A0A077Z0I5_TRITR Loading...

WAP type 'four disulfide core

AlphaFold DB , UniProt , Accession A0A077Z0I5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 240 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	63.1	Low	80.6	Confident	235 Å²	235	129.3 Å²	129.3	100%	1.158	61%	0.609	S	S	*	*				0	107.7	0	-164.6	171	165.5	0	0	106.8	T3	M1-T3 PolarHBondContact O-N 2.73Å
2	K	68.3	Low	80.9	Confident	103 Å²	103	126.4 Å²	126.4	45%	0.448	60%	0.599	S	S	.	*			trans	-65.1	131.7	-174.7	-79.1	-179.9	175.3	167.1	0	110.6	E6 R7 E10	K2-E6 VanDerWaalsContact CA-OE2 3.24Å; K2-E6 WeakPolarHBondContact CA-OE2 3.4Å; K2-E6 HydrophobicContact CB-CB 4.2Å; K2-E6 HydrophobicContact CG-CB 4.45Å; K2-R7 HydrophobicContact CB-CG 4.06Å; K2-E10 IonicContact NZ-OE1 3.96Å; K2-E10 PolarHBondContact NZ-OE1 2.68Å; K2-E10 IonicContact NZ-OE2 2.78Å; K2-E10 PolarHBondContact NZ-OE2 2.89Å
3	T	85.4	Confident	80.7	Confident	76 Å²	76	121.8 Å²	121.8	47%	0.466	58%	0.584	S	S	.	*			trans	-62.7	156.8	176	62.8	0	0	0	0	110.1	M1 V5 E6 R7	M1-T3 PolarHBondContact O-N 2.73Å; T3-V5 PolarHBondContact O-N 2.98Å; T3-E6 PolarHBondContact N-OE2 3.39Å; T3-E6 PolarHBondContact O-N 3.39Å; T3-E6 VanDerWaalsContact O-N 3.13Å; T3-E6 VanDerWaalsContact OG1-CG 3.25Å; T3-E6 WeakPolarHBondContact OG1-CG 3.4Å; T3-E6 PolarHBondContact OG1-N 3.31Å; T3-E6 PolarHBondContact OG1-OE2 3.44Å; T3-R7 PolarHBondContact O-N 2.9Å; T3-R7 VanDerWaalsContact O-N 3.09Å
4	K	85.4	Confident	80.6	Confident	176 Å²	176	119.2 Å²	119.2	77%	0.765	57%	0.574	S	S	*	*	H	α-helix	trans	-56.3	-32.5	177.8	-172.7	176.3	179.8	178.9	0	111.8	R8	K4-R8 WeakPolarHBondContact O-CB 3.24Å; K4-R8 PolarHBondContact O-N 3.42Å
5	V	84.5	Confident	80.2	Confident	106 Å²	106	119.6 Å²	119.6	64%	0.642	57%	0.574	S	S	*	*	H	α-helix	trans	-70.2	-47.7	176.4	179.4	0	0	0	0	110.9	T3 R7 R8 V9	T3-V5 PolarHBondContact O-N 2.98Å; V5-R7 PolarHBondContact O-N 3.35Å; V5-R8 PolarHBondContact O-N 3.23Å; V5-R8 VanDerWaalsContact O-N 3.11Å; V5-V9 HydrophobicContact CG1-CG2 4.33Å; V5-V9 WeakPolarHBondContact O-CG2 3.25Å; V5-V9 PolarHBondContact O-N 2.82Å
6	E	83.2	Confident	79.9	Confident	100 Å²	100	117.8 Å²	117.8	47%	0.467	57%	0.567	S	S	.	*	H	α-helix	trans	-58.1	-44.5	177.9	-76.3	167.4	165.5	0	0	112.5	K2 T3 R8 V9 E10	K2-E6 VanDerWaalsContact CA-OE2 3.24Å; K2-E6 WeakPolarHBondContact CA-OE2 3.4Å; K2-E6 HydrophobicContact CB-CB 4.2Å; K2-E6 HydrophobicContact CG-CB 4.45Å; T3-E6 PolarHBondContact N-OE2 3.39Å; T3-E6 PolarHBondContact O-N 3.39Å; T3-E6 VanDerWaalsContact O-N 3.13Å; T3-E6 VanDerWaalsContact OG1-CG 3.25Å; T3-E6 WeakPolarHBondContact OG1-CG 3.4Å; T3-E6 PolarHBondContact OG1-N 3.31Å; T3-E6 PolarHBondContact OG1-OE2 3.44Å; E6-R8 VanDerWaalsContact C-N 3.3Å; E6-R8 PolarHBondContact O-N 2.82Å; E6-V9 PolarHBondContact O-N 3.13Å; E6-E10 WeakPolarHBondContact O-CB 3.37Å; E6-E10 PolarHBondContact O-N 3.28Å
7	R	84.4	Confident	79.3	Confident	145 Å²	145	118.2 Å²	118.2	55%	0.547	57%	0.568	S	S	.	*	H	α-helix	trans	-59.7	-41.5	175.6	-85.4	-171.3	-85.7	172.7	-7.1	112.3	K2 T3 V5 E10 E11	K2-R7 HydrophobicContact CB-CG 4.06Å; T3-R7 PolarHBondContact O-N 2.9Å; T3-R7 VanDerWaalsContact O-N 3.09Å; V5-R7 PolarHBondContact O-N 3.35Å; R7-E10 PolarHBondContact O-N 3.48Å; R7-E11 PolarHBondContact O-N 3.44Å
8	R	83.2	Confident	78.9	Confident	178 Å²	178	117 Å²	117	67%	0.672	56%	0.56	S	S	*	*	H	α-helix	trans	-70.1	-37.5	-179	-149.1	175	-173.8	-172.5	-0	112.2	K4 V5 E6 E10 I12	K4-R8 WeakPolarHBondContact O-CB 3.24Å; K4-R8 PolarHBondContact O-N 3.42Å; V5-R8 PolarHBondContact O-N 3.23Å; V5-R8 VanDerWaalsContact O-N 3.11Å; E6-R8 VanDerWaalsContact C-N 3.3Å; E6-R8 PolarHBondContact O-N 2.82Å; R8-E10 VanDerWaalsContact C-N 3.34Å; R8-I12 WeakPolarHBondContact O-CD1 3.47Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 3.32Å; R8-I12 PolarHBondContact O-N 3.26Å
9	V	83.5	Confident	78.5	Confident	83 Å²	83	113.8 Å²	113.8	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-65	-40.8	173.8	171.9	0	0	0	0	110.7	V5 E6 I12 T13	V5-V9 HydrophobicContact CG1-CG2 4.33Å; V5-V9 WeakPolarHBondContact O-CG2 3.25Å; V5-V9 PolarHBondContact O-N 2.82Å; E6-V9 PolarHBondContact O-N 3.13Å; V9-I12 PolarHBondContact O-N 3.39Å; V9-T13 WeakPolarHBondContact O-CB 3.38Å; V9-T13 PolarHBondContact O-N 2.91Å; V9-T13 PolarHBondContact O-OG1 3.28Å
10	E	83.7	Confident	77.9	Confident	85 Å²	85	116.7 Å²	116.7	40%	0.397	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-44	178.2	-160.5	168.9	-141.2	0	0	111.8	K2 E6 R7 R8 I12 T13 I14	K2-E10 IonicContact NZ-OE1 3.96Å; K2-E10 PolarHBondContact NZ-OE1 2.68Å; K2-E10 IonicContact NZ-OE2 2.78Å; K2-E10 PolarHBondContact NZ-OE2 2.89Å; E6-E10 WeakPolarHBondContact O-CB 3.37Å; E6-E10 PolarHBondContact O-N 3.28Å; R7-E10 PolarHBondContact O-N 3.48Å; R8-E10 VanDerWaalsContact C-N 3.34Å; E10-I12 PolarHBondContact O-N 3.27Å; E10-T13 PolarHBondContact O-N 3.5Å; E10-I14 HydrophobicContact CG-CD1 4.29Å; E10-I14 VanDerWaalsContact O-CG1 3.28Å; E10-I14 WeakPolarHBondContact O-CG1 3.5Å; E10-I14 PolarHBondContact O-N 3.37Å
11	E	82.1	Confident	77.5	Confident	135 Å²	135	114.5 Å²	114.5	63%	0.631	55%	0.548	S	S	*	.	H	α-helix	trans	-57.8	-46.2	172.5	-80.1	176.9	173.7	0	0	112.4	R7 T13 I14 H15	R7-E11 PolarHBondContact O-N 3.44Å; E11-T13 VanDerWaalsContact C-N 3.33Å; E11-T13 PolarHBondContact O-N 3.5Å; E11-I14 PolarHBondContact O-N 2.93Å; E11-H15 WeakPolarHBondContact O-CB 3.41Å; E11-H15 PolarHBondContact O-N 3.48Å
12	I	83.4	Confident	77.6	Confident	95 Å²	95	109.7 Å²	109.7	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-42.2	177.5	-70.3	166.7	0	0	0	110.4	R8 V9 E10 H15 I16	R8-I12 WeakPolarHBondContact O-CD1 3.47Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 3.32Å; R8-I12 PolarHBondContact O-N 3.26Å; V9-I12 PolarHBondContact O-N 3.39Å; E10-I12 PolarHBondContact O-N 3.27Å; I12-H15 PolarHBondContact O-N 3.45Å; I12-I16 HydrophobicContact CG2-CD1 3.68Å; I12-I16 HydrophobicContact CG2-CG1 4.31Å; I12-I16 VanDerWaalsContact O-CG1 3.28Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.33Å
13	T	79.3	Confident	77.5	Confident	67 Å²	67	110.2 Å²	110.2	41%	0.411	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-45.7	-179.7	-57.7	0	0	0	0	111.2	V9 E10 E11 H15 I16 Q17	V9-T13 WeakPolarHBondContact O-CB 3.38Å; V9-T13 PolarHBondContact O-N 2.91Å; V9-T13 PolarHBondContact O-OG1 3.28Å; E10-T13 PolarHBondContact O-N 3.5Å; E11-T13 VanDerWaalsContact C-N 3.33Å; E11-T13 PolarHBondContact O-N 3.5Å; T13-H15 VanDerWaalsContact C-N 3.31Å; T13-H15 PolarHBondContact O-N 3.39Å; T13-I16 PolarHBondContact O-N 2.93Å; T13-Q17 PolarHBondContact O-N 3.24Å
14	I	78.7	Confident	76.5	Confident	85 Å²	85	111 Å²	111	44%	0.436	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-43.8	174.7	-68.8	166.1	0	0	0	110.2	E10 E11 Q17 K18	E10-I14 HydrophobicContact CG-CD1 4.29Å; E10-I14 VanDerWaalsContact O-CG1 3.28Å; E10-I14 WeakPolarHBondContact O-CG1 3.5Å; E10-I14 PolarHBondContact O-N 3.37Å; E11-I14 PolarHBondContact O-N 2.93Å; I14-Q17 PolarHBondContact O-N 2.92Å; I14-K18 WeakPolarHBondContact O-CG 3.34Å; I14-K18 PolarHBondContact O-N 3.45Å
15	H	74.6	Confident	75.6	Confident	125 Å²	125	108 Å²	108	58%	0.579	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-45.2	178.8	-164.4	73.3	0	0	0	111.9	E11 I12 T13 Q17 K18 V19	E11-H15 WeakPolarHBondContact O-CB 3.41Å; E11-H15 PolarHBondContact O-N 3.48Å; I12-H15 PolarHBondContact O-N 3.45Å; T13-H15 VanDerWaalsContact C-N 3.31Å; T13-H15 PolarHBondContact O-N 3.39Å; H15-Q17 PolarHBondContact O-N 2.9Å; H15-K18 PolarHBondContact O-N 3.22Å; H15-V19 WeakPolarHBondContact O-CG2 3.45Å; H15-V19 PolarHBondContact O-N 3.46Å
16	I	76.2	Confident	74.5	Confident	91 Å²	91	106.3 Å²	106.3	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-44.1	176.8	-69.9	169.2	0	0	0	110.9	I12 T13 V19 R20	I12-I16 HydrophobicContact CG2-CD1 3.68Å; I12-I16 HydrophobicContact CG2-CG1 4.31Å; I12-I16 VanDerWaalsContact O-CG1 3.28Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.33Å; T13-I16 PolarHBondContact O-N 2.93Å; I16-V19 PolarHBondContact O-N 2.86Å; I16-R20 WeakPolarHBondContact O-CB 3.28Å; I16-R20 PolarHBondContact O-N 3.47Å
17	Q	69.2	Low	73.4	Confident	124 Å²	124	106.5 Å²	106.5	58%	0.579	49%	0.491	S	S	*	.	H	α-helix	trans	-61.2	-44.8	176.2	-81.7	-179.1	-27.8	0	0	111.6	T13 I14 H15 R20 T21	T13-Q17 PolarHBondContact O-N 3.24Å; I14-Q17 PolarHBondContact O-N 2.92Å; H15-Q17 PolarHBondContact O-N 2.9Å; Q17-R20 PolarHBondContact O-N 2.89Å; Q17-T21 WeakPolarHBondContact O-CB 3.28Å; Q17-T21 PolarHBondContact O-N 2.97Å; Q17-T21 PolarHBondContact O-OG1 2.92Å
18	K	71.8	Confident	72.1	Confident	97 Å²	97	106.7 Å²	106.7	42%	0.422	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-46.9	176.2	-77.6	-171	174.3	-155.1	0	112.2	I14 H15 R20 T21 R22 E69	I14-K18 WeakPolarHBondContact O-CG 3.34Å; I14-K18 PolarHBondContact O-N 3.45Å; H15-K18 PolarHBondContact O-N 3.22Å; K18-R20 PolarHBondContact O-N 3.41Å; K18-T21 PolarHBondContact O-N 2.66Å; K18-R22 WeakPolarHBondContact O-CG 3.24Å; K18-R22 PolarHBondContact O-N 3.31Å; K18-E69 IonicContact NZ-OE2 3.82Å; K18-E69 PolarHBondContact NZ-OE2 2.89Å
19	V	71.2	Confident	70.8	Confident	57 Å²	57	99.6 Å²	99.6	35%	0.345	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-46.2	178.1	172.9	0	0	0	0	111	H15 I16 T21 R22 Q23	H15-V19 WeakPolarHBondContact O-CG2 3.45Å; H15-V19 PolarHBondContact O-N 3.46Å; I16-V19 PolarHBondContact O-N 2.86Å; V19-T21 VanDerWaalsContact C-N 3.34Å; V19-T21 PolarHBondContact O-N 3.36Å; V19-R22 PolarHBondContact O-N 3.11Å; V19-Q23 HydrophobicContact CG1-CG 4.5Å; V19-Q23 WeakPolarHBondContact O-CB 3.47Å; V19-Q23 WeakPolarHBondContact O-CG 3.5Å; V19-Q23 PolarHBondContact O-N 3.24Å
20	R	67.5	Low	69.4	Low	170 Å²	170	99.3 Å²	99.3	64%	0.642	47%	0.471	S	S	*	.	H	α-helix	trans	-60	-43	175.4	-95.6	-175.7	168.2	175.6	-2.6	112.3	I16 Q17 K18 R22 Q23 L24	I16-R20 WeakPolarHBondContact O-CB 3.28Å; I16-R20 PolarHBondContact O-N 3.47Å; Q17-R20 PolarHBondContact O-N 2.89Å; K18-R20 PolarHBondContact O-N 3.41Å; R20-R22 PolarHBondContact O-N 3.06Å; R20-Q23 PolarHBondContact O-N 2.64Å; R20-L24 WeakPolarHBondContact O-CB 3.43Å; R20-L24 WeakPolarHBondContact O-CG 3.26Å; R20-L24 PolarHBondContact O-N 3.2Å
21	T	68.2	Low	67.9	Low	71 Å²	71	100.9 Å²	100.9	44%	0.436	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-41.2	-179.2	-50.1	0	0	0	0	110.9	Q17 K18 V19 L24 R25	Q17-T21 WeakPolarHBondContact O-CB 3.28Å; Q17-T21 PolarHBondContact O-N 2.97Å; Q17-T21 PolarHBondContact O-OG1 2.92Å; K18-T21 PolarHBondContact O-N 2.66Å; V19-T21 VanDerWaalsContact C-N 3.34Å; V19-T21 PolarHBondContact O-N 3.36Å; T21-L24 PolarHBondContact O-N 3.07Å; T21-R25 WeakPolarHBondContact O-CB 3.29Å; T21-R25 WeakPolarHBondContact O-CG 3.4Å; T21-R25 PolarHBondContact O-N 3.4Å
22	R	66.8	Low	66.4	Low	134 Å²	134	99 Å²	99	51%	0.506	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-44.2	172.5	-73.3	-177.2	-174.2	-167.5	0.3	112.2	K18 V19 R20 R25 R26 E69	K18-R22 WeakPolarHBondContact O-CG 3.24Å; K18-R22 PolarHBondContact O-N 3.31Å; V19-R22 PolarHBondContact O-N 3.11Å; R20-R22 PolarHBondContact O-N 3.06Å; R22-R25 PolarHBondContact O-N 2.67Å; R22-R26 WeakPolarHBondContact O-CG 3.49Å; R22-R26 PolarHBondContact O-N 3.09Å; R22-E69 IonicContact CZ-OE1 3.73Å; R22-E69 IonicContact NE-OE1 3.74Å; R22-E69 PolarHBondContact NE-OE1 3.09Å; R22-E69 VanDerWaalsContact NH2-CD 3.3Å; R22-E69 IonicContact NH2-OE1 2.74Å; R22-E69 PolarHBondContact NH2-OE1 3.18Å; R22-E69 IonicContact NH2-OE2 2.98Å
23	Q	65.4	Low	64.8	Low	114 Å²	114	98.6 Å²	98.6	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-42.3	177.6	-75.8	-179	-10.6	0	0	112.2	V19 R20 R26 L27	V19-Q23 HydrophobicContact CG1-CG 4.5Å; V19-Q23 WeakPolarHBondContact O-CB 3.47Å; V19-Q23 WeakPolarHBondContact O-CG 3.5Å; V19-Q23 PolarHBondContact O-N 3.24Å; R20-Q23 PolarHBondContact O-N 2.64Å; Q23-R26 WeakPolarHBondContact O-CB 3.46Å; Q23-R26 PolarHBondContact O-N 3.08Å; Q23-L27 PolarHBondContact O-N 3.3Å
24	L	64	Low	63.3	Low	94 Å²	94	100.9 Å²	100.9	49%	0.492	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-43.5	176.1	-75.8	167.8	0	0	0	111.6	R20 T21 R26 L27 F28	R20-L24 WeakPolarHBondContact O-CB 3.43Å; R20-L24 WeakPolarHBondContact O-CG 3.26Å; R20-L24 PolarHBondContact O-N 3.2Å; T21-L24 PolarHBondContact O-N 3.07Å; L24-R26 VanDerWaalsContact C-N 3.3Å; L24-R26 PolarHBondContact O-N 3.29Å; L24-L27 PolarHBondContact O-N 3.25Å; L24-F28 WeakPolarHBondContact O-CD2 3.46Å; L24-F28 PolarHBondContact O-N 3.21Å
25	R	66.5	Low	61.8	Low	112 Å²	112	100.4 Å²	100.4	42%	0.423	49%	0.494	S	S	.	.	H	α-helix	trans	-58.4	-43.3	173.3	-78.3	-175.8	-175.7	-176.2	6	111.5	T21 R22 F29 M66	T21-R25 WeakPolarHBondContact O-CB 3.29Å; T21-R25 WeakPolarHBondContact O-CG 3.4Å; T21-R25 PolarHBondContact O-N 3.4Å; R22-R25 PolarHBondContact O-N 2.67Å; R25-F29 VanDerWaalsContact O-CB 3.29Å; R25-F29 WeakPolarHBondContact O-CB 3.4Å; R25-F29 PolarHBondContact O-N 2.8Å; R25-M66 PolarHBondContact NH1-O 2.95Å
26	R	61.7	Low	60.8	Low	70 Å²	70	98 Å²	98	26%	0.264	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-44.6	174.7	-79.5	-177	172	-178.1	-2.7	112.6	R22 Q23 L24 F29 C30 E67	R22-R26 WeakPolarHBondContact O-CG 3.49Å; R22-R26 PolarHBondContact O-N 3.09Å; Q23-R26 WeakPolarHBondContact O-CB 3.46Å; Q23-R26 PolarHBondContact O-N 3.08Å; L24-R26 VanDerWaalsContact C-N 3.3Å; L24-R26 PolarHBondContact O-N 3.29Å; R26-F29 CarbonylContact O-C 3.49Å; R26-F29 PolarHBondContact O-N 3.29Å; R26-C30 PolarHBondContact O-N 3.29Å; R26-C30 PolarHBondContact O-SG 3.23Å; R26-E67 WeakPolarHBondContact CG-OE1 3.39Å; R26-E67 IonicContact CZ-OE1 3.38Å; R26-E67 IonicContact CZ-OE2 3.82Å; R26-E67 IonicContact NE-OE1 3.41Å; R26-E67 PolarHBondContact NE-OE1 3.3Å; R26-E67 IonicContact NE-OE2 2.69Å; R26-E67 IonicContact NH2-OE1 2.67Å; R26-E67 PolarHBondContact NH2-OE1 3.14Å; R26-E67 IonicContact NH2-OE2 2.72Å; R26-E67 PolarHBondContact NH2-OE2 3.48Å
27	L	60	Low	60	Low	105 Å²	105	97.9 Å²	97.9	55%	0.55	49%	0.494	S	S	.	.	H	α-helix	trans	-62.7	-49.6	178.4	-88.4	158.7	0	0	0	112	Q23 L24 F29 C30 I31	Q23-L27 PolarHBondContact O-N 3.3Å; L24-L27 PolarHBondContact O-N 3.25Å; L27-F29 PolarHBondContact O-N 3.08Å; L27-C30 PolarHBondContact O-N 2.95Å; L27-I31 WeakPolarHBondContact O-CG1 3.33Å; L27-I31 PolarHBondContact O-N 3.29Å; L27-I31 VanDerWaalsContact O-N 3.08Å
28	F	58	Low	60.4	Low	149 Å²	149	98.8 Å²	98.8	65%	0.654	50%	0.503	S	S	*	.	H	α-helix	trans	-57.7	-37.4	174.1	-94.2	-81.6	0	0	0	111.7	L24 N32	L24-F28 WeakPolarHBondContact O-CD2 3.46Å; L24-F28 PolarHBondContact O-N 3.21Å; F28-N32 PolarHBondContact O-N 2.87Å; F28-N32 VanDerWaalsContact O-N 3.08Å
29	F	54.9	Low	61.1	Low	29 Å²	29	96 Å²	96	13%	0.127	50%	0.501	C	S	.	.	H	α-helix	trans	-71.5	-41.3	177	-160	-105.6	0	0	0	112.7	R25 R26 L27 I31 N32 W33 E62 Q63	R25-F29 VanDerWaalsContact O-CB 3.29Å; R25-F29 WeakPolarHBondContact O-CB 3.4Å; R25-F29 PolarHBondContact O-N 2.8Å; R26-F29 CarbonylContact O-C 3.49Å; R26-F29 PolarHBondContact O-N 3.29Å; L27-F29 PolarHBondContact O-N 3.08Å; F29-I31 PolarHBondContact O-N 2.98Å; F29-N32 CarbonylContact O-C 3.58Å; F29-N32 PolarHBondContact O-N 2.93Å; F29-N32 VanDerWaalsContact O-N 3.09Å; F29-W33 AromaticContact CD1-CE3 3.82Å; F29-W33 HydrophobicContact CD1-CE3 3.82Å; F29-W33 HydrophobicContact CD1-CZ3 4.47Å; F29-W33 HydrophobicContact CE1-CD2 4.44Å; F29-W33 AromaticContact CE1-CE3 3.34Å; F29-W33 HydrophobicContact CE1-CE3 3.34Å; F29-W33 AromaticContact CE1-CZ3 3.77Å; F29-W33 HydrophobicContact CE1-CZ3 3.77Å; F29-W33 HydrophobicContact CZ-CE3 4.36Å; F29-W33 VanDerWaalsContact O-CB 3.26Å; F29-W33 WeakPolarHBondContact O-CB 3.46Å; F29-W33 PolarHBondContact O-N 3.35Å; F29-E62 HydrophobicContact CE2-CB 3.93Å; F29-E62 HydrophobicContact CZ-CB 3.77Å; F29-Q63 HydrophobicContact CD1-CB 3.93Å; F29-Q63 HydrophobicContact CD1-CG 4.08Å; F29-Q63 HydrophobicContact CE1-CB 3.6Å; F29-Q63 HydrophobicContact CE1-CG 4.26Å; F29-Q63 HydrophobicContact CZ-CB 4.13Å
30	C	54.2	Low	62	Low	77 Å²	77	93.8 Å²	93.8	52%	0.52	49%	0.49	S	S	.	.	H	α-helix	trans	-58.4	-37.4	174.4	-70.8	0	0	0	0	112	R26 L27 W33 C34	R26-C30 PolarHBondContact O-N 3.29Å; R26-C30 PolarHBondContact O-SG 3.23Å; L27-C30 PolarHBondContact O-N 2.95Å; C30-W33 PolarHBondContact O-N 2.95Å; C30-C34 PolarHBondContact O-N 2.93Å
31	I	53.3	Low	63.2	Low	117 Å²	117	92 Å²	92	60%	0.6	48%	0.484	S	S	*	.	H	α-helix	trans	-65.3	-45.3	175.2	-63.9	164.4	0	0	0	110.2	L27 F29	L27-I31 WeakPolarHBondContact O-CG1 3.33Å; L27-I31 PolarHBondContact O-N 3.29Å; L27-I31 VanDerWaalsContact O-N 3.08Å; F29-I31 PolarHBondContact O-N 2.98Å
32	N	50.5	Low	64.3	Low	95 Å²	95	88.7 Å²	88.7	51%	0.508	46%	0.464	S	S	.	.	H	α-helix	trans	-70.9	-27.8	175	-95.9	-10.6	0	0	0	113.9	F28 F29 A35 K36	F28-N32 PolarHBondContact O-N 2.87Å; F28-N32 VanDerWaalsContact O-N 3.08Å; F29-N32 CarbonylContact O-C 3.58Å; F29-N32 PolarHBondContact O-N 2.93Å; F29-N32 VanDerWaalsContact O-N 3.09Å; N32-A35 WeakPolarHBondContact O-CB 3.37Å; N32-A35 PolarHBondContact O-N 3.45Å; N32-A35 VanDerWaalsContact O-N 3.07Å; N32-K36 PolarHBondContact O-N 2.92Å
33	W	48.3	Very low	65.5	Low	88 Å²	88	85.9 Å²	85.9	33%	0.333	45%	0.453	S	S	.	.	H	α-helix	trans	-65.4	-41.2	178.9	-175.4	-63.4	0	0	0	110.3	F29 C30 A35 K36 R56 G59	F29-W33 AromaticContact CD1-CE3 3.82Å; F29-W33 HydrophobicContact CD1-CE3 3.82Å; F29-W33 HydrophobicContact CD1-CZ3 4.47Å; F29-W33 HydrophobicContact CE1-CD2 4.44Å; F29-W33 AromaticContact CE1-CE3 3.34Å; F29-W33 HydrophobicContact CE1-CE3 3.34Å; F29-W33 AromaticContact CE1-CZ3 3.77Å; F29-W33 HydrophobicContact CE1-CZ3 3.77Å; F29-W33 HydrophobicContact CZ-CE3 4.36Å; F29-W33 VanDerWaalsContact O-CB 3.26Å; F29-W33 WeakPolarHBondContact O-CB 3.46Å; F29-W33 PolarHBondContact O-N 3.35Å; C30-W33 PolarHBondContact O-N 2.95Å; W33-A35 PolarHBondContact O-N 3.38Å; W33-K36 PolarHBondContact O-N 3.23Å; W33-R56 HydrophobicContact CH2-CG 4.36Å; W33-R56 HydrophobicContact CZ2-CB 4.33Å; W33-R56 HydrophobicContact CZ2-CG 4.17Å; W33-G59 VanDerWaalsContact CZ3-C 3.43Å
34	C	48.2	Very low	66.9	Low	115 Å²	115	80.5 Å²	80.5	78%	0.777	43%	0.429	S	S	*	.	H	α-helix	trans	-65.3	-21.9	173.4	-77.4	0	0	0	0	113	C30	C30-C34 PolarHBondContact O-N 2.93Å
35	A	47.4	Very low	68.2	Low	75 Å²	75	83.5 Å²	83.5	62%	0.62	44%	0.44	S	S	*	.	H	α-helix	trans	-85.8	-23.6	179.3	0	0	0	0	0	113.5	N32 W33 A37	N32-A35 WeakPolarHBondContact O-CB 3.37Å; N32-A35 PolarHBondContact O-N 3.45Å; N32-A35 VanDerWaalsContact O-N 3.07Å; W33-A35 PolarHBondContact O-N 3.38Å; A35-A37 PolarHBondContact O-N 2.82Å
36	K	54.8	Low	69.5	Low	75 Å²	75	82.3 Å²	82.3	33%	0.326	45%	0.445	S	S	.	.			trans	-92.2	72.7	177.7	-69.6	-173.3	179.8	179.4	0	110.6	N32 W33 D38 E62 T128	N32-K36 PolarHBondContact O-N 2.92Å; W33-K36 PolarHBondContact O-N 3.23Å; K36-D38 VanDerWaalsContact C-N 3.28Å; K36-E62 IonicContact NZ-OE1 2.64Å; K36-E62 PolarHBondContact NZ-OE1 2.7Å; K36-E62 IonicContact NZ-OE2 2.89Å; K36-E62 PolarHBondContact NZ-OE2 3.02Å; K36-T128 HydrophobicContact CD-CG2 4.26Å; K36-T128 PolarHBondContact NZ-OG1 3.44Å
37	A	58.9	Low	71	Confident	87 Å²	87	80.1 Å²	80.1	72%	0.719	44%	0.441	S	S	*	.			trans	-69	-28.2	176.7	0	0	0	0	0	112.6	A35	A35-A37 PolarHBondContact O-N 2.82Å
38	D	76.3	Confident	72.7	Confident	143 Å²	143	77.3 Å²	77.3	77%	0.765	44%	0.437	S	S	*	.	S	Bend	trans	-93.5	136.4	179.4	-78	-33.4	0	0	0	112	K36	K36-D38 VanDerWaalsContact C-N 3.28Å
39	G	87.3	Confident	74.4	Confident	38 Å²	38	74.2 Å²	74.2	39%	0.392	42%	0.421	S	S	.	.			trans	-64.1	-165.6	168.5	0	0	0	0	0	112.3	L53	G39-L53 CarbonylContact C-O 3.43Å; G39-L53 WeakPolarHBondContact CA-O 3.31Å
40	A	90.6	Very high	76.3	Confident	12 Å²	12	75.9 Å²	75.9	10%	0.099	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.1	174	0	0	0	0	0	110.4	L53 V58 V127	A40-L53 HydrophobicContact CB-CB 4.32Å; A40-L53 PolarHBondContact N-O 2.95Å; A40-L53 PolarHBondContact O-N 2.73Å; A40-V58 HydrophobicContact CB-CG2 3.7Å; A40-V127 HydrophobicContact CB-CG1 3.6Å; A40-V127 WeakPolarHBondContact CB-O 3.43Å
