A0A077Z9F6_TRITR Loading...

JTB domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9F6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 176 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	60.8	Low	78	Confident	199 Å²	199	109.8 Å²	109.8	98%	0.98	52%	0.519	S	S	*	.				0	-49.4	0	-144.2	-170.5	-67.6	0	0	112.5	E3 L4 V5	M1-E3 PolarHBondContact O-N 3.17Å; M1-L4 PolarHBondContact O-N 2.67Å; M1-V5 WeakPolarHBondContact O-CG2 3.28Å; M1-V5 PolarHBondContact O-N 3.22Å
2	L	72.9	Confident	78.7	Confident	110 Å²	110	109.8 Å²	109.8	58%	0.576	52%	0.523	S	S	*	.	H	α-helix	trans	-57.5	-44.6	179.6	-173.7	66.3	0	0	0	113.7	L4 V5 K6	L2-L4 PolarHBondContact O-N 2.91Å; L2-V5 PolarHBondContact O-N 3.08Å; L2-K6 HydrophobicContact CG-CD 4.18Å; L2-K6 HydrophobicContact CG-CG 4.43Å; L2-K6 WeakPolarHBondContact O-CB 3.41Å; L2-K6 VanDerWaalsContact O-CG 3.27Å; L2-K6 WeakPolarHBondContact O-CG 2.83Å; L2-K6 PolarHBondContact O-N 3.21Å
3	E	75.8	Confident	79.1	Confident	99 Å²	99	108.3 Å²	108.3	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-62.6	-38.2	177.2	-68.3	-57.1	123.2	0	0	113	M1 K6 F7	M1-E3 PolarHBondContact O-N 3.17Å; E3-K6 PolarHBondContact O-N 2.67Å; E3-K6 WeakPolarHBondContact OE1-CD 3.26Å; E3-K6 IonicContact OE1-NZ 2.67Å; E3-K6 PolarHBondContact OE1-NZ 2.86Å; E3-F7 VanDerWaalsContact O-CB 3.3Å; E3-F7 WeakPolarHBondContact O-CB 3.13Å; E3-F7 PolarHBondContact O-N 3.09Å
4	L	74.3	Confident	79.5	Confident	130 Å²	130	109 Å²	109	68%	0.681	52%	0.519	S	S	*	.	H	α-helix	trans	-67.4	-40.5	175.7	-166.5	75.5	0	0	0	111.2	M1 L2 F7 R8	M1-L4 PolarHBondContact O-N 2.67Å; L2-L4 PolarHBondContact O-N 2.91Å; L4-F7 PolarHBondContact O-N 3Å; L4-R8 VanDerWaalsContact O-CB 3.22Å; L4-R8 WeakPolarHBondContact O-CB 3.29Å; L4-R8 PolarHBondContact O-N 2.78Å
5	V	77	Confident	80	Confident	41 Å²	41	109.7 Å²	109.7	25%	0.248	52%	0.524	C	S	.	.	H	α-helix	trans	-66.9	-37.5	175.3	173.7	0	0	0	0	111.2	M1 L2 R9	M1-V5 WeakPolarHBondContact O-CG2 3.28Å; M1-V5 PolarHBondContact O-N 3.22Å; L2-V5 PolarHBondContact O-N 3.08Å; V5-R9 WeakPolarHBondContact O-CB 2.73Å; V5-R9 WeakPolarHBondContact O-CG 3.11Å; V5-R9 PolarHBondContact O-N 3.33Å
6	K	79.5	Confident	80.4	Confident	77 Å²	77	109.8 Å²	109.8	34%	0.335	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-48	174.5	-75.5	171.8	177.2	173.4	0	111.1	L2 E3 R8 R9 L10	L2-K6 HydrophobicContact CG-CD 4.18Å; L2-K6 HydrophobicContact CG-CG 4.43Å; L2-K6 WeakPolarHBondContact O-CB 3.41Å; L2-K6 VanDerWaalsContact O-CG 3.27Å; L2-K6 WeakPolarHBondContact O-CG 2.83Å; L2-K6 PolarHBondContact O-N 3.21Å; E3-K6 PolarHBondContact O-N 2.67Å; E3-K6 WeakPolarHBondContact OE1-CD 3.26Å; E3-K6 IonicContact OE1-NZ 2.67Å; E3-K6 PolarHBondContact OE1-NZ 2.86Å; K6-R8 VanDerWaalsContact C-N 3.33Å; K6-R8 PolarHBondContact O-N 3.17Å; K6-R9 PolarHBondContact O-N 3.19Å; K6-L10 WeakPolarHBondContact O-CB 3.37Å; K6-L10 PolarHBondContact O-N 2.73Å
7	F	82.6	Confident	80.6	Confident	144 Å²	144	105.6 Å²	105.6	63%	0.632	51%	0.506	S	S	*	.	H	α-helix	trans	-61.2	-43.1	176.5	-172	-95.7	0	0	0	110.9	E3 L4 R9 L10 A11	E3-F7 VanDerWaalsContact O-CB 3.3Å; E3-F7 WeakPolarHBondContact O-CB 3.13Å; E3-F7 PolarHBondContact O-N 3.09Å; L4-F7 PolarHBondContact O-N 3Å; F7-R9 PolarHBondContact O-N 2.9Å; F7-L10 PolarHBondContact O-N 3.01Å; F7-A11 VanDerWaalsContact O-CB 3.29Å; F7-A11 WeakPolarHBondContact O-CB 3.32Å; F7-A11 PolarHBondContact O-N 2.63Å
8	R	84.1	Confident	80.9	Confident	167 Å²	167	103.1 Å²	103.1	63%	0.63	50%	0.498	S	S	*	.	H	α-helix	trans	-60.8	-45.1	174.6	-168.6	174.7	76.9	177.6	5.2	111.8	L4 K6 L10 A11 L12	L4-R8 VanDerWaalsContact O-CB 3.22Å; L4-R8 WeakPolarHBondContact O-CB 3.29Å; L4-R8 PolarHBondContact O-N 2.78Å; K6-R8 VanDerWaalsContact C-N 3.33Å; K6-R8 PolarHBondContact O-N 3.17Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 3.27Å; R8-A11 PolarHBondContact O-N 3.05Å; R8-L12 HydrophobicContact CG-CD1 4.44Å; R8-L12 WeakPolarHBondContact O-CB 3.35Å; R8-L12 VanDerWaalsContact O-CG 3.23Å; R8-L12 WeakPolarHBondContact O-CG 3.5Å; R8-L12 PolarHBondContact O-N 3.15Å
9	R	84.8	Confident	81.3	Confident	148 Å²	148	105 Å²	105	56%	0.558	51%	0.505	S	S	*	.	H	α-helix	trans	-63.3	-40.2	175.5	-78.7	-171.3	-113.9	-136	3.4	112.1	V5 K6 F7 L12 L13	V5-R9 WeakPolarHBondContact O-CB 2.73Å; V5-R9 WeakPolarHBondContact O-CG 3.11Å; V5-R9 PolarHBondContact O-N 3.33Å; K6-R9 PolarHBondContact O-N 3.19Å; F7-R9 PolarHBondContact O-N 2.9Å; R9-L12 PolarHBondContact O-N 2.97Å; R9-L13 WeakPolarHBondContact O-CG 3.44Å; R9-L13 PolarHBondContact O-N 2.04Å
10	L	82.1	Confident	81.5	Confident	55 Å²	55	103.1 Å²	103.1	29%	0.288	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-44.7	178.2	-173.7	71.3	0	0	0	111.7	K6 F7 R8 L12 L13 F14 L134	K6-L10 WeakPolarHBondContact O-CB 3.37Å; K6-L10 PolarHBondContact O-N 2.73Å; F7-L10 PolarHBondContact O-N 3.01Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 3.27Å; L10-L12 VanDerWaalsContact C-N 3.3Å; L10-L12 PolarHBondContact O-N 3.04Å; L10-L13 PolarHBondContact O-N 3.44Å; L10-F14 WeakPolarHBondContact O-CB 3.29Å; L10-F14 PolarHBondContact O-N 3.04Å; L10-L134 HydrophobicContact CD1-CD2 3.43Å; L10-L134 VanDerWaalsContact CD1-CD2 3.43Å; L10-L134 HydrophobicContact CD2-CD2 3.78Å; L10-L134 HydrophobicContact CG-CD2 4.12Å
11	A	84.1	Confident	81.6	Confident	38 Å²	38	100.2 Å²	100.2	31%	0.314	49%	0.486	S	S	.	.	H	α-helix	trans	-58.3	-44.2	174.3	0	0	0	0	0	110.7	F7 R8 L13 F14 M15	F7-A11 VanDerWaalsContact O-CB 3.29Å; F7-A11 WeakPolarHBondContact O-CB 3.32Å; F7-A11 PolarHBondContact O-N 2.63Å; R8-A11 PolarHBondContact O-N 3.05Å; A11-L13 PolarHBondContact O-N 3.36Å; A11-F14 PolarHBondContact O-N 2.85Å; A11-M15 WeakPolarHBondContact O-CB 3.26Å; A11-M15 WeakPolarHBondContact O-CG 3.39Å; A11-M15 PolarHBondContact O-N 2.82Å
12	L	86.9	Confident	82.8	Confident	109 Å²	109	92.6 Å²	92.6	57%	0.571	46%	0.455	S	S	*	.	H	α-helix	trans	-61.4	-43.2	176	-72.7	171.5	0	0	0	112.8	R8 R9 L10 F14 M15 L16	R8-L12 HydrophobicContact CG-CD1 4.44Å; R8-L12 WeakPolarHBondContact O-CB 3.35Å; R8-L12 VanDerWaalsContact O-CG 3.23Å; R8-L12 WeakPolarHBondContact O-CG 3.5Å; R8-L12 PolarHBondContact O-N 3.15Å; R9-L12 PolarHBondContact O-N 2.97Å; L10-L12 VanDerWaalsContact C-N 3.3Å; L10-L12 PolarHBondContact O-N 3.04Å; L12-F14 VanDerWaalsContact C-N 3.35Å; L12-M15 PolarHBondContact O-N 2.94Å; L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 3.18Å
