777	S	S	*	*			cis	-117.2	-176.8	6.5	-73.5	-59.8	0	0	0	113.7
610	A	29.7	Very low	31.2	Very low	87 Å²	87	145.9 Å²	145.9	72%	0.719	79%	0.788	S	S	*	*			trans	-140.6	171.6	178.4	0	0	0	0	0	111.1
611	E	29.9	Very low	31	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	79%	0.789	S	S	*	*			trans	71.2	147.7	-176.7	-45.9	-173.6	150.3	0	0	113.2
612	T	29	Very low	31.1	Very low	124 Å²	124	145.2 Å²	145.2	76%	0.761	79%	0.793	S	S	*	*			cis	-153.6	163.4	-1	-5.3	0	0	0	0	107.5
613	T	28.9	Very low	30.8	Very low	110 Å²	110	145 Å²	145	68%	0.675	79%	0.792	S	S	*	*			cis	-154	166.6	6.1	-37	0	0	0	0	109.1
614	D	27.9	Very low	30.7	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	79%	0.792	S	S	*	*			trans	62.4	155.6	160.1	-76.1	-19	0	0	0	119.8
615	G	28.9	Very low	30.2	Very low	63 Å²	63	142.3 Å²	142.3	65%	0.649	79%	0.793	S	S	*	*			cis	168.7	121.5	-5.3	0	0	0	0	0	113.6
616	Q	31.3	Very low	30.2	Very low	172 Å²	172	140.1 Å²	140.1	80%	0.804	79%	0.791	S	S	*	*			trans	63	112.6	150	-163.5	173.1	33	0	0	121
617	K	28.5	Very low	30.1	Very low	209 Å²	209	137.9 Å²	137.9	91%	0.909	79%	0.792	S	S	*	*				-157.5	140.4	122.6	-116	171.6	-173.9	175.6	0	112.8
618	D	32	Very low	30.2	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	79%	0.785	S	S	*	*			trans	-96.2	178.6	-173.5	-74	-74.9	0	0	0	113.9
619	T	29.9	Very low	30.1	Very low	146 Å²	146	130.7 Å²	130.7	90%	0.896	79%	0.787	S	S	*	*			trans	88.8	127.6	160	69	0	0	0	0	118.8
620	S	31.2	Very low	30.8	Very low	111 Å²	111	129.1 Å²	129.1	78%	0.776	79%	0.785	S	S	*	*			trans	-113.6	151.4	174.1	55.4	0	0	0	0	110
621	V	29.2	Very low	31	Very low	133 Å²	133	134.3 Å²	134.3	81%	0.806	79%	0.791	S	S	*	*			trans	-166.6	121.8	151.8	129.4	0	0	0	0	112.3
622	V	32	Very low	31.7	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	78%	0.784	S	S	*	*			trans	55.5	144.6	140.6	-168.4	0	0	0	0	122.4
623	D	31.4	Very low	31.8	Very low	160 Å²	160	132 Å²	132	86%	0.856	78%	0.784	S	S	*	*			trans	-59.9	-176.8	167.5	-54.7	-93.5	0	0	0	115.1
624	G	29	Very low	32	Very low	69 Å²	69	135.4 Å²	135.4	71%	0.711	79%	0.79	S	S	*	*			trans	165.2	-13.6	144.3	0	0	0	0	0	125.5
625	D	33	Very low	32.3	Very low	166 Å²	166	133 Å²	133	89%	0.888	78%	0.784	S	S	*	*			trans	61.1	-178.3	167.5	-158.1	10.9	0	0	0	118.8
626	V	31.9	Very low	32.5	Very low	119 Å²	119	135.7 Å²	135.7	72%	0.721	79%	0.788	S	S	*	*			trans	82.8	108	164.7	-165.9	0	0	0	0	119.1
627	S	29.2	Very low	32.5	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	78%	0.784	S	S	*	*				167.4	136.3	103.7	-156.6	0	0	0	0	117.5
628	A	30.6	Very low	33	Very low	84 Å²	84	130.8 Å²	130.8	69%	0.694	78%	0.775	S	S	*	*			trans	35.9	123.8	146.6	0	0	0	0	0	125.8
629	S	31.7	Very low	33.1	Very low	120 Å²	120	131.8 Å²	131.8	84%	0.839	78%	0.777	S	S	*	*				36.7	161	117.8	-56.1	0	0	0	0	123.7
630	P	42.1	Very low	33.2	Very low	126 Å²	126	130.3 Å²	130.3	82%	0.818	77%	0.773	S	S	*	*			cis	-132.1	-164.2	0.2	42	-23.4	0	0	0	115.4
631	K	34.3	Very low	33	Very low	196 Å²	196	131.3 Å²	131.3	85%	0.852	78%	0.778	S	S	*	*			trans	-109.3	155	167.9	-63.5	177.9	178.5	174.1	0	110.8
632	P	43.4	Very low	33.1	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	78%	0.776	S	S	*	*				-158.6	149.7	99.5	37.4	-16.9	0	0	0	120.1
633	I	31.8	Very low	34.1	Very low	148 Å²	148	128.6 Å²	128.6	76%	0.759	77%	0.774	S	S	*	*			trans	65.5	106.4	136	-62.9	172.4	0	0	0	120.1
634	K	32.6	Very low	34	Very low	182 Å²	182	128.7 Å²	128.7	79%	0.791	77%	0.774	S	S	*	*				73.2	142.2	92.5	-70.5	179.5	178.6	178.1	0	116.6
635	P	35.4	Very low	34.6	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	77%	0.774	S	S	*	*				-134	143	66	10	16.5	0	0	0	116.7
636	T	31.5	Very low	34.9	Very low	119 Å²	119	128.4 Å²	128.4	73%	0.73	77%	0.768	S	S	*	*				59.5	144.3	91.2	67.2	0	0	0	0	117.9