41	Y	91.7	Very high	78.3	Confident	133 Å²	133	73 Å²	73	52%	0.522	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.4	168.3	-175.5	-108.8	0	0	0	108.9	Y43 S50 S52 S131	Y41-Y43 HydrophobicContact CE1-CG 4.44Å; Y41-S50 VanDerWaalsContact OH-CB 3.32Å; Y41-S50 WeakPolarHBondContact OH-CB 3.49Å; Y41-S52 WeakPolarHBondContact CD2-OG 3.39Å; Y41-S131 WeakPolarHBondContact O-CB 3.29Å
42	L	92	Very high	80.2	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.6	177	-75.2	147.5	0	0	0	107.8	S50 L51 L134 L188 F191	L42-S50 CarbonylContact O-C 3.46Å; L42-S50 WeakPolarHBondContact O-CA 3.45Å; L42-L51 HydrophobicContact CB-CB 4.18Å; L42-L51 HydrophobicContact CD1-CB 4.49Å; L42-L51 HydrophobicContact CD1-CD2 3.8Å; L42-L51 HydrophobicContact CD1-CG 4.35Å; L42-L51 PolarHBondContact N-O 2.82Å; L42-L51 PolarHBondContact O-N 2.98Å; L42-L134 HydrophobicContact CD1-CD2 4.29Å; L42-L134 HydrophobicContact CD2-CB 4.03Å; L42-L134 HydrophobicContact CD2-CD2 4.05Å; L42-L134 HydrophobicContact CD2-CG 4.49Å; L42-L188 HydrophobicContact CD1-CD1 4.29Å; L42-F191 HydrophobicContact CB-CE1 3.88Å; L42-F191 HydrophobicContact CB-CZ 4.01Å
43	Y	92.6	Very high	82.3	Confident	74 Å²	74	67 Å²	67	29%	0.29	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.8	177.1	-177.3	-119.2	0	0	0	110.6	Y41 E45 R49	Y41-Y43 HydrophobicContact CE1-CG 4.44Å; Y43-E45 HydrophobicContact CD1-CG 4.25Å; Y43-E45 WeakPolarHBondContact CD1-OE1 3.5Å; Y43-E45 HydrophobicContact CE1-CG 4.05Å; Y43-E45 WeakPolarHBondContact CE1-OE1 3.26Å; Y43-R49 WeakPolarHBondContact CD2-O 3.19Å
44	S	93.8	Very high	84.5	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.014	40%	0.398	C	S	.	.			trans	-116.9	104	173.9	-179	0	0	0	0	109	V46 S47 G48 R49 V135 E195	S44-V46 PolarHBondContact O-N 2.89Å; S44-V46 VanDerWaalsContact O-N 3.14Å; S44-S47 VanDerWaalsContact CB-OG 3.3Å; S44-S47 WeakPolarHBondContact CB-OG 3.32Å; S44-S47 PolarHBondContact O-N 2.94Å; S44-S47 PolarHBondContact OG-N 2.91Å; S44-S47 PolarHBondContact OG-OG 3.35Å; S44-G48 WeakPolarHBondContact O-CA 3.26Å; S44-G48 PolarHBondContact O-N 2.75Å; S44-R49 PolarHBondContact N-O 2.74Å; S44-V135 WeakPolarHBondContact OG-CG1 3.09Å; S44-E195 VanDerWaalsContact CB-OE2 3.24Å; S44-E195 WeakPolarHBondContact CB-OE2 3.3Å; S44-E195 PolarHBondContact OG-OE2 3.08Å
45	E	92.5	Very high	86.6	Confident	156 Å²	156	62.6 Å²	62.6	73%	0.729	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-34.2	173.7	-65.9	-67.9	162.4	0	0	112.1	Y43	Y43-E45 HydrophobicContact CD1-CG 4.25Å; Y43-E45 WeakPolarHBondContact CD1-OE1 3.5Å; Y43-E45 HydrophobicContact CE1-CG 4.05Å; Y43-E45 WeakPolarHBondContact CE1-OE1 3.26Å
46	V	92	Very high	88.8	Confident	87 Å²	87	65.2 Å²	65.2	53%	0.527	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-33	-173.4	-171.7	0	0	0	0	112.8	S44 R139	S44-V46 PolarHBondContact O-N 2.89Å; S44-V46 VanDerWaalsContact O-N 3.14Å; V46-R139 VanDerWaalsContact CG1-NH2 3.31Å
47	S	94	Very high	90.8	Very high	25 Å²	25	63 Å²	63	18%	0.175	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-9.4	179.3	72.9	0	0	0	0	113.4	S44 R49 E195	S44-S47 VanDerWaalsContact CB-OG 3.3Å; S44-S47 WeakPolarHBondContact CB-OG 3.32Å; S44-S47 PolarHBondContact O-N 2.94Å; S44-S47 PolarHBondContact OG-N 2.91Å; S44-S47 PolarHBondContact OG-OG 3.35Å; S47-R49 PolarHBondContact O-N 3.02Å; S47-R49 WeakPolarHBondContact OG-CB 3.4Å; S47-R49 PolarHBondContact OG-N 2.77Å; S47-R49 PolarHBondContact OG-NE 2.84Å; S47-E195 WeakPolarHBondContact CB-OE1 3.16Å; S47-E195 VanDerWaalsContact OG-CD 3.3Å; S47-E195 PolarHBondContact OG-OE1 3.12Å; S47-E195 PolarHBondContact OG-OE2 2.76Å
48	G	94.8	Very high	92.5	Very high	46 Å²	46	59 Å²	59	47%	0.474	33%	0.325	S	S	.	.			trans	67.4	5.5	-171.9	0	0	0	0	0	114.4	S44	S44-G48 WeakPolarHBondContact O-CA 3.26Å; S44-G48 PolarHBondContact O-N 2.75Å
49	R	95.4	Very high	93.3	Very high	83 Å²	83	52.4 Å²	52.4	31%	0.313	29%	0.29	S	S	.	.			trans	-86.6	147	-177.2	-72.2	-176.7	-69.2	-118.8	-3.1	112.1	Y43 S44 S47 F191 A194 E195	Y43-R49 WeakPolarHBondContact CD2-O 3.19Å; S44-R49 PolarHBondContact N-O 2.74Å; S47-R49 PolarHBondContact O-N 3.02Å; S47-R49 WeakPolarHBondContact OG-CB 3.4Å; S47-R49 PolarHBondContact OG-N 2.77Å; S47-R49 PolarHBondContact OG-NE 2.84Å; R49-F191 HydrophobicContact CB-CE2 4.07Å; R49-A194 PolarHBondContact NH2-O 3.09Å; R49-E195 IonicContact CZ-OE1 2.79Å; R49-E195 VanDerWaalsContact CZ-OE1 3.24Å; R49-E195 IonicContact NE-OE1 3.99Å; R49-E195 PolarHBondContact NE-OE1 3.1Å; R49-E195 IonicContact NH2-OE1 2.89Å; R49-E195 PolarHBondContact NH2-OE1 3.04Å
50	S	94.7	Very high	93.6	Very high	64 Å²	64	51.3 Å²	51.3	45%	0.448	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.4	172.5	61.3	0	0	0	0	112.4	Y41 L42	Y41-S50 VanDerWaalsContact OH-CB 3.32Å; Y41-S50 WeakPolarHBondContact OH-CB 3.49Å; L42-S50 CarbonylContact O-C 3.46Å; L42-S50 WeakPolarHBondContact O-CA 3.45Å
51	L	95	Very high	93.9	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.094	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.2	166.2	167.2	67.8	0	0	0	109.1	L42 L53 K187 L188 F191	L42-L51 HydrophobicContact CB-CB 4.18Å; L42-L51 HydrophobicContact CD1-CB 4.49Å; L42-L51 HydrophobicContact CD1-CD2 3.8Å; L42-L51 HydrophobicContact CD1-CG 4.35Å; L42-L51 PolarHBondContact N-O 2.82Å; L42-L51 PolarHBondContact O-N 2.98Å; L51-L53 HydrophobicContact CD1-CD2 4.13Å; L51-L53 HydrophobicContact CD1-CG 4.3Å; L51-L53 HydrophobicContact CD2-CD1 4.08Å; L51-L53 HydrophobicContact CD2-CD2 4.29Å; L51-L53 HydrophobicContact CD2-CG 4.05Å; L51-L53 HydrophobicContact CG-CD2 4.38Å; L51-L53 HydrophobicContact CG-CG 4.05Å; L51-K187 HydrophobicContact CD1-CB 4.19Å; L51-L188 HydrophobicContact CD2-CD1 4.13Å; L51-F191 HydrophobicContact CB-CB 3.94Å; L51-F191 HydrophobicContact CB-CD1 4.22Å; L51-F191 HydrophobicContact CB-CD2 3.57Å; L51-F191 HydrophobicContact CB-CE2 4.1Å; L51-F191 HydrophobicContact CB-CG 3.63Å; L51-F191 HydrophobicContact CD2-CB 3.74Å; L51-F191 HydrophobicContact CD2-CD1 4.3Å; L51-F191 HydrophobicContact CD2-CG 4.06Å; L51-F191 HydrophobicContact CG-CB 4.33Å; L51-F191 HydrophobicContact CG-CG 4.45Å
52	S	94.1	Very high	93.9	Very high	79 Å²	79	45.4 Å²	45.4	55%	0.552	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	125.2	168.9	-53.6	0	0	0	0	109.6	Y41	Y41-S52 WeakPolarHBondContact CD2-OG 3.39Å
53	L	94.4	Very high	93.9	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.6	171.7	-65.6	170	0	0	0	108.7	G39 A40 L51 E57 V58 I61 V127 K187 L188	G39-L53 CarbonylContact C-O 3.43Å; G39-L53 WeakPolarHBondContact CA-O 3.31Å; A40-L53 HydrophobicContact CB-CB 4.32Å; A40-L53 PolarHBondContact N-O 2.95Å; A40-L53 PolarHBondContact O-N 2.73Å; L51-L53 HydrophobicContact CD1-CD2 4.13Å; L51-L53 HydrophobicContact CD1-CG 4.3Å; L51-L53 HydrophobicContact CD2-CD1 4.08Å; L51-L53 HydrophobicContact CD2-CD2 4.29Å; L51-L53 HydrophobicContact CD2-CG 4.05Å; L51-L53 HydrophobicContact CG-CD2 4.38Å; L51-L53 HydrophobicContact CG-CG 4.05Å; L53-E57 HydrophobicContact CB-CB 4.3Å; L53-E57 HydrophobicContact CD2-CB 4.11Å; L53-V58 HydrophobicContact CB-CG2 3.79Å; L53-V58 HydrophobicContact CD1-CG2 4.46Å; L53-I61 HydrophobicContact CD1-CD1 3.93Å; L53-I61 HydrophobicContact CD2-CD1 4.4Å; L53-V127 HydrophobicContact CD1-CG1 3.61Å; L53-K187 HydrophobicContact CD2-CB 4.19Å; L53-K187 HydrophobicContact CD2-CD 4.4Å; L53-L188 HydrophobicContact CD1-CD1 4.47Å
54	T	94.3	Very high	94.1	Very high	79 Å²	79	43.4 Å²	43.4	49%	0.485	24%	0.244	S	C	.	.			trans	-65.3	156.6	171	60.3	0	0	0	0	110.7	R56 E57 V58	T54-R56 PolarHBondContact O-N 3.01Å; T54-R56 VanDerWaalsContact O-N 3.09Å; T54-E57 PolarHBondContact N-OE2 3.25Å; T54-E57 PolarHBondContact O-N 3.2Å; T54-E57 VanDerWaalsContact OG1-CG 3.28Å; T54-E57 WeakPolarHBondContact OG1-CG 3.43Å; T54-E57 PolarHBondContact OG1-N 3.4Å; T54-E57 PolarHBondContact OG1-OE2 3.31Å; T54-V58 WeakPolarHBondContact O-CG2 3.38Å; T54-V58 PolarHBondContact O-N 3.43Å
55	A	92.5	Very high	94.1	Very high	32 Å²	32	44 Å²	44	26%	0.264	25%	0.246	S	C	.	.	H	α-helix	trans	-52.2	-35.8	174.3	0	0	0	0	0	112	G59	A55-G59 PolarHBondContact O-N 3.21Å
56	R	94.2	Very high	94.1	Very high	130 Å²	130	41 Å²	41	49%	0.491	23%	0.233	S	C	.	.	H	α-helix	trans	-65.4	-44.7	174.8	-174	175.2	-175.1	-131.3	-2.2	113.2	W33 T54 G59 L60	W33-R56 HydrophobicContact CH2-CG 4.36Å; W33-R56 HydrophobicContact CZ2-CB 4.33Å; W33-R56 HydrophobicContact CZ2-CG 4.17Å; T54-R56 PolarHBondContact O-N 3.01Å; T54-R56 VanDerWaalsContact O-N 3.09Å; R56-G59 PolarHBondContact O-N 3.48Å; R56-L60 HydrophobicContact CG-CD1 4.28Å; R56-L60 WeakPolarHBondContact O-CB 3.49Å; R56-L60 VanDerWaalsContact O-CG 3.26Å; R56-L60 WeakPolarHBondContact O-CG 3.16Å; R56-L60 PolarHBondContact O-N 3.46Å
57	E	95.6	Very high	94.2	Very high	28 Å²	28	39 Å²	39	13%	0.131	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-40.9	178.3	-73.2	164.6	137.3	0	0	111.6	L53 T54 L60 I61 A184 K187	L53-E57 HydrophobicContact CB-CB 4.3Å; L53-E57 HydrophobicContact CD2-CB 4.11Å; T54-E57 PolarHBondContact N-OE2 3.25Å; T54-E57 PolarHBondContact O-N 3.2Å; T54-E57 VanDerWaalsContact OG1-CG 3.28Å; T54-E57 WeakPolarHBondContact OG1-CG 3.43Å; T54-E57 PolarHBondContact OG1-N 3.4Å; T54-E57 PolarHBondContact OG1-OE2 3.31Å; E57-L60 PolarHBondContact O-N 2.92Å; E57-I61 WeakPolarHBondContact O-CD1 3.49Å; E57-I61 WeakPolarHBondContact O-CG1 3.35Å; E57-I61 PolarHBondContact O-N 2.92Å; E57-A184 HydrophobicContact CB-CB 4.03Å; E57-A184 HydrophobicContact CG-CB 4.15Å; E57-K187 WeakPolarHBondContact OE1-CD 3.4Å; E57-K187 WeakPolarHBondContact OE1-CE 3.38Å; E57-K187 IonicContact OE1-NZ 3.77Å; E57-K187 PolarHBondContact OE1-NZ 2.92Å; E57-K187 IonicContact OE2-NZ 2.74Å
58	V	94.1	Very high	94.1	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-50.4	172.8	174.5	0	0	0	0	110.3	A40 L53 T54 L60 I61 E62 V127 T128	A40-V58 HydrophobicContact CB-CG2 3.7Å; L53-V58 HydrophobicContact CB-CG2 3.79Å; L53-V58 HydrophobicContact CD1-CG2 4.46Å; T54-V58 WeakPolarHBondContact O-CG2 3.38Å; T54-V58 PolarHBondContact O-N 3.43Å; V58-L60 VanDerWaalsContact C-N 3.33Å; V58-L60 PolarHBondContact O-N 2.89Å; V58-I61 PolarHBondContact O-N 3.38Å; V58-E62 PolarHBondContact O-N 2.8Å; V58-V127 HydrophobicContact CG1-CG1 4.27Å; V58-V127 HydrophobicContact CG2-CG1 3.93Å; V58-T128 HydrophobicContact CG1-CG2 3.31Å
59	G	92.8	Very high	93.9	Very high	4 Å²	4	40 Å²	40	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-40.2	178.6	0	0	0	0	0	112.9	W33 A55 R56 Q63	W33-G59 VanDerWaalsContact CZ3-C 3.43Å; A55-G59 PolarHBondContact O-N 3.21Å; R56-G59 PolarHBondContact O-N 3.48Å; G59-Q63 WeakPolarHBondContact O-CB 3.36Å; G59-Q63 PolarHBondContact O-N 2.7Å
60	L	95.2	Very high	93.8	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-42.7	175	-74	169.3	0	0	0	112.2	R56 E57 V58 S64 Q180 V181 A184	R56-L60 HydrophobicContact CG-CD1 4.28Å; R56-L60 WeakPolarHBondContact O-CB 3.49Å; R56-L60 VanDerWaalsContact O-CG 3.26Å; R56-L60 WeakPolarHBondContact O-CG 3.16Å; R56-L60 PolarHBondContact O-N 3.46Å; E57-L60 PolarHBondContact O-N 2.92Å; V58-L60 VanDerWaalsContact C-N 3.33Å; V58-L60 PolarHBondContact O-N 2.89Å; L60-S64 WeakPolarHBondContact O-CB 3.42Å; L60-S64 PolarHBondContact O-N 3.03Å; L60-S64 PolarHBondContact O-OG 2.89Å; L60-Q180 HydrophobicContact CD1-CB 3.84Å; L60-V181 HydrophobicContact CB-CG2 4.33Å; L60-V181 HydrophobicContact CD2-CG2 3.88Å; L60-A184 HydrophobicContact CB-CB 4.37Å
61	I	95.8	Very high	93.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-52	178.8	-70	158	0	0	0	110.6	L53 E57 V58 S64 W65 A124 V127 A184 W185 L188	L53-I61 HydrophobicContact CD1-CD1 3.93Å; L53-I61 HydrophobicContact CD2-CD1 4.4Å; E57-I61 WeakPolarHBondContact O-CD1 3.49Å; E57-I61 WeakPolarHBondContact O-CG1 3.35Å; E57-I61 PolarHBondContact O-N 2.92Å; V58-I61 PolarHBondContact O-N 3.38Å; I61-S64 PolarHBondContact O-OG 3.36Å; I61-W65 WeakPolarHBondContact O-CB 3.41Å; I61-W65 PolarHBondContact O-N 3.5Å; I61-A124 HydrophobicContact CG2-CB 4.35Å; I61-V127 HydrophobicContact CG2-CG2 4.25Å; I61-A184 HydrophobicContact CD1-CB 4.09Å; I61-A184 HydrophobicContact CG1-CB 3.85Å; I61-W185 HydrophobicContact CG1-CG 4.45Å; I61-W185 HydrophobicContact CG2-CD2 4.49Å; I61-W185 HydrophobicContact CG2-CH2 4.47Å; I61-W185 HydrophobicContact CG2-CZ2 3.97Å; I61-L188 HydrophobicContact CD1-CB 4.14Å; I61-L188 HydrophobicContact CD1-CD2 4.11Å; I61-L188 HydrophobicContact CG2-CD2 3.96Å
62	E	92.7	Very high	93.5	Very high	21 Å²	21	43.7 Å²	43.7	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-64.4	-45.5	-178	-70.8	-178	164.2	0	0	111.3	F29 K36 V58 W65 M66 T128	F29-E62 HydrophobicContact CE2-CB 3.93Å; F29-E62 HydrophobicContact CZ-CB 3.77Å; K36-E62 IonicContact NZ-OE1 2.64Å; K36-E62 PolarHBondContact NZ-OE1 2.7Å; K36-E62 IonicContact NZ-OE2 2.89Å; K36-E62 PolarHBondContact NZ-OE2 3.02Å; V58-E62 PolarHBondContact O-N 2.8Å; E62-W65 PolarHBondContact O-N 3.03Å; E62-M66 WeakPolarHBondContact O-CB 3.43Å; E62-M66 VanDerWaalsContact O-CG 3.26Å; E62-M66 WeakPolarHBondContact O-CG 3.28Å; E62-M66 PolarHBondContact O-N 3.43Å; E62-T128 VanDerWaalsContact OE1-CG2 3.3Å; E62-T128 WeakPolarHBondContact OE1-CG2 3.26Å; E62-T128 PolarHBondContact OE1-OG1 3.05Å
63	Q	92.3	Very high	93.5	Very high	31 Å²	31	44 Å²	44	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-66.1	-48.1	-178.7	-172.2	171.1	-2.3	0	0	111.9	F29 G59 W65 M66 E67	F29-Q63 HydrophobicContact CD1-CB 3.93Å; F29-Q63 HydrophobicContact CD1-CG 4.08Å; F29-Q63 HydrophobicContact CE1-CB 3.6Å; F29-Q63 HydrophobicContact CE1-CG 4.26Å; F29-Q63 HydrophobicContact CZ-CB 4.13Å; G59-Q63 WeakPolarHBondContact O-CB 3.36Å; G59-Q63 PolarHBondContact O-N 2.7Å; Q63-W65 PolarHBondContact O-N 2.8Å; Q63-M66 PolarHBondContact O-N 3.49Å; Q63-M66 VanDerWaalsContact O-N 3.08Å; Q63-E67 HydrophobicContact CG-CG 4.2Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.07Å; Q63-E67 PolarHBondContact NE2-OE1 3.17Å; Q63-E67 WeakPolarHBondContact O-CB 3.43Å; Q63-E67 WeakPolarHBondContact O-CG 3.34Å; Q63-E67 PolarHBondContact O-N 3.49Å
64	S	95.7	Very high	93.6	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.014	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-37.5	179.7	57	0	0	0	0	111.9	L60 I61 I68 W185	L60-S64 WeakPolarHBondContact O-CB 3.42Å; L60-S64 PolarHBondContact O-N 3.03Å; L60-S64 PolarHBondContact O-OG 2.89Å; I61-S64 PolarHBondContact O-OG 3.36Å; S64-I68 WeakPolarHBondContact O-CD1 3.36Å; S64-I68 WeakPolarHBondContact O-CG1 3.26Å; S64-I68 PolarHBondContact O-N 2.63Å; S64-W185 PolarHBondContact OG-NE1 2.98Å
65	W	95	Very high	93.6	Very high	16 Å²	16	40 Å²	40	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-41	173.5	-171.5	-115.6	0	0	0	113.5	I61 E62 Q63 I68 K71 L74 L120 G121 A124 W185	I61-W65 WeakPolarHBondContact O-CB 3.41Å; I61-W65 PolarHBondContact O-N 3.5Å; E62-W65 PolarHBondContact O-N 3.03Å; Q63-W65 PolarHBondContact O-N 2.8Å; W65-I68 HydrophobicContact CE3-CD1 3.97Å; W65-I68 HydrophobicContact CZ3-CD1 4.38Å; W65-I68 PolarHBondContact O-N 3.27Å; W65-K71 HydrophobicContact CH2-CB 4.46Å; W65-K71 HydrophobicContact CH2-CD 4.22Å; W65-K71 HydrophobicContact CH2-CG 4.19Å; W65-K71 HydrophobicContact CZ2-CD 3.6Å; W65-K71 HydrophobicContact CZ2-CG 4.08Å; W65-K71 VanDerWaalsContact NE1-CE 3.33Å; W65-K71 WeakPolarHBondContact O-CE 3.15Å; W65-K71 PolarHBondContact O-NZ 2.9Å; W65-L74 HydrophobicContact CZ3-CD2 3.99Å; W65-L120 HydrophobicContact CH2-CB 3.66Å; W65-L120 HydrophobicContact CZ2-CB 4.44Å; W65-L120 HydrophobicContact CZ3-CB 3.77Å; W65-L120 HydrophobicContact CZ3-CD1 4.42Å; W65-G121 VanDerWaalsContact CZ2-CA 3.41Å; W65-A124 HydrophobicContact CB-CB 3.64Å; W65-A124 HydrophobicContact CD2-CB 4.02Å; W65-A124 HydrophobicContact CG-CB 3.44Å; W65-A124 VanDerWaalsContact CG-CB 3.44Å; W65-W185 HydrophobicContact CB-CZ2 4.17Å; W65-W185 HydrophobicContact CE3-CH2 4.19Å; W65-W185 HydrophobicContact CE3-CZ2 4.25Å
66	M	92.4	Very high	93.8	Very high	93 Å²	93	41.6 Å²	41.6	46%	0.458	19%	0.194	S	C	.	.	H	α-helix	trans	-71.4	-30	-179.6	-75.6	-62.2	-65.7	0	0	113.2	R25 E62 Q63 I68	R25-M66 PolarHBondContact NH1-O 2.95Å; E62-M66 WeakPolarHBondContact O-CB 3.43Å; E62-M66 VanDerWaalsContact O-CG 3.26Å; E62-M66 WeakPolarHBondContact O-CG 3.28Å; E62-M66 PolarHBondContact O-N 3.43Å; Q63-M66 PolarHBondContact O-N 3.49Å; Q63-M66 VanDerWaalsContact O-N 3.08Å; M66-I68 VanDerWaalsContact C-N 3.34Å
67	E	92.6	Very high	93.9	Very high	43 Å²	43	37.4 Å²	37.4	20%	0.201	18%	0.18	C	C	.	.	H	α-helix	trans	-76.4	-19.8	178.2	-72.6	-171.2	-174.9	0	0	113.1	R26 Q63 E69	R26-E67 WeakPolarHBondContact CG-OE1 3.39Å; R26-E67 IonicContact CZ-OE1 3.38Å; R26-E67 IonicContact CZ-OE2 3.82Å; R26-E67 IonicContact NE-OE1 3.41Å; R26-E67 PolarHBondContact NE-OE1 3.3Å; R26-E67 IonicContact NE-OE2 2.69Å; R26-E67 IonicContact NH2-OE1 2.67Å; R26-E67 PolarHBondContact NH2-OE1 3.14Å; R26-E67 IonicContact NH2-OE2 2.72Å; R26-E67 PolarHBondContact NH2-OE2 3.48Å; Q63-E67 HydrophobicContact CG-CG 4.2Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.07Å; Q63-E67 PolarHBondContact NE2-OE1 3.17Å; Q63-E67 WeakPolarHBondContact O-CB 3.43Å; Q63-E67 WeakPolarHBondContact O-CG 3.34Å; Q63-E67 PolarHBondContact O-N 3.49Å; E67-E69 PolarHBondContact O-N 3.18Å; E67-E69 VanDerWaalsContact O-N 3.12Å
68	I	93.5	Very high	94	Very high	10 Å²	10	36 Å²	36	5%	0.051	17%	0.173	C	C	.	.			trans	-68.5	108.8	171.7	-66.2	155.8	0	0	0	109.3	S64 W65 M66 K71 L74 K172	S64-I68 WeakPolarHBondContact O-CD1 3.36Å; S64-I68 WeakPolarHBondContact O-CG1 3.26Å; S64-I68 PolarHBondContact O-N 2.63Å; W65-I68 HydrophobicContact CE3-CD1 3.97Å; W65-I68 HydrophobicContact CZ3-CD1 4.38Å; W65-I68 PolarHBondContact O-N 3.27Å; M66-I68 VanDerWaalsContact C-N 3.34Å; I68-K71 HydrophobicContact CG2-CG 3.93Å; I68-K71 PolarHBondContact O-NZ 3.19Å; I68-L74 HydrophobicContact CD1-CD1 3.48Å; I68-L74 VanDerWaalsContact CD1-CD1 3.48Å; I68-L74 HydrophobicContact CG1-CD1 3.99Å; I68-L74 HydrophobicContact CG2-CB 4.11Å; I68-L74 HydrophobicContact CG2-CD1 4.15Å; I68-K172 HydrophobicContact CG1-CB 4.26Å; I68-K172 HydrophobicContact CG1-CG 4.42Å
69	E	90.2	Very high	94	Very high	84 Å²	84	36.1 Å²	36.1	39%	0.393	17%	0.173	S	C	.	.	S	Bend	trans	-65.3	-54.9	176.8	-80.7	179.6	-158.5	0	0	111.6	K18 R22 E67	K18-E69 IonicContact NZ-OE2 3.82Å; K18-E69 PolarHBondContact NZ-OE2 2.89Å; R22-E69 IonicContact CZ-OE1 3.73Å; R22-E69 IonicContact NE-OE1 3.74Å; R22-E69 PolarHBondContact NE-OE1 3.09Å; R22-E69 VanDerWaalsContact NH2-CD 3.3Å; R22-E69 IonicContact NH2-OE1 2.74Å; R22-E69 PolarHBondContact NH2-OE1 3.18Å; R22-E69 IonicContact NH2-OE2 2.98Å; E67-E69 PolarHBondContact O-N 3.18Å; E67-E69 VanDerWaalsContact O-N 3.12Å
70	D	93	Very high	94.2	Very high	92 Å²	92	38.8 Å²	38.8	49%	0.492	18%	0.182	S	C	.	.			trans	-107.4	96	-176.1	-164.5	-24.8	0	0	0	110.2	D72 E73 L74	D70-D72 PolarHBondContact OD1-N 3.47Å; D70-E73 HydrophobicContact CB-CB 3.91Å; D70-E73 VanDerWaalsContact CG-CB 3.4Å; D70-E73 PolarHBondContact OD1-N 3.29Å; D70-L74 PolarHBondContact O-N 2.96Å; D70-L74 VanDerWaalsContact O-N 3.15Å
71	K	91.7	Very high	94.3	Very high	57 Å²	57	42.3 Å²	42.3	25%	0.248	19%	0.194	C	C	.	.	H	α-helix	trans	-75.7	-27.6	-179.6	-70	173	169.9	59.4	0	112.1	W65 I68 G75	W65-K71 HydrophobicContact CH2-CB 4.46Å; W65-K71 HydrophobicContact CH2-CD 4.22Å; W65-K71 HydrophobicContact CH2-CG 4.19Å; W65-K71 HydrophobicContact CZ2-CD 3.6Å; W65-K71 HydrophobicContact CZ2-CG 4.08Å; W65-K71 VanDerWaalsContact NE1-CE 3.33Å; W65-K71 WeakPolarHBondContact O-CE 3.15Å; W65-K71 PolarHBondContact O-NZ 2.9Å; I68-K71 HydrophobicContact CG2-CG 3.93Å; I68-K71 PolarHBondContact O-NZ 3.19Å; K71-G75 PolarHBondContact O-N 3.15Å
72	D	91.5	Very high	94.2	Very high	93 Å²	93	42.3 Å²	42.3	50%	0.497	20%	0.195	S	C	.	.	H	α-helix	trans	-72	-40.9	176.9	-72.9	-19.9	0	0	0	109.9	D70 G75 R76	D70-D72 PolarHBondContact OD1-N 3.47Å; D72-G75 PolarHBondContact O-N 2.84Å; D72-R76 WeakPolarHBondContact O-CB 3.47Å; D72-R76 PolarHBondContact O-N 2.91Å