13	L	83.8	Confident	83.5	Confident	91 Å²	91	90.1 Å²	90.1	48%	0.476	44%	0.444	S	S	.	.	H	α-helix	trans	-64	-40.9	175.9	-71.2	173.2	0	0	0	111.8	R9 L10 A11 L16 F17 F133	R9-L13 WeakPolarHBondContact O-CG 3.44Å; R9-L13 PolarHBondContact O-N 2.04Å; L10-L13 PolarHBondContact O-N 3.44Å; A11-L13 PolarHBondContact O-N 3.36Å; L13-L16 PolarHBondContact O-N 3.12Å; L13-F17 WeakPolarHBondContact O-CB 3.46Å; L13-F17 PolarHBondContact O-N 2.89Å; L13-F133 HydrophobicContact CD1-CE1 4.29Å
14	F	84.2	Confident	83.9	Confident	118 Å²	118	87.9 Å²	87.9	52%	0.518	44%	0.437	S	S	.	.	H	α-helix	trans	-66.1	-45	176.6	-178.5	-101.2	0	0	0	111.8	L10 A11 L12 L16 F17 V18	L10-F14 WeakPolarHBondContact O-CB 3.29Å; L10-F14 PolarHBondContact O-N 3.04Å; A11-F14 PolarHBondContact O-N 2.85Å; L12-F14 VanDerWaalsContact C-N 3.35Å; F14-L16 VanDerWaalsContact C-N 3.32Å; F14-L16 PolarHBondContact O-N 3Å; F14-F17 WeakPolarHBondContact O-CB 3.34Å; F14-F17 PolarHBondContact O-N 2.9Å; F14-V18 HydrophobicContact CD1-CG2 4.17Å; F14-V18 HydrophobicContact CE1-CG2 3.75Å; F14-V18 HydrophobicContact CE2-CG2 4.24Å; F14-V18 HydrophobicContact CZ-CG2 3.79Å; F14-V18 WeakPolarHBondContact O-CG2 3.48Å; F14-V18 PolarHBondContact O-N 3.15Å
15	M	86.6	Confident	84.3	Confident	120 Å²	120	86.4 Å²	86.4	59%	0.591	43%	0.43	S	S	*	.	H	α-helix	trans	-62.3	-40.4	176	-69.6	-56	-66.1	0	0	111.7	A11 L12 V18 F19	A11-M15 WeakPolarHBondContact O-CB 3.26Å; A11-M15 WeakPolarHBondContact O-CG 3.39Å; A11-M15 PolarHBondContact O-N 2.82Å; L12-M15 PolarHBondContact O-N 2.94Å; M15-V18 PolarHBondContact O-N 3.05Å; M15-F19 VanDerWaalsContact O-CB 3.29Å; M15-F19 WeakPolarHBondContact O-CB 3.44Å; M15-F19 PolarHBondContact O-N 3.45Å
16	L	87.2	Confident	84.7	Confident	111 Å²	111	89.7 Å²	89.7	58%	0.581	45%	0.445	S	S	*	.	H	α-helix	trans	-65.1	-40.5	174.7	-176.3	137.8	0	0	0	111.4	L12 L13 F14 F19 V20	L12-L16 VanDerWaalsContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 3.18Å; L13-L16 PolarHBondContact O-N 3.12Å; F14-L16 VanDerWaalsContact C-N 3.32Å; F14-L16 PolarHBondContact O-N 3Å; L16-F19 PolarHBondContact O-N 3.27Å; L16-V20 HydrophobicContact CD2-CG2 4.35Å; L16-V20 VanDerWaalsContact O-CG2 3.3Å; L16-V20 WeakPolarHBondContact O-CG2 3.45Å; L16-V20 PolarHBondContact O-N 3.4Å
17	F	84.1	Confident	84.7	Confident	38 Å²	38	91.7 Å²	91.7	17%	0.167	46%	0.456	C	S	.	.	H	α-helix	trans	-62	-48.4	174.1	175	-116.5	0	0	0	111.8	L13 F14 F19 V20 L21 I126 I130	L13-F17 WeakPolarHBondContact O-CB 3.46Å; L13-F17 PolarHBondContact O-N 2.89Å; F14-F17 WeakPolarHBondContact O-CB 3.34Å; F14-F17 PolarHBondContact O-N 2.9Å; F17-F19 VanDerWaalsContact C-N 3.28Å; F17-F19 PolarHBondContact O-N 2.97Å; F17-V20 PolarHBondContact O-N 3.24Å; F17-L21 HydrophobicContact CD1-CD1 4.06Å; F17-L21 HydrophobicContact CD1-CG 4.47Å; F17-L21 HydrophobicContact CD2-CG 4.27Å; F17-L21 HydrophobicContact CE1-CD1 3.48Å; F17-L21 VanDerWaalsContact CE1-CD1 3.48Å; F17-L21 HydrophobicContact CE1-CG 4.12Å; F17-L21 HydrophobicContact CE2-CD1 4.09Å; F17-L21 HydrophobicContact CE2-CD2 3.83Å; F17-L21 HydrophobicContact CE2-CG 3.84Å; F17-L21 HydrophobicContact CZ-CD1 3.52Å; F17-L21 HydrophobicContact CZ-CD2 3.9Å; F17-L21 HydrophobicContact CZ-CG 3.81Å; F17-L21 WeakPolarHBondContact O-CG 3.43Å; F17-L21 PolarHBondContact O-N 3.04Å; F17-I126 HydrophobicContact CD2-CG2 3.79Å; F17-I126 HydrophobicContact CE2-CB 4.06Å; F17-I126 HydrophobicContact CE2-CG2 3.2Å; F17-I126 HydrophobicContact CZ-CG2 3.98Å; F17-I130 HydrophobicContact CB-CD1 4.18Å; F17-I130 HydrophobicContact CD1-CD1 3.44Å; F17-I130 VanDerWaalsContact CD1-CD1 3.44Å; F17-I130 HydrophobicContact CD2-CD1 3.43Å; F17-I130 VanDerWaalsContact CD2-CD1 3.43Å; F17-I130 HydrophobicContact CE1-CD1 3.49Å; F17-I130 VanDerWaalsContact CE1-CD1 3.49Å; F17-I130 HydrophobicContact CE2-CD1 3.53Å; F17-I130 HydrophobicContact CG-CD1 3.38Å; F17-I130 HydrophobicContact CZ-CD1 3.52Å
18	V	85.6	Confident	84.3	Confident	60 Å²	60	88.2 Å²	88.2	36%	0.364	44%	0.442	S	S	.	.	H	α-helix	trans	-60.6	-39	175.8	172.9	0	0	0	0	111.2	F14 M15 L21 A22	F14-V18 HydrophobicContact CD1-CG2 4.17Å; F14-V18 HydrophobicContact CE1-CG2 3.75Å; F14-V18 HydrophobicContact CE2-CG2 4.24Å; F14-V18 HydrophobicContact CZ-CG2 3.79Å; F14-V18 WeakPolarHBondContact O-CG2 3.48Å; F14-V18 PolarHBondContact O-N 3.15Å; M15-V18 PolarHBondContact O-N 3.05Å; V18-L21 PolarHBondContact O-N 2.78Å; V18-A22 VanDerWaalsContact O-CB 3.32Å; V18-A22 WeakPolarHBondContact O-CB 3.44Å; V18-A22 PolarHBondContact O-N 3.04Å
19	F	88.5	Confident	84	Confident	140 Å²	140	84.5 Å²	84.5	61%	0.614	44%	0.435	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.9	178.6	-99	0	0	0	111.9	M15 L16 F17 L21 A22 V23	M15-F19 VanDerWaalsContact O-CB 3.29Å; M15-F19 WeakPolarHBondContact O-CB 3.44Å; M15-F19 PolarHBondContact O-N 3.45Å; L16-F19 PolarHBondContact O-N 3.27Å; F17-F19 VanDerWaalsContact C-N 3.28Å; F17-F19 PolarHBondContact O-N 2.97Å; F19-L21 PolarHBondContact O-N 3.38Å; F19-A22 PolarHBondContact O-N 3.26Å; F19-V23 HydrophobicContact CD1-CG2 4.19Å; F19-V23 HydrophobicContact CE1-CG2 3.76Å; F19-V23 HydrophobicContact CE2-CG2 4.12Å; F19-V23 HydrophobicContact CZ-CG2 3.73Å; F19-V23 WeakPolarHBondContact O-CG2 3.05Å; F19-V23 PolarHBondContact O-N 2.91Å
20	V	85.3	Confident	83.5	Confident	66 Å²	66	83.3 Å²	83.3	40%	0.4	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-44.2	175.2	170.9	0	0	0	0	110.7	L16 F17 A22 V23 V24	L16-V20 HydrophobicContact CD2-CG2 4.35Å; L16-V20 VanDerWaalsContact O-CG2 3.3Å; L16-V20 WeakPolarHBondContact O-CG2 3.45Å; L16-V20 PolarHBondContact O-N 3.4Å; F17-V20 PolarHBondContact O-N 3.24Å; V20-A22 VanDerWaalsContact C-N 3.35Å; V20-A22 PolarHBondContact O-N 2.88Å; V20-V23 PolarHBondContact O-N 3.42Å; V20-V24 HydrophobicContact CG1-CG2 4.46Å; V20-V24 WeakPolarHBondContact O-CB 3.41Å; V20-V24 VanDerWaalsContact O-CG2 3.29Å; V20-V24 WeakPolarHBondContact O-CG2 3.46Å; V20-V24 PolarHBondContact O-N 2.65Å