637	K	31.1	Very low	34.8	Very low	166 Å²	166	134.7 Å²	134.7	72%	0.722	78%	0.779	S	S	*	*			cis	-168.4	-164.3	-2.4	-117.8	-170.8	178.2	-171	0	107.8	M639	K637-M639 HydrophobicContact CD-CG 4.27Å; K637-M639 HydrophobicContact CD-SD 4.18Å; K637-M639 PolarHBondContact NZ-SD 3.28Å; K637-M639 VanDerWaalsContact NZ-SD 3.4Å
638	P	40.7	Very low	35.1	Very low	112 Å²	112	138 Å²	138	73%	0.727	78%	0.782	S	S	*	*			cis	-126.3	149.6	-4.6	42.7	-26.7	0	0	0	115
639	M	32.8	Very low	36.1	Very low	145 Å²	145	139.3 Å²	139.3	71%	0.714	78%	0.784	S	S	*	*				84.4	101.6	85.9	-61.2	-174.9	52.5	0	0	121.3	K637	K637-M639 HydrophobicContact CD-CG 4.27Å; K637-M639 HydrophobicContact CD-SD 4.18Å; K637-M639 PolarHBondContact NZ-SD 3.28Å; K637-M639 VanDerWaalsContact NZ-SD 3.4Å
640	S	32.5	Very low	36.1	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	78%	0.784	S	S	*	*				37.8	134.1	126.6	-158.4	0	0	0	0	124.8
641	C	25.8	Very low	35.5	Very low	132 Å²	132	138.8 Å²	138.8	89%	0.892	78%	0.78	S	S	*	*			trans	-158.2	172.8	141.5	-100.2	0	0	0	0	112.3
642	A	32.4	Very low	35.4	Very low	91 Å²	91	140.6 Å²	140.6	75%	0.752	78%	0.781	S	S	*	*			trans	-140.3	-163.8	-178.2	0	0	0	0	0	110.9
643	P	51.9	Low	34.8	Very low	114 Å²	114	144.4 Å²	144.4	74%	0.74	79%	0.79	S	S	*	*				-118.9	-167.8	-78.9	38.5	-25	0	0	0	114
644	L	30.3	Very low	34.5	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	79%	0.79	S	S	*	*			trans	83.5	159.9	176.1	-53.9	172	0	0	0	116.5
645	P	41.9	Very low	34.2	Very low	112 Å²	112	136.4 Å²	136.4	73%	0.727	79%	0.786	S	S	*	*			cis	-118.8	171.3	-11.1	38.8	-25.7	0	0	0	113.8
646	P	38.3	Very low	33.9	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	79%	0.785	S	S	*	*			trans	-73.8	164	170	32.5	-36.5	0	0	0	112.9
647	R	30.3	Very low	33.6	Very low	252 Å²	252	142.2 Å²	142.2	95%	0.951	79%	0.79	S	S	*	*			trans	-119.8	113.4	168.7	-116.3	-177.1	178.3	-179.1	-0.4	110.7
648	E	35.7	Very low	33.4	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-81.3	163.1	172.9	-80.2	-171.1	139.2	0	0	112.6
649	P	50.6	Low	33.2	Very low	113 Å²	113	146 Å²	146	73%	0.734	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.4	152.7	175.9	34.7	-35.9	0	0	0	112.7
650	P	32.9	Very low	33.1	Very low	129 Å²	129	143.6 Å²	143.6	84%	0.838	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.4	148.9	161.7	34.5	-31	0	0	0	111.2
651	S	30	Very low	32.8	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	80%	0.804	S	S	*	*			trans	-140.3	141.5	179.9	73.6	0	0	0	0	114
652	R	32.3	Very low	32.9	Very low	234 Å²	234	147.4 Å²	147.4	88%	0.883	80%	0.8	S	S	*	*			trans	62.9	169.7	160.1	-70.7	-177.2	164.7	-170.3	-3.2	118.9
653	Q	29.2	Very low	32.7	Very low	191 Å²	191	149.9 Å²	149.9	89%	0.893	80%	0.796	S	S	*	*			trans	81.1	136.8	167.5	-55.2	-163.8	18.2	0	0	115.9
654	A	27	Very low	31.6	Very low	92 Å²	92	151.2 Å²	151.2	76%	0.76	80%	0.797	S	S	*	*			cis	-155.8	154.3	-8.3	0	0	0	0	0	113
655	G	25.1	Very low	31.5	Very low	70 Å²	70	154.1 Å²	154.1	72%	0.722	80%	0.797	S	S	*	*			trans	71.5	169.2	138.8	0	0	0	0	0	119.6
656	I	29.4	Very low	32.2	Very low	141 Å²	141	153.7 Å²	153.7	72%	0.723	79%	0.794	S	S	*	*			cis	-148.2	164.5	-19.1	-40.1	171.5	0	0	0	107
657	Y	26.1	Very low	32.9	Very low	214 Å²	214	153 Å²	153	84%	0.839	79%	0.789	S	S	*	*			trans	91.8	121	157.7	-67.5	-66.5	0	0	0	122
658	R	25.8	Very low	32.9	Very low	229 Å²	229	147.6 Å²	147.6	86%	0.864	78%	0.779	S	S	*	*			trans	-54.4	169.1	151.2	-110.5	-176.3	-178.1	178.8	1.2	112
659	P	36.4	Very low	32.6	Very low	129 Å²	129	143.4 Å²	143.4	84%	0.838	77%	0.77	S	S	*	*			cis	-139.6	-165.3	46	39.4	-18.7	0	0	0	116
660	A	30.2	Very low	31.7	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	77%	0.774	S	S	*	*			trans	-136.4	154	-172.1	0	0	0	0	0	113
661	S	27.9	Very low	31.7	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	77%	0.771	S	S	*	*			trans	-164.5	118	171	36.9	0	0	0	0	106.4
662	R	27.9	Very low	31.8	Very low	219 Å²	219	145.9 Å²	145.9	83%	0.826	77%	0.77	S	S	*	*				80.5	122.1	73.4	-89.4	-166	175.4	-160	4.1	113.4