73	E	94.5	Very high	94.3	Very high	84 Å²	84	41.4 Å²	41.4	39%	0.393	19%	0.19	S	C	.	.	H	α-helix	trans	-66.4	-39.7	174.1	-173.2	55.2	-155.9	0	0	112.4	D70 G75 R76 E77	D70-E73 HydrophobicContact CB-CB 3.91Å; D70-E73 VanDerWaalsContact CG-CB 3.4Å; D70-E73 PolarHBondContact OD1-N 3.29Å; E73-G75 PolarHBondContact O-N 2.81Å; E73-R76 WeakPolarHBondContact O-CB 3.39Å; E73-R76 PolarHBondContact O-N 3.19Å; E73-R76 WeakPolarHBondContact OE2-CD 3.21Å; E73-R76 IonicContact OE2-CZ 3.5Å; E73-R76 IonicContact OE2-NE 2.77Å; E73-R76 PolarHBondContact OE2-NE 2.98Å; E73-E77 WeakPolarHBondContact O-CB 3.46Å; E73-E77 PolarHBondContact O-N 3Å
74	L	95.6	Very high	94.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-46.6	172.3	178.3	128.5	0	0	0	111.7	W65 I68 D70 R76 E77 V78 L120 V168 I169 K172	W65-L74 HydrophobicContact CZ3-CD2 3.99Å; I68-L74 HydrophobicContact CD1-CD1 3.48Å; I68-L74 VanDerWaalsContact CD1-CD1 3.48Å; I68-L74 HydrophobicContact CG1-CD1 3.99Å; I68-L74 HydrophobicContact CG2-CB 4.11Å; I68-L74 HydrophobicContact CG2-CD1 4.15Å; D70-L74 PolarHBondContact O-N 2.96Å; D70-L74 VanDerWaalsContact O-N 3.15Å; L74-R76 VanDerWaalsContact C-N 3.26Å; L74-R76 PolarHBondContact O-N 2.95Å; L74-E77 PolarHBondContact O-N 2.81Å; L74-V78 WeakPolarHBondContact O-CG2 3.32Å; L74-V78 PolarHBondContact O-N 3.32Å; L74-L120 HydrophobicContact CD2-CD1 4.09Å; L74-V168 HydrophobicContact CD1-CG1 3.98Å; L74-V168 HydrophobicContact CG-CG1 3.94Å; L74-I169 HydrophobicContact CD1-CG1 4.24Å; L74-I169 HydrophobicContact CD2-CG1 4.3Å; L74-K172 HydrophobicContact CD1-CG 3.77Å
75	G	94.8	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-40.2	175.7	0	0	0	0	0	111.8	K71 D72 E73 V78 F79 L113	K71-G75 PolarHBondContact O-N 3.15Å; D72-G75 PolarHBondContact O-N 2.84Å; E73-G75 PolarHBondContact O-N 2.81Å; G75-V78 PolarHBondContact O-N 2.81Å; G75-F79 WeakPolarHBondContact O-CB 3.35Å; G75-F79 PolarHBondContact O-N 2.86Å; G75-L113 WeakPolarHBondContact O-CD1 3.4Å
76	R	96.1	Very high	94.3	Very high	65 Å²	65	47.3 Å²	47.3	25%	0.245	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-47.3	179.7	-173.5	-165.2	-51.3	-70.9	-5.5	110.4	D72 E73 L74 F79 R80 D104 F109 L113	D72-R76 WeakPolarHBondContact O-CB 3.47Å; D72-R76 PolarHBondContact O-N 2.91Å; E73-R76 WeakPolarHBondContact O-CB 3.39Å; E73-R76 PolarHBondContact O-N 3.19Å; E73-R76 WeakPolarHBondContact OE2-CD 3.21Å; E73-R76 IonicContact OE2-CZ 3.5Å; E73-R76 IonicContact OE2-NE 2.77Å; E73-R76 PolarHBondContact OE2-NE 2.98Å; L74-R76 VanDerWaalsContact C-N 3.26Å; L74-R76 PolarHBondContact O-N 2.95Å; R76-F79 PolarHBondContact O-N 2.97Å; R76-R80 HydrophobicContact CG-CG 4.4Å; R76-R80 WeakPolarHBondContact O-CB 3.48Å; R76-R80 WeakPolarHBondContact O-CG 3.46Å; R76-R80 PolarHBondContact O-N 3.26Å; R76-D104 WeakPolarHBondContact CD-OD1 3.48Å; R76-D104 WeakPolarHBondContact CG-OD1 3.41Å; R76-D104 IonicContact CZ-OD1 3.7Å; R76-D104 IonicContact NE-OD1 3.16Å; R76-D104 IonicContact NH1-OD1 3.35Å; R76-D104 PolarHBondContact NH1-OD1 3.44Å; R76-F109 HydrophobicContact CG-CE1 4.28Å; R76-F109 HydrophobicContact CG-CZ 4.2Å; R76-L113 HydrophobicContact CB-CD1 4.29Å; R76-L113 HydrophobicContact CB-CD2 4.18Å
77	E	96.9	Very high	94.3	Very high	41 Å²	41	49.9 Å²	49.9	19%	0.192	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-46.3	177.6	-177.4	170.9	-171.1	0	0	111.7	E73 L74 F79 R81 V168 K172	E73-E77 WeakPolarHBondContact O-CB 3.46Å; E73-E77 PolarHBondContact O-N 3Å; L74-E77 PolarHBondContact O-N 2.81Å; E77-F79 PolarHBondContact O-N 3.48Å; E77-R81 WeakPolarHBondContact O-CB 3.43Å; E77-R81 VanDerWaalsContact O-CG 3.26Å; E77-R81 WeakPolarHBondContact O-CG 3.48Å; E77-R81 PolarHBondContact O-N 2.91Å; E77-R81 IonicContact OE1-CZ 2.76Å; E77-R81 IonicContact OE1-NE 3.02Å; E77-R81 PolarHBondContact OE1-NE 3.48Å; E77-R81 IonicContact OE1-NH2 2.75Å; E77-R81 PolarHBondContact OE1-NH2 3.41Å; E77-V168 HydrophobicContact CB-CG1 4.3Å; E77-V168 HydrophobicContact CG-CG1 4.13Å; E77-V168 HydrophobicContact CG-CG2 4.1Å; E77-K172 WeakPolarHBondContact OE2-CE 3.42Å; E77-K172 IonicContact OE2-NZ 2.91Å; E77-K172 PolarHBondContact OE2-NZ 3.2Å
78	V	96.9	Very high	94.2	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.9	-51.6	174.7	172	0	0	0	0	110.3	L74 G75 R81 V82 L116 I164 M165 V168	L74-V78 WeakPolarHBondContact O-CG2 3.32Å; L74-V78 PolarHBondContact O-N 3.32Å; G75-V78 PolarHBondContact O-N 2.81Å; V78-R81 PolarHBondContact O-N 3.37Å; V78-V82 HydrophobicContact CG1-CG2 4.46Å; V78-V82 WeakPolarHBondContact O-CG2 3.44Å; V78-V82 PolarHBondContact O-N 3Å; V78-L116 HydrophobicContact CB-CD2 4.13Å; V78-L116 HydrophobicContact CG1-CD2 3.72Å; V78-I164 HydrophobicContact CB-CG2 4.49Å; V78-I164 HydrophobicContact CG1-CG2 4.13Å; V78-M165 HydrophobicContact CG1-CG 3.61Å; V78-V168 HydrophobicContact CG2-CB 3.64Å; V78-V168 HydrophobicContact CG2-CG1 3.81Å; V78-V168 HydrophobicContact CG2-CG2 3.85Å
79	F	94.8	Very high	94.1	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-71.8	-39.3	-171.1	-161.2	-137.9	0	0	0	112.2	G75 R76 E77 V82 L83 F93 L95 F109 H112 L116	G75-F79 WeakPolarHBondContact O-CB 3.35Å; G75-F79 PolarHBondContact O-N 2.86Å; R76-F79 PolarHBondContact O-N 2.97Å; E77-F79 PolarHBondContact O-N 3.48Å; F79-V82 PolarHBondContact O-N 3.24Å; F79-L83 HydrophobicContact CD1-CD1 4.1Å; F79-L83 HydrophobicContact CD2-CG 4.41Å; F79-L83 HydrophobicContact CE1-CD1 3.89Å; F79-L83 HydrophobicContact CE2-CD1 4.37Å; F79-L83 HydrophobicContact CE2-CD2 4.22Å; F79-L83 HydrophobicContact CE2-CG 4.23Å; F79-L83 HydrophobicContact CG-CD1 4.4Å; F79-L83 HydrophobicContact CZ-CD1 4.03Å; F79-L83 HydrophobicContact CZ-CD2 4.22Å; F79-L83 HydrophobicContact CZ-CG 4.31Å; F79-L83 VanDerWaalsContact O-CG 3.3Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.37Å; F79-F93 HydrophobicContact CE2-CD1 4.09Å; F79-F93 HydrophobicContact CE2-CD2 4.02Å; F79-F93 AromaticContact CE2-CE1 3.9Å; F79-F93 HydrophobicContact CE2-CE1 3.9Å; F79-F93 AromaticContact CE2-CE2 3.84Å; F79-F93 HydrophobicContact CE2-CE2 3.84Å; F79-F93 HydrophobicContact CE2-CG 4.15Å; F79-F93 AromaticContact CE2-CZ 3.78Å; F79-F93 HydrophobicContact CE2-CZ 3.78Å; F79-F93 HydrophobicContact CZ-CB 4.45Å; F79-F93 AromaticContact CZ-CD1 3.72Å; F79-F93 HydrophobicContact CZ-CD1 3.72Å; F79-F93 HydrophobicContact CZ-CD2 4.18Å; F79-F93 AromaticContact CZ-CE1 3.94Å; F79-F93 HydrophobicContact CZ-CE1 3.94Å; F79-F93 HydrophobicContact CZ-CE2 4.39Å; F79-F93 AromaticContact CZ-CG 3.86Å; F79-F93 HydrophobicContact CZ-CG 3.86Å; F79-F93 HydrophobicContact CZ-CZ 4.27Å; F79-L95 HydrophobicContact CE1-CD1 4.25Å; F79-L95 HydrophobicContact CZ-CD1 4.41Å; F79-F109 HydrophobicContact CB-CE2 4.23Å; F79-F109 HydrophobicContact CB-CZ 4.4Å; F79-F109 AromaticContact CD1-CD2 3.49Å; F79-F109 HydrophobicContact CD1-CD2 3.49Å; F79-F109 VanDerWaalsContact CD1-CD2 3.49Å; F79-F109 AromaticContact CD1-CE2 3.32Å; F79-F109 HydrophobicContact CD1-CE2 3.32Å; F79-F109 HydrophobicContact CD1-CG 4.24Å; F79-F109 AromaticContact CD1-CZ 3.94Å; F79-F109 HydrophobicContact CD1-CZ 3.94Å; F79-F109 AromaticContact CE1-CD2 3.65Å; F79-F109 HydrophobicContact CE1-CD2 3.65Å; F79-F109 AromaticContact CE1-CE2 3.97Å; F79-F109 HydrophobicContact CE1-CE2 3.97Å; F79-F109 HydrophobicContact CE1-CG 4.3Å; F79-F109 HydrophobicContact CG-CE2 4.09Å; F79-H112 HydrophobicContact CD1-CB 4.34Å; F79-H112 HydrophobicContact CE1-CB 3.43Å; F79-H112 VanDerWaalsContact CE1-CB 3.43Å; F79-H112 HydrophobicContact CE2-CB 4.35Å; F79-H112 HydrophobicContact CZ-CB 3.45Å; F79-H112 VanDerWaalsContact CZ-CB 3.45Å; F79-L116 HydrophobicContact CB-CD2 4.02Å; F79-L116 HydrophobicContact CD2-CD2 4.45Å; F79-L116 HydrophobicContact CG-CD2 4.48Å
80	R	96.3	Very high	94.2	Very high	60 Å²	60	50.9 Å²	50.9	23%	0.226	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-50.6	170.6	-75.6	-170.9	68.6	95.2	12.8	110.9	R76 V82 L83 L84 D100 D104 F109	R76-R80 HydrophobicContact CG-CG 4.4Å; R76-R80 WeakPolarHBondContact O-CB 3.48Å; R76-R80 WeakPolarHBondContact O-CG 3.46Å; R76-R80 PolarHBondContact O-N 3.26Å; R80-V82 VanDerWaalsContact C-N 3.3Å; R80-V82 PolarHBondContact O-N 2.96Å; R80-L83 PolarHBondContact O-N 2.84Å; R80-L84 WeakPolarHBondContact O-CB 3.44Å; R80-L84 VanDerWaalsContact O-CG 3.23Å; R80-L84 WeakPolarHBondContact O-CG 3.49Å; R80-L84 PolarHBondContact O-N 3.45Å; R80-D100 PolarHBondContact NH1-O 2.97Å; R80-D100 VanDerWaalsContact NH1-O 3.07Å; R80-D100 PolarHBondContact NH2-O 2.95Å; R80-D104 IonicContact CZ-OD2 3.24Å; R80-D104 IonicContact NH1-OD2 3.22Å; R80-D104 PolarHBondContact NH1-OD2 3.37Å; R80-F109 HydrophobicContact CG-CE2 4.12Å; R80-F109 HydrophobicContact CG-CZ 3.85Å
81	R	97.1	Very high	94.1	Very high	89 Å²	89	49.4 Å²	49.4	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-58.5	-42	179.3	-74.6	-177.9	-173.8	-155.9	9.9	111.7	E77 V78 S85 I164 D167	E77-R81 WeakPolarHBondContact O-CB 3.43Å; E77-R81 VanDerWaalsContact O-CG 3.26Å; E77-R81 WeakPolarHBondContact O-CG 3.48Å; E77-R81 PolarHBondContact O-N 2.91Å; E77-R81 IonicContact OE1-CZ 2.76Å; E77-R81 IonicContact OE1-NE 3.02Å; E77-R81 PolarHBondContact OE1-NE 3.48Å; E77-R81 IonicContact OE1-NH2 2.75Å; E77-R81 PolarHBondContact OE1-NH2 3.41Å; V78-R81 PolarHBondContact O-N 3.37Å; R81-S85 VanDerWaalsContact O-CB 3.24Å; R81-S85 WeakPolarHBondContact O-CB 3.34Å; R81-S85 PolarHBondContact O-N 3.38Å; R81-S85 PolarHBondContact O-OG 2.9Å; R81-I164 HydrophobicContact CB-CD1 4.2Å; R81-I164 HydrophobicContact CB-CG2 3.64Å; R81-D167 IonicContact CZ-OD2 3.13Å; R81-D167 IonicContact NH1-OD2 2.64Å; R81-D167 PolarHBondContact NH1-OD2 2.96Å
82	V	95.2	Very high	94	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-52	176	167	0	0	0	0	111.3	V78 F79 R80 L84 S85 N86 I89 M161 I164	V78-V82 HydrophobicContact CG1-CG2 4.46Å; V78-V82 WeakPolarHBondContact O-CG2 3.44Å; V78-V82 PolarHBondContact O-N 3Å; F79-V82 PolarHBondContact O-N 3.24Å; R80-V82 VanDerWaalsContact C-N 3.3Å; R80-V82 PolarHBondContact O-N 2.96Å; V82-L84 PolarHBondContact O-N 2.98Å; V82-S85 PolarHBondContact O-N 3.22Å; V82-N86 PolarHBondContact O-N 3.25Å; V82-I89 HydrophobicContact CG1-CD1 4.31Å; V82-I89 HydrophobicContact CG1-CG2 3.72Å; V82-M161 HydrophobicContact CG1-CG 3.71Å; V82-M161 HydrophobicContact CG2-CB 4.46Å; V82-M161 HydrophobicContact CG2-CG 3.94Å; V82-I164 HydrophobicContact CB-CD1 4.33Å; V82-I164 HydrophobicContact CG2-CB 4.12Å; V82-I164 HydrophobicContact CG2-CD1 3.73Å; V82-I164 HydrophobicContact CG2-CG2 4.12Å
83	L	94.9	Very high	93.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-37.4	-176.3	-67.1	174.9	0	0	0	112.4	F79 R80 S85 I89 R90 F93 L95 L103 F109	F79-L83 HydrophobicContact CD1-CD1 4.1Å; F79-L83 HydrophobicContact CD2-CG 4.41Å; F79-L83 HydrophobicContact CE1-CD1 3.89Å; F79-L83 HydrophobicContact CE2-CD1 4.37Å; F79-L83 HydrophobicContact CE2-CD2 4.22Å; F79-L83 HydrophobicContact CE2-CG 4.23Å; F79-L83 HydrophobicContact CG-CD1 4.4Å; F79-L83 HydrophobicContact CZ-CD1 4.03Å; F79-L83 HydrophobicContact CZ-CD2 4.22Å; F79-L83 HydrophobicContact CZ-CG 4.31Å; F79-L83 VanDerWaalsContact O-CG 3.3Å; F79-L83 WeakPolarHBondContact O-CG 3.47Å; F79-L83 PolarHBondContact O-N 3.37Å; R80-L83 PolarHBondContact O-N 2.84Å; L83-S85 VanDerWaalsContact C-N 3.35Å; L83-I89 HydrophobicContact CD2-CG2 4.49Å; L83-R90 HydrophobicContact CB-CG 3.75Å; L83-R90 HydrophobicContact CD2-CB 4.47Å; L83-R90 HydrophobicContact CD2-CG 3.77Å; L83-R90 HydrophobicContact CG-CG 4.28Å; L83-R90 WeakPolarHBondContact O-CD 3.32Å; L83-R90 WeakPolarHBondContact O-CG 3.21Å; L83-F93 HydrophobicContact CD2-CB 4.14Å; L83-F93 HydrophobicContact CD2-CD2 3.83Å; L83-F93 HydrophobicContact CD2-CG 4.26Å; L83-L95 HydrophobicContact CD1-CD1 3.6Å; L83-L95 HydrophobicContact CD2-CD1 4.29Å; L83-L103 HydrophobicContact CD1-CD2 4.21Å; L83-F109 HydrophobicContact CD1-CD2 3.66Å; L83-F109 HydrophobicContact CD1-CE2 3.79Å
84	L	95.4	Very high	93.6	Very high	80 Å²	80	46.5 Å²	46.5	42%	0.419	23%	0.225	S	C	.	.	H	α-helix	trans	-78.9	-17.6	179.2	-61.8	177	0	0	0	113.3	R80 V82 D100 L103	R80-L84 WeakPolarHBondContact O-CB 3.44Å; R80-L84 VanDerWaalsContact O-CG 3.23Å; R80-L84 WeakPolarHBondContact O-CG 3.49Å; R80-L84 PolarHBondContact O-N 3.45Å; V82-L84 PolarHBondContact O-N 2.98Å; L84-D100 HydrophobicContact CD2-CB 4.24Å; L84-D100 VanDerWaalsContact CD2-CG 3.46Å; L84-D100 VanDerWaalsContact CD2-OD2 3.31Å; L84-D100 WeakPolarHBondContact CD2-OD2 3.36Å; L84-L103 HydrophobicContact CD2-CD1 4.34Å
85	S	95.1	Very high	93.5	Very high	71 Å²	71	46.4 Å²	46.4	50%	0.497	23%	0.225	S	C	.	.	H	α-helix	trans	-83.6	-23.7	178.6	-62.8	0	0	0	0	113.4	R81 V82 L83	R81-S85 VanDerWaalsContact O-CB 3.24Å; R81-S85 WeakPolarHBondContact O-CB 3.34Å; R81-S85 PolarHBondContact O-N 3.38Å; R81-S85 PolarHBondContact O-OG 2.9Å; V82-S85 PolarHBondContact O-N 3.22Å; L83-S85 VanDerWaalsContact C-N 3.35Å
86	N	92.2	Very high	93.4	Very high	22 Å²	22	50.4 Å²	50.4	12%	0.118	24%	0.243	C	C	.	.			trans	-151.7	110.5	-176.1	-168.5	-39.2	0	0	0	111.8	V82 K88 I89 R90 E156 L160	V82-N86 PolarHBondContact O-N 3.25Å; N86-K88 VanDerWaalsContact C-N 3.26Å; N86-K88 PolarHBondContact O-N 3.02Å; N86-K88 VanDerWaalsContact OD1-CB 3.3Å; N86-K88 WeakPolarHBondContact OD1-CB 3.34Å; N86-K88 PolarHBondContact OD1-N 2.98Å; N86-I89 HydrophobicContact CB-CB 4.28Å; N86-I89 HydrophobicContact CB-CD1 3.87Å; N86-I89 HydrophobicContact CB-CG1 3.91Å; N86-I89 WeakPolarHBondContact O-CB 3.37Å; N86-I89 PolarHBondContact O-N 3.45Å; N86-I89 PolarHBondContact OD1-N 3.3Å; N86-R90 PolarHBondContact O-N 3.44Å; N86-E156 PolarHBondContact ND2-OE1 3.44Å; N86-L160 HydrophobicContact CB-CD2 3.84Å
87	E	91.3	Very high	93.3	Very high	148 Å²	148	52.7 Å²	52.7	69%	0.692	26%	0.264	S	S	*	.	H	α-helix	trans	-62.1	-30.5	-179.2	-170.8	179.9	-175.9	0	0	113.2	I89 R90 T91	E87-I89 VanDerWaalsContact C-N 3.3Å; E87-I89 PolarHBondContact O-N 3.48Å; E87-R90 VanDerWaalsContact O-CB 3.3Å; E87-R90 WeakPolarHBondContact O-CB 3.16Å; E87-R90 PolarHBondContact O-N 3.24Å; E87-T91 PolarHBondContact O-N 3.03Å; E87-T91 PolarHBondContact O-OG1 3.38Å
88	K	91.2	Very high	93.3	Very high	129 Å²	129	51.2 Å²	51.2	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-65.2	-37.8	175.2	-60.5	-177.8	-178.9	174.2	0	110.9	N86 R90 T91 V92 Y157	N86-K88 VanDerWaalsContact C-N 3.26Å; N86-K88 PolarHBondContact O-N 3.02Å; N86-K88 VanDerWaalsContact OD1-CB 3.3Å; N86-K88 WeakPolarHBondContact OD1-CB 3.34Å; N86-K88 PolarHBondContact OD1-N 2.98Å; K88-R90 VanDerWaalsContact C-N 3.34Å; K88-R90 PolarHBondContact O-N 2.92Å; K88-T91 WeakPolarHBondContact O-CB 3.44Å; K88-T91 PolarHBondContact O-N 3.29Å; K88-T91 VanDerWaalsContact O-N 3.12Å; K88-V92 WeakPolarHBondContact O-CG2 3.4Å; K88-V92 PolarHBondContact O-N 2.86Å; K88-Y157 HydrophobicContact CB-CE1 4.34Å; K88-Y157 WeakPolarHBondContact CB-OH 3.24Å; K88-Y157 WeakPolarHBondContact CD-OH 3.45Å
89	I	91.5	Very high	93.2	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-40.4	174.9	-62.2	-178.8	0	0	0	110.5	V82 L83 N86 E87 T91 V92 F93 Y157 L160	V82-I89 HydrophobicContact CG1-CD1 4.31Å; V82-I89 HydrophobicContact CG1-CG2 3.72Å; L83-I89 HydrophobicContact CD2-CG2 4.49Å; N86-I89 HydrophobicContact CB-CB 4.28Å; N86-I89 HydrophobicContact CB-CD1 3.87Å; N86-I89 HydrophobicContact CB-CG1 3.91Å; N86-I89 WeakPolarHBondContact O-CB 3.37Å; N86-I89 PolarHBondContact O-N 3.45Å; N86-I89 PolarHBondContact OD1-N 3.3Å; E87-I89 VanDerWaalsContact C-N 3.3Å; E87-I89 PolarHBondContact O-N 3.48Å; I89-T91 PolarHBondContact O-N 3.02Å; I89-V92 WeakPolarHBondContact O-CB 3.02Å; I89-V92 PolarHBondContact O-N 3.17Å; I89-V92 VanDerWaalsContact O-N 3.1Å; I89-F93 HydrophobicContact CG2-CD2 3.62Å; I89-F93 HydrophobicContact CG2-CE2 3.56Å; I89-F93 VanDerWaalsContact O-CD2 3.3Å; I89-F93 WeakPolarHBondContact O-CD2 3.48Å; I89-F93 PolarHBondContact O-N 2.93Å; I89-Y157 HydrophobicContact CD1-CD1 3.91Å; I89-Y157 HydrophobicContact CD1-CG 4.03Å; I89-Y157 HydrophobicContact CG1-CD1 3.65Å; I89-Y157 HydrophobicContact CG1-CD2 4.31Å; I89-Y157 HydrophobicContact CG1-CE1 4.23Å; I89-Y157 HydrophobicContact CG1-CG 3.73Å; I89-L160 HydrophobicContact CD1-CD2 3.79Å
90	R	92.7	Very high	93.2	Very high	27 Å²	27	57.1 Å²	57.1	10%	0.102	29%	0.293	C	S	.	.	H	α-helix	trans	-55.7	-39.3	171.1	-96.4	177.1	116.7	151.3	8.9	112.9	L83 N86 E87 K88 F93 D94 L95 H96 C98 D100	L83-R90 HydrophobicContact CB-CG 3.75Å; L83-R90 HydrophobicContact CD2-CB 4.47Å; L83-R90 HydrophobicContact CD2-CG 3.77Å; L83-R90 HydrophobicContact CG-CG 4.28Å; L83-R90 WeakPolarHBondContact O-CD 3.32Å; L83-R90 WeakPolarHBondContact O-CG 3.21Å; N86-R90 PolarHBondContact O-N 3.44Å; E87-R90 VanDerWaalsContact O-CB 3.3Å; E87-R90 WeakPolarHBondContact O-CB 3.16Å; E87-R90 PolarHBondContact O-N 3.24Å; K88-R90 VanDerWaalsContact C-N 3.34Å; K88-R90 PolarHBondContact O-N 2.92Å; R90-F93 PolarHBondContact O-N 3.45Å; R90-D94 PolarHBondContact O-N 3.28Å; R90-L95 PolarHBondContact NE-O 3.3Å; R90-L95 PolarHBondContact O-N 2.94Å; R90-H96 HydrophobicContact CB-CB 4.29Å; R90-H96 PolarHBondContact O-N 3.03Å; R90-C98 PolarHBondContact NH2-O 3.17Å; R90-D100 IonicContact CZ-OD1 2.66Å; R90-D100 IonicContact NH1-OD1 3.7Å; R90-D100 PolarHBondContact NH1-OD1 2.94Å; R90-D100 IonicContact NH2-OD1 3.95Å; R90-D100 PolarHBondContact NH2-OD1 3.16Å
91	T	90.8	Very high	93.2	Very high	61 Å²	61	60 Å²	60	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-65.1	-42.9	176.5	-53.6	0	0	0	0	111.1	E87 K88 I89 F93 D94	E87-T91 PolarHBondContact O-N 3.03Å; E87-T91 PolarHBondContact O-OG1 3.38Å; K88-T91 WeakPolarHBondContact O-CB 3.44Å; K88-T91 PolarHBondContact O-N 3.29Å; K88-T91 VanDerWaalsContact O-N 3.12Å; I89-T91 PolarHBondContact O-N 3.02Å; T91-F93 VanDerWaalsContact C-N 3.27Å; T91-F93 PolarHBondContact O-N 3.4Å; T91-D94 PolarHBondContact O-N 2.84Å
92	V	88.6	Confident	93.1	Very high	36 Å²	36	60.2 Å²	60.2	22%	0.218	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-38.5	176.1	174.6	0	0	0	0	112.2	K88 I89 D94 W150 V151 Y157	K88-V92 WeakPolarHBondContact O-CG2 3.4Å; K88-V92 PolarHBondContact O-N 2.86Å; I89-V92 WeakPolarHBondContact O-CB 3.02Å; I89-V92 PolarHBondContact O-N 3.17Å; I89-V92 VanDerWaalsContact O-N 3.1Å; V92-D94 VanDerWaalsContact C-N 3.31Å; V92-W150 HydrophobicContact CG1-CB 4.48Å; V92-V151 HydrophobicContact CG1-CG2 4.01Å; V92-Y157 HydrophobicContact CG2-CE2 4.37Å
93	F	88.5	Confident	93.1	Very high	36 Å²	36	60.2 Å²	60.2	16%	0.158	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	3.6	177.6	-74.8	-74.1	0	0	0	114.5	F79 L83 I89 R90 T91 L95 T108 H112 M161	F79-F93 HydrophobicContact CE2-CD1 4.09Å; F79-F93 HydrophobicContact CE2-CD2 4.02Å; F79-F93 AromaticContact CE2-CE1 3.9Å; F79-F93 HydrophobicContact CE2-CE1 3.9Å; F79-F93 AromaticContact CE2-CE2 3.84Å; F79-F93 HydrophobicContact CE2-CE2 3.84Å; F79-F93 HydrophobicContact CE2-CG 4.15Å; F79-F93 AromaticContact CE2-CZ 3.78Å; F79-F93 HydrophobicContact CE2-CZ 3.78Å; F79-F93 HydrophobicContact CZ-CB 4.45Å; F79-F93 AromaticContact CZ-CD1 3.72Å; F79-F93 HydrophobicContact CZ-CD1 3.72Å; F79-F93 HydrophobicContact CZ-CD2 4.18Å; F79-F93 AromaticContact CZ-CE1 3.94Å; F79-F93 HydrophobicContact CZ-CE1 3.94Å; F79-F93 HydrophobicContact CZ-CE2 4.39Å; F79-F93 AromaticContact CZ-CG 3.86Å; F79-F93 HydrophobicContact CZ-CG 3.86Å; F79-F93 HydrophobicContact CZ-CZ 4.27Å; L83-F93 HydrophobicContact CD2-CB 4.14Å; L83-F93 HydrophobicContact CD2-CD2 3.83Å; L83-F93 HydrophobicContact CD2-CG 4.26Å; I89-F93 HydrophobicContact CG2-CD2 3.62Å; I89-F93 HydrophobicContact CG2-CE2 3.56Å; I89-F93 VanDerWaalsContact O-CD2 3.3Å; I89-F93 WeakPolarHBondContact O-CD2 3.48Å; I89-F93 PolarHBondContact O-N 2.93Å; R90-F93 PolarHBondContact O-N 3.45Å; T91-F93 VanDerWaalsContact C-N 3.27Å; T91-F93 PolarHBondContact O-N 3.4Å; F93-L95 VanDerWaalsContact C-N 3.31Å; F93-L95 HydrophobicContact CB-CD1 4.09Å; F93-L95 HydrophobicContact CB-CG 4.36Å; F93-L95 PolarHBondContact O-N 2.7Å; F93-T108 WeakPolarHBondContact O-CG2 3.44Å; F93-H112 HydrophobicContact CD1-CB 4.42Å; F93-H112 AromaticContact CD1-CD2 3.76Å; F93-H112 AromaticContact CD1-CE1 3.68Å; F93-H112 AromaticContact CD1-CG 3.7Å; F93-H112 AromaticContact CD1-ND1 3.65Å; F93-H112 AromaticContact CD1-NE2 3.77Å; F93-H112 HydrophobicContact CE1-CB 4.49Å; F93-H112 AromaticContact CE1-CE1 3.9Å; F93-H112 AromaticContact CE1-CG 3.95Å; F93-H112 AromaticContact CE1-ND1 3.59Å; F93-M161 HydrophobicContact CE2-SD 4.46Å; F93-M161 HydrophobicContact CZ-CE 4.37Å; F93-M161 HydrophobicContact CZ-SD 4.46Å