21	L	83.7	Confident	82.8	Confident	43 Å²	43	87.2 Å²	87.2	23%	0.225	45%	0.45	C	S	.	.	H	α-helix	trans	-59.1	-45.7	173.9	-69.4	-174.2	0	0	0	111.8	F17 V18 F19 V24 L25 L123	F17-L21 HydrophobicContact CD1-CD1 4.06Å; F17-L21 HydrophobicContact CD1-CG 4.47Å; F17-L21 HydrophobicContact CD2-CG 4.27Å; F17-L21 HydrophobicContact CE1-CD1 3.48Å; F17-L21 VanDerWaalsContact CE1-CD1 3.48Å; F17-L21 HydrophobicContact CE1-CG 4.12Å; F17-L21 HydrophobicContact CE2-CD1 4.09Å; F17-L21 HydrophobicContact CE2-CD2 3.83Å; F17-L21 HydrophobicContact CE2-CG 3.84Å; F17-L21 HydrophobicContact CZ-CD1 3.52Å; F17-L21 HydrophobicContact CZ-CD2 3.9Å; F17-L21 HydrophobicContact CZ-CG 3.81Å; F17-L21 WeakPolarHBondContact O-CG 3.43Å; F17-L21 PolarHBondContact O-N 3.04Å; V18-L21 PolarHBondContact O-N 2.78Å; F19-L21 PolarHBondContact O-N 3.38Å; L21-V24 PolarHBondContact O-N 2.67Å; L21-L25 WeakPolarHBondContact O-CB 2.98Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 2.86Å; L21-L123 HydrophobicContact CD2-CD2 3.16Å
22	A	86.8	Confident	81.8	Confident	39 Å²	39	90.9 Å²	90.9	32%	0.322	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-43.6	178.1	0	0	0	0	0	111.5	V18 F19 V20 L25 I26	V18-A22 VanDerWaalsContact O-CB 3.32Å; V18-A22 WeakPolarHBondContact O-CB 3.44Å; V18-A22 PolarHBondContact O-N 3.04Å; F19-A22 PolarHBondContact O-N 3.26Å; V20-A22 VanDerWaalsContact C-N 3.35Å; V20-A22 PolarHBondContact O-N 2.88Å; A22-L25 PolarHBondContact O-N 2.03Å; A22-I26 WeakPolarHBondContact O-CB 3.44Å; A22-I26 WeakPolarHBondContact O-CD1 3.06Å; A22-I26 WeakPolarHBondContact O-CG1 3.49Å; A22-I26 PolarHBondContact O-N 2.96Å
23	V	86.1	Confident	80.6	Confident	58 Å²	58	89.5 Å²	89.5	35%	0.352	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176	170.8	0	0	0	0	110.7	F19 V20 I26 M27	F19-V23 HydrophobicContact CD1-CG2 4.19Å; F19-V23 HydrophobicContact CE1-CG2 3.76Å; F19-V23 HydrophobicContact CE2-CG2 4.12Å; F19-V23 HydrophobicContact CZ-CG2 3.73Å; F19-V23 WeakPolarHBondContact O-CG2 3.05Å; F19-V23 PolarHBondContact O-N 2.91Å; V20-V23 PolarHBondContact O-N 3.42Å; V23-I26 PolarHBondContact O-N 2.82Å; V23-M27 HydrophobicContact CG1-CG 4.25Å; V23-M27 WeakPolarHBondContact O-CB 3.41Å; V23-M27 WeakPolarHBondContact O-CG 3.48Å; V23-M27 PolarHBondContact O-N 3.44Å
24	V	84.3	Confident	79.5	Confident	52 Å²	52	90.4 Å²	90.4	32%	0.315	46%	0.458	S	S	.	.	H	α-helix	trans	-61.2	-48.1	175.9	171.4	0	0	0	0	110.5	V20 L21 I26 M27 E28 L119	V20-V24 HydrophobicContact CG1-CG2 4.46Å; V20-V24 WeakPolarHBondContact O-CB 3.41Å; V20-V24 VanDerWaalsContact O-CG2 3.29Å; V20-V24 WeakPolarHBondContact O-CG2 3.46Å; V20-V24 PolarHBondContact O-N 2.65Å; L21-V24 PolarHBondContact O-N 2.67Å; V24-I26 VanDerWaalsContact C-N 3.3Å; V24-I26 PolarHBondContact O-N 2.97Å; V24-M27 PolarHBondContact O-N 2.89Å; V24-M27 VanDerWaalsContact O-N 3.13Å; V24-E28 HydrophobicContact CG1-CG 4.45Å; V24-E28 WeakPolarHBondContact O-CB 3.03Å; V24-E28 WeakPolarHBondContact O-CG 3.27Å; V24-E28 PolarHBondContact O-N 3.22Å; V24-L119 HydrophobicContact CG1-CD1 3.49Å; V24-L119 VanDerWaalsContact CG1-CD1 3.49Å
25	L	83.3	Confident	78.1	Confident	100 Å²	100	89.3 Å²	89.3	52%	0.524	45%	0.454	S	S	.	.	H	α-helix	trans	-61.3	-37.7	175.9	-71.5	173.1	0	0	0	112.3	L21 A22 N29	L21-L25 WeakPolarHBondContact O-CB 2.98Å; L21-L25 VanDerWaalsContact O-CG 3.25Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 2.86Å; A22-L25 PolarHBondContact O-N 2.03Å; L25-N29 WeakPolarHBondContact O-CB 3.12Å; L25-N29 PolarHBondContact O-N 3.41Å
26	I	85.6	Confident	76.3	Confident	109 Å²	109	87.4 Å²	87.4	56%	0.559	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-41.2	174.9	-70.7	161.5	0	0	0	110.1	A22 V23 V24 N29 F30	A22-I26 WeakPolarHBondContact O-CB 3.44Å; A22-I26 WeakPolarHBondContact O-CD1 3.06Å; A22-I26 WeakPolarHBondContact O-CG1 3.49Å; A22-I26 PolarHBondContact O-N 2.96Å; V23-I26 PolarHBondContact O-N 2.82Å; V24-I26 VanDerWaalsContact C-N 3.3Å; V24-I26 PolarHBondContact O-N 2.97Å; I26-N29 CarbonylContact O-C 3.6Å; I26-N29 PolarHBondContact O-N 2.97Å; I26-F30 WeakPolarHBondContact O-CA 3.4Å; I26-F30 WeakPolarHBondContact O-CB 3.42Å; I26-F30 PolarHBondContact O-N 3.13Å
27	M	78.5	Confident	74.2	Confident	119 Å²	119	84.5 Å²	84.5	59%	0.586	44%	0.441	S	S	*	.	H	α-helix	trans	-67.4	-38.1	177.5	-72	-59.2	-64.8	0	0	111.4	V23 V24 F30 H31	V23-M27 HydrophobicContact CG1-CG 4.25Å; V23-M27 WeakPolarHBondContact O-CB 3.41Å; V23-M27 WeakPolarHBondContact O-CG 3.48Å; V23-M27 PolarHBondContact O-N 3.44Å; V24-M27 PolarHBondContact O-N 2.89Å; V24-M27 VanDerWaalsContact O-N 3.13Å; M27-F30 PolarHBondContact O-N 3.25Å; M27-H31 VanDerWaalsContact O-CB 3.27Å; M27-H31 WeakPolarHBondContact O-CB 3.37Å; M27-H31 PolarHBondContact O-N 2.03Å
28	E	74.8	Confident	72.2	Confident	72 Å²	72	89.5 Å²	89.5	34%	0.336	46%	0.462	S	S	.	.	H	α-helix	trans	-67.2	-48.3	173	-72.4	-173.2	140.9	0	0	111.5	V24 F30 H31 F32 L119	V24-E28 HydrophobicContact CG1-CG 4.45Å; V24-E28 WeakPolarHBondContact O-CB 3.03Å; V24-E28 WeakPolarHBondContact O-CG 3.27Å; V24-E28 PolarHBondContact O-N 3.22Å; E28-F30 VanDerWaalsContact C-N 3.25Å; E28-F30 PolarHBondContact O-N 2.55Å; E28-H31 PolarHBondContact O-N 2.96Å; E28-F32 VanDerWaalsContact O-CB 3.26Å; E28-F32 WeakPolarHBondContact O-CB 3.27Å; E28-F32 PolarHBondContact O-N 3Å; E28-L119 WeakPolarHBondContact OE1-CD1 3.42Å; E28-L119 VanDerWaalsContact OE1-CD2 3.24Å; E28-L119 WeakPolarHBondContact OE1-CD2 3.33Å; E28-L119 WeakPolarHBondContact OE1-CG 3.22Å; E28-L119 WeakPolarHBondContact OE2-CD2 3.22Å
29	N	76.9	Confident	70.1	Confident	88 Å²	88	88.4 Å²	88.4	47%	0.471	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-34.6	176.2	-171	45.8	0	0	0	110.7	L25 I26 L33	L25-N29 WeakPolarHBondContact O-CB 3.12Å; L25-N29 PolarHBondContact O-N 3.41Å; I26-N29 CarbonylContact O-C 3.6Å; I26-N29 PolarHBondContact O-N 2.97Å; N29-L33 WeakPolarHBondContact ND2-CD1 3.37Å; N29-L33 WeakPolarHBondContact O-CA 3.38Å; N29-L33 WeakPolarHBondContact O-CB 3.19Å; N29-L33 WeakPolarHBondContact O-CG 2.97Å; N29-L33 PolarHBondContact O-N 2.86Å
30	F	75	Confident	67.7	Low	123 Å²	123	88.8 Å²	88.8	54%	0.539	46%	0.458	S	S	.	.	H	α-helix	trans	-72.2	-39.7	173.9	-175.4	-94	0	0	0	111.1	I26 M27 E28 F32 L33 N34	I26-F30 WeakPolarHBondContact O-CA 3.4Å; I26-F30 WeakPolarHBondContact O-CB 3.42Å; I26-F30 PolarHBondContact O-N 3.13Å; M27-F30 PolarHBondContact O-N 3.25Å; E28-F30 VanDerWaalsContact C-N 3.25Å; E28-F30 PolarHBondContact O-N 2.55Å; F30-F32 VanDerWaalsContact C-N 3.28Å; F30-F32 PolarHBondContact O-N 3.48Å; F30-L33 CarbonylContact O-C 3.51Å; F30-L33 PolarHBondContact O-N 3.05Å; F30-N34 HydrophobicContact CD1-CB 4.34Å; F30-N34 HydrophobicContact CE1-CB 4.08Å; F30-N34 HydrophobicContact CZ-CB 4.4Å; F30-N34 WeakPolarHBondContact O-CA 3.38Å; F30-N34 WeakPolarHBondContact O-CB 3.03Å; F30-N34 PolarHBondContact O-N 2.92Å