663	Q	27.9	Very low	31.7	Very low	143 Å²	143	143.9 Å²	143.9	67%	0.668	77%	0.768	S	S	*	*			trans	69.7	156.2	152.9	-72.2	173.3	-104.7	0	0	116.2
664	D	28.2	Very low	31.8	Very low	142 Å²	142	141.3 Å²	141.3	76%	0.759	76%	0.759	S	S	*	*			cis	-142.4	-163.4	3.3	-112.3	-32.8	0	0	0	112.4
665	R	29.2	Very low	32	Very low	223 Å²	223	143.2 Å²	143.2	84%	0.842	77%	0.767	S	S	*	*			trans	-151.8	173.7	-178.5	-163.5	-125.6	-76.4	-161.4	-4.5	109
666	P	55	Low	32.4	Very low	102 Å²	102	145.1 Å²	145.1	66%	0.662	76%	0.76	S	S	*	*			cis	-83.5	-122	-44.5	36.2	-20.4	0	0	0	108.2
667	P	54.1	Low	32.4	Very low	101 Å²	101	144.3 Å²	144.3	66%	0.656	76%	0.755	S	S	*	*			cis	-82.3	-151.9	-4.8	42.1	-40.5	0	0	0	111.3
668	D	29.1	Very low	32.6	Very low	139 Å²	139	142.7 Å²	142.7	74%	0.743	75%	0.747	S	S	*	*			cis	-152.6	-145.1	6.8	-122.6	-33.7	0	0	0	109.4
669	S	31.3	Very low	32.7	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	74%	0.743	S	S	*	*				-152.1	172.3	-105.5	-74.4	0	0	0	0	111
670	D	30.6	Very low	32.2	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	74%	0.736	S	S	*	*			trans	65	121.9	178.1	-57.5	-24	0	0	0	117.1
671	A	33.3	Very low	32.8	Very low	93 Å²	93	141.8 Å²	141.8	77%	0.769	73%	0.732	S	S	*	*				82.9	140.2	50.5	0	0	0	0	0	112.7
672	E	32.8	Very low	32.8	Very low	154 Å²	154	141.9 Å²	141.9	72%	0.72	72%	0.724	S	S	*	*			cis	-160.9	148.4	2.4	-152.5	-168.9	-141.8	0	0	110.6
673	K	30.3	Very low	32.9	Very low	192 Å²	192	137.4 Å²	137.4	84%	0.835	73%	0.727	S	S	*	*				173.7	141.9	121.6	-98.7	170.6	-179.1	171.6	0	115.1
674	L	30.6	Very low	33	Very low	137 Å²	137	136 Å²	136	72%	0.717	73%	0.733	S	S	*	*			trans	-97.1	159.6	174.5	-68.4	72	0	0	0	111.1	D676	L674-D676 HydrophobicContact CD2-CB 4.37Å
675	S	31.8	Very low	33.6	Very low	131 Å²	131	135.5 Å²	135.5	92%	0.916	74%	0.737	S	S	*	*				-126.4	146.1	122.2	57.8	0	0	0	0	108.7
676	D	31.8	Very low	33.7	Very low	111 Å²	111	129.8 Å²	129.8	59%	0.594	74%	0.738	S	S	*	*			trans	-127.8	156.5	-165.2	174	32.2	0	0	0	110.4	L674	L674-D676 HydrophobicContact CD2-CB 4.37Å
677	M	29.5	Very low	32.5	Very low	123 Å²	123	129.7 Å²	129.7	61%	0.606	75%	0.746	S	S	*	*			trans	174.2	104.9	130.9	-90.3	-74.1	97	0	0	111.6
678	R	30.2	Very low	31.4	Very low	181 Å²	181	133.2 Å²	133.2	68%	0.683	76%	0.759	S	S	*	*			trans	62.9	148	135.1	-62.6	-178	-177.3	-166.5	5	120.5
679	Q	28.4	Very low	31.3	Very low	165 Å²	165	129.7 Å²	129.7	77%	0.771	76%	0.755	S	S	*	*			cis	-156.7	165	-12.8	-121.3	162.3	-17.8	0	0	111.7
680	K	25.4	Very low	31.2	Very low	159 Å²	159	133.4 Å²	133.4	69%	0.691	77%	0.768	S	S	*	*			trans	-74	-179.8	174.9	-112.8	-159.5	177.1	-159.1	0	112.4	D682	K680-D682 WeakPolarHBondContact CE-OD1 3.43Å; K680-D682 IonicContact NZ-OD1 3.28Å; K680-D682 PolarHBondContact NZ-OD1 2.94Å; K680-D682 IonicContact NZ-OD2 3.91Å; K680-D682 PolarHBondContact NZ-OD2 2.86Å
681	P	44	Very low	31.1	Very low	108 Å²	108	130.8 Å²	130.8	70%	0.701	76%	0.762	S	S	*	*			cis	-139.8	155.8	22	40	-20	0	0	0	120
682	D	27.8	Very low	30.9	Very low	111 Å²	111	129.8 Å²	129.8	59%	0.594	76%	0.761	S	S	*	*			trans	37.1	123.1	131.5	-50.7	-30.1	0	0	0	122.3	K680	K680-D682 WeakPolarHBondContact CE-OD1 3.43Å; K680-D682 IonicContact NZ-OD1 3.28Å; K680-D682 PolarHBondContact NZ-OD1 2.94Å; K680-D682 IonicContact NZ-OD2 3.91Å; K680-D682 PolarHBondContact NZ-OD2 2.86Å
683	S	30	Very low	30.6	Very low	126 Å²	126	129.2 Å²	129.2	88%	0.881	77%	0.767	S	S	*	*				-175.6	153.3	110.4	40.2	0	0	0	0	113.1
684	S	28.8	Very low	30.4	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	77%	0.765	S	S	*	*			trans	-144.3	146.6	164.2	61.6	0	0	0	0	109.5
685	P	42.3	Very low	30.3	Very low	131 Å²	131	127.1 Å²	127.1	85%	0.851	77%	0.77	S	S	*	*				-140.5	173.6	123.6	36.8	-23.5	0	0	0	113.7
686	A	30	Very low	30	Very low	103 Å²	103	125.8 Å²	125.8	85%	0.851	76%	0.761	S	S	*	*			trans	-77	155.5	-167.3	0	0	0	0	0	116.3
687	A	30.3	Very low	29.8	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	78%	0.777	S	S	*	*			trans	-155.3	158.6	149.1	0	0	0	0	0	111.8