94	D	90.2	Very high	93.1	Very high	101 Å²	101	62.3 Å²	62.3	54%	0.54	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	41.6	-176.4	-161.2	33.8	0	0	0	113.4	R90 T91 V92 H96	R90-D94 PolarHBondContact O-N 3.28Å; T91-D94 PolarHBondContact O-N 2.84Å; V92-D94 VanDerWaalsContact C-N 3.31Å; D94-H96 IonicContact OD1-CE1 3.86Å
95	L	93.7	Very high	93.1	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.338	C	S	.	.			trans	-126.7	14.9	-177.8	-68.5	172.8	0	0	0	112.8	F79 L83 R90 F93 T97 C98 L103 N106 T108 F109	F79-L95 HydrophobicContact CE1-CD1 4.25Å; F79-L95 HydrophobicContact CZ-CD1 4.41Å; L83-L95 HydrophobicContact CD1-CD1 3.6Å; L83-L95 HydrophobicContact CD2-CD1 4.29Å; R90-L95 PolarHBondContact NE-O 3.3Å; R90-L95 PolarHBondContact O-N 2.94Å; F93-L95 VanDerWaalsContact C-N 3.31Å; F93-L95 HydrophobicContact CB-CD1 4.09Å; F93-L95 HydrophobicContact CB-CG 4.36Å; F93-L95 PolarHBondContact O-N 2.7Å; L95-T97 VanDerWaalsContact C-N 3.35Å; L95-C98 HydrophobicContact CD2-CB 4.37Å; L95-C98 PolarHBondContact O-N 3.16Å; L95-L103 HydrophobicContact CB-CD2 4.46Å; L95-L103 HydrophobicContact CD1-CD2 4.5Å; L95-N106 HydrophobicContact CD2-CB 4.39Å; L95-N106 WeakPolarHBondContact CD2-OD1 3.32Å; L95-T108 HydrophobicContact CD2-CG2 4.24Å; L95-T108 HydrophobicContact CG-CG2 4.35Å; L95-F109 HydrophobicContact CD1-CB 4.08Å; L95-F109 HydrophobicContact CD1-CD2 4.17Å; L95-F109 HydrophobicContact CD2-CB 4.3Å
96	H	93	Very high	93.1	Very high	85 Å²	85	63.4 Å²	63.4	39%	0.394	33%	0.326	S	S	.	.	S	Bend	trans	-73.8	-24	-178.5	64.2	-75.2	0	0	0	113.2	R90 D94	R90-H96 HydrophobicContact CB-CB 4.29Å; R90-H96 PolarHBondContact O-N 3.03Å; D94-H96 IonicContact OD1-CE1 3.86Å
97	T	94.1	Very high	93.3	Very high	112 Å²	112	68 Å²	68	69%	0.687	35%	0.347	S	S	*	.	S	Bend	trans	-93.1	-8.9	175.4	58.5	0	0	0	0	113.7	L95	L95-T97 VanDerWaalsContact C-N 3.35Å
98	C	95	Very high	93.4	Very high	11 Å²	11	62.9 Å²	62.9	7%	0.074	33%	0.325	C	S	.	.	S	Bend	trans	-84	124.5	-178.6	-178.1	0	0	0	0	109.9	R90 L95 L103	R90-C98 PolarHBondContact NH2-O 3.17Å; L95-C98 HydrophobicContact CD2-CB 4.37Å; L95-C98 PolarHBondContact O-N 3.16Å; C98-L103 HydrophobicContact CB-CD2 4.42Å
99	P	95.6	Very high	93.6	Very high	53 Å²	53	56.8 Å²	56.8	34%	0.344	30%	0.299	S	S	.	.			trans	-58.7	150.5	174.8	-24.7	34.8	0	0	0	113.6	D101 E102 L103	P99-D101 VanDerWaalsContact C-N 3.28Å; P99-D101 VanDerWaalsContact CB-OD1 3.27Å; P99-D101 WeakPolarHBondContact CB-OD1 3.22Å; P99-D101 PolarHBondContact O-N 3.48Å; P99-E102 HydrophobicContact CB-CB 4.29Å; P99-E102 HydrophobicContact CB-CG 4.14Å; P99-E102 HydrophobicContact CG-CG 4.31Å; P99-E102 PolarHBondContact O-N 3.47Å; P99-E102 VanDerWaalsContact O-N 3.09Å; P99-L103 PolarHBondContact O-N 3.1Å
100	D	95.4	Very high	93.7	Very high	75 Å²	75	59.9 Å²	59.9	40%	0.401	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34	-174.7	-70.1	5.2	0	0	0	113.6	R80 L84 R90	R80-D100 PolarHBondContact NH1-O 2.97Å; R80-D100 VanDerWaalsContact NH1-O 3.07Å; R80-D100 PolarHBondContact NH2-O 2.95Å; L84-D100 HydrophobicContact CD2-CB 4.24Å; L84-D100 VanDerWaalsContact CD2-CG 3.46Å; L84-D100 VanDerWaalsContact CD2-OD2 3.31Å; L84-D100 WeakPolarHBondContact CD2-OD2 3.36Å; R90-D100 IonicContact CZ-OD1 2.66Å; R90-D100 IonicContact NH1-OD1 3.7Å; R90-D100 PolarHBondContact NH1-OD1 2.94Å; R90-D100 IonicContact NH2-OD1 3.95Å; R90-D100 PolarHBondContact NH2-OD1 3.16Å
101	D	95.5	Very high	93.7	Very high	120 Å²	120	66.5 Å²	66.5	64%	0.642	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-18.7	178.5	58.5	-44.1	0	0	0	112.9	P99	P99-D101 VanDerWaalsContact C-N 3.28Å; P99-D101 VanDerWaalsContact CB-OD1 3.27Å; P99-D101 WeakPolarHBondContact CB-OD1 3.22Å; P99-D101 PolarHBondContact O-N 3.48Å
102	E	96	Very high	93.7	Very high	94 Å²	94	66.4 Å²	66.4	44%	0.439	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-10	178.2	-64.3	-175.7	-172.6	0	0	113.7	P99 D104 Q105 N106	P99-E102 HydrophobicContact CB-CB 4.29Å; P99-E102 HydrophobicContact CB-CG 4.14Å; P99-E102 HydrophobicContact CG-CG 4.31Å; P99-E102 PolarHBondContact O-N 3.47Å; P99-E102 VanDerWaalsContact O-N 3.09Å; E102-D104 VanDerWaalsContact C-N 3.26Å; E102-D104 PolarHBondContact O-N 3.3Å; E102-D104 VanDerWaalsContact O-N 3.13Å; E102-Q105 WeakPolarHBondContact O-CB 3.46Å; E102-Q105 PolarHBondContact O-N 2.9Å; E102-N106 PolarHBondContact O-N 3.22Å
103	L	95.4	Very high	94	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-49.5	-44.3	-177.1	-80	173	0	0	0	113.1	L83 L84 L95 C98 P99 Q105 N106 F109	L83-L103 HydrophobicContact CD1-CD2 4.21Å; L84-L103 HydrophobicContact CD2-CD1 4.34Å; L95-L103 HydrophobicContact CB-CD2 4.46Å; L95-L103 HydrophobicContact CD1-CD2 4.5Å; C98-L103 HydrophobicContact CB-CD2 4.42Å; P99-L103 PolarHBondContact O-N 3.1Å; L103-Q105 PolarHBondContact O-N 3.4Å; L103-N106 WeakPolarHBondContact O-CB 3.34Å; L103-N106 PolarHBondContact O-N 2.85Å; L103-F109 HydrophobicContact CB-CD2 4.29Å; L103-F109 HydrophobicContact CB-CE2 4.46Å; L103-F109 HydrophobicContact CD2-CD2 4.23Å; L103-F109 WeakPolarHBondContact O-CB 3.43Å; L103-F109 WeakPolarHBondContact O-CD1 3.46Å; L103-F109 WeakPolarHBondContact O-CG 3.46Å
104	D	93.6	Very high	94.1	Very high	45 Å²	45	70.8 Å²	70.8	24%	0.241	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-70	-18.4	-176.3	-73	-57.2	0	0	0	113.8	R76 R80 E102 F109 K110	R76-D104 WeakPolarHBondContact CD-OD1 3.48Å; R76-D104 WeakPolarHBondContact CG-OD1 3.41Å; R76-D104 IonicContact CZ-OD1 3.7Å; R76-D104 IonicContact NE-OD1 3.16Å; R76-D104 IonicContact NH1-OD1 3.35Å; R76-D104 PolarHBondContact NH1-OD1 3.44Å; R80-D104 IonicContact CZ-OD2 3.24Å; R80-D104 IonicContact NH1-OD2 3.22Å; R80-D104 PolarHBondContact NH1-OD2 3.37Å; E102-D104 VanDerWaalsContact C-N 3.26Å; E102-D104 PolarHBondContact O-N 3.3Å; E102-D104 VanDerWaalsContact O-N 3.13Å; D104-F109 WeakPolarHBondContact OD1-CE1 3.37Å; D104-K110 WeakPolarHBondContact O-CE 3.31Å
105	Q	95.2	Very high	94.1	Very high	129 Å²	129	69.3 Å²	69.3	60%	0.603	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-91.6	-21.5	177.4	-62.4	144.2	15.5	0	0	111.3	E102 L103 K110	E102-Q105 WeakPolarHBondContact O-CB 3.46Å; E102-Q105 PolarHBondContact O-N 2.9Å; L103-Q105 PolarHBondContact O-N 3.4Å; Q105-K110 VanDerWaalsContact O-CE 3.32Å; Q105-K110 WeakPolarHBondContact O-CE 3.43Å; Q105-K110 PolarHBondContact O-NZ 3.06Å
106	N	96.4	Very high	94	Very high	45 Å²	45	70.1 Å²	70.1	24%	0.241	35%	0.35	C	S	.	.			trans	-66.5	129.6	-179	-173.4	-66.1	0	0	0	112.6	L95 E102 L103 T108 F109 K110	L95-N106 HydrophobicContact CD2-CB 4.39Å; L95-N106 WeakPolarHBondContact CD2-OD1 3.32Å; E102-N106 PolarHBondContact O-N 3.22Å; L103-N106 WeakPolarHBondContact O-CB 3.34Å; L103-N106 PolarHBondContact O-N 2.85Å; N106-T108 WeakPolarHBondContact OD1-CA 3.4Å; N106-T108 VanDerWaalsContact OD1-CB 3.25Å; N106-T108 WeakPolarHBondContact OD1-CB 3.14Å; N106-T108 PolarHBondContact OD1-N 3.01Å; N106-F109 HydrophobicContact CB-CB 4Å; N106-F109 WeakPolarHBondContact O-CB 3.26Å; N106-F109 PolarHBondContact O-N 2.66Å; N106-F109 PolarHBondContact OD1-N 3.24Å; N106-F109 VanDerWaalsContact OD1-N 3.14Å; N106-K110 WeakPolarHBondContact O-CG 3.46Å; N106-K110 PolarHBondContact O-N 3.28Å
107	E	95.6	Very high	93.8	Very high	120 Å²	120	66.7 Å²	66.7	56%	0.561	34%	0.336	S	S	*	.	H	α-helix	trans	-71	-32.1	-177	-69.7	-55.7	131.4	0	0	114	K110 R111	E107-K110 PolarHBondContact O-N 3.49Å; E107-K110 IonicContact OE1-NZ 2.83Å; E107-K110 PolarHBondContact OE1-NZ 3.33Å; E107-R111 WeakPolarHBondContact O-CB 3.29Å; E107-R111 PolarHBondContact O-N 2.78Å
108	T	92.8	Very high	93.7	Very high	40 Å²	40	66.8 Å²	66.8	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-64.4	-45	172.9	-61.9	0	0	0	0	109.6	F93 L95 N106 R111 H112	F93-T108 WeakPolarHBondContact O-CG2 3.44Å; L95-T108 HydrophobicContact CD2-CG2 4.24Å; L95-T108 HydrophobicContact CG-CG2 4.35Å; N106-T108 WeakPolarHBondContact OD1-CA 3.4Å; N106-T108 VanDerWaalsContact OD1-CB 3.25Å; N106-T108 WeakPolarHBondContact OD1-CB 3.14Å; N106-T108 PolarHBondContact OD1-N 3.01Å; T108-R111 PolarHBondContact O-N 2.89Å; T108-H112 PolarHBondContact O-CD2 2.95Å; T108-H112 VanDerWaalsContact O-CD2 3.23Å; T108-H112 PolarHBondContact O-N 2.99Å; T108-H112 VanDerWaalsContact O-N 3.11Å
109	F	95.2	Very high	93.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-51.7	174.5	178.8	-89.5	0	0	0	111.8	R76 F79 R80 L83 L95 L103 D104 N106 R111 H112 L113	R76-F109 HydrophobicContact CG-CE1 4.28Å; R76-F109 HydrophobicContact CG-CZ 4.2Å; F79-F109 HydrophobicContact CB-CE2 4.23Å; F79-F109 HydrophobicContact CB-CZ 4.4Å; F79-F109 AromaticContact CD1-CD2 3.49Å; F79-F109 HydrophobicContact CD1-CD2 3.49Å; F79-F109 VanDerWaalsContact CD1-CD2 3.49Å; F79-F109 AromaticContact CD1-CE2 3.32Å; F79-F109 HydrophobicContact CD1-CE2 3.32Å; F79-F109 HydrophobicContact CD1-CG 4.24Å; F79-F109 AromaticContact CD1-CZ 3.94Å; F79-F109 HydrophobicContact CD1-CZ 3.94Å; F79-F109 AromaticContact CE1-CD2 3.65Å; F79-F109 HydrophobicContact CE1-CD2 3.65Å; F79-F109 AromaticContact CE1-CE2 3.97Å; F79-F109 HydrophobicContact CE1-CE2 3.97Å; F79-F109 HydrophobicContact CE1-CG 4.3Å; F79-F109 HydrophobicContact CG-CE2 4.09Å; R80-F109 HydrophobicContact CG-CE2 4.12Å; R80-F109 HydrophobicContact CG-CZ 3.85Å; L83-F109 HydrophobicContact CD1-CD2 3.66Å; L83-F109 HydrophobicContact CD1-CE2 3.79Å; L95-F109 HydrophobicContact CD1-CB 4.08Å; L95-F109 HydrophobicContact CD1-CD2 4.17Å; L95-F109 HydrophobicContact CD2-CB 4.3Å; L103-F109 HydrophobicContact CB-CD2 4.29Å; L103-F109 HydrophobicContact CB-CE2 4.46Å; L103-F109 HydrophobicContact CD2-CD2 4.23Å; L103-F109 WeakPolarHBondContact O-CB 3.43Å; L103-F109 WeakPolarHBondContact O-CD1 3.46Å; L103-F109 WeakPolarHBondContact O-CG 3.46Å; D104-F109 WeakPolarHBondContact OD1-CE1 3.37Å; N106-F109 HydrophobicContact CB-CB 4Å; N106-F109 WeakPolarHBondContact O-CB 3.26Å; N106-F109 PolarHBondContact O-N 2.66Å; N106-F109 PolarHBondContact OD1-N 3.24Å; N106-F109 VanDerWaalsContact OD1-N 3.14Å; F109-R111 VanDerWaalsContact C-N 3.26Å; F109-R111 PolarHBondContact O-N 2.72Å; F109-H112 PolarHBondContact O-N 3.25Å; F109-L113 HydrophobicContact CE1-CD2 4.13Å; F109-L113 WeakPolarHBondContact O-CB 3.3Å; F109-L113 PolarHBondContact O-N 2.91Å
110	K	95.2	Very high	93.4	Very high	67 Å²	67	65.1 Å²	65.1	29%	0.291	32%	0.318	S	S	.	.	H	α-helix	trans	-58	-36.2	179.3	-69.7	173.3	-164.6	163.3	0	112.9	D104 Q105 N106 E107 K114	D104-K110 WeakPolarHBondContact O-CE 3.31Å; Q105-K110 VanDerWaalsContact O-CE 3.32Å; Q105-K110 WeakPolarHBondContact O-CE 3.43Å; Q105-K110 PolarHBondContact O-NZ 3.06Å; N106-K110 WeakPolarHBondContact O-CG 3.46Å; N106-K110 PolarHBondContact O-N 3.28Å; E107-K110 PolarHBondContact O-N 3.49Å; E107-K110 IonicContact OE1-NZ 2.83Å; E107-K110 PolarHBondContact OE1-NZ 3.33Å; K110-K114 WeakPolarHBondContact O-CG 3.39Å; K110-K114 PolarHBondContact O-N 2.69Å; K110-K114 VanDerWaalsContact O-N 3.1Å
111	R	92.6	Very high	93.2	Very high	167 Å²	167	62.2 Å²	62.2	63%	0.63	31%	0.305	S	S	*	.	H	α-helix	trans	-69	-45.1	178.7	-168.6	-174.9	-52.1	168.1	7.1	112.2	E107 T108 F109 K114 S115	E107-R111 WeakPolarHBondContact O-CB 3.29Å; E107-R111 PolarHBondContact O-N 2.78Å; T108-R111 PolarHBondContact O-N 2.89Å; F109-R111 VanDerWaalsContact C-N 3.26Å; F109-R111 PolarHBondContact O-N 2.72Å; R111-K114 PolarHBondContact O-N 2.89Å; R111-S115 PolarHBondContact O-N 3.37Å; R111-S115 VanDerWaalsContact O-N 3.16Å; R111-S115 PolarHBondContact O-OG 3.11Å
112	H	90.7	Very high	93	Very high	59 Å²	59	58.3 Å²	58.3	27%	0.273	28%	0.284	S	S	.	.	H	α-helix	trans	-67.7	-38.9	176.5	-77.1	-66.9	0	0	0	111.8	F79 F93 T108 F109 K114 S115 L116	F79-H112 HydrophobicContact CD1-CB 4.34Å; F79-H112 HydrophobicContact CE1-CB 3.43Å; F79-H112 VanDerWaalsContact CE1-CB 3.43Å; F79-H112 HydrophobicContact CE2-CB 4.35Å; F79-H112 HydrophobicContact CZ-CB 3.45Å; F79-H112 VanDerWaalsContact CZ-CB 3.45Å; F93-H112 HydrophobicContact CD1-CB 4.42Å; F93-H112 AromaticContact CD1-CD2 3.76Å; F93-H112 AromaticContact CD1-CE1 3.68Å; F93-H112 AromaticContact CD1-CG 3.7Å; F93-H112 AromaticContact CD1-ND1 3.65Å; F93-H112 AromaticContact CD1-NE2 3.77Å; F93-H112 HydrophobicContact CE1-CB 4.49Å; F93-H112 AromaticContact CE1-CE1 3.9Å; F93-H112 AromaticContact CE1-CG 3.95Å; F93-H112 AromaticContact CE1-ND1 3.59Å; T108-H112 PolarHBondContact O-CD2 2.95Å; T108-H112 VanDerWaalsContact O-CD2 3.23Å; T108-H112 PolarHBondContact O-N 2.99Å; T108-H112 VanDerWaalsContact O-N 3.11Å; F109-H112 PolarHBondContact O-N 3.25Å; H112-K114 PolarHBondContact O-N 3.26Å; H112-S115 WeakPolarHBondContact O-CB 3.39Å; H112-S115 PolarHBondContact O-N 3.44Å; H112-S115 VanDerWaalsContact O-N 3.17Å; H112-L116 WeakPolarHBondContact O-CB 3.19Å; H112-L116 PolarHBondContact O-N 3.32Å
113	L	93.6	Very high	92.9	Very high	10 Å²	10	53.8 Å²	53.8	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-53.8	-53.1	172.2	171	56.8	0	0	0	111.8	G75 R76 F109 S115 L116 S117	G75-L113 WeakPolarHBondContact O-CD1 3.4Å; R76-L113 HydrophobicContact CB-CD1 4.29Å; R76-L113 HydrophobicContact CB-CD2 4.18Å; F109-L113 HydrophobicContact CE1-CD2 4.13Å; F109-L113 WeakPolarHBondContact O-CB 3.3Å; F109-L113 PolarHBondContact O-N 2.91Å; L113-S115 VanDerWaalsContact C-N 3.27Å; L113-S115 PolarHBondContact O-N 3Å; L113-L116 PolarHBondContact O-N 3.19Å; L113-L116 VanDerWaalsContact O-N 3.17Å; L113-S117 PolarHBondContact O-N 3.42Å; L113-S117 PolarHBondContact O-OG 2.8Å
114	K	91.8	Very high	92.7	Very high	154 Å²	154	53.9 Å²	53.9	67%	0.67	26%	0.264	S	S	*	.	H	α-helix	trans	-58	-40.9	177.6	-74.6	177.2	-179.9	178.9	0	112.3	K110 R111 H112 L118	K110-K114 WeakPolarHBondContact O-CG 3.39Å; K110-K114 PolarHBondContact O-N 2.69Å; K110-K114 VanDerWaalsContact O-N 3.1Å; R111-K114 PolarHBondContact O-N 2.89Å; H112-K114 PolarHBondContact O-N 3.26Å; K114-L118 WeakPolarHBondContact O-CB 3.31Å; K114-L118 PolarHBondContact O-N 3.35Å
115	S	90.2	Very high	92.5	Very high	69 Å²	69	55.5 Å²	55.5	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-65.8	-40	179.1	-56.8	0	0	0	0	111.8	R111 H112 L113 F119	R111-S115 PolarHBondContact O-N 3.37Å; R111-S115 VanDerWaalsContact O-N 3.16Å; R111-S115 PolarHBondContact O-OG 3.11Å; H112-S115 WeakPolarHBondContact O-CB 3.39Å; H112-S115 PolarHBondContact O-N 3.44Å; H112-S115 VanDerWaalsContact O-N 3.17Å; L113-S115 VanDerWaalsContact C-N 3.27Å; L113-S115 PolarHBondContact O-N 3Å; S115-F119 WeakPolarHBondContact O-CB 3.34Å; S115-F119 PolarHBondContact O-N 3.49Å
116	L	90.5	Very high	92	Very high	17 Å²	17	49.5 Å²	49.5	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-47.5	177.1	175.8	61.3	0	0	0	111.9	V78 F79 H112 L113 L118 F119 L120 M165	V78-L116 HydrophobicContact CB-CD2 4.13Å; V78-L116 HydrophobicContact CG1-CD2 3.72Å; F79-L116 HydrophobicContact CB-CD2 4.02Å; F79-L116 HydrophobicContact CD2-CD2 4.45Å; F79-L116 HydrophobicContact CG-CD2 4.48Å; H112-L116 WeakPolarHBondContact O-CB 3.19Å; H112-L116 PolarHBondContact O-N 3.32Å; L113-L116 PolarHBondContact O-N 3.19Å; L113-L116 VanDerWaalsContact O-N 3.17Å; L116-L118 VanDerWaalsContact C-N 3.28Å; L116-L118 PolarHBondContact O-N 3.46Å; L116-F119 HydrophobicContact CD1-CD1 4.44Å; L116-F119 WeakPolarHBondContact O-CB 3.41Å; L116-F119 PolarHBondContact O-N 3.24Å; L116-F119 VanDerWaalsContact O-N 3.16Å; L116-L120 HydrophobicContact CD1-CD1 4.42Å; L116-L120 HydrophobicContact CD1-CG 4.37Å; L116-L120 HydrophobicContact CG-CD1 4.5Å; L116-L120 PolarHBondContact O-N 3.4Å; L116-M165 HydrophobicContact CD1-CE 3.47Å; L116-M165 VanDerWaalsContact CD1-CE 3.47Å; L116-M165 HydrophobicContact CD1-SD 4.12Å
117	S	90.3	Very high	91.4	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-40.9	176.8	-63.9	0	0	0	0	111.5	L113 G121	L113-S117 PolarHBondContact O-N 3.42Å; L113-S117 PolarHBondContact O-OG 2.8Å; S117-G121 PolarHBondContact O-N 3.38Å
118	L	90.3	Very high	90.6	Very high	114 Å²	114	44.7 Å²	44.7	60%	0.597	23%	0.228	S	C	*	.	H	α-helix	trans	-63.6	-44.9	174.5	-179.7	63.3	0	0	0	111.8	K114 L116 G121 I122	K114-L118 WeakPolarHBondContact O-CB 3.31Å; K114-L118 PolarHBondContact O-N 3.35Å; L116-L118 VanDerWaalsContact C-N 3.28Å; L116-L118 PolarHBondContact O-N 3.46Å; L118-G121 PolarHBondContact O-N 3.05Å; L118-I122 HydrophobicContact CD1-CD1 4.28Å; L118-I122 HydrophobicContact CD1-CG1 4.44Å; L118-I122 HydrophobicContact CG-CD1 4.02Å; L118-I122 WeakPolarHBondContact O-CG1 3.49Å; L118-I122 PolarHBondContact O-N 3.26Å
119	F	91	Very high	89.7	Confident	30 Å²	30	47.1 Å²	47.1	13%	0.132	24%	0.243	C	C	.	.	H	α-helix	trans	-58.9	-47.8	178.2	168.8	-106.7	0	0	0	112.2	S115 L116 G121 I122 C123 I141 M165 L189 V192 I196	S115-F119 WeakPolarHBondContact O-CB 3.34Å; S115-F119 PolarHBondContact O-N 3.49Å; L116-F119 HydrophobicContact CD1-CD1 4.44Å; L116-F119 WeakPolarHBondContact O-CB 3.41Å; L116-F119 PolarHBondContact O-N 3.24Å; L116-F119 VanDerWaalsContact O-N 3.16Å; F119-G121 VanDerWaalsContact C-N 3.32Å; F119-G121 PolarHBondContact O-N 3.05Å; F119-I122 PolarHBondContact O-N 2.97Å; F119-C123 PolarHBondContact O-N 2.92Å; F119-C123 PolarHBondContact O-SG 3.38Å; F119-I141 HydrophobicContact CD2-CD1 3.64Å; F119-I141 HydrophobicContact CE2-CD1 3.98Å; F119-M165 HydrophobicContact CE1-SD 4.47Å; F119-L189 HydrophobicContact CE1-CD2 4.24Å; F119-L189 HydrophobicContact CZ-CD2 4.47Å; F119-V192 HydrophobicContact CE2-CG1 3.68Å; F119-V192 HydrophobicContact CZ-CG1 3.62Å; F119-I196 HydrophobicContact CE2-CD1 4.01Å; F119-I196 HydrophobicContact CZ-CD1 4.13Å
120	L	93.5	Very high	88.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-40.1	176.7	-70	175.8	0	0	0	111.7	W65 L74 L116 I122 C123 A124 M165 I169 W185 L189	W65-L120 HydrophobicContact CH2-CB 3.66Å; W65-L120 HydrophobicContact CZ2-CB 4.44Å; W65-L120 HydrophobicContact CZ3-CB 3.77Å; W65-L120 HydrophobicContact CZ3-CD1 4.42Å; L74-L120 HydrophobicContact CD2-CD1 4.09Å; L116-L120 HydrophobicContact CD1-CD1 4.42Å; L116-L120 HydrophobicContact CD1-CG 4.37Å; L116-L120 HydrophobicContact CG-CD1 4.5Å; L116-L120 PolarHBondContact O-N 3.4Å; L120-I122 PolarHBondContact O-N 3.34Å; L120-C123 PolarHBondContact O-N 2.84Å; L120-A124 PolarHBondContact O-N 2.85Å; L120-M165 HydrophobicContact CD2-CG 4.34Å; L120-M165 HydrophobicContact CD2-SD 3.95Å; L120-I169 HydrophobicContact CD2-CD1 4.29Å; L120-W185 HydrophobicContact CD2-CZ3 4.17Å; L120-L189 HydrophobicContact CD2-CD2 4.37Å
121	G	92.5	Very high	87.2	Confident	13 Å²	13	47.3 Å²	47.3	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-42.6	174.9	0	0	0	0	0	113	W65 S117 L118 F119 A124 T125	W65-G121 VanDerWaalsContact CZ2-CA 3.41Å; S117-G121 PolarHBondContact O-N 3.38Å; L118-G121 PolarHBondContact O-N 3.05Å; F119-G121 VanDerWaalsContact C-N 3.32Å; F119-G121 PolarHBondContact O-N 3.05Å; G121-A124 PolarHBondContact O-N 2.97Å; G121-T125 WeakPolarHBondContact O-CB 3.36Å; G121-T125 WeakPolarHBondContact O-CG2 3.33Å; G121-T125 PolarHBondContact O-N 3.47Å; G121-T125 PolarHBondContact O-OG1 3.43Å
122	I	90.9	Very high	86.7	Confident	38 Å²	38	44.9 Å²	44.9	20%	0.195	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-46	174.6	-70.8	166.8	0	0	0	110.4	L118 F119 L120 A124 T125 S126 L134 I137	L118-I122 HydrophobicContact CD1-CD1 4.28Å; L118-I122 HydrophobicContact CD1-CG1 4.44Å; L118-I122 HydrophobicContact CG-CD1 4.02Å; L118-I122 WeakPolarHBondContact O-CG1 3.49Å; L118-I122 PolarHBondContact O-N 3.26Å; F119-I122 PolarHBondContact O-N 2.97Å; L120-I122 PolarHBondContact O-N 3.34Å; I122-A124 PolarHBondContact O-N 3.44Å; I122-T125 PolarHBondContact O-N 3.08Å; I122-T125 PolarHBondContact O-OG1 3.06Å; I122-S126 WeakPolarHBondContact O-CB 3.24Å; I122-S126 PolarHBondContact O-N 3.28Å; I122-S126 PolarHBondContact O-OG 3.39Å; I122-L134 HydrophobicContact CG2-CD1 4.27Å; I122-I137 HydrophobicContact CD1-CG2 4.42Å; I122-I137 HydrophobicContact CG2-CD1 3.65Å; I122-I137 HydrophobicContact CG2-CG2 4.11Å