31	H	67.4	Low	65.2	Low	137 Å²	137	95.1 Å²	95.1	63%	0.634	48%	0.48	S	S	*	.	H	α-helix	trans	-62.8	-40.5	173.6	-173	-74	0	0	0	110.8	M27 E28 E35	M27-H31 VanDerWaalsContact O-CB 3.27Å; M27-H31 WeakPolarHBondContact O-CB 3.37Å; M27-H31 PolarHBondContact O-N 2.03Å; E28-H31 PolarHBondContact O-N 2.96Å; H31-E35 PolarHBondContact O-N 2.57Å
32	F	63.9	Low	62.8	Low	116 Å²	116	102.4 Å²	102.4	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-51.1	174	-170	-97.1	0	0	0	111.2	E28 F30 N34 E35 E36	E28-F32 VanDerWaalsContact O-CB 3.26Å; E28-F32 WeakPolarHBondContact O-CB 3.27Å; E28-F32 PolarHBondContact O-N 3Å; F30-F32 VanDerWaalsContact C-N 3.28Å; F30-F32 PolarHBondContact O-N 3.48Å; F32-N34 VanDerWaalsContact C-N 3.35Å; F32-N34 PolarHBondContact O-N 3.5Å; F32-E35 CarbonylContact O-C 3.57Å; F32-E35 WeakPolarHBondContact O-CB 3.31Å; F32-E35 PolarHBondContact O-N 2.83Å; F32-E36 HydrophobicContact CD1-CG 4.07Å; F32-E36 HydrophobicContact CE1-CG 3.85Å; F32-E36 VanDerWaalsContact CE1-OE1 3.27Å; F32-E36 WeakPolarHBondContact CE1-OE1 3.43Å; F32-E36 WeakPolarHBondContact CE1-OE2 3.09Å; F32-E36 HydrophobicContact CZ-CG 4.33Å; F32-E36 VanDerWaalsContact CZ-OE1 3.31Å; F32-E36 WeakPolarHBondContact CZ-OE1 3.39Å; F32-E36 WeakPolarHBondContact O-CG 3.33Å; F32-E36 PolarHBondContact O-N 2.65Å
33	L	60.2	Low	60	Low	80 Å²	80	105.2 Å²	105.2	42%	0.419	53%	0.527	S	S	.	.	H	α-helix	trans	-74.2	-15.6	178.5	-69.7	177.2	0	0	0	114	N29 F30 E36 G37	N29-L33 WeakPolarHBondContact ND2-CD1 3.37Å; N29-L33 WeakPolarHBondContact O-CA 3.38Å; N29-L33 WeakPolarHBondContact O-CB 3.19Å; N29-L33 WeakPolarHBondContact O-CG 2.97Å; N29-L33 PolarHBondContact O-N 2.86Å; F30-L33 CarbonylContact O-C 3.51Å; F30-L33 PolarHBondContact O-N 3.05Å; L33-E36 HydrophobicContact CD2-CB 4.45Å; L33-E36 CarbonylContact O-C 3.41Å; L33-G37 WeakPolarHBondContact O-CA 3.08Å; L33-G37 PolarHBondContact O-N 3.22Å
34	N	60.5	Low	57.3	Low	110 Å²	110	111.5 Å²	111.5	59%	0.588	55%	0.55	S	S	*	*	H	α-helix	trans	-79.9	-29.8	171.9	-169.6	39.1	0	0	0	109.2	F30 F32	F30-N34 HydrophobicContact CD1-CB 4.34Å; F30-N34 HydrophobicContact CE1-CB 4.08Å; F30-N34 HydrophobicContact CZ-CB 4.4Å; F30-N34 WeakPolarHBondContact O-CA 3.38Å; F30-N34 WeakPolarHBondContact O-CB 3.03Å; F30-N34 PolarHBondContact O-N 2.92Å; F32-N34 VanDerWaalsContact C-N 3.35Å; F32-N34 PolarHBondContact O-N 3.5Å
35	E	55.1	Low	54.6	Low	95 Å²	95	118.1 Å²	118.1	44%	0.444	58%	0.577	S	S	.	*	H	α-helix	trans	-71.9	-39.9	164.2	-68.5	-93.6	142.9	0	0	110.7	H31 F32 I39 Y91	H31-E35 PolarHBondContact O-N 2.57Å; F32-E35 CarbonylContact O-C 3.57Å; F32-E35 WeakPolarHBondContact O-CB 3.31Å; F32-E35 PolarHBondContact O-N 2.83Å; E35-I39 WeakPolarHBondContact O-CG1 3.41Å; E35-Y91 PolarHBondContact OE2-OH 2.97Å
36	E	50.5	Low	52.1	Low	80 Å²	80	117.5 Å²	117.5	37%	0.374	59%	0.587	S	S	.	*	H	α-helix	trans	-84.5	-7.9	175.9	-48.7	-157.8	145	0	0	116.5	F32 L33 K38 I39	F32-E36 HydrophobicContact CD1-CG 4.07Å; F32-E36 HydrophobicContact CE1-CG 3.85Å; F32-E36 VanDerWaalsContact CE1-OE1 3.27Å; F32-E36 WeakPolarHBondContact CE1-OE1 3.43Å; F32-E36 WeakPolarHBondContact CE1-OE2 3.09Å; F32-E36 HydrophobicContact CZ-CG 4.33Å; F32-E36 VanDerWaalsContact CZ-OE1 3.31Å; F32-E36 WeakPolarHBondContact CZ-OE1 3.39Å; F32-E36 WeakPolarHBondContact O-CG 3.33Å; F32-E36 PolarHBondContact O-N 2.65Å; L33-E36 HydrophobicContact CD2-CB 4.45Å; L33-E36 CarbonylContact O-C 3.41Å; E36-K38 VanDerWaalsContact C-N 3.27Å; E36-K38 PolarHBondContact O-N 3.43Å; E36-I39 HydrophobicContact CB-CB 4.24Å; E36-I39 HydrophobicContact CB-CD1 3.94Å; E36-I39 HydrophobicContact CB-CG1 4.29Å; E36-I39 HydrophobicContact CB-CG2 4.46Å; E36-I39 HydrophobicContact CG-CD1 3.91Å; E36-I39 WeakPolarHBondContact O-CA 3.08Å; E36-I39 WeakPolarHBondContact O-CB 3.44Å; E36-I39 PolarHBondContact O-N 3.34Å
37	G	41.4	Very low	49.4	Very low	50 Å²	50	119.4 Å²	119.4	52%	0.515	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-25.6	-175.7	0	0	0	0	0	110.7	L33 I39	L33-G37 WeakPolarHBondContact O-CA 3.08Å; L33-G37 PolarHBondContact O-N 3.22Å; G37-I39 PolarHBondContact O-N 2.7Å
38	K	42.4	Very low	46.9	Very low	142 Å²	142	117.5 Å²	117.5	62%	0.617	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-6.4	166.3	-141.9	-179.4	-177.6	-169.6	0	112.3	E36	E36-K38 VanDerWaalsContact C-N 3.27Å; E36-K38 PolarHBondContact O-N 3.43Å
39	I	42.8	Very low	44.7	Very low	38 Å²	38	117.9 Å²	117.9	20%	0.195	64%	0.638	C	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	-21.3	-166.8	-66.9	-173.3	0	0	0	114.7	E35 E36 G37 R90	E35-I39 WeakPolarHBondContact O-CG1 3.41Å; E36-I39 HydrophobicContact CB-CB 4.24Å; E36-I39 HydrophobicContact CB-CD1 3.94Å; E36-I39 HydrophobicContact CB-CG1 4.29Å; E36-I39 HydrophobicContact CB-CG2 4.46Å; E36-I39 HydrophobicContact CG-CD1 3.91Å; E36-I39 WeakPolarHBondContact O-CA 3.08Å; E36-I39 WeakPolarHBondContact O-CB 3.44Å; E36-I39 PolarHBondContact O-N 3.34Å; G37-I39 PolarHBondContact O-N 2.7Å; I39-R90 PolarHBondContact O-NH1 3.31Å; I39-R90 PolarHBondContact O-NH2 3.46Å
40	Q	36.4	Very low	42.5	Very low	148 Å²	148	120.4 Å²	120.4	69%	0.692	66%	0.656	S	S	*	*	S	Bend	trans	-113.1	-12.3	-179	-74.8	-74.1	6.2	0	0	115.7	K42	Q40-K42 PolarHBondContact O-N 3.46Å; Q40-K42 VanDerWaalsContact O-N 3.15Å
41	F	34.2	Very low	40.6	Very low	198 Å²	198	118.7 Å²	118.7	87%	0.868	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	108.4	177.4	-104.7	-93	0	0	0	110.6
42	K	32.4	Very low	39.4	Very low	196 Å²	196	119.4 Å²	119.4	85%	0.852	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.3	49.4	175.4	-147.2	176.2	-174.5	-179.3	0	115.9	Q40 K44	Q40-K42 PolarHBondContact O-N 3.46Å; Q40-K42 VanDerWaalsContact O-N 3.15Å; K42-K44 PolarHBondContact O-N 3.42Å
43	S	29.4	Very low	38.8	Very low	98 Å²	98	120.3 Å²	120.3	69%	0.685	68%	0.683	S	S	*	*			trans	-65.5	99.8	143.9	68.9	0	0	0	0	109.1
44	K	27.4	Very low	38.3	Very low	191 Å²	191	128.2 Å²	128.2	83%	0.83	71%	0.708	S	S	*	*			trans	-167.2	129.5	150.4	-107.1	-176.5	-170.1	-159.7	0	109.9	K42	K42-K44 PolarHBondContact O-N 3.42Å
45	Q	28.6	Very low	38.2	Very low	190 Å²	190	126.4 Å²	126.4	89%	0.888	70%	0.704	S	S	*	*			trans	81.3	99.2	176	-60.7	174.1	-14	0	0	114.7
46	A	30.6	Very low	38.7	Very low	88 Å²	88	125.4 Å²	125.4	73%	0.727	70%	0.699	S	S	*	*				84.5	111.5	56.5	0	0	0	0	0	113.9
47	V	29.7	Very low	39.9	Very low	149 Å²	149	124.1 Å²	124.1	90%	0.903	70%	0.699	S	S	*	*			trans	75.8	121.8	139	-176.5	0	0	0	0	119.4