688	N	30.4	Very low	29.6	Very low	175 Å²	175	132.5 Å²	132.5	94%	0.936	79%	0.785	S	S	*	*			trans	-69.3	157.3	-176.4	-48.6	-53.3	0	0	0	113.7
689	G	28.8	Very low	29.9	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	78%	0.784	S	S	*	*			trans	173.3	69.6	169.4	0	0	0	0	0	116.3	S691	G689-S691 PolarHBondContact O-OG 3.25Å
690	D	27.7	Very low	29.8	Very low	170 Å²	170	126.8 Å²	126.8	91%	0.909	79%	0.789	S	S	*	*			trans	-61.3	137.6	169	-174.9	22	0	0	0	110.9
691	S	29.5	Very low	29.9	Very low	98 Å²	98	128.5 Å²	128.5	69%	0.685	80%	0.796	S	S	*	*			trans	-135.7	75.4	-165.5	-68.9	0	0	0	0	112	G689 V693	G689-S691 PolarHBondContact O-OG 3.25Å; S691-V693 PolarHBondContact O-N 2.86Å
692	G	28.1	Very low	29.2	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	81%	0.807	S	S	*	*			trans	-66.1	120.3	173.9	0	0	0	0	0	112.8	L694	G692-L694 PolarHBondContact O-N 2.68Å
693	V	26.4	Very low	29.2	Very low	141 Å²	141	138.2 Å²	138.2	86%	0.855	82%	0.819	S	S	*	*			trans	-80.5	105.5	176.2	178.1	0	0	0	0	110.2	S691	S691-V693 PolarHBondContact O-N 2.86Å
694	L	26.8	Very low	29.1	Very low	152 Å²	152	140.4 Å²	140.4	80%	0.796	82%	0.815	S	S	*	*			trans	-101.2	118.8	-179	-153.2	163	0	0	0	110.9	G692 S696	G692-L694 PolarHBondContact O-N 2.68Å; L694-S696 PolarHBondContact O-N 2.97Å
695	V	28.3	Very low	29	Very low	134 Å²	134	145.3 Å²	145.3	81%	0.812	82%	0.822	S	S	*	*			trans	-74.8	111.4	-174.2	180	0	0	0	0	111.5
696	S	25.1	Very low	28.3	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	82%	0.817	S	S	*	*			trans	-83.5	126.8	179.6	-70.1	0	0	0	0	113.5	L694	L694-S696 PolarHBondContact O-N 2.97Å
697	R	27.6	Very low	28.4	Very low	246 Å²	246	143.5 Å²	143.5	93%	0.928	81%	0.812	S	S	*	*			trans	-86	132.4	164.1	-74.4	175.4	167	170.4	-4.8	110.5
698	V	26.3	Very low	28.9	Very low	129 Å²	129	144.5 Å²	144.5	78%	0.782	81%	0.81	S	S	*	*			trans	-150	163.6	166.1	-122.1	0	0	0	0	109.5
699	P	36.2	Very low	28.9	Very low	103 Å²	103	146 Å²	146	67%	0.669	81%	0.809	S	S	*	*				-127.7	175.3	-98	42.4	-28.6	0	0	0	115.2
700	S	25.2	Very low	28.8	Very low	123 Å²	123	146.4 Å²	146.4	86%	0.86	81%	0.813	S	S	*	*			trans	-81.4	141.8	166.1	-60.6	0	0	0	0	112
701	F	28.5	Very low	28.8	Very low	194 Å²	194	144.5 Å²	144.5	85%	0.851	81%	0.807	S	S	*	*			trans	-81.8	144.3	-179.3	-77.3	-105.1	0	0	0	113.5
702	Q	30	Very low	29.8	Very low	198 Å²	198	145.6 Å²	145.6	93%	0.925	81%	0.812	S	S	*	*			trans	-126.2	146.4	145.6	-78.4	-169.1	-12.5	0	0	109.1
703	R	27.8	Very low	29.8	Very low	225 Å²	225	147.3 Å²	147.3	85%	0.849	82%	0.819	S	S	*	*			trans	-117.1	110.5	-168.5	-150.5	-177.1	-162.5	-161.3	6.9	112.2
704	Q	27.3	Very low	29.9	Very low	172 Å²	172	147.9 Å²	147.9	80%	0.804	82%	0.817	S	S	*	*			trans	34.8	129.4	147.9	-63.4	175.4	-44.7	0	0	120.5
705	K	26.7	Very low	30	Very low	216 Å²	216	150 Å²	150	94%	0.939	82%	0.815	S	S	*	*				-136.8	150.7	120.4	-128.4	174.9	-177.3	-179.9	0	110.5
706	A	27.1	Very low	29.9	Very low	90 Å²	90	151.5 Å²	151.5	74%	0.744	81%	0.813	S	S	*	*			trans	-96	172.7	-173.8	0	0	0	0	0	110
707	S	31.6	Very low	30.1	Very low	107 Å²	107	149.9 Å²	149.9	75%	0.748	81%	0.812	S	S	*	*			cis	-178.8	-167.3	-6.1	35.7	0	0	0	0	107
708	P	42.4	Very low	30.1	Very low	122 Å²	122	147.5 Å²	147.5	79%	0.792	81%	0.811	S	S	*	*				-112.4	-168.3	-65.6	38.4	-25.3	0	0	0	111.9
709	K	30.1	Very low	30.3	Very low	207 Å²	207	145.5 Å²	145.5	90%	0.9	80%	0.803	S	S	*	*			trans	-75.2	153	177.3	-66.9	-179.4	176.6	-179.5	0	113.7
710	G	25.6	Very low	29.9	Very low	72 Å²	72	148 Å²	148	74%	0.742	81%	0.81	S	S	*	*			trans	-152.7	143.1	161.5	0	0	0	0	0	111
711	T	28.4	Very low	30.1	Very low	129 Å²	129	144.9 Å²	144.9	79%	0.791	80%	0.798	S	S	*	*			trans	-170	152.6	-169.9	-49.2	0	0	0	0	109.5
712	P	51.1	Low	30.1	Very low	122 Å²	122	142.1 Å²	142.1	79%	0.792	80%	0.797	S	S	*	*			cis	-118.4	173.2	-29.2	36.3	-22.1	0	0	0	113.1