123	C	93.1	Very high	86.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.5	-49.3	178.9	-68.1	0	0	0	0	111.1	F119 L120 T125 V127 W185 L188 L189	F119-C123 PolarHBondContact O-N 2.92Å; F119-C123 PolarHBondContact O-SG 3.38Å; L120-C123 PolarHBondContact O-N 2.84Å; C123-T125 PolarHBondContact O-N 2.84Å; C123-V127 WeakPolarHBondContact O-CG2 3.43Å; C123-W185 HydrophobicContact CB-CZ3 4.28Å; C123-L188 HydrophobicContact CB-CD2 4.15Å; C123-L189 HydrophobicContact CB-CD2 4.44Å
124	A	92.1	Very high	86.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-40.9	-179.7	0	0	0	0	0	113.4	I61 W65 L120 G121 I122 W185	I61-A124 HydrophobicContact CG2-CB 4.35Å; W65-A124 HydrophobicContact CB-CB 3.64Å; W65-A124 HydrophobicContact CD2-CB 4.02Å; W65-A124 HydrophobicContact CG-CB 3.44Å; W65-A124 VanDerWaalsContact CG-CB 3.44Å; L120-A124 PolarHBondContact O-N 2.85Å; G121-A124 PolarHBondContact O-N 2.97Å; I122-A124 PolarHBondContact O-N 3.44Å; A124-W185 HydrophobicContact CB-CH2 3.77Å; A124-W185 HydrophobicContact CB-CZ2 4.02Å
125	T	88.2	Confident	86.5	Confident	79 Å²	79	41.7 Å²	41.7	49%	0.485	24%	0.239	S	C	.	.	H	α-helix	trans	-87.6	-20.6	-171.4	55.6	0	0	0	0	113.9	G121 I122 C123 V129	G121-T125 WeakPolarHBondContact O-CB 3.36Å; G121-T125 WeakPolarHBondContact O-CG2 3.33Å; G121-T125 PolarHBondContact O-N 3.47Å; G121-T125 PolarHBondContact O-OG1 3.43Å; I122-T125 PolarHBondContact O-N 3.08Å; I122-T125 PolarHBondContact O-OG1 3.06Å; C123-T125 PolarHBondContact O-N 2.84Å; T125-V129 VanDerWaalsContact O-CG2 3.31Å; T125-V129 WeakPolarHBondContact O-CG2 3.37Å
126	S	86.4	Confident	86.6	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-92.4	-5.8	-175.2	-53.4	0	0	0	0	113.7	I122 T128 V129	I122-S126 WeakPolarHBondContact O-CB 3.24Å; I122-S126 PolarHBondContact O-N 3.28Å; I122-S126 PolarHBondContact O-OG 3.39Å; S126-T128 PolarHBondContact O-N 2.96Å; S126-V129 PolarHBondContact O-N 2.91Å
127	V	83.7	Confident	86.6	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.03	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-36.3	-178.5	-176.3	0	0	0	0	111.9	A40 L53 V58 I61 C123 L188	A40-V127 HydrophobicContact CB-CG1 3.6Å; A40-V127 WeakPolarHBondContact CB-O 3.43Å; L53-V127 HydrophobicContact CD1-CG1 3.61Å; V58-V127 HydrophobicContact CG1-CG1 4.27Å; V58-V127 HydrophobicContact CG2-CG1 3.93Å; I61-V127 HydrophobicContact CG2-CG2 4.25Å; C123-V127 WeakPolarHBondContact O-CG2 3.43Å; V127-L188 HydrophobicContact CG2-CD1 4.13Å; V127-L188 HydrophobicContact CG2-CD2 3.82Å
128	T	77	Confident	86.8	Confident	60 Å²	60	41.4 Å²	41.4	37%	0.368	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-8	-174.8	53.4	0	0	0	0	114.6	K36 V58 E62 S126	K36-T128 HydrophobicContact CD-CG2 4.26Å; K36-T128 PolarHBondContact NZ-OG1 3.44Å; V58-T128 HydrophobicContact CG1-CG2 3.31Å; E62-T128 VanDerWaalsContact OE1-CG2 3.3Å; E62-T128 WeakPolarHBondContact OE1-CG2 3.26Å; E62-T128 PolarHBondContact OE1-OG1 3.05Å; S126-T128 PolarHBondContact O-N 2.96Å
129	V	74.1	Confident	87	Confident	91 Å²	91	37.3 Å²	37.3	55%	0.552	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-10.8	-174.4	179.6	0	0	0	0	112.3	T125 S126	T125-V129 VanDerWaalsContact O-CG2 3.31Å; T125-V129 WeakPolarHBondContact O-CG2 3.37Å; S126-V129 PolarHBondContact O-N 2.91Å
130	G	67.9	Low	87.1	Confident	33 Å²	33	43.5 Å²	43.5	34%	0.34	23%	0.234	S	C	.	.			trans	140.4	133.1	174.6	0	0	0	0	0	111.3	D132 R133	G130-D132 PolarHBondContact O-N 3.23Å; G130-R133 PolarHBondContact O-N 3.37Å
131	S	70.5	Confident	86.9	Confident	37 Å²	37	45.3 Å²	45.3	26%	0.259	24%	0.244	S	C	.	.	H	α-helix	trans	-50.8	-44	-176.8	48	0	0	0	0	112.7	Y41 R133 L134 V135	Y41-S131 WeakPolarHBondContact O-CB 3.29Å; S131-R133 VanDerWaalsContact C-N 3.28Å; S131-R133 PolarHBondContact O-N 3.45Å; S131-L134 PolarHBondContact O-N 2.99Å; S131-V135 WeakPolarHBondContact O-CG2 3.46Å; S131-V135 PolarHBondContact O-N 2.92Å
132	D	83	Confident	86.9	Confident	117 Å²	117	44.7 Å²	44.7	63%	0.626	24%	0.237	S	C	*	.	H	α-helix	trans	-70.8	-29.6	-168.4	-57.2	-7.1	0	0	0	111.6	G130 S136	G130-D132 PolarHBondContact O-N 3.23Å; D132-S136 WeakPolarHBondContact O-CB 3.33Å; D132-S136 PolarHBondContact O-N 2.87Å
133	R	87.1	Confident	87	Confident	143 Å²	143	46.1 Å²	46.1	54%	0.54	24%	0.243	S	C	.	.	H	α-helix	trans	-67.1	-49.5	-178.6	-176	176.7	179.1	178.5	-0.5	110.9	G130 S131 S136 I137	G130-R133 PolarHBondContact O-N 3.37Å; S131-R133 VanDerWaalsContact C-N 3.28Å; S131-R133 PolarHBondContact O-N 3.45Å; R133-S136 PolarHBondContact O-N 3.23Å; R133-I137 HydrophobicContact CG-CD1 3.94Å; R133-I137 VanDerWaalsContact O-CG1 3.26Å; R133-I137 WeakPolarHBondContact O-CG1 3.37Å; R133-I137 PolarHBondContact O-N 3.11Å
134	L	91.1	Very high	86.7	Confident	2 Å²	2	53 Å²	53	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-43.1	-179	-178.3	57.4	0	0	0	110.7	L42 I122 S131 I137 A138 L188 V192	L42-L134 HydrophobicContact CD1-CD2 4.29Å; L42-L134 HydrophobicContact CD2-CB 4.03Å; L42-L134 HydrophobicContact CD2-CD2 4.05Å; L42-L134 HydrophobicContact CD2-CG 4.49Å; I122-L134 HydrophobicContact CG2-CD1 4.27Å; S131-L134 PolarHBondContact O-N 2.99Å; L134-I137 PolarHBondContact O-N 2.91Å; L134-A138 WeakPolarHBondContact O-CB 3.38Å; L134-A138 PolarHBondContact O-N 3.42Å; L134-L188 HydrophobicContact CD2-CD1 3.78Å; L134-V192 HydrophobicContact CD1-CG2 4.16Å; L134-V192 HydrophobicContact CD2-CG2 3.92Å; L134-V192 HydrophobicContact CG-CG2 4.1Å
135	V	93.2	Very high	86.5	Confident	10 Å²	10	55.4 Å²	55.4	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-60.2	-48.8	175.7	173.1	0	0	0	0	110.8	S44 S131 I137 A138 R139 F191	S44-V135 WeakPolarHBondContact OG-CG1 3.09Å; S131-V135 WeakPolarHBondContact O-CG2 3.46Å; S131-V135 PolarHBondContact O-N 2.92Å; V135-I137 VanDerWaalsContact C-N 3.33Å; V135-I137 PolarHBondContact O-N 3.47Å; V135-A138 PolarHBondContact O-N 3.28Å; V135-R139 HydrophobicContact CG1-CG 4.33Å; V135-R139 WeakPolarHBondContact O-CB 3.45Å; V135-R139 VanDerWaalsContact O-CG 3.26Å; V135-R139 WeakPolarHBondContact O-CG 3.37Å; V135-R139 PolarHBondContact O-N 2.97Å; V135-F191 HydrophobicContact CG2-CE1 3.81Å; V135-F191 HydrophobicContact CG2-CZ 3.88Å
136	S	92.2	Very high	86.5	Confident	53 Å²	53	52.6 Å²	52.6	37%	0.371	27%	0.267	S	S	.	.	H	α-helix	trans	-58.5	-43.3	178.3	-177.9	0	0	0	0	112.3	D132 R133 R139 R140	D132-S136 WeakPolarHBondContact O-CB 3.33Å; D132-S136 PolarHBondContact O-N 2.87Å; R133-S136 PolarHBondContact O-N 3.23Å; S136-R139 PolarHBondContact O-N 3.41Å; S136-R140 WeakPolarHBondContact O-CB 3.22Å; S136-R140 WeakPolarHBondContact O-CG 3.18Å; S136-R140 PolarHBondContact O-N 2.88Å
137	I	91.3	Very high	86.4	Confident	38 Å²	38	57.2 Å²	57.2	20%	0.195	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-48	177.6	-67.1	166.3	0	0	0	110.7	I122 R133 L134 V135 R139 R140 I141	I122-I137 HydrophobicContact CD1-CG2 4.42Å; I122-I137 HydrophobicContact CG2-CD1 3.65Å; I122-I137 HydrophobicContact CG2-CG2 4.11Å; R133-I137 HydrophobicContact CG-CD1 3.94Å; R133-I137 VanDerWaalsContact O-CG1 3.26Å; R133-I137 WeakPolarHBondContact O-CG1 3.37Å; R133-I137 PolarHBondContact O-N 3.11Å; L134-I137 PolarHBondContact O-N 2.91Å; V135-I137 VanDerWaalsContact C-N 3.33Å; V135-I137 PolarHBondContact O-N 3.47Å; I137-R139 VanDerWaalsContact C-N 3.26Å; I137-R139 PolarHBondContact O-N 3.48Å; I137-R140 PolarHBondContact O-N 3.2Å; I137-I141 HydrophobicContact CG2-CD1 3.89Å; I137-I141 HydrophobicContact CG2-CG1 4.37Å; I137-I141 VanDerWaalsContact O-CG1 3.3Å; I137-I141 WeakPolarHBondContact O-CG1 3.35Å; I137-I141 PolarHBondContact O-N 3.36Å
138	A	92.9	Very high	86.2	Confident	2 Å²	2	62.5 Å²	62.5	2%	0.017	31%	0.314	C	S	.	.	H	α-helix	trans	-55.9	-44.5	177.4	0	0	0	0	0	111.2	L134 V135 I141 G142 V192 E195 I196	L134-A138 WeakPolarHBondContact O-CB 3.38Å; L134-A138 PolarHBondContact O-N 3.42Å; V135-A138 PolarHBondContact O-N 3.28Å; A138-I141 WeakPolarHBondContact O-CB 3.26Å; A138-I141 PolarHBondContact O-N 3.01Å; A138-G142 PolarHBondContact O-N 2.67Å; A138-G142 VanDerWaalsContact O-N 3.08Å; A138-V192 HydrophobicContact CB-CG1 4.02Å; A138-E195 HydrophobicContact CB-CB 3.83Å; A138-I196 HydrophobicContact CB-CG1 4.03Å; A138-I196 VanDerWaalsContact O-CG1 3.29Å; A138-I196 WeakPolarHBondContact O-CG1 3.25Å
139	R	94.6	Very high	86	Confident	29 Å²	29	69.7 Å²	69.7	11%	0.109	33%	0.334	C	S	.	.	H	α-helix	trans	-64.5	-46.2	178.6	-69.6	-176.1	64	78.8	10.3	112.6	V46 V135 S136 I137 I141 G142 E143 E195 H198 S199	V46-R139 VanDerWaalsContact CG1-NH2 3.31Å; V135-R139 HydrophobicContact CG1-CG 4.33Å; V135-R139 WeakPolarHBondContact O-CB 3.45Å; V135-R139 VanDerWaalsContact O-CG 3.26Å; V135-R139 WeakPolarHBondContact O-CG 3.37Å; V135-R139 PolarHBondContact O-N 2.97Å; S136-R139 PolarHBondContact O-N 3.41Å; I137-R139 VanDerWaalsContact C-N 3.26Å; I137-R139 PolarHBondContact O-N 3.48Å; R139-I141 VanDerWaalsContact C-N 3.26Å; R139-I141 PolarHBondContact O-N 3.03Å; R139-G142 PolarHBondContact O-N 3.14Å; R139-G142 VanDerWaalsContact O-N 3.07Å; R139-E143 WeakPolarHBondContact O-CG 3.34Å; R139-E143 PolarHBondContact O-N 3.13Å; R139-E195 IonicContact NH1-OE2 3.51Å; R139-H198 PolarHBondContact NH1-ND1 2.83Å; R139-S199 VanDerWaalsContact CA-OG 3.31Å; R139-S199 WeakPolarHBondContact CA-OG 3.42Å; R139-S199 VanDerWaalsContact O-CB 3.29Å; R139-S199 WeakPolarHBondContact O-CB 3.19Å; R139-S199 PolarHBondContact O-OG 3.34Å
140	R	93	Very high	86.1	Confident	159 Å²	159	72.6 Å²	72.6	60%	0.6	34%	0.335	S	S	*	.	H	α-helix	trans	-59.3	-36.5	174.8	-78.7	174.9	170.9	-172.8	-0.6	112.8	S136 I137 K144	S136-R140 WeakPolarHBondContact O-CB 3.22Å; S136-R140 WeakPolarHBondContact O-CG 3.18Å; S136-R140 PolarHBondContact O-N 2.88Å; I137-R140 PolarHBondContact O-N 3.2Å; R140-K144 WeakPolarHBondContact O-CB 3.37Å; R140-K144 WeakPolarHBondContact O-CG 3.35Å; R140-K144 PolarHBondContact O-N 3.17Å
141	I	90.5	Very high	86.5	Confident	39 Å²	39	72.3 Å²	72.3	20%	0.2	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-53.8	173.3	-71.3	170.9	0	0	0	108.5	F119 I137 A138 R139 E143 K144 H145 I196	F119-I141 HydrophobicContact CD2-CD1 3.64Å; F119-I141 HydrophobicContact CE2-CD1 3.98Å; I137-I141 HydrophobicContact CG2-CD1 3.89Å; I137-I141 HydrophobicContact CG2-CG1 4.37Å; I137-I141 VanDerWaalsContact O-CG1 3.3Å; I137-I141 WeakPolarHBondContact O-CG1 3.35Å; I137-I141 PolarHBondContact O-N 3.36Å; A138-I141 WeakPolarHBondContact O-CB 3.26Å; A138-I141 PolarHBondContact O-N 3.01Å; R139-I141 VanDerWaalsContact C-N 3.26Å; R139-I141 PolarHBondContact O-N 3.03Å; I141-E143 PolarHBondContact O-N 3.2Å; I141-K144 PolarHBondContact O-N 2.84Å; I141-H145 WeakPolarHBondContact CG2-CE1 3.36Å; I141-H145 WeakPolarHBondContact CG2-ND1 3.39Å; I141-H145 PolarHBondContact O-N 2.82Å; I141-H145 PolarHBondContact O-ND1 2.59Å; I141-I196 HydrophobicContact CB-CG1 4.33Å; I141-I196 HydrophobicContact CG2-CD1 4.03Å; I141-I196 HydrophobicContact CG2-CG1 4.15Å; I141-I196 HydrophobicContact CG2-CG2 3.96Å
142	G	91.5	Very high	86.8	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.8	-42.4	-178.7	0	0	0	0	0	113.8	A138 R139 K144 H145 I196 S199 F200	A138-G142 PolarHBondContact O-N 2.67Å; A138-G142 VanDerWaalsContact O-N 3.08Å; R139-G142 PolarHBondContact O-N 3.14Å; R139-G142 VanDerWaalsContact O-N 3.07Å; G142-K144 VanDerWaalsContact C-N 3.35Å; G142-K144 PolarHBondContact O-N 3.07Å; G142-H145 PolarHBondContact O-N 3.24Å; G142-H145 VanDerWaalsContact O-N 3.11Å; G142-I196 WeakPolarHBondContact CA-O 3.28Å; G142-S199 VanDerWaalsContact CA-OG 3.25Å; G142-S199 WeakPolarHBondContact CA-OG 3.43Å; G142-F200 WeakPolarHBondContact O-CA 3.3Å
143	E	93.2	Very high	86.7	Confident	68 Å²	68	69.6 Å²	69.6	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-58.5	-45.2	175	-71.1	157.3	-163.3	0	0	111.6	R139 I141 H145 V146 E203	R139-E143 WeakPolarHBondContact O-CG 3.34Å; R139-E143 PolarHBondContact O-N 3.13Å; I141-E143 PolarHBondContact O-N 3.2Å; E143-H145 VanDerWaalsContact C-N 3.29Å; E143-H145 PolarHBondContact O-N 3.29Å; E143-V146 PolarHBondContact O-N 2.83Å; E143-E203 HydrophobicContact CB-CB 4.48Å; E143-E203 HydrophobicContact CB-CG 4.37Å; E143-E203 HydrophobicContact CG-CB 4.26Å
144	K	88.1	Confident	86.5	Confident	144 Å²	144	65.9 Å²	65.9	63%	0.626	30%	0.303	S	S	*	.	H	α-helix	trans	-66.5	-31.7	177.3	-76.6	-174.2	177.4	-172.2	0	112.6	R140 I141 G142 V146 N147	R140-K144 WeakPolarHBondContact O-CB 3.37Å; R140-K144 WeakPolarHBondContact O-CG 3.35Å; R140-K144 PolarHBondContact O-N 3.17Å; I141-K144 PolarHBondContact O-N 2.84Å; G142-K144 VanDerWaalsContact C-N 3.35Å; G142-K144 PolarHBondContact O-N 3.07Å; K144-V146 PolarHBondContact O-N 3.44Å; K144-N147 WeakPolarHBondContact O-CB 3.3Å; K144-N147 PolarHBondContact O-N 3.09Å; K144-N147 VanDerWaalsContact O-N 3.12Å; K144-N147 PolarHBondContact O-ND2 3.5Å; K144-N147 VanDerWaalsContact O-ND2 3.14Å
145	H	87.5	Confident	86.1	Confident	52 Å²	52	68.3 Å²	68.3	24%	0.241	32%	0.323	C	S	.	.	H	α-helix	trans	-66.8	-22.3	-176.4	-82	67.5	0	0	0	113.1	I141 G142 E143 N147 F148 V151 F200	I141-H145 WeakPolarHBondContact CG2-CE1 3.36Å; I141-H145 WeakPolarHBondContact CG2-ND1 3.39Å; I141-H145 PolarHBondContact O-N 2.82Å; I141-H145 PolarHBondContact O-ND1 2.59Å; G142-H145 PolarHBondContact O-N 3.24Å; G142-H145 VanDerWaalsContact O-N 3.11Å; E143-H145 VanDerWaalsContact C-N 3.29Å; E143-H145 PolarHBondContact O-N 3.29Å; H145-N147 PolarHBondContact O-N 3.26Å; H145-N147 VanDerWaalsContact O-N 3.16Å; H145-F148 PolarHBondContact O-N 3.27Å; H145-F148 VanDerWaalsContact O-N 3.1Å; H145-V151 HydrophobicContact CB-CG1 4.21Å; H145-F200 HydrophobicContact CB-CD2 3.88Å; H145-F200 HydrophobicContact CB-CE2 4.28Å
146	V	86.8	Confident	85.8	Confident	20 Å²	20	73 Å²	73	12%	0.121	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.1	173.8	-175.2	0	0	0	0	112.6	E143 K144 F148 F200 E203 L204	E143-V146 PolarHBondContact O-N 2.83Å; K144-V146 PolarHBondContact O-N 3.44Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.14Å; V146-F200 HydrophobicContact CB-CD2 4.36Å; V146-F200 HydrophobicContact CB-CE2 4.28Å; V146-F200 HydrophobicContact CG2-CB 4.42Å; V146-F200 HydrophobicContact CG2-CD2 3.46Å; V146-F200 VanDerWaalsContact CG2-CD2 3.46Å; V146-F200 HydrophobicContact CG2-CE2 3.76Å; V146-F200 HydrophobicContact CG2-CG 3.9Å; V146-F200 HydrophobicContact CG2-CZ 4.42Å; V146-F200 WeakPolarHBondContact CG2-O 3.49Å; V146-E203 HydrophobicContact CB-CG 4.1Å; V146-E203 HydrophobicContact CG1-CG 4.43Å; V146-E203 HydrophobicContact CG2-CB 3.85Å; V146-E203 HydrophobicContact CG2-CG 3.78Å; V146-L204 HydrophobicContact CG1-CB 4.23Å; V146-L204 HydrophobicContact CG1-CD1 3.99Å; V146-L204 HydrophobicContact CG2-CB 4.35Å
147	N	84.3	Confident	85.7	Confident	100 Å²	100	72 Å²	72	54%	0.535	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-13.2	177.7	-59.9	-51.9	0	0	0	113.8	K144 H145 R207	K144-N147 WeakPolarHBondContact O-CB 3.3Å; K144-N147 PolarHBondContact O-N 3.09Å; K144-N147 VanDerWaalsContact O-N 3.12Å; K144-N147 PolarHBondContact O-ND2 3.5Å; K144-N147 VanDerWaalsContact O-ND2 3.14Å; H145-N147 PolarHBondContact O-N 3.26Å; H145-N147 VanDerWaalsContact O-N 3.16Å; N147-R207 PolarHBondContact OD1-NH1 3.28Å; N147-R207 PolarHBondContact OD1-NH2 3.49Å
148	F	80	Confident	85.7	Confident	115 Å²	115	71.7 Å²	71.7	50%	0.504	33%	0.329	S	S	.	.	S	Bend	trans	-93.6	109.3	-179.9	-60.9	-69.7	0	0	0	109.7	H145 V146 W150 V151	H145-F148 PolarHBondContact O-N 3.27Å; H145-F148 VanDerWaalsContact O-N 3.1Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.14Å; F148-W150 PolarHBondContact O-N 2.65Å; F148-V151 HydrophobicContact CB-CB 3.96Å; F148-V151 HydrophobicContact CB-CG2 3.46Å; F148-V151 VanDerWaalsContact CB-CG2 3.46Å; F148-V151 HydrophobicContact CD2-CG2 4.44Å; F148-V151 HydrophobicContact CG-CG2 4.27Å; F148-V151 PolarHBondContact O-N 3.22Å
149	R	73.2	Confident	85.7	Confident	212 Å²	212	76.4 Å²	76.4	80%	0.8	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-38.5	-173.8	179.5	177.7	175.7	168.5	-0.2	114.5
150	W	77.1	Confident	85.7	Confident	151 Å²	151	77.3 Å²	77.3	57%	0.572	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-6.8	-174.5	-51.8	117	0	0	0	113.7	V92 F148 T152	V92-W150 HydrophobicContact CG1-CB 4.48Å; F148-W150 PolarHBondContact O-N 2.65Å; W150-T152 PolarHBondContact O-N 3.48Å
151	V	75.4	Confident	85.7	Confident	28 Å²	28	71.2 Å²	71.2	17%	0.17	34%	0.338	C	S	.	.			trans	-80.9	114.1	-179.2	174.7	0	0	0	0	109.1	V92 H145 F148 F200	V92-V151 HydrophobicContact CG1-CG2 4.01Å; H145-V151 HydrophobicContact CB-CG1 4.21Å; F148-V151 HydrophobicContact CB-CB 3.96Å; F148-V151 HydrophobicContact CB-CG2 3.46Å; F148-V151 VanDerWaalsContact CB-CG2 3.46Å; F148-V151 HydrophobicContact CD2-CG2 4.44Å; F148-V151 HydrophobicContact CG-CG2 4.27Å; F148-V151 PolarHBondContact O-N 3.22Å; V151-F200 HydrophobicContact CG1-CE2 4.28Å
152	T	77	Confident	86	Confident	74 Å²	74	70.6 Å²	70.6	45%	0.454	33%	0.334	S	S	.	.			trans	-106.6	157.6	164.1	62.2	0	0	0	0	109.6	W150 D154 W158	W150-T152 PolarHBondContact O-N 3.48Å; T152-D154 PolarHBondContact O-N 2.83Å; T152-W158 PolarHBondContact O-NE1 3.22Å; T152-W158 VanDerWaalsContact O-NE1 3.16Å
153	F	79.8	Confident	86.3	Confident	22 Å²	22	72.3 Å²	72.3	10%	0.096	35%	0.352	C	S	.	.			trans	-91.1	46.1	170.3	-121.8	-75.1	0	0	0	111.8	A155 W158 I193 I196 K197 F200	F153-A155 PolarHBondContact O-N 2.74Å; F153-W158 AromaticContact CD1-CD1 3.61Å; F153-W158 AromaticContact CD1-CD2 3.98Å; F153-W158 HydrophobicContact CD1-CD2 3.98Å; F153-W158 AromaticContact CD1-CE2 3.84Å; F153-W158 AromaticContact CD1-CG 3.85Å; F153-W158 HydrophobicContact CD1-CG 3.85Å; F153-W158 AromaticContact CD1-NE1 3.61Å; F153-W158 AromaticContact CD2-CE2 3.93Å; F153-W158 AromaticContact CD2-CZ2 3.93Å; F153-W158 HydrophobicContact CD2-CZ2 3.93Å; F153-W158 AromaticContact CD2-NE1 3.93Å; F153-W158 HydrophobicContact CE1-CB 4.33Å; F153-W158 AromaticContact CE1-CD1 3.77Å; F153-W158 AromaticContact CE1-CD2 3.31Å; F153-W158 HydrophobicContact CE1-CD2 3.31Å; F153-W158 AromaticContact CE1-CE2 3.45Å; F153-W158 VanDerWaalsContact CE1-CE2 3.45Å; F153-W158 AromaticContact CE1-CE3 3.79Å; F153-W158 HydrophobicContact CE1-CE3 3.79Å; F153-W158 AromaticContact CE1-CG 3.55Å; F153-W158 HydrophobicContact CE1-CG 3.55Å; F153-W158 HydrophobicContact CE1-CH2 4.41Å; F153-W158 HydrophobicContact CE1-CZ2 4.02Å; F153-W158 HydrophobicContact CE1-CZ3 4.3Å; F153-W158 AromaticContact CE1-NE1 3.72Å; F153-W158 HydrophobicContact CE2-CD2 4.2Å; F153-W158 AromaticContact CE2-CE2 3.54Å; F153-W158 AromaticContact CE2-CH2 3.73Å; F153-W158 HydrophobicContact CE2-CH2 3.73Å; F153-W158 AromaticContact CE2-CZ2 3.28Å; F153-W158 HydrophobicContact CE2-CZ2 3.28Å; F153-W158 HydrophobicContact CE2-CZ3 4.35Å; F153-W158 AromaticContact CG-NE1 3.74Å; F153-W158 AromaticContact CZ-CD2 3.46Å; F153-W158 HydrophobicContact CZ-CD2 3.46Å; F153-W158 VanDerWaalsContact CZ-CD2 3.46Å; F153-W158 AromaticContact CZ-CE2 3.29Å; F153-W158 AromaticContact CZ-CE3 3.64Å; F153-W158 HydrophobicContact CZ-CE3 3.64Å; F153-W158 HydrophobicContact CZ-CG 4.2Å; F153-W158 AromaticContact CZ-CH2 3.53Å; F153-W158 HydrophobicContact CZ-CH2 3.53Å; F153-W158 AromaticContact CZ-CZ2 3.34Å; F153-W158 HydrophobicContact CZ-CZ2 3.34Å; F153-W158 AromaticContact CZ-CZ3 3.67Å; F153-W158 HydrophobicContact CZ-CZ3 3.67Å; F153-W158 AromaticContact CZ-NE1 3.93Å; F153-I193 HydrophobicContact CE1-CG2 4.13Å; F153-I196 HydrophobicContact CE2-CB 4.38Å; F153-I196 HydrophobicContact CE2-CG2 3.57Å; F153-I196 HydrophobicContact CZ-CB 3.88Å; F153-I196 HydrophobicContact CZ-CG2 3.47Å; F153-I196 VanDerWaalsContact CZ-CG2 3.47Å; F153-K197 HydrophobicContact CB-CG 4.35Å; F153-K197 HydrophobicContact CD1-CB 3.52Å; F153-K197 HydrophobicContact CD1-CD 3.94Å; F153-K197 HydrophobicContact CD1-CG 3.53Å; F153-K197 HydrophobicContact CE1-CB 3.38Å; F153-K197 HydrophobicContact CE1-CD 4.47Å; F153-K197 HydrophobicContact CE1-CG 3.97Å; F153-K197 HydrophobicContact CE2-CB 4.41Å; F153-K197 HydrophobicContact CG-CB 4.09Å; F153-K197 HydrophobicContact CG-CG 3.89Å; F153-K197 VanDerWaalsContact CZ-CA 3.45Å; F153-K197 HydrophobicContact CZ-CB 3.86Å; F153-K197 VanDerWaalsContact CZ-N 3.33Å; F153-F200 HydrophobicContact CB-CD1 4.11Å; F153-F200 HydrophobicContact CB-CE1 4.27Å; F153-F200 HydrophobicContact CD2-CB 3.74Å; F153-F200 AromaticContact CD2-CD1 3.8Å; F153-F200 HydrophobicContact CD2-CD1 3.8Å; F153-F200 HydrophobicContact CD2-CD2 4.08Å; F153-F200 HydrophobicContact CD2-CE1 4.44Å; F153-F200 AromaticContact CD2-CG 3.61Å; F153-F200 HydrophobicContact CD2-CG 3.61Å; F153-F200 HydrophobicContact CE2-CB 3.97Å; F153-F200 HydrophobicContact CE2-CG 4.23Å; F153-F200 HydrophobicContact CG-CD1 4.38Å