48	G	25.6	Very low	42	Very low	79 Å²	79	122 Å²	122	81%	0.814	68%	0.676	S	S	*	*			trans	114.1	105.3	141.4	0	0	0	0	0	116.3
49	G	28.7	Very low	43.8	Very low	80 Å²	80	117.9 Å²	117.9	83%	0.825	66%	0.657	S	S	*	*			trans	175.4	54.9	173	0	0	0	0	0	115.6
50	T	30.4	Very low	45.8	Very low	140 Å²	140	123 Å²	123	86%	0.859	68%	0.68	S	S	*	*			trans	-67.7	152.2	162.5	42.5	0	0	0	0	111.5
51	A	34.8	Very low	48.1	Very low	87 Å²	87	124.4 Å²	124.4	72%	0.719	68%	0.683	S	S	*	*			trans	92.9	99.6	165.1	0	0	0	0	0	118
52	Q	42.8	Very low	50.5	Low	153 Å²	153	116.8 Å²	116.8	72%	0.715	65%	0.651	S	S	*	*				-178	105	121.2	-96.3	175.7	30.5	0	0	109.1	K83	Q52-K83 PolarHBondContact O-NZ 2.89Å
53	T	50.5	Low	53	Low	134 Å²	134	112.7 Å²	112.7	82%	0.822	64%	0.642	S	S	*	*			trans	-110.1	106	-175	40.4	0	0	0	0	109.6
54	R	49.8	Very low	55.6	Low	247 Å²	247	111.1 Å²	111.1	93%	0.932	62%	0.623	S	S	*	*	S	Bend	trans	-176.1	-36.6	147.6	-108.4	173.7	-171.2	-178.4	2.9	114.5
55	S	58.7	Low	58.2	Low	72 Å²	72	107.2 Å²	107.2	50%	0.503	61%	0.611	S	S	.	*	S	Bend	trans	-93.8	-21.7	-179.1	52.2	0	0	0	0	114.1	S57	S55-S57 VanDerWaalsContact C-N 3.3Å; S55-S57 PolarHBondContact O-N 3.47Å
56	E	65.3	Low	60.8	Low	73 Å²	73	102.7 Å²	102.7	34%	0.341	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	16.6	-167	-63.3	-178.5	174.6	0	0	115.2	W59 K83	E56-W59 WeakPolarHBondContact O-CH2 3.4Å; E56-W59 VanDerWaalsContact O-CZ2 3.29Å; E56-W59 WeakPolarHBondContact O-CZ2 3.26Å; E56-W59 WeakPolarHBondContact O-CZ3 3.49Å; E56-K83 VanDerWaalsContact CD-CE 3.45Å; E56-K83 VanDerWaalsContact OE1-CD 3.26Å; E56-K83 WeakPolarHBondContact OE1-CD 3.49Å; E56-K83 VanDerWaalsContact OE1-CE 3.28Å; E56-K83 WeakPolarHBondContact OE1-CE 3.26Å; E56-K83 IonicContact OE1-NZ 2.67Å; E56-K83 PolarHBondContact OE1-NZ 2.92Å; E56-K83 WeakPolarHBondContact OE2-CE 3.43Å; E56-K83 IonicContact OE2-NZ 2.67Å; E56-K83 PolarHBondContact OE2-NZ 3.05Å
57	S	76.9	Confident	63	Low	53 Å²	53	102.8 Å²	102.8	37%	0.371	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.3	32.3	171	-47.3	0	0	0	0	110.3	S55 W59 E60	S55-S57 VanDerWaalsContact C-N 3.3Å; S55-S57 PolarHBondContact O-N 3.47Å; S57-W59 PolarHBondContact O-N 2.78Å; S57-E60 PolarHBondContact O-N 2.78Å; S57-E60 VanDerWaalsContact O-N 3.08Å
58	C	83.9	Confident	65.3	Low	5 Å²	5	98.8 Å²	98.8	3%	0.034	55%	0.552	C	S	.	*	H	α-helix	trans	-58.6	-30.9	-179.4	58.1	0	0	0	0	112.4	E60 K61 E62 C97 S100 V103	C58-E60 PolarHBondContact O-N 3.19Å; C58-E60 VanDerWaalsContact O-N 3.09Å; C58-K61 PolarHBondContact O-N 2.78Å; C58-E62 WeakPolarHBondContact O-CB 3.1Å; C58-E62 PolarHBondContact O-N 3.39Å; C58-C97 VanDerWaalsContact C-SG 3.57Å; C58-C97 HydrophobicContact CB-CB 3.71Å; C58-C97 WeakPolarHBondContact CB-SG 3.44Å; C58-C97 WeakPolarHBondContact SG-CB 3.44Å; C58-C97 CovalentContact SG-SG 2.04Å; C58-C97 PolarHBondContact SG-SG 3.49Å; C58-S100 VanDerWaalsContact CB-CB 3.44Å; C58-S100 WeakPolarHBondContact CB-OG 3.02Å; C58-V103 WeakPolarHBondContact SG-CG2 3.21Å
59	W	81.2	Confident	67.9	Low	57 Å²	57	99.4 Å²	99.4	22%	0.216	54%	0.542	C	S	.	.	H	α-helix	trans	-62.4	-14.1	176.7	60.1	76.5	0	0	0	114.6	E56 S57 F64 V95 C97 V103 R105	E56-W59 WeakPolarHBondContact O-CH2 3.4Å; E56-W59 VanDerWaalsContact O-CZ2 3.29Å; E56-W59 WeakPolarHBondContact O-CZ2 3.26Å; E56-W59 WeakPolarHBondContact O-CZ3 3.49Å; S57-W59 PolarHBondContact O-N 2.78Å; W59-F64 HydrophobicContact CB-CB 4.42Å; W59-F64 HydrophobicContact CB-CD1 3.54Å; W59-F64 HydrophobicContact CB-CD2 4.47Å; W59-F64 HydrophobicContact CB-CE1 3.88Å; W59-F64 HydrophobicContact CB-CG 3.88Å; W59-F64 HydrophobicContact CB-CZ 4.5Å; W59-F64 WeakPolarHBondContact O-CD1 3.1Å; W59-F64 WeakPolarHBondContact O-CE1 3.27Å; W59-V95 HydrophobicContact CE3-CG2 4.17Å; W59-C97 PolarHBondContact N-SG 3.42Å; W59-V103 HydrophobicContact CE3-CG2 3.77Å; W59-V103 HydrophobicContact CZ3-CG2 3.77Å; W59-R105 HydrophobicContact CD2-CB 4.33Å; W59-R105 HydrophobicContact CE3-CB 4Å; W59-R105 HydrophobicContact CH2-CB 3.4Å; W59-R105 VanDerWaalsContact CH2-CB 3.4Å; W59-R105 HydrophobicContact CZ2-CB 3.84Å; W59-R105 HydrophobicContact CZ3-CB 3.54Å
60	E	84.3	Confident	70.5	Confident	146 Å²	146	97.4 Å²	97.4	68%	0.682	52%	0.515	S	S	*	.	H	α-helix	trans	-86.3	-24	174	-62.5	-177.6	175.9	0	0	112.6	S57 C58	S57-E60 PolarHBondContact O-N 2.78Å; S57-E60 VanDerWaalsContact O-N 3.08Å; C58-E60 PolarHBondContact O-N 3.19Å; C58-E60 VanDerWaalsContact O-N 3.09Å
61	K	85.9	Confident	72.7	Confident	176 Å²	176	92.4 Å²	92.4	77%	0.765	48%	0.484	S	S	*	.	H	α-helix	trans	-111.6	-21	-171.5	-61.9	-179.2	-177.3	177	0	113	C58	C58-K61 PolarHBondContact O-N 2.78Å
62	E	84.2	Confident	74.9	Confident	39 Å²	39	92 Å²	92	18%	0.182	48%	0.475	C	S	.	.	S	Bend	trans	-126	151.7	-174.7	-61.6	172	-156.4	0	0	110.1	C58 C97 K99 S100	C58-E62 WeakPolarHBondContact O-CB 3.1Å; C58-E62 PolarHBondContact O-N 3.39Å; E62-C97 WeakPolarHBondContact OE2-CB 3.19Å; E62-K99 HydrophobicContact CG-CD 4.38Å; E62-K99 HydrophobicContact CG-CG 4.45Å; E62-K99 WeakPolarHBondContact OE2-CA 3.1Å; E62-K99 WeakPolarHBondContact OE2-CB 3.26Å; E62-K99 PolarHBondContact OE2-N 2.68Å; E62-S100 PolarHBondContact OE1-OG 3.45Å; E62-S100 PolarHBondContact OE2-N 3.47Å
63	T	84.1	Confident	76.7	Confident	109 Å²	109	85.4 Å²	85.4	67%	0.669	45%	0.445	S	S	*	.			trans	-59.9	137	163.1	45.1	0	0	0	0	109.2	S98	T63-S98 PolarHBondContact O-N 2.89Å; T63-S98 VanDerWaalsContact O-N 3.12Å; T63-S98 PolarHBondContact O-OG 3.13Å; T63-S98 PolarHBondContact OG1-OG 3.06Å
64	F	83.5	Confident	78.1	Confident	65 Å²	65	81.8 Å²	81.8	29%	0.285	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145	-179.8	67.8	-87.1	0	0	0	110.3	W59 I66 V95 N96	W59-F64 HydrophobicContact CB-CB 4.42Å; W59-F64 HydrophobicContact CB-CD1 3.54Å; W59-F64 HydrophobicContact CB-CD2 4.47Å; W59-F64 HydrophobicContact CB-CE1 3.88Å; W59-F64 HydrophobicContact CB-CG 3.88Å; W59-F64 HydrophobicContact CB-CZ 4.5Å; W59-F64 WeakPolarHBondContact O-CD1 3.1Å; W59-F64 WeakPolarHBondContact O-CE1 3.27Å; F64-I66 HydrophobicContact CD2-CG1 4.44Å; F64-I66 HydrophobicContact CE2-CG1 4.15Å; F64-V95 HydrophobicContact CD2-CB 4.03Å; F64-V95 HydrophobicContact CD2-CG1 3.88Å; F64-V95 HydrophobicContact CE2-CG1 4.28Å; F64-N96 CarbonylContact C-O 3.6Å; F64-N96 VanDerWaalsContact CA-O 3.22Å; F64-N96 WeakPolarHBondContact CA-O 2.82Å