713	A	27.6	Very low	30.2	Very low	108 Å²	108	137.8 Å²	137.8	89%	0.893	78%	0.784	S	S	*	*			trans	-150.2	156.7	162.1	0	0	0	0	0	112.7
714	N	28	Very low	30.2	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	78%	0.781	S	S	*	*			trans	-99.5	174.6	-159.9	-165.3	9.5	0	0	0	114.3
715	R	29.2	Very low	30.3	Very low	197 Å²	197	133.5 Å²	133.5	74%	0.743	78%	0.78	S	S	*	*			trans	100.4	109.8	157.3	-58.4	-167.1	121	141	5.7	122.4
716	E	27	Very low	30.3	Very low	165 Å²	165	132.6 Å²	132.6	77%	0.771	78%	0.776	S	S	*	*				57.2	135.6	113.1	-60.3	168.3	120.4	0	0	123.1
717	G	28.4	Very low	30.3	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	78%	0.777	S	S	*	*			trans	118.7	108.8	171.5	0	0	0	0	0	112.8
718	H	28.4	Very low	30.3	Very low	195 Å²	195	132.9 Å²	132.9	90%	0.903	78%	0.778	S	S	*	*				46.9	131.6	61.6	-73.7	-76.9	0	0	0	114.5
719	S	28.6	Very low	29.5	Very low	87 Å²	87	134 Å²	134	61%	0.608	77%	0.773	S	S	*	*			cis	-165.8	-178.9	-14	64.5	0	0	0	0	108
720	D	29.1	Very low	29.4	Very low	155 Å²	155	132.2 Å²	132.2	83%	0.829	77%	0.765	S	S	*	*			cis	-126.4	-134.1	1.7	-100.3	-68.2	0	0	0	108.6
721	G	28.1	Very low	29.5	Very low	59 Å²	59	138.4 Å²	138.4	61%	0.608	77%	0.774	S	S	*	*			cis	176.2	97.8	-1.2	0	0	0	0	0	109.2
722	V	30.4	Very low	29.4	Very low	135 Å²	135	137 Å²	137	82%	0.818	78%	0.776	S	S	*	*				60.1	100.9	96.4	176.6	0	0	0	0	111.3
723	T	30.4	Very low	28.4	Very low	108 Å²	108	139.5 Å²	139.5	66%	0.663	78%	0.781	S	S	*	*				-151.1	166.3	61.4	51.5	0	0	0	0	112.1
724	K	29	Very low	28.3	Very low	179 Å²	179	139.4 Å²	139.4	78%	0.778	77%	0.773	S	S	*	*			cis	-167.3	-176	-8.6	-99.8	163.5	-172.7	163.5	0	104.4
725	T	28.3	Very low	28.4	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	77%	0.774	S	S	*	*			cis	-138.9	-96.7	14.3	-43.6	0	0	0	0	112.1
726	K	27.9	Very low	28.5	Very low	197 Å²	197	139 Å²	139	86%	0.857	77%	0.774	S	S	*	*			trans	-156.3	165.4	-174.1	-60.6	-178.8	-180	176.8	0	107.6
727	S	27.3	Very low	28.9	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	78%	0.778	S	S	*	*			cis	-156	141	22.3	55	0	0	0	0	115.9
728	A	30.4	Very low	29.2	Very low	94 Å²	94	142.1 Å²	142.1	78%	0.777	79%	0.786	S	S	*	*			trans	57.6	143.9	131.3	0	0	0	0	0	124.8
729	E	26.8	Very low	29.4	Very low	146 Å²	146	143.7 Å²	143.7	68%	0.682	78%	0.784	S	S	*	*			trans	86.7	116.7	151.4	-63.5	-121.1	100.9	0	0	122.6
730	K	28.1	Very low	29.8	Very low	170 Å²	170	144.8 Å²	144.8	74%	0.739	79%	0.788	S	S	*	*			trans	58.1	120.9	137.6	-68.2	169.1	179.6	139.8	0	121
731	H	25.9	Very low	30.2	Very low	202 Å²	202	143.6 Å²	143.6	94%	0.935	79%	0.789	S	S	*	*			trans	-67.2	141.7	158.4	-75.4	-91.6	0	0	0	112.1
732	A	27.3	Very low	30.4	Very low	100 Å²	100	149.6 Å²	149.6	83%	0.826	80%	0.801	S	S	*	*			trans	-135.4	151.1	161.7	0	0	0	0	0	110.1
733	I	29.5	Very low	30.6	Very low	173 Å²	173	148.9 Å²	148.9	89%	0.887	80%	0.799	S	S	*	*			trans	-88.3	132.6	-175.4	-62	161.7	0	0	0	109.8
734	C	26.1	Very low	31	Very low	107 Å²	107	150 Å²	150	72%	0.723	81%	0.809	S	S	*	*			trans	-155	116.4	165.4	-146.5	0	0	0	0	115.4
735	R	30.9	Very low	31.3	Very low	227 Å²	227	146.6 Å²	146.6	86%	0.857	81%	0.807	S	S	*	*			trans	49.2	149.4	138.3	-64.1	179.8	-178.7	-173.9	-0.4	122.1
736	P	30.6	Very low	31.6	Very low	115 Å²	115	152 Å²	152	75%	0.747	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76	159.3	178.4	32.8	-36.9	0	0	0	113.9
737	P	35.8	Very low	31.6	Very low	132 Å²	132	148 Å²	148	86%	0.857	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.2	170.6	-173.3	34.2	-37.3	0	0	0	115.4
738	I	35.1	Very low	32.2	Very low	168 Å²	168	148.9 Å²	148.9	86%	0.862	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102.2	165.7	-169.6	-68	168.4	0	0	0	112
739	R	32.6	Very low	32.4	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-53.6	148.4	177.6	-176	-176.2	-73.5	171.5	-3.6	113.7
740	P	37.1	Very low	32.9	Very low	109 Å²	109	147.5 Å²	147.5	71%	0.708	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65.1	164.8	173.7	-20.8	33.9	0	0	0	114.9