154	D	83.1	Confident	86.5	Confident	66 Å²	66	69.8 Å²	69.8	35%	0.353	34%	0.341	S	S	.	.			trans	-62.2	123.8	175.2	-163.5	-39.6	0	0	0	109.5	T152 E156 Y157 W158	T152-D154 PolarHBondContact O-N 2.83Å; D154-E156 PolarHBondContact O-N 3.16Å; D154-E156 WeakPolarHBondContact OD1-CB 3.49Å; D154-E156 PolarHBondContact OD1-N 3.18Å; D154-Y157 HydrophobicContact CB-CD2 3.86Å; D154-Y157 HydrophobicContact CB-CE2 4.07Å; D154-Y157 HydrophobicContact CB-CG 4.14Å; D154-Y157 PolarHBondContact O-N 3.04Å; D154-W158 VanDerWaalsContact O-CD1 3.28Å; D154-W158 PolarHBondContact O-N 2.77Å
155	A	82.7	Confident	87	Confident	53 Å²	53	63.2 Å²	63.2	44%	0.438	31%	0.312	S	S	.	.	H	α-helix	trans	-57.3	-35.1	-178.9	0	0	0	0	0	111.4	F153 Y157 L159	F153-A155 PolarHBondContact O-N 2.74Å; A155-Y157 PolarHBondContact O-N 3.48Å; A155-L159 HydrophobicContact CB-CD1 4.36Å; A155-L159 WeakPolarHBondContact O-CB 3.35Å; A155-L159 WeakPolarHBondContact O-CD1 3.36Å; A155-L159 WeakPolarHBondContact O-CG 3.2Å; A155-L159 PolarHBondContact O-N 3.03Å
156	E	87.4	Confident	87.5	Confident	107 Å²	107	61.7 Å²	61.7	50%	0.5	31%	0.306	S	S	.	.	H	α-helix	trans	-58.1	-48.5	179.2	-169.6	-170.5	157.2	0	0	111.3	N86 D154 L160	N86-E156 PolarHBondContact ND2-OE1 3.44Å; D154-E156 PolarHBondContact O-N 3.16Å; D154-E156 WeakPolarHBondContact OD1-CB 3.49Å; D154-E156 PolarHBondContact OD1-N 3.18Å; E156-L160 VanDerWaalsContact O-CB 3.28Å; E156-L160 WeakPolarHBondContact O-CB 3.46Å; E156-L160 PolarHBondContact O-N 2.93Å
157	Y	90.5	Very high	88.1	Confident	32 Å²	32	64.7 Å²	64.7	13%	0.125	32%	0.322	C	S	.	.	H	α-helix	trans	-70.1	-46.2	-173.9	-56.8	-14.7	0	0	0	111.8	K88 I89 V92 D154 A155 L160 M161	K88-Y157 HydrophobicContact CB-CE1 4.34Å; K88-Y157 WeakPolarHBondContact CB-OH 3.24Å; K88-Y157 WeakPolarHBondContact CD-OH 3.45Å; I89-Y157 HydrophobicContact CD1-CD1 3.91Å; I89-Y157 HydrophobicContact CD1-CG 4.03Å; I89-Y157 HydrophobicContact CG1-CD1 3.65Å; I89-Y157 HydrophobicContact CG1-CD2 4.31Å; I89-Y157 HydrophobicContact CG1-CE1 4.23Å; I89-Y157 HydrophobicContact CG1-CG 3.73Å; V92-Y157 HydrophobicContact CG2-CE2 4.37Å; D154-Y157 HydrophobicContact CB-CD2 3.86Å; D154-Y157 HydrophobicContact CB-CE2 4.07Å; D154-Y157 HydrophobicContact CB-CG 4.14Å; D154-Y157 PolarHBondContact O-N 3.04Å; A155-Y157 PolarHBondContact O-N 3.48Å; Y157-L160 PolarHBondContact O-N 3.41Å; Y157-M161 WeakPolarHBondContact O-CB 3.41Å; Y157-M161 WeakPolarHBondContact O-CG 3.29Å; Y157-M161 PolarHBondContact O-N 3.07Å
158	W	90.3	Very high	88.7	Confident	32 Å²	32	59.9 Å²	59.9	12%	0.121	30%	0.296	C	S	.	.	H	α-helix	trans	-70.7	-35	-177.8	-72.5	84.8	0	0	0	112.1	T152 F153 D154 K162 I193 I196	T152-W158 PolarHBondContact O-NE1 3.22Å; T152-W158 VanDerWaalsContact O-NE1 3.16Å; F153-W158 AromaticContact CD1-CD1 3.61Å; F153-W158 AromaticContact CD1-CD2 3.98Å; F153-W158 HydrophobicContact CD1-CD2 3.98Å; F153-W158 AromaticContact CD1-CE2 3.84Å; F153-W158 AromaticContact CD1-CG 3.85Å; F153-W158 HydrophobicContact CD1-CG 3.85Å; F153-W158 AromaticContact CD1-NE1 3.61Å; F153-W158 AromaticContact CD2-CE2 3.93Å; F153-W158 AromaticContact CD2-CZ2 3.93Å; F153-W158 HydrophobicContact CD2-CZ2 3.93Å; F153-W158 AromaticContact CD2-NE1 3.93Å; F153-W158 HydrophobicContact CE1-CB 4.33Å; F153-W158 AromaticContact CE1-CD1 3.77Å; F153-W158 AromaticContact CE1-CD2 3.31Å; F153-W158 HydrophobicContact CE1-CD2 3.31Å; F153-W158 AromaticContact CE1-CE2 3.45Å; F153-W158 VanDerWaalsContact CE1-CE2 3.45Å; F153-W158 AromaticContact CE1-CE3 3.79Å; F153-W158 HydrophobicContact CE1-CE3 3.79Å; F153-W158 AromaticContact CE1-CG 3.55Å; F153-W158 HydrophobicContact CE1-CG 3.55Å; F153-W158 HydrophobicContact CE1-CH2 4.41Å; F153-W158 HydrophobicContact CE1-CZ2 4.02Å; F153-W158 HydrophobicContact CE1-CZ3 4.3Å; F153-W158 AromaticContact CE1-NE1 3.72Å; F153-W158 HydrophobicContact CE2-CD2 4.2Å; F153-W158 AromaticContact CE2-CE2 3.54Å; F153-W158 AromaticContact CE2-CH2 3.73Å; F153-W158 HydrophobicContact CE2-CH2 3.73Å; F153-W158 AromaticContact CE2-CZ2 3.28Å; F153-W158 HydrophobicContact CE2-CZ2 3.28Å; F153-W158 HydrophobicContact CE2-CZ3 4.35Å; F153-W158 AromaticContact CG-NE1 3.74Å; F153-W158 AromaticContact CZ-CD2 3.46Å; F153-W158 HydrophobicContact CZ-CD2 3.46Å; F153-W158 VanDerWaalsContact CZ-CD2 3.46Å; F153-W158 AromaticContact CZ-CE2 3.29Å; F153-W158 AromaticContact CZ-CE3 3.64Å; F153-W158 HydrophobicContact CZ-CE3 3.64Å; F153-W158 HydrophobicContact CZ-CG 4.2Å; F153-W158 AromaticContact CZ-CH2 3.53Å; F153-W158 HydrophobicContact CZ-CH2 3.53Å; F153-W158 AromaticContact CZ-CZ2 3.34Å; F153-W158 HydrophobicContact CZ-CZ2 3.34Å; F153-W158 AromaticContact CZ-CZ3 3.67Å; F153-W158 HydrophobicContact CZ-CZ3 3.67Å; F153-W158 AromaticContact CZ-NE1 3.93Å; D154-W158 VanDerWaalsContact O-CD1 3.28Å; D154-W158 PolarHBondContact O-N 2.77Å; W158-K162 WeakPolarHBondContact O-CB 3.25Å; W158-K162 PolarHBondContact O-N 3.33Å; W158-I193 HydrophobicContact CB-CG2 4.19Å; W158-I193 HydrophobicContact CE3-CG1 4.29Å; W158-I193 HydrophobicContact CE3-CG2 4.06Å; W158-I196 HydrophobicContact CH2-CG2 3.89Å; W158-I196 HydrophobicContact CZ3-CD1 4.28Å; W158-I196 HydrophobicContact CZ3-CG2 4.14Å
159	L	92.6	Very high	89.6	Confident	101 Å²	101	54.4 Å²	54.4	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-70.5	-39.5	174.5	-69.3	174	0	0	0	111.9	A155 K162 G163	A155-L159 HydrophobicContact CB-CD1 4.36Å; A155-L159 WeakPolarHBondContact O-CB 3.35Å; A155-L159 WeakPolarHBondContact O-CD1 3.36Å; A155-L159 WeakPolarHBondContact O-CG 3.2Å; A155-L159 PolarHBondContact O-N 3.03Å; L159-K162 PolarHBondContact O-N 2.69Å; L159-G163 PolarHBondContact O-N 3Å
160	L	94.6	Very high	90.7	Very high	49 Å²	49	44.9 Å²	44.9	26%	0.257	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-49.5	173.7	178.6	60.9	0	0	0	111	N86 I89 E156 Y157 K162 G163 I164	N86-L160 HydrophobicContact CB-CD2 3.84Å; I89-L160 HydrophobicContact CD1-CD2 3.79Å; E156-L160 VanDerWaalsContact O-CB 3.28Å; E156-L160 WeakPolarHBondContact O-CB 3.46Å; E156-L160 PolarHBondContact O-N 2.93Å; Y157-L160 PolarHBondContact O-N 3.41Å; L160-K162 PolarHBondContact O-N 3.16Å; L160-G163 PolarHBondContact O-N 2.95Å; L160-I164 HydrophobicContact CD1-CD1 3.75Å; L160-I164 HydrophobicContact CD1-CG1 4.23Å; L160-I164 HydrophobicContact CG-CD1 3.97Å; L160-I164 WeakPolarHBondContact O-CG1 3.41Å; L160-I164 PolarHBondContact O-N 3.42Å
161	M	94	Very high	91.6	Very high	30 Å²	30	40.7 Å²	40.7	15%	0.148	23%	0.232	C	C	.	.	H	α-helix	trans	-55.6	-48.5	175.5	-79.8	-176.4	67.2	0	0	111.9	V82 F93 Y157 I164 M165	V82-M161 HydrophobicContact CG1-CG 3.71Å; V82-M161 HydrophobicContact CG2-CB 4.46Å; V82-M161 HydrophobicContact CG2-CG 3.94Å; F93-M161 HydrophobicContact CE2-SD 4.46Å; F93-M161 HydrophobicContact CZ-CE 4.37Å; F93-M161 HydrophobicContact CZ-SD 4.46Å; Y157-M161 WeakPolarHBondContact O-CB 3.41Å; Y157-M161 WeakPolarHBondContact O-CG 3.29Å; Y157-M161 PolarHBondContact O-N 3.07Å; M161-I164 PolarHBondContact O-N 3.34Å; M161-M165 HydrophobicContact CB-CE 4.06Å; M161-M165 HydrophobicContact CE-CE 3.82Å; M161-M165 VanDerWaalsContact O-CG 3.26Å; M161-M165 WeakPolarHBondContact O-CG 3.31Å; M161-M165 PolarHBondContact O-N 3.47Å
162	K	96.7	Very high	92.6	Very high	26 Å²	26	44 Å²	44	11%	0.113	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-48.6	175.6	-173.4	-167.6	60.6	155.9	0	111.7	W158 L159 L160 I164 M165 V166 N186 L189 S190 I193	W158-K162 WeakPolarHBondContact O-CB 3.25Å; W158-K162 PolarHBondContact O-N 3.33Å; L159-K162 PolarHBondContact O-N 2.69Å; L160-K162 PolarHBondContact O-N 3.16Å; K162-I164 VanDerWaalsContact C-N 3.32Å; K162-I164 PolarHBondContact O-N 3.35Å; K162-M165 PolarHBondContact O-N 3.45Å; K162-V166 HydrophobicContact CG-CG2 4.4Å; K162-V166 WeakPolarHBondContact O-CG2 3.23Å; K162-V166 PolarHBondContact O-N 3.38Å; K162-N186 WeakPolarHBondContact CE-OD1 3.27Å; K162-N186 PolarHBondContact NZ-OD1 3.5Å; K162-L189 HydrophobicContact CD-CB 4.32Å; K162-L189 HydrophobicContact CG-CB 3.93Å; K162-S190 WeakPolarHBondContact CD-OG 3.3Å; K162-S190 PolarHBondContact NZ-OG 3.42Å; K162-I193 HydrophobicContact CB-CD1 3.59Å; K162-I193 HydrophobicContact CD-CD1 4.15Å; K162-I193 HydrophobicContact CG-CD1 3.86Å
163	G	98	Very high	93.5	Very high	36 Å²	36	41.5 Å²	41.5	37%	0.371	23%	0.228	S	C	.	.	H	α-helix	trans	-57.2	-46.8	-178.1	0	0	0	0	0	111.5	L159 L160 V166 D167	L159-G163 PolarHBondContact O-N 3Å; L160-G163 PolarHBondContact O-N 2.95Å; G163-V166 PolarHBondContact O-N 2.96Å; G163-D167 WeakPolarHBondContact O-CB 3.3Å; G163-D167 PolarHBondContact O-N 2.99Å
164	I	98.2	Very high	94	Very high	16 Å²	16	46.5 Å²	46.5	8%	0.082	25%	0.246	C	C	.	.	H	α-helix	trans	-66.5	-42	177.8	-67	170.7	0	0	0	111.5	V78 R81 V82 L160 M161 K162 V166 D167 V168	V78-I164 HydrophobicContact CB-CG2 4.49Å; V78-I164 HydrophobicContact CG1-CG2 4.13Å; R81-I164 HydrophobicContact CB-CD1 4.2Å; R81-I164 HydrophobicContact CB-CG2 3.64Å; V82-I164 HydrophobicContact CB-CD1 4.33Å; V82-I164 HydrophobicContact CG2-CB 4.12Å; V82-I164 HydrophobicContact CG2-CD1 3.73Å; V82-I164 HydrophobicContact CG2-CG2 4.12Å; L160-I164 HydrophobicContact CD1-CD1 3.75Å; L160-I164 HydrophobicContact CD1-CG1 4.23Å; L160-I164 HydrophobicContact CG-CD1 3.97Å; L160-I164 WeakPolarHBondContact O-CG1 3.41Å; L160-I164 PolarHBondContact O-N 3.42Å; M161-I164 PolarHBondContact O-N 3.34Å; K162-I164 VanDerWaalsContact C-N 3.32Å; K162-I164 PolarHBondContact O-N 3.35Å; I164-V166 VanDerWaalsContact C-N 3.34Å; I164-V166 PolarHBondContact O-N 3.4Å; I164-D167 PolarHBondContact O-N 2.66Å; I164-V168 HydrophobicContact CG2-CG2 4.13Å; I164-V168 WeakPolarHBondContact O-CB 3.47Å; I164-V168 VanDerWaalsContact O-CG2 3.29Å; I164-V168 WeakPolarHBondContact O-CG2 3.37Å; I164-V168 PolarHBondContact O-N 2.8Å
165	M	98.1	Very high	94.4	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-56.9	-48.8	175	-73.4	172.9	-152.6	0	0	111.5	V78 L116 F119 L120 M161 K162 I169 L189	V78-M165 HydrophobicContact CG1-CG 3.61Å; L116-M165 HydrophobicContact CD1-CE 3.47Å; L116-M165 VanDerWaalsContact CD1-CE 3.47Å; L116-M165 HydrophobicContact CD1-SD 4.12Å; F119-M165 HydrophobicContact CE1-SD 4.47Å; L120-M165 HydrophobicContact CD2-CG 4.34Å; L120-M165 HydrophobicContact CD2-SD 3.95Å; M161-M165 HydrophobicContact CB-CE 4.06Å; M161-M165 HydrophobicContact CE-CE 3.82Å; M161-M165 VanDerWaalsContact O-CG 3.26Å; M161-M165 WeakPolarHBondContact O-CG 3.31Å; M161-M165 PolarHBondContact O-N 3.47Å; K162-M165 PolarHBondContact O-N 3.45Å; M165-I169 WeakPolarHBondContact O-CB 3.33Å; M165-I169 WeakPolarHBondContact O-CD1 3.33Å; M165-I169 WeakPolarHBondContact O-CG1 3.41Å; M165-I169 PolarHBondContact O-N 2.85Å; M165-L189 HydrophobicContact CB-CD1 3.99Å; M165-L189 HydrophobicContact SD-CD1 4.39Å
166	V	98.4	Very high	94.8	Very high	19 Å²	19	58.5 Å²	58.5	12%	0.115	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-47	179.7	172.9	0	0	0	0	110.8	K162 G163 I164 I169 A170 G182 W185 N186 L189	K162-V166 HydrophobicContact CG-CG2 4.4Å; K162-V166 WeakPolarHBondContact O-CG2 3.23Å; K162-V166 PolarHBondContact O-N 3.38Å; G163-V166 PolarHBondContact O-N 2.96Å; I164-V166 VanDerWaalsContact C-N 3.34Å; I164-V166 PolarHBondContact O-N 3.4Å; V166-I169 PolarHBondContact O-N 2.86Å; V166-A170 VanDerWaalsContact O-CB 3.24Å; V166-A170 WeakPolarHBondContact O-CB 3.36Å; V166-A170 PolarHBondContact O-N 3.42Å; V166-G182 VanDerWaalsContact CG1-O 3.31Å; V166-G182 WeakPolarHBondContact CG1-O 3.23Å; V166-W185 HydrophobicContact CG2-CB 4.32Å; V166-N186 HydrophobicContact CG1-CB 4.3Å; V166-N186 HydrophobicContact CG2-CB 4.08Å; V166-L189 HydrophobicContact CG2-CD1 3.98Å
167	D	98.2	Very high	95.1	Very high	83 Å²	83	55.3 Å²	55.3	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-50	-179.8	-178.9	62.2	0	0	0	111.7	R81 G163 I164 I169 A170 S171	R81-D167 IonicContact CZ-OD2 3.13Å; R81-D167 IonicContact NH1-OD2 2.64Å; R81-D167 PolarHBondContact NH1-OD2 2.96Å; G163-D167 WeakPolarHBondContact O-CB 3.3Å; G163-D167 PolarHBondContact O-N 2.99Å; I164-D167 PolarHBondContact O-N 2.66Å; D167-I169 PolarHBondContact O-N 3.41Å; D167-A170 PolarHBondContact O-N 3.2Å; D167-S171 WeakPolarHBondContact O-CB 3.29Å; D167-S171 PolarHBondContact O-N 2.83Å
168	V	97.9	Very high	95.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-45.5	-179.7	175.9	0	0	0	0	110.6	L74 E77 V78 I164 A170 S171 K172	L74-V168 HydrophobicContact CD1-CG1 3.98Å; L74-V168 HydrophobicContact CG-CG1 3.94Å; E77-V168 HydrophobicContact CB-CG1 4.3Å; E77-V168 HydrophobicContact CG-CG1 4.13Å; E77-V168 HydrophobicContact CG-CG2 4.1Å; V78-V168 HydrophobicContact CG2-CB 3.64Å; V78-V168 HydrophobicContact CG2-CG1 3.81Å; V78-V168 HydrophobicContact CG2-CG2 3.85Å; I164-V168 HydrophobicContact CG2-CG2 4.13Å; I164-V168 WeakPolarHBondContact O-CB 3.47Å; I164-V168 VanDerWaalsContact O-CG2 3.29Å; I164-V168 WeakPolarHBondContact O-CG2 3.37Å; I164-V168 PolarHBondContact O-N 2.8Å; V168-A170 PolarHBondContact O-N 3.45Å; V168-S171 PolarHBondContact O-N 3.22Å; V168-S171 PolarHBondContact O-OG 2.79Å; V168-K172 WeakPolarHBondContact O-CG 3.37Å; V168-K172 PolarHBondContact O-N 2.89Å
169	I	97.6	Very high	95.8	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-45.4	177.7	-68.7	166.5	0	0	0	111.2	L74 L120 M165 V166 D167 S171 K172 Q173 V181 W185	L74-I169 HydrophobicContact CD1-CG1 4.24Å; L74-I169 HydrophobicContact CD2-CG1 4.3Å; L120-I169 HydrophobicContact CD2-CD1 4.29Å; M165-I169 WeakPolarHBondContact O-CB 3.33Å; M165-I169 WeakPolarHBondContact O-CD1 3.33Å; M165-I169 WeakPolarHBondContact O-CG1 3.41Å; M165-I169 PolarHBondContact O-N 2.85Å; V166-I169 PolarHBondContact O-N 2.86Å; D167-I169 PolarHBondContact O-N 3.41Å; I169-S171 VanDerWaalsContact C-N 3.33Å; I169-S171 PolarHBondContact O-N 3.11Å; I169-K172 PolarHBondContact O-N 2.98Å; I169-Q173 WeakPolarHBondContact O-CG 3.35Å; I169-Q173 PolarHBondContact O-NE2 3.42Å; I169-Q173 VanDerWaalsContact O-NE2 3.14Å; I169-V181 HydrophobicContact CG2-CG1 4.14Å; I169-W185 HydrophobicContact CD1-CD2 3.83Å; I169-W185 HydrophobicContact CD1-CE3 3.79Å; I169-W185 HydrophobicContact CD1-CG 4.44Å; I169-W185 HydrophobicContact CD1-CH2 4.05Å; I169-W185 HydrophobicContact CD1-CZ2 4.12Å; I169-W185 HydrophobicContact CD1-CZ3 3.91Å; I169-W185 HydrophobicContact CG2-CD2 4.31Å; I169-W185 HydrophobicContact CG2-CG 4.21Å; I169-W185 HydrophobicContact CG2-CZ2 4.48Å
170	A	97.5	Very high	96	Very high	12 Å²	12	56.6 Å²	56.6	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-37.1	179	0	0	0	0	0	112.1	V166 D167 V168 K172 Q173 A178	V166-A170 VanDerWaalsContact O-CB 3.24Å; V166-A170 WeakPolarHBondContact O-CB 3.36Å; V166-A170 PolarHBondContact O-N 3.42Å; D167-A170 PolarHBondContact O-N 3.2Å; V168-A170 PolarHBondContact O-N 3.45Å; A170-K172 PolarHBondContact O-N 2.7Å; A170-Q173 VanDerWaalsContact O-CB 3.32Å; A170-Q173 WeakPolarHBondContact O-CB 3.3Å; A170-Q173 WeakPolarHBondContact O-CG 3.3Å; A170-Q173 PolarHBondContact O-N 3.42Å; A170-A178 WeakPolarHBondContact O-CB 3.24Å
171	S	96.6	Very high	96.2	Very high	62 Å²	62	54.4 Å²	54.4	43%	0.434	28%	0.277	S	S	.	.	H	α-helix	trans	-64.2	-22.8	178.5	80	0	0	0	0	113.8	D167 V168 I169 Q173	D167-S171 WeakPolarHBondContact O-CB 3.29Å; D167-S171 PolarHBondContact O-N 2.83Å; V168-S171 PolarHBondContact O-N 3.22Å; V168-S171 PolarHBondContact O-OG 2.79Å; I169-S171 VanDerWaalsContact C-N 3.33Å; I169-S171 PolarHBondContact O-N 3.11Å; S171-Q173 PolarHBondContact O-N 3.24Å
172	K	95.7	Very high	96.4	Very high	97 Å²	97	53.3 Å²	53.3	42%	0.422	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.2	175.2	-55.8	-50.3	175.9	-176.8	0	113	I68 L74 E77 V168 I169 A170	I68-K172 HydrophobicContact CG1-CB 4.26Å; I68-K172 HydrophobicContact CG1-CG 4.42Å; L74-K172 HydrophobicContact CD1-CG 3.77Å; E77-K172 WeakPolarHBondContact OE2-CE 3.42Å; E77-K172 IonicContact OE2-NZ 2.91Å; E77-K172 PolarHBondContact OE2-NZ 3.2Å; V168-K172 WeakPolarHBondContact O-CG 3.37Å; V168-K172 PolarHBondContact O-N 2.89Å; I169-K172 PolarHBondContact O-N 2.98Å; A170-K172 PolarHBondContact O-N 2.7Å
173	Q	94.7	Very high	96.5	Very high	22 Å²	22	56.7 Å²	56.7	10%	0.103	29%	0.293	C	S	.	.	S	Bend	trans	-95.1	164.5	-177.4	-47	-53.5	-49.7	0	0	111.6	I169 A170 S171 A178 V181	I169-Q173 WeakPolarHBondContact O-CG 3.35Å; I169-Q173 PolarHBondContact O-NE2 3.42Å; I169-Q173 VanDerWaalsContact O-NE2 3.14Å; A170-Q173 VanDerWaalsContact O-CB 3.32Å; A170-Q173 WeakPolarHBondContact O-CB 3.3Å; A170-Q173 WeakPolarHBondContact O-CG 3.3Å; A170-Q173 PolarHBondContact O-N 3.42Å; S171-Q173 PolarHBondContact O-N 3.24Å; Q173-A178 HydrophobicContact CB-CB 4.48Å; Q173-V181 HydrophobicContact CG-CB 4.03Å; Q173-V181 HydrophobicContact CG-CG1 3.86Å; Q173-V181 HydrophobicContact CG-CG2 3.96Å
174	R	91.8	Very high	96.5	Very high	127 Å²	127	55 Å²	55	48%	0.479	28%	0.276	S	S	.	.			trans	-62.1	143.9	169.6	-64.8	-177.4	-68.8	-166.4	-0.7	109.4	K176 E177 A178	R174-K176 PolarHBondContact O-N 3.14Å; R174-E177 IonicContact CZ-OE1 2.7Å; R174-E177 IonicContact CZ-OE2 2.66Å; R174-E177 VanDerWaalsContact CZ-OE2 3.3Å; R174-E177 IonicContact NE-OE1 3.96Å; R174-E177 IonicContact NE-OE2 2.83Å; R174-E177 PolarHBondContact NE-OE2 2.79Å; R174-E177 IonicContact NH2-OE1 3.3Å; R174-E177 PolarHBondContact NH2-OE1 3.42Å; R174-E177 IonicContact NH2-OE2 2.73Å; R174-E177 PolarHBondContact NH2-OE2 2.94Å; R174-E177 PolarHBondContact O-N 3.12Å; R174-A178 PolarHBondContact O-N 2.99Å
175	H	90.6	Very high	96.5	Very high	179 Å²	179	54.3 Å²	54.3	83%	0.829	27%	0.272	S	S	*	.	H	α-helix	trans	-50.7	-38	-177.3	-172.3	61.3	0	0	0	113.7	E177	H175-E177 VanDerWaalsContact C-N 3.3Å; H175-E177 PolarHBondContact O-N 3.48Å
176	K	92.2	Very high	96.5	Very high	192 Å²	192	56.8 Å²	56.8	84%	0.835	29%	0.286	S	S	*	.	H	α-helix	trans	-67.6	-24.4	178.2	-62.9	-174.8	178.7	-175.9	0	114.5	R174	R174-K176 PolarHBondContact O-N 3.14Å
177	E	93.8	Very high	96.5	Very high	40 Å²	40	60.4 Å²	60.4	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-103.5	-22.6	-177.2	-71.1	167.3	153.8	0	0	112.2	R174 H175 T179 Q180 V181	R174-E177 IonicContact CZ-OE1 2.7Å; R174-E177 IonicContact CZ-OE2 2.66Å; R174-E177 VanDerWaalsContact CZ-OE2 3.3Å; R174-E177 IonicContact NE-OE1 3.96Å; R174-E177 IonicContact NE-OE2 2.83Å; R174-E177 PolarHBondContact NE-OE2 2.79Å; R174-E177 IonicContact NH2-OE1 3.3Å; R174-E177 PolarHBondContact NH2-OE1 3.42Å; R174-E177 IonicContact NH2-OE2 2.73Å; R174-E177 PolarHBondContact NH2-OE2 2.94Å; R174-E177 PolarHBondContact O-N 3.12Å; H175-E177 VanDerWaalsContact C-N 3.3Å; H175-E177 PolarHBondContact O-N 3.48Å; E177-T179 VanDerWaalsContact C-N 3.34Å; E177-T179 PolarHBondContact O-N 2.96Å; E177-Q180 PolarHBondContact O-N 2.93Å; E177-V181 HydrophobicContact CB-CG2 4.44Å; E177-V181 WeakPolarHBondContact O-CG2 3.39Å; E177-V181 PolarHBondContact O-N 3.33Å
178	A	96.8	Very high	96.4	Very high	20 Å²	20	56.5 Å²	56.5	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-50.8	-48	-173.2	0	0	0	0	0	113.1	A170 Q173 R174 Q180 V181 G182	A170-A178 WeakPolarHBondContact O-CB 3.24Å; Q173-A178 HydrophobicContact CB-CB 4.48Å; R174-A178 PolarHBondContact O-N 2.99Å; A178-Q180 PolarHBondContact O-N 3.23Å; A178-V181 PolarHBondContact O-N 2.62Å; A178-G182 PolarHBondContact O-N 2.9Å