65	D	82.9	Confident	79.4	Confident	110 Å²	110	74.3 Å²	74.3	59%	0.588	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.8	172.3	-67.3	-41.5	0	0	0	110	L67 V95 N96	D65-L67 HydrophobicContact CB-CD1 4.31Å; D65-L67 WeakPolarHBondContact O-CD1 3.38Å; D65-L67 PolarHBondContact O-N 3.43Å; D65-V95 CarbonylContact O-C 3.55Å; D65-V95 WeakPolarHBondContact O-CA 3.35Å; D65-N96 PolarHBondContact N-O 3.48Å; D65-N96 PolarHBondContact O-N 3.47Å
66	I	82.1	Confident	80.3	Confident	95 Å²	95	78.1 Å²	78.1	49%	0.487	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.2	177.6	-57.9	170.3	0	0	0	108	F64 M68 V95	F64-I66 HydrophobicContact CD2-CG1 4.44Å; F64-I66 HydrophobicContact CE2-CG1 4.15Å; I66-M68 WeakPolarHBondContact CG2-O 3.11Å; I66-V95 HydrophobicContact CG1-CG1 4.34Å
67	L	78.7	Confident	80.9	Confident	90 Å²	90	76 Å²	76	47%	0.471	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-35.4	-179.3	-88.6	64	0	0	0	112.1	D65 K94 N96 V102	D65-L67 HydrophobicContact CB-CD1 4.31Å; D65-L67 WeakPolarHBondContact O-CD1 3.38Å; D65-L67 PolarHBondContact O-N 3.43Å; L67-K94 HydrophobicContact CB-CD 4.46Å; L67-K94 HydrophobicContact CB-CG 4.42Å; L67-K94 PolarHBondContact N-O 3.29Å; L67-N96 HydrophobicContact CD1-CB 3.22Å; L67-N96 HydrophobicContact CD2-CB 4.08Å; L67-N96 HydrophobicContact CG-CB 4.28Å; L67-V102 HydrophobicContact CD2-CG2 4.42Å
68	M	77.5	Confident	80.8	Confident	64 Å²	64	78.1 Å²	78.1	32%	0.315	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.9	178	-172.7	178	170.9	0	0	107.7	I66 T71 E93 K94	I66-M68 WeakPolarHBondContact CG2-O 3.11Å; M68-T71 HydrophobicContact CE-CG2 3.67Å; M68-T71 WeakPolarHBondContact CE-OG1 3.4Å; M68-E93 WeakPolarHBondContact O-CB 3.34Å; M68-K94 HydrophobicContact CB-CB 3.51Å; M68-K94 PolarHBondContact N-O 3Å; M68-K94 PolarHBondContact O-N 2.91Å
69	P	79.8	Confident	80.4	Confident	93 Å²	93	84.5 Å²	84.5	60%	0.604	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	163.7	178.5	29.1	-35.4	0	0	0	110.8	T71	P69-T71 WeakPolarHBondContact O-CG2 3.33Å; P69-T71 PolarHBondContact O-N 3.5Å
70	C	82.2	Confident	80.1	Confident	38 Å²	38	84.7 Å²	84.7	26%	0.257	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	107.9	177.5	-168	0	0	0	0	111.6	Y91 C107	C70-Y91 WeakPolarHBondContact SG-CB 3.22Å; C70-C107 WeakPolarHBondContact CA-SG 3.31Å; C70-C107 HydrophobicContact CB-CB 3.91Å; C70-C107 WeakPolarHBondContact CB-SG 3.24Å; C70-C107 WeakPolarHBondContact SG-CB 3.46Å; C70-C107 CovalentContact SG-SG 2.03Å; C70-C107 PolarHBondContact SG-SG 3.19Å
71	T	77.2	Confident	79.6	Confident	34 Å²	34	79.3 Å²	79.3	21%	0.209	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149	-178.4	49.1	0	0	0	0	112	M68 P69 Y91 Y92	M68-T71 HydrophobicContact CE-CG2 3.67Å; M68-T71 WeakPolarHBondContact CE-OG1 3.4Å; P69-T71 WeakPolarHBondContact O-CG2 3.33Å; P69-T71 PolarHBondContact O-N 3.5Å; T71-Y91 VanDerWaalsContact O-CA 3.27Å; T71-Y91 WeakPolarHBondContact O-CA 3.33Å; T71-Y92 PolarHBondContact N-O 2.81Å; T71-Y92 WeakPolarHBondContact O-CD1 3.29Å; T71-Y92 PolarHBondContact O-N 2.76Å; T71-Y92 PolarHBondContact OG1-O 3.35Å
72	P	80.5	Confident	78.5	Confident	80 Å²	80	74 Å²	74	52%	0.519	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.6	175.8	28.3	-34.5	0	0	0	110.7	S74 Y91	P72-S74 PolarHBondContact O-N 2.78Å; P72-Y91 HydrophobicContact CB-CD1 4.1Å; P72-Y91 HydrophobicContact CB-CE1 3.95Å
73	C	81.6	Confident	77.7	Confident	13 Å²	13	77.6 Å²	77.6	9%	0.088	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-63.4	118.5	174.8	-63.8	0	0	0	0	110.7	K78 C85 R90 Y92	C73-K78 HydrophobicContact CB-CG 4.44Å; C73-C85 HydrophobicContact CB-CB 3.73Å; C73-C85 WeakPolarHBondContact CB-SG 3.34Å; C73-C85 VanDerWaalsContact SG-CA 3.52Å; C73-C85 WeakPolarHBondContact SG-CB 3.5Å; C73-C85 CovalentContact SG-SG 2.03Å; C73-C85 PolarHBondContact SG-SG 3.13Å; C73-R90 PolarHBondContact N-O 3.33Å; C73-R90 VanDerWaalsContact SG-C 3.59Å; C73-R90 PolarHBondContact SG-O 2.86Å; C73-Y92 HydrophobicContact CB-CD1 4.42Å
74	S	79.7	Confident	77	Confident	58 Å²	58	73.5 Å²	73.5	41%	0.406	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-70.3	161.2	168.8	-169.6	0	0	0	0	110.6	P72 F76 D77 K78	P72-S74 PolarHBondContact O-N 2.78Å; S74-F76 PolarHBondContact O-N 3.37Å; S74-D77 WeakPolarHBondContact CB-OD2 3.37Å; S74-D77 PolarHBondContact N-OD2 3.24Å; S74-D77 PolarHBondContact O-N 2.82Å; S74-K78 WeakPolarHBondContact O-CG 3.24Å; S74-K78 PolarHBondContact O-N 3.27Å
75	D	77.6	Confident	76.5	Confident	90 Å²	90	70.8 Å²	70.8	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-63.6	-28	176.4	-63.2	-49	0	0	0	111.8	K78	D75-K78 IonicContact OD1-NZ 2.78Å; D75-K78 PolarHBondContact OD1-NZ 3.21Å
76	F	77.4	Confident	75.8	Confident	153 Å²	153	66.5 Å²	66.5	67%	0.671	38%	0.376	S	S	*	.	H	α-helix	trans	-69	-42	170.1	-176.3	-97	0	0	0	112.4	S74 K78 I79 A80	S74-F76 PolarHBondContact O-N 3.37Å; F76-K78 VanDerWaalsContact C-N 3.29Å; F76-K78 PolarHBondContact O-N 3.26Å; F76-I79 WeakPolarHBondContact O-CB 3Å; F76-I79 PolarHBondContact O-N 3.31Å; F76-A80 HydrophobicContact CD1-CB 4.44Å; F76-A80 HydrophobicContact CE1-CB 4.12Å; F76-A80 PolarHBondContact O-N 2.85Å
77	D	78.8	Confident	74.7	Confident	27 Å²	27	68.2 Å²	68.2	14%	0.144	39%	0.393	C	S	.	.	H	α-helix	trans	-68.6	-29.2	-179.3	-56.3	-43.2	0	0	0	112	S74 I79 A80 L81 Y92	S74-D77 WeakPolarHBondContact CB-OD2 3.37Å; S74-D77 PolarHBondContact N-OD2 3.24Å; S74-D77 PolarHBondContact O-N 2.82Å; D77-I79 PolarHBondContact O-N 3.38Å; D77-A80 PolarHBondContact O-N 2.85Å; D77-L81 CarbonylContact O-C 3.55Å; D77-L81 VanDerWaalsContact O-CA 3.26Å; D77-L81 WeakPolarHBondContact O-CA 3.41Å; D77-L81 WeakPolarHBondContact O-CB 3.25Å; D77-L81 PolarHBondContact O-N 2.99Å; D77-Y92 HydrophobicContact CB-CE1 4.37Å; D77-Y92 PolarHBondContact OD2-OH 3.34Å; D77-Y92 VanDerWaalsContact OD2-OH 3.13Å
78	K	74.6	Confident	74	Confident	98 Å²	98	69.7 Å²	69.7	43%	0.426	41%	0.406	S	S	.	.	H	α-helix	trans	-60.2	-30.7	171.9	-68.6	173.4	-169.8	164.4	0	112.4	C73 S74 D75 F76 A82	C73-K78 HydrophobicContact CB-CG 4.44Å; S74-K78 WeakPolarHBondContact O-CG 3.24Å; S74-K78 PolarHBondContact O-N 3.27Å; D75-K78 IonicContact OD1-NZ 2.78Å; D75-K78 PolarHBondContact OD1-NZ 3.21Å; F76-K78 VanDerWaalsContact C-N 3.29Å; F76-K78 PolarHBondContact O-N 3.26Å; K78-A82 VanDerWaalsContact O-CA 3.29Å; K78-A82 WeakPolarHBondContact O-CA 3.37Å; K78-A82 WeakPolarHBondContact O-CB 3.39Å