741	P	36.2	Very low	33	Very low	130 Å²	130	148.9 Å²	148.9	84%	0.844	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-88.8	165.9	-170.5	36.2	-37.2	0	0	0	115.5
742	E	32.4	Very low	33.2	Very low	186 Å²	186	148.1 Å²	148.1	87%	0.869	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-95.3	158.3	176.3	-67.7	-176.5	154.7	0	0	113.3
743	P	34.4	Very low	33.2	Very low	119 Å²	119	150.7 Å²	150.7	77%	0.773	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79.1	162.6	176.5	32.8	-35.8	0	0	0	114.1
744	P	40	Very low	33.8	Very low	133 Å²	133	147.5 Å²	147.5	86%	0.864	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83	166.1	-166.8	33.5	-37.8	0	0	0	116
745	S	34.3	Very low	33.9	Very low	107 Å²	107	149.1 Å²	149.1	75%	0.748	82%	0.815	S	S	*	*			trans	-133.5	145.8	-163.3	61.2	0	0	0	0	115.9
746	R	34.2	Very low	33.7	Very low	241 Å²	241	143.3 Å²	143.3	91%	0.909	82%	0.815	S	S	*	*			trans	170.3	158.5	154.1	-96.6	160.7	-165.7	-141.4	2.2	108.1
747	C	29.6	Very low	33.7	Very low	113 Å²	113	142.8 Å²	142.8	76%	0.764	82%	0.82	S	S	*	*			cis	-146.9	-170.6	14.4	-124.8	0	0	0	0	110.8
748	P	39.4	Very low	33.3	Very low	126 Å²	126	142.4 Å²	142.4	82%	0.818	82%	0.821	S	S	*	*			trans	-91.9	175.7	-153	38.1	-40.7	0	0	0	118.4
749	A	33.5	Very low	33.1	Very low	95 Å²	95	140.3 Å²	140.3	79%	0.785	82%	0.82	S	S	*	*			trans	-110	168.2	-174.7	0	0	0	0	0	114.9
750	P	37.2	Very low	33	Very low	116 Å²	116	139.3 Å²	139.3	75%	0.753	83%	0.825	S	S	*	*			trans	-140.4	137.4	151	35.2	-18.4	0	0	0	117.6
751	Q	31.3	Very low	32.7	Very low	199 Å²	199	137.4 Å²	137.4	93%	0.93	83%	0.825	S	S	*	*			trans	76.6	174.4	144.4	-61.1	-175.4	6.4	0	0	121.5
752	K	30.8	Very low	32.4	Very low	186 Å²	186	139.8 Å²	139.8	81%	0.809	83%	0.828	S	S	*	*			trans	-113	142.1	-136.6	-69.6	177.9	174.5	178.5	0	117
753	L	25.9	Very low	32.6	Very low	155 Å²	155	136.7 Å²	136.7	81%	0.812	82%	0.824	S	S	*	*			trans	64.7	159.4	137.5	-72.2	172.3	0	0	0	120.6
754	P	43.3	Very low	32.6	Very low	106 Å²	106	137.2 Å²	137.2	69%	0.688	83%	0.825	S	S	*	*			cis	-136.2	178.8	-17.5	40.4	-23	0	0	0	116.3
755	V	27.6	Very low	32.8	Very low	141 Å²	141	134.8 Å²	134.8	86%	0.855	81%	0.811	S	S	*	*			trans	62.1	112.4	160.9	-165.1	0	0	0	0	120.6
756	A	27.2	Very low	32.9	Very low	104 Å²	104	139.3 Å²	139.3	86%	0.86	81%	0.813	S	S	*	*				-175.1	161.8	128.1	0	0	0	0	0	110.2
757	A	30.8	Very low	33.3	Very low	104 Å²	104	133.3 Å²	133.3	86%	0.86	80%	0.803	S	S	*	*			trans	-119.5	141.9	-176.5	0	0	0	0	0	113.5
758	S	27.3	Very low	33.9	Very low	124 Å²	124	130.4 Å²	130.4	87%	0.867	79%	0.787	S	S	*	*			trans	-161.1	163.9	153	61	0	0	0	0	110.1
759	C	29.6	Very low	33.8	Very low	125 Å²	125	127.9 Å²	127.9	85%	0.845	77%	0.772	S	S	*	*			trans	-117.7	133.7	-179.5	-64	0	0	0	0	111
760	E	31.8	Very low	34.1	Very low	206 Å²	206	130.7 Å²	130.7	96%	0.963	77%	0.767	S	S	*	*			trans	-177.2	156.7	153.4	-107.5	173.6	-158.5	0	0	107.6
761	G	30.7	Very low	34.4	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	76%	0.76	S	S	*	*			cis	178.6	146.1	-6	0	0	0	0	0	109.9
762	M	29.8	Very low	34.7	Very low	180 Å²	180	127.3 Å²	127.3	89%	0.887	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-93.2	143.8	174.5	-86.1	-82.1	-80.4	0	0	111
763	P	36.3	Very low	35	Very low	121 Å²	121	126.1 Å²	126.1	79%	0.786	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.8	134.8	-170.3	27.5	-34.7	0	0	0	112.5
764	T	34.7	Very low	35.5	Very low	130 Å²	130	126.4 Å²	126.4	80%	0.798	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-87.1	145.5	178.7	41.6	0	0	0	0	112.3
765	S	43.8	Very low	35.2	Very low	82 Å²	82	125.7 Å²	125.7	57%	0.573	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.6	143.4	-179.3	175.9	0	0	0	0	112.7	V767 A768	S765-V767 PolarHBondContact O-N 3.01Å; S765-A768 WeakPolarHBondContact O-CB 3.34Å; S765-A768 PolarHBondContact O-N 2.92Å