179	T	97.7	Very high	96.4	Very high	101 Å²	101	56.5 Å²	56.5	62%	0.62	28%	0.279	S	S	*	.	H	α-helix	trans	-62.4	-41.4	178.4	-52.1	0	0	0	0	112.4	E177 G182 N183	E177-T179 VanDerWaalsContact C-N 3.34Å; E177-T179 PolarHBondContact O-N 2.96Å; T179-G182 PolarHBondContact O-N 2.7Å; T179-N183 WeakPolarHBondContact O-CB 3.31Å; T179-N183 PolarHBondContact O-N 2.72Å; T179-N183 PolarHBondContact O-ND2 3.43Å
180	Q	97.7	Very high	96.4	Very high	71 Å²	71	58.6 Å²	58.6	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-72.3	-41.5	-177.4	-65.6	168.8	-16.5	0	0	111.1	L60 E177 A178 N183 A184	L60-Q180 HydrophobicContact CD1-CB 3.84Å; E177-Q180 PolarHBondContact O-N 2.93Å; A178-Q180 PolarHBondContact O-N 3.23Å; Q180-N183 PolarHBondContact O-N 3.32Å; Q180-A184 PolarHBondContact O-N 3.4Å
181	V	98	Very high	96.3	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-47.1	172.8	172.9	0	0	0	0	110.1	L60 I169 Q173 E177 A178 N183 A184 W185	L60-V181 HydrophobicContact CB-CG2 4.33Å; L60-V181 HydrophobicContact CD2-CG2 3.88Å; I169-V181 HydrophobicContact CG2-CG1 4.14Å; Q173-V181 HydrophobicContact CG-CB 4.03Å; Q173-V181 HydrophobicContact CG-CG1 3.86Å; Q173-V181 HydrophobicContact CG-CG2 3.96Å; E177-V181 HydrophobicContact CB-CG2 4.44Å; E177-V181 WeakPolarHBondContact O-CG2 3.39Å; E177-V181 PolarHBondContact O-N 3.33Å; A178-V181 PolarHBondContact O-N 2.62Å; V181-N183 VanDerWaalsContact C-N 3.32Å; V181-N183 PolarHBondContact O-N 3.01Å; V181-A184 PolarHBondContact O-N 3.39Å; V181-W185 PolarHBondContact O-N 3.44Å
182	G	98.4	Very high	96.2	Very high	8 Å²	8	55.8 Å²	55.8	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-57.4	-44.4	177.6	0	0	0	0	0	112.4	V166 A178 T179 N186	V166-G182 VanDerWaalsContact CG1-O 3.31Å; V166-G182 WeakPolarHBondContact CG1-O 3.23Å; A178-G182 PolarHBondContact O-N 2.9Å; T179-G182 PolarHBondContact O-N 2.7Å; G182-N186 WeakPolarHBondContact O-CB 3.38Å; G182-N186 PolarHBondContact O-N 3.33Å
183	N	98.4	Very high	96.2	Very high	96 Å²	96	52.2 Å²	52.2	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-63.4	-44.2	177.1	-72.3	-16.7	0	0	0	112.7	T179 Q180 V181 N186 K187	T179-N183 WeakPolarHBondContact O-CB 3.31Å; T179-N183 PolarHBondContact O-N 2.72Å; T179-N183 PolarHBondContact O-ND2 3.43Å; Q180-N183 PolarHBondContact O-N 3.32Å; V181-N183 VanDerWaalsContact C-N 3.32Å; V181-N183 PolarHBondContact O-N 3.01Å; N183-N186 PolarHBondContact O-N 3.3Å; N183-K187 PolarHBondContact O-N 2.95Å
184	A	97.9	Very high	96.2	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-47	179.2	0	0	0	0	0	111.6	E57 L60 I61 Q180 V181 N186 K187 L188	E57-A184 HydrophobicContact CB-CB 4.03Å; E57-A184 HydrophobicContact CG-CB 4.15Å; L60-A184 HydrophobicContact CB-CB 4.37Å; I61-A184 HydrophobicContact CD1-CB 4.09Å; I61-A184 HydrophobicContact CG1-CB 3.85Å; Q180-A184 PolarHBondContact O-N 3.4Å; V181-A184 PolarHBondContact O-N 3.39Å; A184-N186 PolarHBondContact O-N 3.24Å; A184-K187 PolarHBondContact O-N 3.45Å; A184-L188 PolarHBondContact O-N 3.35Å; A184-L188 VanDerWaalsContact O-N 3.11Å
185	W	98.3	Very high	96.4	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-39.6	175.3	-85.9	95.4	0	0	0	112.8	I61 S64 W65 L120 C123 A124 V166 I169 V181 K187 L188 L189	I61-W185 HydrophobicContact CG1-CG 4.45Å; I61-W185 HydrophobicContact CG2-CD2 4.49Å; I61-W185 HydrophobicContact CG2-CH2 4.47Å; I61-W185 HydrophobicContact CG2-CZ2 3.97Å; S64-W185 PolarHBondContact OG-NE1 2.98Å; W65-W185 HydrophobicContact CB-CZ2 4.17Å; W65-W185 HydrophobicContact CE3-CH2 4.19Å; W65-W185 HydrophobicContact CE3-CZ2 4.25Å; L120-W185 HydrophobicContact CD2-CZ3 4.17Å; C123-W185 HydrophobicContact CB-CZ3 4.28Å; A124-W185 HydrophobicContact CB-CH2 3.77Å; A124-W185 HydrophobicContact CB-CZ2 4.02Å; V166-W185 HydrophobicContact CG2-CB 4.32Å; I169-W185 HydrophobicContact CD1-CD2 3.83Å; I169-W185 HydrophobicContact CD1-CE3 3.79Å; I169-W185 HydrophobicContact CD1-CG 4.44Å; I169-W185 HydrophobicContact CD1-CH2 4.05Å; I169-W185 HydrophobicContact CD1-CZ2 4.12Å; I169-W185 HydrophobicContact CD1-CZ3 3.91Å; I169-W185 HydrophobicContact CG2-CD2 4.31Å; I169-W185 HydrophobicContact CG2-CG 4.21Å; I169-W185 HydrophobicContact CG2-CZ2 4.48Å; V181-W185 PolarHBondContact O-N 3.44Å; W185-K187 VanDerWaalsContact C-N 3.34Å; W185-K187 PolarHBondContact O-N 2.98Å; W185-L188 HydrophobicContact CE3-CD2 4.46Å; W185-L188 PolarHBondContact O-N 2.86Å; W185-L189 HydrophobicContact CE3-CD1 4.04Å; W185-L189 HydrophobicContact CE3-CD2 4.34Å; W185-L189 HydrophobicContact CE3-CG 4.04Å; W185-L189 HydrophobicContact CZ3-CD2 4.39Å; W185-L189 WeakPolarHBondContact O-CB 3.29Å; W185-L189 WeakPolarHBondContact O-CG 3.45Å; W185-L189 PolarHBondContact O-N 2.93Å
186	N	98.4	Very high	96.5	Very high	59 Å²	59	38 Å²	38	32%	0.316	20%	0.201	S	C	.	.	H	α-helix	trans	-62.5	-40.8	177.1	179.5	55.5	0	0	0	111.9	K162 V166 G182 N183 A184 S190	K162-N186 WeakPolarHBondContact CE-OD1 3.27Å; K162-N186 PolarHBondContact NZ-OD1 3.5Å; V166-N186 HydrophobicContact CG1-CB 4.3Å; V166-N186 HydrophobicContact CG2-CB 4.08Å; G182-N186 WeakPolarHBondContact O-CB 3.38Å; G182-N186 PolarHBondContact O-N 3.33Å; N183-N186 PolarHBondContact O-N 3.3Å; A184-N186 PolarHBondContact O-N 3.24Å; N186-S190 WeakPolarHBondContact O-CB 3.36Å; N186-S190 PolarHBondContact O-N 3.44Å; N186-S190 PolarHBondContact O-OG 2.77Å
187	K	97.8	Very high	96.6	Very high	95 Å²	95	33 Å²	33	41%	0.413	18%	0.179	S	C	.	.	H	α-helix	trans	-60.2	-52.1	173.3	-80.6	-176.4	176.1	179.5	0	111.3	L51 L53 E57 N183 A184 W185 S190 F191	L51-K187 HydrophobicContact CD1-CB 4.19Å; L53-K187 HydrophobicContact CD2-CB 4.19Å; L53-K187 HydrophobicContact CD2-CD 4.4Å; E57-K187 WeakPolarHBondContact OE1-CD 3.4Å; E57-K187 WeakPolarHBondContact OE1-CE 3.38Å; E57-K187 IonicContact OE1-NZ 3.77Å; E57-K187 PolarHBondContact OE1-NZ 2.92Å; E57-K187 IonicContact OE2-NZ 2.74Å; N183-K187 PolarHBondContact O-N 2.95Å; A184-K187 PolarHBondContact O-N 3.45Å; W185-K187 VanDerWaalsContact C-N 3.34Å; W185-K187 PolarHBondContact O-N 2.98Å; K187-S190 PolarHBondContact O-N 3.06Å; K187-F191 PolarHBondContact O-N 3.38Å
188	L	96.9	Very high	96.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.1	-54.5	-179.8	177.6	62.9	0	0	0	111.9	L42 L51 L53 I61 C123 V127 L134 A184 W185 S190 F191 V192	L42-L188 HydrophobicContact CD1-CD1 4.29Å; L51-L188 HydrophobicContact CD2-CD1 4.13Å; L53-L188 HydrophobicContact CD1-CD1 4.47Å; I61-L188 HydrophobicContact CD1-CB 4.14Å; I61-L188 HydrophobicContact CD1-CD2 4.11Å; I61-L188 HydrophobicContact CG2-CD2 3.96Å; C123-L188 HydrophobicContact CB-CD2 4.15Å; V127-L188 HydrophobicContact CG2-CD1 4.13Å; V127-L188 HydrophobicContact CG2-CD2 3.82Å; L134-L188 HydrophobicContact CD2-CD1 3.78Å; A184-L188 PolarHBondContact O-N 3.35Å; A184-L188 VanDerWaalsContact O-N 3.11Å; W185-L188 HydrophobicContact CE3-CD2 4.46Å; W185-L188 PolarHBondContact O-N 2.86Å; L188-S190 VanDerWaalsContact C-N 3.31Å; L188-S190 PolarHBondContact O-N 3.35Å; L188-F191 PolarHBondContact O-N 3.27Å; L188-V192 HydrophobicContact CD1-CG2 4.26Å; L188-V192 WeakPolarHBondContact O-CG2 3.3Å; L188-V192 PolarHBondContact O-N 3.32Å
189	L	97.3	Very high	96.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.6	-31.3	-176.2	-66.9	178	0	0	0	112.3	F119 L120 C123 K162 M165 V166 W185 V192 I193	F119-L189 HydrophobicContact CE1-CD2 4.24Å; F119-L189 HydrophobicContact CZ-CD2 4.47Å; L120-L189 HydrophobicContact CD2-CD2 4.37Å; C123-L189 HydrophobicContact CB-CD2 4.44Å; K162-L189 HydrophobicContact CD-CB 4.32Å; K162-L189 HydrophobicContact CG-CB 3.93Å; M165-L189 HydrophobicContact CB-CD1 3.99Å; M165-L189 HydrophobicContact SD-CD1 4.39Å; V166-L189 HydrophobicContact CG2-CD1 3.98Å; W185-L189 HydrophobicContact CE3-CD1 4.04Å; W185-L189 HydrophobicContact CE3-CD2 4.34Å; W185-L189 HydrophobicContact CE3-CG 4.04Å; W185-L189 HydrophobicContact CZ3-CD2 4.39Å; W185-L189 WeakPolarHBondContact O-CB 3.29Å; W185-L189 WeakPolarHBondContact O-CG 3.45Å; W185-L189 PolarHBondContact O-N 2.93Å; L189-V192 PolarHBondContact O-N 3.41Å; L189-I193 VanDerWaalsContact O-CB 3.29Å; L189-I193 WeakPolarHBondContact O-CB 3.34Å; L189-I193 VanDerWaalsContact O-CG1 3.23Å; L189-I193 WeakPolarHBondContact O-CG1 3.32Å; L189-I193 PolarHBondContact O-N 2.99Å
190	S	97.2	Very high	96.4	Very high	44 Å²	44	28.2 Å²	28.2	31%	0.308	15%	0.146	S	C	.	.	H	α-helix	trans	-64.1	-42.5	174.3	-61.4	0	0	0	0	111.6	K162 N186 K187 L188 A194	K162-S190 WeakPolarHBondContact CD-OG 3.3Å; K162-S190 PolarHBondContact NZ-OG 3.42Å; N186-S190 WeakPolarHBondContact O-CB 3.36Å; N186-S190 PolarHBondContact O-N 3.44Å; N186-S190 PolarHBondContact O-OG 2.77Å; K187-S190 PolarHBondContact O-N 3.06Å; L188-S190 VanDerWaalsContact C-N 3.31Å; L188-S190 PolarHBondContact O-N 3.35Å; S190-A194 WeakPolarHBondContact O-CB 3.1Å; S190-A194 PolarHBondContact O-N 2.97Å
191	F	96.2	Very high	96.2	Very high	16 Å²	16	28.8 Å²	28.8	7%	0.07	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-49.4	174.3	176	-97.1	0	0	0	111.5	L42 R49 L51 V135 K187 L188 I193 A194 E195	L42-F191 HydrophobicContact CB-CE1 3.88Å; L42-F191 HydrophobicContact CB-CZ 4.01Å; R49-F191 HydrophobicContact CB-CE2 4.07Å; L51-F191 HydrophobicContact CB-CB 3.94Å; L51-F191 HydrophobicContact CB-CD1 4.22Å; L51-F191 HydrophobicContact CB-CD2 3.57Å; L51-F191 HydrophobicContact CB-CE2 4.1Å; L51-F191 HydrophobicContact CB-CG 3.63Å; L51-F191 HydrophobicContact CD2-CB 3.74Å; L51-F191 HydrophobicContact CD2-CD1 4.3Å; L51-F191 HydrophobicContact CD2-CG 4.06Å; L51-F191 HydrophobicContact CG-CB 4.33Å; L51-F191 HydrophobicContact CG-CG 4.45Å; V135-F191 HydrophobicContact CG2-CE1 3.81Å; V135-F191 HydrophobicContact CG2-CZ 3.88Å; K187-F191 PolarHBondContact O-N 3.38Å; L188-F191 PolarHBondContact O-N 3.27Å; F191-I193 PolarHBondContact O-N 3.16Å; F191-A194 WeakPolarHBondContact O-CB 3.16Å; F191-A194 PolarHBondContact O-N 2.98Å; F191-E195 HydrophobicContact CE1-CG 4.12Å; F191-E195 HydrophobicContact CZ-CG 4.1Å; F191-E195 PolarHBondContact O-N 3.1Å
192	V	94.9	Very high	96	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-47	-179.6	173	0	0	0	0	111.4	F119 L134 A138 L188 L189 A194 E195 I196	F119-V192 HydrophobicContact CE2-CG1 3.68Å; F119-V192 HydrophobicContact CZ-CG1 3.62Å; L134-V192 HydrophobicContact CD1-CG2 4.16Å; L134-V192 HydrophobicContact CD2-CG2 3.92Å; L134-V192 HydrophobicContact CG-CG2 4.1Å; A138-V192 HydrophobicContact CB-CG1 4.02Å; L188-V192 HydrophobicContact CD1-CG2 4.26Å; L188-V192 WeakPolarHBondContact O-CG2 3.3Å; L188-V192 PolarHBondContact O-N 3.32Å; L189-V192 PolarHBondContact O-N 3.41Å; V192-A194 VanDerWaalsContact C-N 3.3Å; V192-A194 PolarHBondContact O-N 3.03Å; V192-E195 PolarHBondContact O-N 3.16Å; V192-E195 VanDerWaalsContact O-N 3.16Å; V192-I196 HydrophobicContact CG1-CD1 3.94Å; V192-I196 HydrophobicContact CG1-CG1 4.41Å; V192-I196 VanDerWaalsContact O-CG1 3.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.43Å; V192-I196 PolarHBondContact O-N 3.3Å
193	I	94.7	Very high	95.8	Very high	22 Å²	22	33 Å²	33	11%	0.113	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-36.4	178.2	-70.8	170	0	0	0	111.3	F153 W158 K162 L189 F191 E195 I196 K197	F153-I193 HydrophobicContact CE1-CG2 4.13Å; W158-I193 HydrophobicContact CB-CG2 4.19Å; W158-I193 HydrophobicContact CE3-CG1 4.29Å; W158-I193 HydrophobicContact CE3-CG2 4.06Å; K162-I193 HydrophobicContact CB-CD1 3.59Å; K162-I193 HydrophobicContact CD-CD1 4.15Å; K162-I193 HydrophobicContact CG-CD1 3.86Å; L189-I193 VanDerWaalsContact O-CB 3.29Å; L189-I193 WeakPolarHBondContact O-CB 3.34Å; L189-I193 VanDerWaalsContact O-CG1 3.23Å; L189-I193 WeakPolarHBondContact O-CG1 3.32Å; L189-I193 PolarHBondContact O-N 2.99Å; F191-I193 PolarHBondContact O-N 3.16Å; I193-E195 VanDerWaalsContact C-N 3.33Å; I193-E195 PolarHBondContact O-N 3.07Å; I193-I196 PolarHBondContact O-N 3.49Å; I193-K197 WeakPolarHBondContact O-CB 3.45Å; I193-K197 PolarHBondContact O-N 3.49Å
194	A	95.2	Very high	95.4	Very high	27 Å²	27	31.4 Å²	31.4	22%	0.223	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-40.2	174.6	0	0	0	0	0	111.8	R49 S190 F191 V192 K197 H198	R49-A194 PolarHBondContact NH2-O 3.09Å; S190-A194 WeakPolarHBondContact O-CB 3.1Å; S190-A194 PolarHBondContact O-N 2.97Å; F191-A194 WeakPolarHBondContact O-CB 3.16Å; F191-A194 PolarHBondContact O-N 2.98Å; V192-A194 VanDerWaalsContact C-N 3.3Å; V192-A194 PolarHBondContact O-N 3.03Å; A194-K197 PolarHBondContact O-N 2.96Å; A194-H198 WeakPolarHBondContact O-CB 3.41Å; A194-H198 PolarHBondContact O-N 3.49Å
195	E	95	Very high	95	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-44.3	174.5	-70.8	-50.8	109.6	0	0	112.6	S44 S47 R49 A138 R139 F191 V192 I193 K197 H198 S199	S44-E195 VanDerWaalsContact CB-OE2 3.24Å; S44-E195 WeakPolarHBondContact CB-OE2 3.3Å; S44-E195 PolarHBondContact OG-OE2 3.08Å; S47-E195 WeakPolarHBondContact CB-OE1 3.16Å; S47-E195 VanDerWaalsContact OG-CD 3.3Å; S47-E195 PolarHBondContact OG-OE1 3.12Å; S47-E195 PolarHBondContact OG-OE2 2.76Å; R49-E195 IonicContact CZ-OE1 2.79Å; R49-E195 VanDerWaalsContact CZ-OE1 3.24Å; R49-E195 IonicContact NE-OE1 3.99Å; R49-E195 PolarHBondContact NE-OE1 3.1Å; R49-E195 IonicContact NH2-OE1 2.89Å; R49-E195 PolarHBondContact NH2-OE1 3.04Å; A138-E195 HydrophobicContact CB-CB 3.83Å; R139-E195 IonicContact NH1-OE2 3.51Å; F191-E195 HydrophobicContact CE1-CG 4.12Å; F191-E195 HydrophobicContact CZ-CG 4.1Å; F191-E195 PolarHBondContact O-N 3.1Å; V192-E195 PolarHBondContact O-N 3.16Å; V192-E195 VanDerWaalsContact O-N 3.16Å; I193-E195 VanDerWaalsContact C-N 3.33Å; I193-E195 PolarHBondContact O-N 3.07Å; E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 PolarHBondContact O-N 3.37Å; E195-H198 PolarHBondContact O-N 3.32Å; E195-S199 PolarHBondContact O-N 3.18Å; E195-S199 PolarHBondContact O-OG 3.04Å
196	I	94.1	Very high	94.7	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-46.9	174.5	-60.5	167.1	0	0	0	110	F119 A138 I141 G142 F153 W158 V192 I193 H198 S199 F200	F119-I196 HydrophobicContact CE2-CD1 4.01Å; F119-I196 HydrophobicContact CZ-CD1 4.13Å; A138-I196 HydrophobicContact CB-CG1 4.03Å; A138-I196 VanDerWaalsContact O-CG1 3.29Å; A138-I196 WeakPolarHBondContact O-CG1 3.25Å; I141-I196 HydrophobicContact CB-CG1 4.33Å; I141-I196 HydrophobicContact CG2-CD1 4.03Å; I141-I196 HydrophobicContact CG2-CG1 4.15Å; I141-I196 HydrophobicContact CG2-CG2 3.96Å; G142-I196 WeakPolarHBondContact CA-O 3.28Å; F153-I196 HydrophobicContact CE2-CB 4.38Å; F153-I196 HydrophobicContact CE2-CG2 3.57Å; F153-I196 HydrophobicContact CZ-CB 3.88Å; F153-I196 HydrophobicContact CZ-CG2 3.47Å; F153-I196 VanDerWaalsContact CZ-CG2 3.47Å; W158-I196 HydrophobicContact CH2-CG2 3.89Å; W158-I196 HydrophobicContact CZ3-CD1 4.28Å; W158-I196 HydrophobicContact CZ3-CG2 4.14Å; V192-I196 HydrophobicContact CG1-CD1 3.94Å; V192-I196 HydrophobicContact CG1-CG1 4.41Å; V192-I196 VanDerWaalsContact O-CG1 3.31Å; V192-I196 WeakPolarHBondContact O-CG1 3.43Å; V192-I196 PolarHBondContact O-N 3.3Å; I193-I196 PolarHBondContact O-N 3.49Å; I196-H198 VanDerWaalsContact C-N 3.34Å; I196-H198 PolarHBondContact O-N 3.43Å; I196-S199 PolarHBondContact O-N 2.86Å; I196-S199 PolarHBondContact O-OG 3.43Å; I196-F200 VanDerWaalsContact O-CB 3.3Å; I196-F200 WeakPolarHBondContact O-CB 3.47Å; I196-F200 PolarHBondContact O-N 3.05Å
197	K	94.2	Very high	94.1	Very high	87 Å²	87	40.3 Å²	40.3	38%	0.378	21%	0.206	S	C	.	.	H	α-helix	trans	-57.5	-48.9	178.6	-178.5	173.1	177.7	175.8	0	111.4	F153 I193 A194 E195 F200 L201	F153-K197 HydrophobicContact CB-CG 4.35Å; F153-K197 HydrophobicContact CD1-CB 3.52Å; F153-K197 HydrophobicContact CD1-CD 3.94Å; F153-K197 HydrophobicContact CD1-CG 3.53Å; F153-K197 HydrophobicContact CE1-CB 3.38Å; F153-K197 HydrophobicContact CE1-CD 4.47Å; F153-K197 HydrophobicContact CE1-CG 3.97Å; F153-K197 HydrophobicContact CE2-CB 4.41Å; F153-K197 HydrophobicContact CG-CB 4.09Å; F153-K197 HydrophobicContact CG-CG 3.89Å; F153-K197 VanDerWaalsContact CZ-CA 3.45Å; F153-K197 HydrophobicContact CZ-CB 3.86Å; F153-K197 VanDerWaalsContact CZ-N 3.33Å; I193-K197 WeakPolarHBondContact O-CB 3.45Å; I193-K197 PolarHBondContact O-N 3.49Å; A194-K197 PolarHBondContact O-N 2.96Å; E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 PolarHBondContact O-N 3.37Å; K197-F200 PolarHBondContact O-N 3.26Å; K197-L201 HydrophobicContact CG-CD1 3.97Å; K197-L201 HydrophobicContact CG-CG 4.46Å; K197-L201 VanDerWaalsContact O-CG 3.32Å; K197-L201 WeakPolarHBondContact O-CG 3.42Å; K197-L201 PolarHBondContact O-N 3.2Å
198	H	95.3	Very high	93.4	Very high	51 Å²	51	39.9 Å²	39.9	24%	0.236	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-45.1	-175.9	-179	-73.4	0	0	0	111.5	R139 A194 E195 I196 F200 L201 C202	R139-H198 PolarHBondContact NH1-ND1 2.83Å; A194-H198 WeakPolarHBondContact O-CB 3.41Å; A194-H198 PolarHBondContact O-N 3.49Å; E195-H198 PolarHBondContact O-N 3.32Å; I196-H198 VanDerWaalsContact C-N 3.34Å; I196-H198 PolarHBondContact O-N 3.43Å; H198-F200 VanDerWaalsContact C-N 3.35Å; H198-F200 PolarHBondContact O-N 3.29Å; H198-L201 PolarHBondContact O-N 3.46Å; H198-C202 PolarHBondContact CE1-SG 3.01Å; H198-C202 PolarHBondContact O-N 3.04Å; H198-C202 PolarHBondContact O-SG 2.64Å
199	S	94.8	Very high	92.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.8	-36.7	177.9	69.6	0	0	0	0	112.5	R139 G142 E195 I196 C202 E203	R139-S199 VanDerWaalsContact CA-OG 3.31Å; R139-S199 WeakPolarHBondContact CA-OG 3.42Å; R139-S199 VanDerWaalsContact O-CB 3.29Å; R139-S199 WeakPolarHBondContact O-CB 3.19Å; R139-S199 PolarHBondContact O-OG 3.34Å; G142-S199 VanDerWaalsContact CA-OG 3.25Å; G142-S199 WeakPolarHBondContact CA-OG 3.43Å; E195-S199 PolarHBondContact O-N 3.18Å; E195-S199 PolarHBondContact O-OG 3.04Å; I196-S199 PolarHBondContact O-N 2.86Å; I196-S199 PolarHBondContact O-OG 3.43Å; S199-C202 PolarHBondContact O-N 3.29Å; S199-E203 VanDerWaalsContact O-CB 3.3Å; S199-E203 WeakPolarHBondContact O-CB 3.5Å; S199-E203 PolarHBondContact O-N 2.98Å
200	F	93.1	Very high	91.9	Very high	10 Å²	10	50.8 Å²	50.8	4%	0.044	26%	0.263	C	S	.	.	H	α-helix	trans	-57.6	-49.5	171.6	176.2	-85.3	0	0	0	111.7	G142 H145 V146 V151 F153 I196 K197 H198 E203 L204	G142-F200 WeakPolarHBondContact O-CA 3.3Å; H145-F200 HydrophobicContact CB-CD2 3.88Å; H145-F200 HydrophobicContact CB-CE2 4.28Å; V146-F200 HydrophobicContact CB-CD2 4.36Å; V146-F200 HydrophobicContact CB-CE2 4.28Å; V146-F200 HydrophobicContact CG2-CB 4.42Å; V146-F200 HydrophobicContact CG2-CD2 3.46Å; V146-F200 VanDerWaalsContact CG2-CD2 3.46Å; V146-F200 HydrophobicContact CG2-CE2 3.76Å; V146-F200 HydrophobicContact CG2-CG 3.9Å; V146-F200 HydrophobicContact CG2-CZ 4.42Å; V146-F200 WeakPolarHBondContact CG2-O 3.49Å; V151-F200 HydrophobicContact CG1-CE2 4.28Å; F153-F200 HydrophobicContact CB-CD1 4.11Å; F153-F200 HydrophobicContact CB-CE1 4.27Å; F153-F200 HydrophobicContact CD2-CB 3.74Å; F153-F200 AromaticContact CD2-CD1 3.8Å; F153-F200 HydrophobicContact CD2-CD1 3.8Å; F153-F200 HydrophobicContact CD2-CD2 4.08Å; F153-F200 HydrophobicContact CD2-CE1 4.44Å; F153-F200 AromaticContact CD2-CG 3.61Å; F153-F200 HydrophobicContact CD2-CG 3.61Å; F153-F200 HydrophobicContact CE2-CB 3.97Å; F153-F200 HydrophobicContact CE2-CG 4.23Å; F153-F200 HydrophobicContact CG-CD1 4.38Å; I196-F200 VanDerWaalsContact O-CB 3.3Å; I196-F200 WeakPolarHBondContact O-CB 3.47Å; I196-F200 PolarHBondContact O-N 3.05Å; K197-F200 PolarHBondContact O-N 3.26Å; H198-F200 VanDerWaalsContact C-N 3.35Å; H198-F200 PolarHBondContact O-N 3.29Å; F200-E203 PolarHBondContact O-N 3.26Å; F200-L204 HydrophobicContact CE1-CD2 4.03Å; F200-L204 VanDerWaalsContact O-CB 3.3Å; F200-L204 WeakPolarHBondContact O-CB 3.33Å; F200-L204 PolarHBondContact O-N 3.38Å