79	I	75.3	Confident	73.4	Confident	139 Å²	139	67.4 Å²	67.4	71%	0.713	40%	0.397	S	S	*	.	H	α-helix	trans	-84.7	-49.1	178	-57.3	170.6	0	0	0	109.6	F76 D77	F76-I79 WeakPolarHBondContact O-CB 3Å; F76-I79 PolarHBondContact O-N 3.31Å; D77-I79 PolarHBondContact O-N 3.38Å
80	A	75.3	Confident	72.9	Confident	61 Å²	61	67.8 Å²	67.8	50%	0.504	39%	0.386	S	S	.	.	H	α-helix	trans	-73	-37.1	-175.2	0	0	0	0	0	113.5	F76 D77	F76-A80 HydrophobicContact CD1-CB 4.44Å; F76-A80 HydrophobicContact CE1-CB 4.12Å; F76-A80 PolarHBondContact O-N 2.85Å; D77-A80 PolarHBondContact O-N 2.85Å
81	L	71.8	Confident	72.7	Confident	34 Å²	34	67.5 Å²	67.5	18%	0.178	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	41.5	-177.1	-77.1	69.7	0	0	0	110.5	D77 K83 T84 C85 Y92 Y104	D77-L81 CarbonylContact O-C 3.55Å; D77-L81 VanDerWaalsContact O-CA 3.26Å; D77-L81 WeakPolarHBondContact O-CA 3.41Å; D77-L81 WeakPolarHBondContact O-CB 3.25Å; D77-L81 PolarHBondContact O-N 2.99Å; L81-K83 PolarHBondContact O-N 3.36Å; L81-T84 PolarHBondContact O-N 2.83Å; L81-C85 PolarHBondContact O-N 3.24Å; L81-Y92 HydrophobicContact CD2-CD2 3.87Å; L81-Y92 HydrophobicContact CD2-CE2 3.85Å; L81-Y104 HydrophobicContact CD2-CD1 3.66Å; L81-Y104 HydrophobicContact CD2-CD2 3.96Å; L81-Y104 HydrophobicContact CD2-CE1 4.06Å; L81-Y104 HydrophobicContact CD2-CE2 4.38Å; L81-Y104 HydrophobicContact CD2-CG 3.58Å
82	A	63.8	Low	73	Confident	64 Å²	64	66.7 Å²	66.7	53%	0.529	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-26.1	-177.1	0	0	0	0	0	114.4	K78	K78-A82 VanDerWaalsContact O-CA 3.29Å; K78-A82 WeakPolarHBondContact O-CA 3.37Å; K78-A82 WeakPolarHBondContact O-CB 3.39Å
83	K	68	Low	73	Confident	114 Å²	114	63.7 Å²	63.7	50%	0.496	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-36.6	178.7	-163	171.2	-172.9	-177.8	0	113.9	Q52 E56 L81	Q52-K83 PolarHBondContact O-NZ 2.89Å; E56-K83 VanDerWaalsContact CD-CE 3.45Å; E56-K83 VanDerWaalsContact OE1-CD 3.26Å; E56-K83 WeakPolarHBondContact OE1-CD 3.49Å; E56-K83 VanDerWaalsContact OE1-CE 3.28Å; E56-K83 WeakPolarHBondContact OE1-CE 3.26Å; E56-K83 IonicContact OE1-NZ 2.67Å; E56-K83 PolarHBondContact OE1-NZ 2.92Å; E56-K83 WeakPolarHBondContact OE2-CE 3.43Å; E56-K83 IonicContact OE2-NZ 2.67Å; E56-K83 PolarHBondContact OE2-NZ 3.05Å; L81-K83 PolarHBondContact O-N 3.36Å
84	T	68.6	Low	73	Confident	24 Å²	24	66 Å²	66	15%	0.147	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-38.4	-177.8	-47.9	0	0	0	0	111.7	L81 G86 S89 Y104 R105	L81-T84 PolarHBondContact O-N 2.83Å; T84-G86 VanDerWaalsContact C-N 3.35Å; T84-G86 PolarHBondContact O-N 2.82Å; T84-S89 WeakPolarHBondContact O-CB 3.32Å; T84-S89 PolarHBondContact O-OG 3.38Å; T84-Y104 WeakPolarHBondContact CG2-O 3.41Å; T84-Y104 PolarHBondContact OG1-O 3.33Å; T84-R105 VanDerWaalsContact CG2-CA 3.5Å
85	C	73.2	Confident	73.1	Confident	7 Å²	7	63.3 Å²	63.3	5%	0.047	34%	0.342	C	S	.	.	S	Bend	trans	-94.5	64.7	173.4	-81.5	0	0	0	0	109.7	C73 L81 Y92	C73-C85 HydrophobicContact CB-CB 3.73Å; C73-C85 WeakPolarHBondContact CB-SG 3.34Å; C73-C85 VanDerWaalsContact SG-CA 3.52Å; C73-C85 WeakPolarHBondContact SG-CB 3.5Å; C73-C85 CovalentContact SG-SG 2.03Å; C73-C85 PolarHBondContact SG-SG 3.13Å; L81-C85 PolarHBondContact O-N 3.24Å; C85-Y92 WeakPolarHBondContact SG-CD1 3.5Å
86	G	67.5	Low	73.4	Confident	20 Å²	20	61.7 Å²	61.7	21%	0.206	33%	0.333	C	S	.	.			trans	-83	178.6	179.2	0	0	0	0	0	112.8	T84 T88 S89	T84-G86 VanDerWaalsContact C-N 3.35Å; T84-G86 PolarHBondContact O-N 2.82Å; G86-T88 PolarHBondContact O-N 3.47Å; G86-S89 PolarHBondContact N-OG 2.89Å; G86-S89 PolarHBondContact O-N 3.5Å; G86-S89 VanDerWaalsContact O-O 3.09Å
87	P	59.5	Low	73.7	Confident	131 Å²	131	54.5 Å²	54.5	85%	0.851	30%	0.302	S	S	*	.	S	Bend	trans	-62.8	-24.1	178.1	24.2	-32.8	0	0	0	113.4
88	T	64.1	Low	74.1	Confident	121 Å²	121	57 Å²	57	74%	0.742	32%	0.321	S	S	*	.	S	Bend	trans	-94	-29.2	179.3	51.6	0	0	0	0	113	G86	G86-T88 PolarHBondContact O-N 3.47Å
89	S	64.9	Low	74.6	Confident	16 Å²	16	61 Å²	61	11%	0.112	34%	0.339	C	S	.	.			trans	-104.7	107.8	-175.9	49.3	0	0	0	0	111.3	T84 G86 S106	T84-S89 WeakPolarHBondContact O-CB 3.32Å; T84-S89 PolarHBondContact O-OG 3.38Å; G86-S89 PolarHBondContact N-OG 2.89Å; G86-S89 PolarHBondContact O-N 3.5Å; G86-S89 VanDerWaalsContact O-O 3.09Å; S89-S106 VanDerWaalsContact CB-CB 3.49Å
90	R	68.7	Low	75	Confident	102 Å²	102	57.1 Å²	57.1	39%	0.385	32%	0.324	S	S	.	.			trans	-89.9	-20.8	-176.1	-63.9	180	-161.1	-90.4	0.4	114.5	I39 C73	I39-R90 PolarHBondContact O-NH1 3.31Å; I39-R90 PolarHBondContact O-NH2 3.46Å; C73-R90 PolarHBondContact N-O 3.33Å; C73-R90 VanDerWaalsContact SG-C 3.59Å; C73-R90 PolarHBondContact SG-O 2.86Å
91	Y	79.4	Confident	75.5	Confident	31 Å²	31	55.4 Å²	55.4	12%	0.122	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.6	-180	-54.6	-103.9	0	0	0	108.9	E35 C70 T71 P72 S106 C107 P109	E35-Y91 PolarHBondContact OE2-OH 2.97Å; C70-Y91 WeakPolarHBondContact SG-CB 3.22Å; T71-Y91 VanDerWaalsContact O-CA 3.27Å; T71-Y91 WeakPolarHBondContact O-CA 3.33Å; P72-Y91 HydrophobicContact CB-CD1 4.1Å; P72-Y91 HydrophobicContact CB-CE1 3.95Å; Y91-S106 WeakPolarHBondContact O-CA 3.44Å; Y91-C107 VanDerWaalsContact C-SG 3.56Å; Y91-C107 WeakPolarHBondContact CB-O 3.41Å; Y91-C107 PolarHBondContact O-N 2.81Å; Y91-P109 HydrophobicContact CD1-CG 4.29Å; Y91-P109 HydrophobicContact CD2-CG 4.09Å; Y91-P109 HydrophobicContact CE1-CG 4.08Å; Y91-P109 HydrophobicContact CE2-CG 3.87Å; Y91-P109 HydrophobicContact CG-CG 4.32Å
92	Y	82.1	Confident	76.1	Confident	17 Å²	17	57.3 Å²	57.3	7%	0.067	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.1	176.9	72.7	-72.1	0	0	0	109.1	T71 C73 D77 L81 C85 Y104 R105	T71-Y92 PolarHBondContact N-O 2.81Å; T71-Y92 WeakPolarHBondContact O-CD1 3.29Å; T71-Y92 PolarHBondContact O-N 2.76Å; T71-Y92 PolarHBondContact OG1-O 3.35Å; C73-Y92 HydrophobicContact CB-CD1 4.42Å; D77-Y92 HydrophobicContact CB-CE1 4.37Å; D77-Y92 PolarHBondContact OD2-OH 3.34Å; D77-Y92 VanDerWaalsContact OD2-OH 3.13Å; L81-Y92 HydrophobicContact CD2-CD2 3.87Å; L81-Y92 HydrophobicContact CD2-CE2 3.85Å; C85-Y92 WeakPolarHBondContact SG-CD1 3.5Å; Y92-Y104 AromaticContact CD2-CD1 3.86Å; Y92-Y104 HydrophobicContact CD2-CD1 3.86Å; Y92-Y104 HydrophobicContact CD2-CE1 4.48Å; Y92-Y104 HydrophobicContact CE2-CD1 4.04Å; Y92-Y104 HydrophobicContact CE2-CE1 4.2Å; Y92-R105 CarbonylContact C-O 3.41Å; Y92-R105 WeakPolarHBondContact CA-O 3.3Å