766	Y	36.3	Very low	35.8	Very low	202 Å²	202	123.9 Å²	123.9	79%	0.792	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-15	178.3	-168.4	-94.9	0	0	0	114.6	S769	Y766-S769 PolarHBondContact O-OG 2.9Å; Y766-S769 VanDerWaalsContact O-OG 3.09Å
767	V	42.6	Very low	36.3	Very low	115 Å²	115	121.7 Å²	121.7	70%	0.697	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-36.3	174	-176.4	0	0	0	0	112	S765 S769	S765-V767 PolarHBondContact O-N 3.01Å; V767-S769 VanDerWaalsContact C-N 3.31Å; V767-S769 PolarHBondContact O-N 3.17Å
768	A	42.4	Very low	36.6	Very low	51 Å²	51	120.2 Å²	120.2	42%	0.421	67%	0.674	S	S	.	*	H	α-helix	trans	-72.7	-21.4	-173.2	0	0	0	0	0	113.9	S765	S765-A768 WeakPolarHBondContact O-CB 3.34Å; S765-A768 PolarHBondContact O-N 2.92Å
769	S	37.4	Very low	37.2	Very low	74 Å²	74	122.2 Å²	122.2	52%	0.517	66%	0.662	S	S	.	*	H	α-helix	trans	-75	-27.1	-178.8	54.2	0	0	0	0	113.5	Y766 V767	Y766-S769 PolarHBondContact O-OG 2.9Å; Y766-S769 VanDerWaalsContact O-OG 3.09Å; V767-S769 VanDerWaalsContact C-N 3.31Å; V767-S769 PolarHBondContact O-N 3.17Å
770	K	39.5	Very low	37.7	Very low	153 Å²	153	123.9 Å²	123.9	67%	0.665	66%	0.658	S	S	*	*	H	α-helix	trans	-73.1	-33.2	177.6	-87.6	-167.7	172.6	-175.6	0	113.7	K772 F773	K770-K772 VanDerWaalsContact C-N 3.32Å; K770-K772 PolarHBondContact O-N 3.18Å; K770-F773 WeakPolarHBondContact O-CB 3.35Å; K770-F773 PolarHBondContact O-N 2.79Å; K770-F773 VanDerWaalsContact O-N 3.13Å
771	T	43	Very low	38	Very low	99 Å²	99	120 Å²	120	61%	0.607	65%	0.648	S	S	*	*	H	α-helix	trans	-61.8	-40.6	-177.6	-34	0	0	0	0	111.7	F773 F774 E775	T771-F773 PolarHBondContact O-N 3.13Å; T771-F774 PolarHBondContact O-N 3.02Å; T771-E775 PolarHBondContact O-N 2.86Å
772	K	38.6	Very low	38.4	Very low	146 Å²	146	122.8 Å²	122.8	64%	0.635	65%	0.65	S	S	*	*	H	α-helix	trans	-64.9	-19.9	177.4	-71.5	-171	174.1	-176.1	0	114.4	K770 N776	K770-K772 VanDerWaalsContact C-N 3.32Å; K770-K772 PolarHBondContact O-N 3.18Å; K772-N776 PolarHBondContact O-N 2.73Å; K772-N776 PolarHBondContact O-ND2 3.44Å
773	F	36.9	Very low	38.8	Very low	160 Å²	160	125.1 Å²	125.1	70%	0.702	65%	0.649	S	S	*	*	H	α-helix	trans	-71.5	-42.4	179.5	-165.5	-94.5	0	0	0	111.7	K770 T771 A777	K770-F773 WeakPolarHBondContact O-CB 3.35Å; K770-F773 PolarHBondContact O-N 2.79Å; K770-F773 VanDerWaalsContact O-N 3.13Å; T771-F773 PolarHBondContact O-N 3.13Å; F773-A777 PolarHBondContact O-N 3.44Å
774	F	36.6	Very low	38.4	Very low	161 Å²	161	130.4 Å²	130.4	71%	0.706	65%	0.653	S	S	*	*	H	α-helix	trans	-74.7	-34.3	177.1	-73.3	-84.9	0	0	0	112.6	T771 N776 A777 S778	T771-F774 PolarHBondContact O-N 3.02Å; F774-N776 VanDerWaalsContact C-N 3.33Å; F774-N776 PolarHBondContact O-N 3.39Å; F774-A777 PolarHBondContact O-N 3.5Å; F774-S778 PolarHBondContact O-N 2.96Å
775	E	36.7	Very low	38.3	Very low	92 Å²	92	129.8 Å²	129.8	43%	0.43	66%	0.655	S	S	.	*	H	α-helix	trans	-67.1	-31.8	178.2	-154.4	-161.7	148.2	0	0	113.2	T771 S778 R779	T771-E775 PolarHBondContact O-N 2.86Å; E775-S778 PolarHBondContact O-OG 3.28Å; E775-S778 VanDerWaalsContact O-OG 3.12Å; E775-R779 WeakPolarHBondContact O-CG 3.33Å; E775-R779 IonicContact OE1-CZ 2.62Å; E775-R779 IonicContact OE1-NE 3.25Å; E775-R779 PolarHBondContact OE1-NE 3.35Å; E775-R779 IonicContact OE1-NH2 3.79Å; E775-R779 PolarHBondContact OE1-NH2 3.13Å
776	N	39.3	Very low	37.7	Very low	103 Å²	103	135.4 Å²	135.4	55%	0.551	67%	0.669	S	S	*	*	H	α-helix	trans	-76.7	-28.8	174.7	-80.5	-24.9	0	0	0	113	K772 F774	K772-N776 PolarHBondContact O-N 2.73Å; K772-N776 PolarHBondContact O-ND2 3.44Å; F774-N776 VanDerWaalsContact C-N 3.33Å; F774-N776 PolarHBondContact O-N 3.39Å
777	A	37.8	Very low	37.5	Very low	57 Å²	57	131.1 Å²	131.1	47%	0.471	67%	0.666	S	S	.	*	H	α-helix	trans	-68.4	-41.6	178.6	0	0	0	0	0	112.2	F773 F774 R779 Q780	F773-A777 PolarHBondContact O-N 3.44Å; F774-A777 PolarHBondContact O-N 3.5Å; A777-R779 PolarHBondContact O-N 3.09Å; A777-Q780 PolarHBondContact O-N 3.26Å