201	L	93.1	Very high	90.8	Very high	84 Å²	84	55.1 Å²	55.1	44%	0.44	28%	0.278	S	S	.	.	H	α-helix	trans	-66.6	-39.6	-179.2	-68.8	173.9	0	0	0	112.2	K197 H198 N205	K197-L201 HydrophobicContact CG-CD1 3.97Å; K197-L201 HydrophobicContact CG-CG 4.46Å; K197-L201 VanDerWaalsContact O-CG 3.32Å; K197-L201 WeakPolarHBondContact O-CG 3.42Å; K197-L201 PolarHBondContact O-N 3.2Å; H198-L201 PolarHBondContact O-N 3.46Å; L201-N205 WeakPolarHBondContact O-CB 3.43Å; L201-N205 PolarHBondContact O-N 2.97Å
202	C	94.4	Very high	89.5	Confident	46 Å²	46	55.9 Å²	55.9	31%	0.311	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-48.2	173.4	-69.8	0	0	0	0	111.5	H198 S199 N205 N206	H198-C202 PolarHBondContact CE1-SG 3.01Å; H198-C202 PolarHBondContact O-N 3.04Å; H198-C202 PolarHBondContact O-SG 2.64Å; S199-C202 PolarHBondContact O-N 3.29Å; C202-N205 PolarHBondContact O-N 3.48Å; C202-N206 WeakPolarHBondContact O-CB 3.37Å; C202-N206 PolarHBondContact O-N 3.05Å; C202-N206 PolarHBondContact O-ND2 2.91Å; C202-N206 PolarHBondContact O-OD1 3.18Å
203	E	93.8	Very high	88.2	Confident	52 Å²	52	61.7 Å²	61.7	24%	0.243	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-39.6	-178.5	178	59.8	-159.2	0	0	111.7	E143 V146 S199 F200 N206 R207	E143-E203 HydrophobicContact CB-CB 4.48Å; E143-E203 HydrophobicContact CB-CG 4.37Å; E143-E203 HydrophobicContact CG-CB 4.26Å; V146-E203 HydrophobicContact CB-CG 4.1Å; V146-E203 HydrophobicContact CG1-CG 4.43Å; V146-E203 HydrophobicContact CG2-CB 3.85Å; V146-E203 HydrophobicContact CG2-CG 3.78Å; S199-E203 VanDerWaalsContact O-CB 3.3Å; S199-E203 WeakPolarHBondContact O-CB 3.5Å; S199-E203 PolarHBondContact O-N 2.98Å; F200-E203 PolarHBondContact O-N 3.26Å; E203-N206 PolarHBondContact O-N 3.49Å; E203-R207 WeakPolarHBondContact O-CG 3.44Å; E203-R207 PolarHBondContact O-N 3.1Å; E203-R207 IonicContact OE1-CZ 2.72Å; E203-R207 IonicContact OE1-NE 3.97Å; E203-R207 PolarHBondContact OE1-NE 3.31Å; E203-R207 IonicContact OE1-NH2 2.8Å; E203-R207 PolarHBondContact OE1-NH2 2.95Å
204	L	90.4	Very high	87.2	Confident	63 Å²	63	66 Å²	66	33%	0.33	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-45.8	173.6	-177.4	64.6	0	0	0	111.5	V146 F200 N206 R207 N208	V146-L204 HydrophobicContact CG1-CB 4.23Å; V146-L204 HydrophobicContact CG1-CD1 3.99Å; V146-L204 HydrophobicContact CG2-CB 4.35Å; F200-L204 HydrophobicContact CE1-CD2 4.03Å; F200-L204 VanDerWaalsContact O-CB 3.3Å; F200-L204 WeakPolarHBondContact O-CB 3.33Å; F200-L204 PolarHBondContact O-N 3.38Å; L204-N206 PolarHBondContact O-N 3.48Å; L204-R207 PolarHBondContact O-N 3.03Å; L204-N208 VanDerWaalsContact O-CG 3.29Å; L204-N208 PolarHBondContact O-N 2.91Å
205	N	91	Very high	86.1	Confident	96 Å²	96	68 Å²	68	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-45.9	176.9	-172.5	59.9	0	0	0	111.3	L201 C202 R207 N208 T209	L201-N205 WeakPolarHBondContact O-CB 3.43Å; L201-N205 PolarHBondContact O-N 2.97Å; C202-N205 PolarHBondContact O-N 3.48Å; N205-R207 VanDerWaalsContact C-N 3.27Å; N205-R207 PolarHBondContact O-N 3.29Å; N205-N208 PolarHBondContact O-N 3.28Å; N205-T209 PolarHBondContact O-N 2.94Å; N205-T209 PolarHBondContact O-OG1 3.32Å
206	N	91.2	Very high	85.2	Confident	79 Å²	79	72.9 Å²	72.9	42%	0.422	38%	0.381	S	S	.	.	H	α-helix	trans	-57.9	-39.1	177.8	-71.6	-14.4	0	0	0	112.4	C202 E203 L204 K210	C202-N206 WeakPolarHBondContact O-CB 3.37Å; C202-N206 PolarHBondContact O-N 3.05Å; C202-N206 PolarHBondContact O-ND2 2.91Å; C202-N206 PolarHBondContact O-OD1 3.18Å; E203-N206 PolarHBondContact O-N 3.49Å; L204-N206 PolarHBondContact O-N 3.48Å; N206-K210 WeakPolarHBondContact O-CB 3.49Å; N206-K210 VanDerWaalsContact O-CG 3.29Å; N206-K210 WeakPolarHBondContact O-CG 3.33Å; N206-K210 PolarHBondContact O-N 3.2Å; N206-K210 VanDerWaalsContact O-N 3.1Å
207	R	86.2	Confident	84.5	Confident	73 Å²	73	77.2 Å²	77.2	28%	0.275	41%	0.407	S	S	.	.	H	α-helix	trans	-68.8	-44.1	176.5	-71.3	176.3	-171.4	-151.3	-3.2	112.3	N147 E203 L204 N205 T209 K210 Q211	N147-R207 PolarHBondContact OD1-NH1 3.28Å; N147-R207 PolarHBondContact OD1-NH2 3.49Å; E203-R207 WeakPolarHBondContact O-CG 3.44Å; E203-R207 PolarHBondContact O-N 3.1Å; E203-R207 IonicContact OE1-CZ 2.72Å; E203-R207 IonicContact OE1-NE 3.97Å; E203-R207 PolarHBondContact OE1-NE 3.31Å; E203-R207 IonicContact OE1-NH2 2.8Å; E203-R207 PolarHBondContact OE1-NH2 2.95Å; L204-R207 PolarHBondContact O-N 3.03Å; N205-R207 VanDerWaalsContact C-N 3.27Å; N205-R207 PolarHBondContact O-N 3.29Å; R207-T209 VanDerWaalsContact C-N 3.33Å; R207-T209 PolarHBondContact O-N 3.21Å; R207-K210 PolarHBondContact O-N 3.12Å; R207-Q211 WeakPolarHBondContact O-CB 3.3Å; R207-Q211 PolarHBondContact O-N 2.95Å
208	N	83.4	Confident	83.6	Confident	87 Å²	87	80 Å²	80	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-63.2	-41.2	178.6	-68	-11.8	0	0	0	111.2	L204 N205 Q211 G212	L204-N208 VanDerWaalsContact O-CG 3.29Å; L204-N208 PolarHBondContact O-N 2.91Å; N205-N208 PolarHBondContact O-N 3.28Å; N208-Q211 PolarHBondContact O-N 3.29Å; N208-G212 PolarHBondContact O-N 3.43Å
209	T	84.1	Confident	82.9	Confident	85 Å²	85	83.3 Å²	83.3	52%	0.521	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-44	175.6	-51.6	0	0	0	0	111.9	N205 R207 G212 M213	N205-T209 PolarHBondContact O-N 2.94Å; N205-T209 PolarHBondContact O-OG1 3.32Å; R207-T209 VanDerWaalsContact C-N 3.33Å; R207-T209 PolarHBondContact O-N 3.21Å; T209-G212 PolarHBondContact O-N 3.45Å; T209-M213 PolarHBondContact O-N 3.2Å
210	K	78.5	Confident	82.4	Confident	144 Å²	144	86.3 Å²	86.3	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-63.3	-44.5	177.2	-74.7	175.6	-178.7	-179.5	0	112.2	N206 R207 G212 M213 D214	N206-K210 WeakPolarHBondContact O-CB 3.49Å; N206-K210 VanDerWaalsContact O-CG 3.29Å; N206-K210 WeakPolarHBondContact O-CG 3.33Å; N206-K210 PolarHBondContact O-N 3.2Å; N206-K210 VanDerWaalsContact O-N 3.1Å; R207-K210 PolarHBondContact O-N 3.12Å; K210-G212 PolarHBondContact O-N 3.5Å; K210-M213 PolarHBondContact O-N 2.97Å; K210-D214 PolarHBondContact O-N 3.16Å
211	Q	72.3	Confident	81.8	Confident	135 Å²	135	91.1 Å²	91.1	63%	0.631	49%	0.485	S	S	*	.	H	α-helix	trans	-63.4	-40.3	176	-77.9	-177.1	-12.2	0	0	112.6	R207 N208 M213 D214 S215	R207-Q211 WeakPolarHBondContact O-CB 3.3Å; R207-Q211 PolarHBondContact O-N 2.95Å; N208-Q211 PolarHBondContact O-N 3.29Å; Q211-M213 VanDerWaalsContact C-N 3.33Å; Q211-D214 PolarHBondContact O-N 3.48Å; Q211-S215 PolarHBondContact O-N 2.92Å
212	G	70.4	Confident	81.4	Confident	32 Å²	32	91.2 Å²	91.2	33%	0.33	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-41.2	174.6	0	0	0	0	0	112.2	N208 T209 K210 S215 N216	N208-G212 PolarHBondContact O-N 3.43Å; T209-G212 PolarHBondContact O-N 3.45Å; K210-G212 PolarHBondContact O-N 3.5Å; G212-S215 PolarHBondContact O-N 3.49Å; G212-N216 VanDerWaalsContact O-CG 3.26Å; G212-N216 PolarHBondContact O-N 3.02Å
213	M	68.1	Low	81	Confident	122 Å²	122	93.1 Å²	93.1	60%	0.601	49%	0.489	S	S	*	.	H	α-helix	trans	-65.1	-44.1	177.1	-161.1	166.8	82	0	0	111.9	T209 K210 Q211 S215 N216 V217	T209-M213 PolarHBondContact O-N 3.2Å; K210-M213 PolarHBondContact O-N 2.97Å; Q211-M213 VanDerWaalsContact C-N 3.33Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.49Å; M213-N216 PolarHBondContact O-N 3.42Å; M213-V217 VanDerWaalsContact O-CG2 3.27Å; M213-V217 WeakPolarHBondContact O-CG2 3.33Å; M213-V217 PolarHBondContact O-N 3.38Å
214	D	72.1	Confident	80.7	Confident	112 Å²	112	96.8 Å²	96.8	60%	0.599	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-39.7	176.2	-77.8	-9.5	0	0	0	112.1	K210 Q211 V217 K218	K210-D214 PolarHBondContact O-N 3.16Å; Q211-D214 PolarHBondContact O-N 3.48Å; D214-V217 PolarHBondContact O-N 2.95Å; D214-K218 WeakPolarHBondContact O-CB 3.42Å; D214-K218 PolarHBondContact O-N 3Å
215	S	72.9	Confident	80.4	Confident	68 Å²	68	98.1 Å²	98.1	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-61.8	-47.4	175.3	-170.4	0	0	0	0	111.5	Q211 G212 M213 V217 K218 E219	Q211-S215 PolarHBondContact O-N 2.92Å; G212-S215 PolarHBondContact O-N 3.49Å; M213-S215 VanDerWaalsContact C-N 3.33Å; M213-S215 PolarHBondContact O-N 3.49Å; S215-V217 PolarHBondContact O-N 3.5Å; S215-K218 PolarHBondContact O-N 3.33Å; S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 PolarHBondContact O-N 3.28Å
216	N	76.4	Confident	80.2	Confident	104 Å²	104	99.1 Å²	99.1	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-40.8	179.3	-69.5	-11.9	0	0	0	112	G212 M213 E219 A220	G212-N216 VanDerWaalsContact O-CG 3.26Å; G212-N216 PolarHBondContact O-N 3.02Å; M213-N216 PolarHBondContact O-N 3.42Å; N216-E219 PolarHBondContact O-N 3.44Å; N216-A220 WeakPolarHBondContact O-CB 3.42Å; N216-A220 PolarHBondContact O-N 2.99Å
217	V	78.7	Confident	80.2	Confident	91 Å²	91	99.3 Å²	99.3	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-43.5	176.1	170.8	0	0	0	0	110.6	M213 D214 S215 E219 A220 L221	M213-V217 VanDerWaalsContact O-CG2 3.27Å; M213-V217 WeakPolarHBondContact O-CG2 3.33Å; M213-V217 PolarHBondContact O-N 3.38Å; D214-V217 PolarHBondContact O-N 2.95Å; S215-V217 PolarHBondContact O-N 3.5Å; V217-E219 VanDerWaalsContact C-N 3.34Å; V217-E219 PolarHBondContact O-N 3.29Å; V217-A220 PolarHBondContact O-N 2.95Å; V217-L221 WeakPolarHBondContact O-CB 3.27Å; V217-L221 PolarHBondContact O-N 2.9Å
218	K	75.2	Confident	80.3	Confident	147 Å²	147	100.3 Å²	100.3	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-41.2	176.7	-171.8	179.8	-179.7	-177.9	0	111.6	D214 S215 L221 M222	D214-K218 WeakPolarHBondContact O-CB 3.42Å; D214-K218 PolarHBondContact O-N 3Å; S215-K218 PolarHBondContact O-N 3.33Å; K218-L221 PolarHBondContact O-N 3.39Å; K218-M222 WeakPolarHBondContact O-CB 3.4Å; K218-M222 VanDerWaalsContact O-CG 3.26Å; K218-M222 WeakPolarHBondContact O-CG 3.48Å; K218-M222 PolarHBondContact O-N 3.35Å
219	E	81.4	Confident	80	Confident	120 Å²	120	104.2 Å²	104.2	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-43.2	178.2	-169.9	159.9	-156.8	0	0	111.9	S215 N216 V217 L221 M222 Q223	S215-E219 WeakPolarHBondContact O-CB 3.44Å; S215-E219 PolarHBondContact O-N 3.28Å; N216-E219 PolarHBondContact O-N 3.44Å; V217-E219 VanDerWaalsContact C-N 3.34Å; V217-E219 PolarHBondContact O-N 3.29Å; E219-L221 VanDerWaalsContact C-N 3.34Å; E219-L221 PolarHBondContact O-N 3.39Å; E219-M222 PolarHBondContact O-N 2.98Å; E219-Q223 WeakPolarHBondContact O-CB 3.41Å; E219-Q223 PolarHBondContact O-N 3.35Å
220	A	84.2	Confident	80.3	Confident	63 Å²	63	105.1 Å²	105.1	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-41.7	173.5	0	0	0	0	0	112.1	N216 V217 Q223 K224	N216-A220 WeakPolarHBondContact O-CB 3.42Å; N216-A220 PolarHBondContact O-N 2.99Å; V217-A220 PolarHBondContact O-N 2.95Å; A220-Q223 PolarHBondContact O-N 3.44Å; A220-K224 PolarHBondContact O-N 3.49Å
221	L	80.9	Confident	80.7	Confident	111 Å²	111	103.6 Å²	103.6	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-44	176.3	-161.2	84	0	0	0	111.6	V217 K218 E219 Q223 K224 L225	V217-L221 WeakPolarHBondContact O-CB 3.27Å; V217-L221 PolarHBondContact O-N 2.9Å; K218-L221 PolarHBondContact O-N 3.39Å; E219-L221 VanDerWaalsContact C-N 3.34Å; E219-L221 PolarHBondContact O-N 3.39Å; L221-Q223 VanDerWaalsContact C-N 3.31Å; L221-Q223 PolarHBondContact O-N 2.9Å; L221-K224 PolarHBondContact O-N 2.98Å; L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 3.28Å
222	M	83.8	Confident	81	Confident	86 Å²	86	102.6 Å²	102.6	42%	0.424	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-36.2	176.8	-75.5	-65.9	-64.8	0	0	112.2	K218 E219 R226	K218-M222 WeakPolarHBondContact O-CB 3.4Å; K218-M222 VanDerWaalsContact O-CG 3.26Å; K218-M222 WeakPolarHBondContact O-CG 3.48Å; K218-M222 PolarHBondContact O-N 3.35Å; E219-M222 PolarHBondContact O-N 2.98Å; M222-R226 PolarHBondContact O-N 3.35Å
223	Q	86.1	Confident	81.6	Confident	85 Å²	85	108 Å²	108	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-67.7	-44.9	175.7	-169.2	55.6	36.6	0	0	111.2	E219 A220 L221 L225 R226 D227	E219-Q223 WeakPolarHBondContact O-CB 3.41Å; E219-Q223 PolarHBondContact O-N 3.35Å; A220-Q223 PolarHBondContact O-N 3.44Å; L221-Q223 VanDerWaalsContact C-N 3.31Å; L221-Q223 PolarHBondContact O-N 2.9Å; Q223-L225 VanDerWaalsContact C-N 3.3Å; Q223-L225 PolarHBondContact O-N 2.91Å; Q223-R226 WeakPolarHBondContact O-CB 3.4Å; Q223-R226 PolarHBondContact O-N 2.85Å; Q223-D227 PolarHBondContact NE2-OD1 3.08Å; Q223-D227 VanDerWaalsContact O-CG 3.22Å; Q223-D227 PolarHBondContact O-N 2.92Å
224	K	87.9	Confident	82.3	Confident	130 Å²	130	107.9 Å²	107.9	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-58.8	-42	175.7	-166.1	179.8	179.3	-175.2	0	112.3	A220 L221 R226 D227 E228	A220-K224 PolarHBondContact O-N 3.49Å; L221-K224 PolarHBondContact O-N 2.98Å; K224-R226 VanDerWaalsContact C-N 3.34Å; K224-R226 PolarHBondContact O-N 3.46Å; K224-D227 PolarHBondContact O-N 2.86Å; K224-E228 WeakPolarHBondContact CE-OE1 3.38Å; K224-E228 WeakPolarHBondContact O-CG 3.48Å; K224-E228 PolarHBondContact O-N 3.04Å
225	L	82.8	Confident	82.5	Confident	91 Å²	91	105.5 Å²	105.5	48%	0.476	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-38.2	174.7	-74.2	170.5	0	0	0	112.4	L221 Q223 W229	L221-L225 WeakPolarHBondContact O-CG 3.26Å; L221-L225 PolarHBondContact O-N 3.28Å; Q223-L225 VanDerWaalsContact C-N 3.3Å; Q223-L225 PolarHBondContact O-N 2.91Å; L225-W229 WeakPolarHBondContact O-CB 3.42Å; L225-W229 PolarHBondContact O-N 3.46Å
226	R	87.5	Confident	82.4	Confident	117 Å²	117	111.3 Å²	111.3	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-63.3	-48.1	173.8	-91.5	-174.3	-78.4	-97.5	1.2	111.5	M222 Q223 K224 E228 W229 E230	M222-R226 PolarHBondContact O-N 3.35Å; Q223-R226 WeakPolarHBondContact O-CB 3.4Å; Q223-R226 PolarHBondContact O-N 2.85Å; K224-R226 VanDerWaalsContact C-N 3.34Å; K224-R226 PolarHBondContact O-N 3.46Å; R226-E228 VanDerWaalsContact C-N 3.34Å; R226-E228 PolarHBondContact O-N 3.33Å; R226-W229 WeakPolarHBondContact O-CB 3.47Å; R226-W229 PolarHBondContact O-N 3.11Å; R226-W229 VanDerWaalsContact O-N 3.11Å; R226-E230 PolarHBondContact O-N 3.44Å
227	D	90.9	Very high	82.1	Confident	82 Å²	82	112.1 Å²	112.1	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-61.6	-43	-179	-59.4	-17.7	0	0	0	111.1	Q223 K224 W229 E230 L231	Q223-D227 PolarHBondContact NE2-OD1 3.08Å; Q223-D227 VanDerWaalsContact O-CG 3.22Å; Q223-D227 PolarHBondContact O-N 2.92Å; K224-D227 PolarHBondContact O-N 2.86Å; D227-W229 VanDerWaalsContact C-N 3.33Å; D227-W229 PolarHBondContact O-N 3.06Å; D227-E230 PolarHBondContact O-N 3.04Å; D227-L231 WeakPolarHBondContact O-CG 3.38Å; D227-L231 PolarHBondContact O-N 3.4Å
228	E	88.2	Confident	81.3	Confident	94 Å²	94	112 Å²	112	44%	0.439	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-39.4	174.1	-75.4	176.8	-170.5	0	0	112.1	K224 R226 L231 L232	K224-E228 WeakPolarHBondContact CE-OE1 3.38Å; K224-E228 WeakPolarHBondContact O-CG 3.48Å; K224-E228 PolarHBondContact O-N 3.04Å; R226-E228 VanDerWaalsContact C-N 3.34Å; R226-E228 PolarHBondContact O-N 3.33Å; E228-L231 PolarHBondContact O-N 2.89Å; E228-L232 WeakPolarHBondContact O-CG 3.41Å; E228-L232 PolarHBondContact O-N 2.94Å; E228-L232 VanDerWaalsContact O-N 3.08Å
229	W	78.5	Confident	80.1	Confident	170 Å²	170	111.2 Å²	111.2	64%	0.644	54%	0.54	S	S	*	.	H	α-helix	trans	-68.5	-38.2	177.2	-143.3	93.2	0	0	0	112.4	L225 R226 D227 L232 R233	L225-W229 WeakPolarHBondContact O-CB 3.42Å; L225-W229 PolarHBondContact O-N 3.46Å; R226-W229 WeakPolarHBondContact O-CB 3.47Å; R226-W229 PolarHBondContact O-N 3.11Å; R226-W229 VanDerWaalsContact O-N 3.11Å; D227-W229 VanDerWaalsContact C-N 3.33Å; D227-W229 PolarHBondContact O-N 3.06Å; W229-L232 PolarHBondContact O-N 3.19Å; W229-R233 HydrophobicContact CE3-CB 4.39Å; W229-R233 HydrophobicContact CZ3-CB 4.4Å; W229-R233 WeakPolarHBondContact O-CB 3.47Å; W229-R233 PolarHBondContact O-N 3.44Å
230	E	88.9	Confident	78.5	Confident	104 Å²	104	114.6 Å²	114.6	49%	0.486	57%	0.573	S	S	.	*	H	α-helix	trans	-62	-44	175.2	-145.7	90.2	-134.9	0	0	110.8	R226 D227 R233 Q234	R226-E230 PolarHBondContact O-N 3.44Å; D227-E230 PolarHBondContact O-N 3.04Å; E230-R233 PolarHBondContact O-N 2.91Å; E230-Q234 WeakPolarHBondContact O-CG 3.4Å; E230-Q234 PolarHBondContact O-N 2.73Å
231	L	87.6	Confident	78.2	Confident	112 Å²	112	117.2 Å²	117.2	59%	0.586	58%	0.576	S	S	*	*	H	α-helix	trans	-60.8	-46.7	175.8	-74.4	168.7	0	0	0	111.9	D227 E228 R233 Q234 S235	D227-L231 WeakPolarHBondContact O-CG 3.38Å; D227-L231 PolarHBondContact O-N 3.4Å; E228-L231 PolarHBondContact O-N 2.89Å; L231-R233 VanDerWaalsContact C-N 3.3Å; L231-R233 PolarHBondContact O-N 3.05Å; L231-Q234 PolarHBondContact O-N 2.97Å; L231-S235 PolarHBondContact O-N 3.27Å
232	L	78.9	Confident	78.1	Confident	114 Å²	114	117.5 Å²	117.5	60%	0.597	58%	0.575	S	S	*	*	H	α-helix	trans	-64	-35	177	-71.4	172.3	0	0	0	112.4	E228 W229 S235 R236	E228-L232 WeakPolarHBondContact O-CG 3.41Å; E228-L232 PolarHBondContact O-N 2.94Å; E228-L232 VanDerWaalsContact O-N 3.08Å; W229-L232 PolarHBondContact O-N 3.19Å; L232-S235 WeakPolarHBondContact CA-OG 3.33Å; L232-S235 PolarHBondContact O-OG 2.97Å; L232-R236 PolarHBondContact O-N 3.42Å; L232-R236 VanDerWaalsContact O-N 3.11Å
233	R	81.8	Confident	77.7	Confident	144 Å²	144	119.3 Å²	119.3	54%	0.543	58%	0.584	S	S	.	*	H	α-helix	trans	-67.3	-42.1	175.6	-173.4	-179.1	179.6	150.9	-0.4	111.3	W229 E230 L231 R236 N237	W229-R233 HydrophobicContact CE3-CB 4.39Å; W229-R233 HydrophobicContact CZ3-CB 4.4Å; W229-R233 WeakPolarHBondContact O-CB 3.47Å; W229-R233 PolarHBondContact O-N 3.44Å; E230-R233 PolarHBondContact O-N 2.91Å; L231-R233 VanDerWaalsContact C-N 3.3Å; L231-R233 PolarHBondContact O-N 3.05Å; R233-R236 PolarHBondContact O-N 3.27Å; R233-N237 PolarHBondContact O-N 3.25Å
234	Q	83.6	Confident	77.3	Confident	120 Å²	120	121.3 Å²	121.3	56%	0.561	60%	0.595	S	S	*	*	H	α-helix	trans	-65.4	-41.4	176.8	-71.3	174.6	16	0	0	111.8	E230 L231 R236 N237 S238	E230-Q234 WeakPolarHBondContact O-CG 3.4Å; E230-Q234 PolarHBondContact O-N 2.73Å; L231-Q234 PolarHBondContact O-N 2.97Å; Q234-R236 VanDerWaalsContact C-N 3.28Å; Q234-R236 PolarHBondContact O-N 3.31Å; Q234-N237 PolarHBondContact O-N 3.26Å; Q234-S238 PolarHBondContact O-N 3.39Å; Q234-S238 PolarHBondContact O-OG 3.36Å
235	S	77.1	Confident	76.6	Confident	62 Å²	62	120.8 Å²	120.8	43%	0.434	60%	0.596	S	S	.	*	H	α-helix	trans	-65.2	-31.6	176.5	69	0	0	0	0	112.6	L231 L232 S238	L231-S235 PolarHBondContact O-N 3.27Å; L232-S235 WeakPolarHBondContact CA-OG 3.33Å; L232-S235 PolarHBondContact O-OG 2.97Å; S235-S238 WeakPolarHBondContact CA-OG 3.35Å; S235-S238 PolarHBondContact O-OG 3.11Å
236	R	71.2	Confident	76.2	Confident	191 Å²	191	122.7 Å²	122.7	72%	0.721	60%	0.604	S	S	*	*	H	α-helix	trans	-71.7	-31.9	176.4	-157.8	179.3	89.7	-179.8	8.9	113.1	L232 R233 Q234 S238	L232-R236 PolarHBondContact O-N 3.42Å; L232-R236 VanDerWaalsContact O-N 3.11Å; R233-R236 PolarHBondContact O-N 3.27Å; Q234-R236 VanDerWaalsContact C-N 3.28Å; Q234-R236 PolarHBondContact O-N 3.31Å; R236-S238 VanDerWaalsContact C-N 3.31Å
237	N	70	Confident	75.4	Confident	120 Å²	120	123.1 Å²	123.1	64%	0.642	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-4	179.3	-69.6	-13.1	0	0	0	113.6	R233 Q234	R233-N237 PolarHBondContact O-N 3.25Å; Q234-N237 PolarHBondContact O-N 3.26Å
238	S	60.1	Low	74.2	Confident	88 Å²	88	126.3 Å²	126.3	62%	0.615	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	8.8	178.8	33.8	0	0	0	0	113.3	Q234 S235 R236 P240	Q234-S238 PolarHBondContact O-N 3.39Å; Q234-S238 PolarHBondContact O-OG 3.36Å; S235-S238 WeakPolarHBondContact CA-OG 3.35Å; S235-S238 PolarHBondContact O-OG 3.11Å; R236-S238 VanDerWaalsContact C-N 3.31Å; S238-P240 WeakPolarHBondContact O-CD 3.48Å
239	I	51.2	Low	73	Confident	131 Å²	131	129 Å²	129	67%	0.672	65%	0.646	S	S	*	*			trans	-91.1	113.5	167.9	-56.3	173.7	0	0	0	107.1
240	P	47.3	Very low	72.5	Confident	192 Å²	192	125.3 Å²	125.3	100%	1.247	65%	0.646	S	S	*	*			trans	-68.9	0	-176	28.3	-33.8	0	0	0	113.7	S238	S238-P240 WeakPolarHBondContact O-CD 3.48Å

Retrieved 240 of 240 residues in 73.8 ms (Link to these results)

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