778	S	36.9	Very low	37.1	Very low	73 Å²	73	135.7 Å²	135.7	51%	0.51	68%	0.677	S	S	.	*	H	α-helix	trans	-66.3	-36.8	179	60	0	0	0	0	112.8	F774 E775 Q780	F774-S778 PolarHBondContact O-N 2.96Å; E775-S778 PolarHBondContact O-OG 3.28Å; E775-S778 VanDerWaalsContact O-OG 3.12Å; S778-Q780 VanDerWaalsContact C-N 3.31Å; S778-Q780 PolarHBondContact O-N 2.77Å
779	R	40.7	Very low	36.6	Very low	167 Å²	167	140.8 Å²	140.8	63%	0.63	70%	0.697	S	S	*	*	H	α-helix	trans	-68.2	-22.9	-179.1	-68.5	178.8	-173.5	-121.7	8.1	114.1	E775 A777	E775-R779 WeakPolarHBondContact O-CG 3.33Å; E775-R779 IonicContact OE1-CZ 2.62Å; E775-R779 IonicContact OE1-NE 3.25Å; E775-R779 PolarHBondContact OE1-NE 3.35Å; E775-R779 IonicContact OE1-NH2 3.79Å; E775-R779 PolarHBondContact OE1-NH2 3.13Å; A777-R779 PolarHBondContact O-N 3.09Å
780	Q	38.8	Very low	36.4	Very low	160 Å²	160	148.9 Å²	148.9	75%	0.748	72%	0.716	S	S	*	*	H	α-helix	trans	-83	-20.2	-179	-71.6	-164.5	-1.2	0	0	114.7	A777 S778	A777-Q780 PolarHBondContact O-N 3.26Å; S778-Q780 VanDerWaalsContact C-N 3.31Å; S778-Q780 PolarHBondContact O-N 2.77Å
781	V	39	Very low	36.2	Very low	125 Å²	125	147 Å²	147	76%	0.758	72%	0.722	S	S	*	*	H	α-helix	trans	-76	-25.8	-178.2	-177.3	0	0	0	0	112.3	R783	V781-R783 VanDerWaalsContact C-N 3.35Å; V781-R783 PolarHBondContact O-N 2.65Å
782	V	39.8	Very low	36.3	Very low	127 Å²	127	148.2 Å²	148.2	77%	0.77	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-0.1	-172.6	-169.9	0	0	0	0	113.5
783	R	37.2	Very low	36.1	Very low	229 Å²	229	144.3 Å²	144.3	86%	0.864	73%	0.733	S	S	*	*			trans	-133	67.9	-178.6	-81.4	-169.4	168.6	-168.7	-2.3	114.5	V781	V781-R783 VanDerWaalsContact C-N 3.35Å; V781-R783 PolarHBondContact O-N 2.65Å
784	R	29.2	Very low	35.9	Very low	232 Å²	232	148.4 Å²	148.4	88%	0.875	74%	0.744	S	S	*	*			trans	-141.4	82.1	157.5	-74.4	-163.9	174.7	-171.9	-1.3	112.4
785	S	30.9	Very low	36.1	Very low	118 Å²	118	146 Å²	146	83%	0.825	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-85.6	140.3	161.1	43.9	0	0	0	0	110.3
786	F	31.1	Very low	36.3	Very low	199 Å²	199	155.2 Å²	155.2	87%	0.873	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.3	143.2	-179	-76.2	-100	0	0	0	112.2
787	P	33.4	Very low	36.1	Very low	113 Å²	113	157.9 Å²	157.9	73%	0.734	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.5	135.7	169	31.6	-33	0	0	0	111.3	N789	P787-N789 PolarHBondContact O-N 3.34Å
788	K	33.5	Very low	36	Very low	211 Å²	211	163.2 Å²	163.2	92%	0.917	81%	0.814	S	S	*	*			trans	-78.5	104.8	168.6	-72.5	-176.9	177.2	-179.8	0	109.9
789	N	31.8	Very low	36	Very low	158 Å²	158	168.2 Å²	168.2	85%	0.845	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-78.5	135.2	164.8	-91.4	-3.6	0	0	0	110.7	P787	P787-N789 PolarHBondContact O-N 3.34Å
790	R	33	Very low	35.7	Very low	243 Å²	243	168.2 Å²	168.2	92%	0.917	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-76.7	140.7	165.2	-70.9	178.6	172.4	176.1	-3.6	109.2
791	S	36.8	Very low	35.5	Very low	114 Å²	114	168.8 Å²	168.8	80%	0.797	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-71.1	155.1	162.8	46.3	0	0	0	0	110.6
792	P	44.8	Very low	35.3	Very low	125 Å²	125	171.7 Å²	171.7	81%	0.812	86%	0.855	S	S	*	*				-140.8	147.1	118.3	37	-25.6	0	0	0	114.3
793	G	33.6	Very low	34.9	Very low	63 Å²	63	174.9 Å²	174.9	65%	0.649	86%	0.861	S	S	*	*				98.4	107.3	129.2	0	0	0	0	0	120.4
794	W	33.3	Very low	34.8	Very low	247 Å²	247	170.7 Å²	170.7	94%	0.936	86%	0.861	S	S	*	*			trans	73.3	100.9	132	-70.2	34.8	0	0	0	120.3
795	S	41.3	Very low	35.2	Very low	110 Å²	110	165.6 Å²	165.6	77%	0.769	86%	0.86	S	S	*	*				40.7	107.3	122.2	-47.5	0	0	0	0	120.5
796	K	39	Very low	35.6	Very low	286 Å²	286	169.9 Å²	169.9	100%	1.243	86%	0.863	S	S	*	*				-157.2	0	97.3	-111.5	-178.7	179.5	-178.1	0	112.2

Retrieved 796 of 796 residues in 218.2 ms (Link to these results)

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