93	E	81.1	Confident	77.2	Confident	18 Å²	18	55.3 Å²	55.3	8%	0.084	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.3	172.8	65.5	-174.6	165.2	0	0	110.1	M68 V95 Y104 R105 C107	M68-E93 WeakPolarHBondContact O-CB 3.34Å; E93-V95 HydrophobicContact CG-CG1 4.1Å; E93-Y104 WeakPolarHBondContact O-CA 3.29Å; E93-R105 HydrophobicContact CG-CG 3.7Å; E93-R105 PolarHBondContact N-O 3.38Å; E93-R105 PolarHBondContact O-N 3.33Å; E93-R105 IonicContact OE1-CZ 3.07Å; E93-R105 IonicContact OE1-NE 2.65Å; E93-R105 PolarHBondContact OE1-NE 2.85Å; E93-R105 IonicContact OE1-NH2 3.47Å; E93-R105 PolarHBondContact OE1-NH2 2.98Å; E93-C107 HydrophobicContact CB-CB 4.36Å; E93-C107 HydrophobicContact CG-CB 3.94Å
94	K	81.8	Confident	77.9	Confident	62 Å²	62	54.2 Å²	54.2	27%	0.27	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118.4	177.3	-169.3	-179.7	-178.6	178.2	0	108	L67 M68 V102 Y104	L67-K94 HydrophobicContact CB-CD 4.46Å; L67-K94 HydrophobicContact CB-CG 4.42Å; L67-K94 PolarHBondContact N-O 3.29Å; M68-K94 HydrophobicContact CB-CB 3.51Å; M68-K94 PolarHBondContact N-O 3Å; M68-K94 PolarHBondContact O-N 2.91Å; K94-V102 HydrophobicContact CD-CG1 4.09Å; K94-V102 HydrophobicContact CG-CG1 3.79Å; K94-Y104 HydrophobicContact CB-CD1 4.03Å; K94-Y104 HydrophobicContact CB-CE1 3.83Å; K94-Y104 HydrophobicContact CD-CE1 3.94Å; K94-Y104 HydrophobicContact CG-CD1 4.14Å; K94-Y104 HydrophobicContact CG-CE1 3.71Å
95	V	82.3	Confident	78.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	147.1	176.8	-59.3	0	0	0	0	110	W59 F64 D65 I66 E93 V102 V103 R105	W59-V95 HydrophobicContact CE3-CG2 4.17Å; F64-V95 HydrophobicContact CD2-CB 4.03Å; F64-V95 HydrophobicContact CD2-CG1 3.88Å; F64-V95 HydrophobicContact CE2-CG1 4.28Å; D65-V95 CarbonylContact O-C 3.55Å; D65-V95 WeakPolarHBondContact O-CA 3.35Å; I66-V95 HydrophobicContact CG1-CG1 4.34Å; E93-V95 HydrophobicContact CG-CG1 4.1Å; V95-V102 WeakPolarHBondContact O-CA 3.38Å; V95-V103 HydrophobicContact CG2-CG2 3.47Å; V95-V103 VanDerWaalsContact CG2-CG2 3.47Å; V95-V103 PolarHBondContact N-O 3.18Å; V95-V103 PolarHBondContact O-N 2.88Å; V95-V103 VanDerWaalsContact O-O 3.1Å; V95-R105 HydrophobicContact CG1-CG 4.35Å
96	N	82.8	Confident	78.8	Confident	57 Å²	57	57.8 Å²	57.8	31%	0.305	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	110.5	171	-177.2	35.6	0	0	0	108.5	F64 D65 L67 V102	F64-N96 CarbonylContact C-O 3.6Å; F64-N96 VanDerWaalsContact CA-O 3.22Å; F64-N96 WeakPolarHBondContact CA-O 2.82Å; D65-N96 PolarHBondContact N-O 3.48Å; D65-N96 PolarHBondContact O-N 3.47Å; L67-N96 HydrophobicContact CD1-CB 3.22Å; L67-N96 HydrophobicContact CD2-CB 4.08Å; L67-N96 HydrophobicContact CG-CB 4.28Å; N96-V102 HydrophobicContact CB-CG2 4.38Å
97	C	85.3	Confident	79.4	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	137.9	173	-68.1	0	0	0	0	109.8	C58 W59 E62 K99 G101	C58-C97 VanDerWaalsContact C-SG 3.57Å; C58-C97 HydrophobicContact CB-CB 3.71Å; C58-C97 WeakPolarHBondContact CB-SG 3.44Å; C58-C97 WeakPolarHBondContact SG-CB 3.44Å; C58-C97 CovalentContact SG-SG 2.04Å; C58-C97 PolarHBondContact SG-SG 3.49Å; W59-C97 PolarHBondContact N-SG 3.42Å; E62-C97 WeakPolarHBondContact OE2-CB 3.19Å; C97-K99 VanDerWaalsContact C-N 3.28Å; C97-K99 PolarHBondContact O-N 2.9Å; C97-G101 WeakPolarHBondContact CB-O 3.37Å; C97-G101 PolarHBondContact N-O 2.83Å; C97-G101 WeakPolarHBondContact O-CA 3.28Å; C97-G101 PolarHBondContact O-N 3.43Å
98	S	86.1	Confident	80.1	Confident	80 Å²	80	60.4 Å²	60.4	56%	0.559	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.4	-173.9	-56.3	0	0	0	0	114.9	T63	T63-S98 PolarHBondContact O-N 2.89Å; T63-S98 VanDerWaalsContact O-N 3.12Å; T63-S98 PolarHBondContact O-OG 3.13Å; T63-S98 PolarHBondContact OG1-OG 3.06Å
99	K	84.6	Confident	80.2	Confident	183 Å²	183	57 Å²	57	80%	0.796	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-36.1	-179.9	-49	176.7	179.2	176.7	0	112.8	E62 C97	E62-K99 HydrophobicContact CG-CD 4.38Å; E62-K99 HydrophobicContact CG-CG 4.45Å; E62-K99 WeakPolarHBondContact OE2-CA 3.1Å; E62-K99 WeakPolarHBondContact OE2-CB 3.26Å; E62-K99 PolarHBondContact OE2-N 2.68Å; C97-K99 VanDerWaalsContact C-N 3.28Å; C97-K99 PolarHBondContact O-N 2.9Å
100	S	83.4	Confident	79.9	Confident	56 Å²	56	62.2 Å²	62.2	39%	0.392	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11.1	-177.1	-63	0	0	0	0	114	C58 E62	C58-S100 VanDerWaalsContact CB-CB 3.44Å; C58-S100 WeakPolarHBondContact CB-OG 3.02Å; E62-S100 PolarHBondContact OE1-OG 3.45Å; E62-S100 PolarHBondContact OE2-N 3.47Å
101	G	86.8	Confident	79.3	Confident	26 Å²	26	67.4 Å²	67.4	27%	0.268	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	79.5	-152.8	179.9	0	0	0	0	0	113.5	C97	C97-G101 WeakPolarHBondContact CB-O 3.37Å; C97-G101 PolarHBondContact N-O 2.83Å; C97-G101 WeakPolarHBondContact O-CA 3.28Å; C97-G101 PolarHBondContact O-N 3.43Å
102	V	85.2	Confident	78.1	Confident	73 Å²	73	71.7 Å²	71.7	44%	0.442	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124	-172.2	174.8	0	0	0	0	111.4	L67 K94 V95 N96	L67-V102 HydrophobicContact CD2-CG2 4.42Å; K94-V102 HydrophobicContact CD-CG1 4.09Å; K94-V102 HydrophobicContact CG-CG1 3.79Å; V95-V102 WeakPolarHBondContact O-CA 3.38Å; N96-V102 HydrophobicContact CB-CG2 4.38Å
103	V	85.4	Confident	76.7	Confident	23 Å²	23	76.1 Å²	76.1	14%	0.139	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.5	175.9	-59	0	0	0	0	111.4	C58 W59 V95	C58-V103 WeakPolarHBondContact SG-CG2 3.21Å; W59-V103 HydrophobicContact CE3-CG2 3.77Å; W59-V103 HydrophobicContact CZ3-CG2 3.77Å; V95-V103 HydrophobicContact CG2-CG2 3.47Å; V95-V103 VanDerWaalsContact CG2-CG2 3.47Å; V95-V103 PolarHBondContact N-O 3.18Å; V95-V103 PolarHBondContact O-N 2.88Å; V95-V103 VanDerWaalsContact O-O 3.1Å
104	Y	83.2	Confident	75.5	Confident	91 Å²	91	78.7 Å²	78.7	36%	0.357	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.3	177.3	-65.2	-84	0	0	0	109.9	L81 T84 Y92 E93 K94	L81-Y104 HydrophobicContact CD2-CD1 3.66Å; L81-Y104 HydrophobicContact CD2-CD2 3.96Å; L81-Y104 HydrophobicContact CD2-CE1 4.06Å; L81-Y104 HydrophobicContact CD2-CE2 4.38Å; L81-Y104 HydrophobicContact CD2-CG 3.58Å; T84-Y104 WeakPolarHBondContact CG2-O 3.41Å; T84-Y104 PolarHBondContact OG1-O 3.33Å; Y92-Y104 AromaticContact CD2-CD1 3.86Å; Y92-Y104 HydrophobicContact CD2-CD1 3.86Å; Y92-Y104 HydrophobicContact CD2-CE1 4.48Å; Y92-Y104 HydrophobicContact CE2-CD1 4.04Å; Y92-Y104 HydrophobicContact CE2-CE1 4.2Å; E93-Y104 WeakPolarHBondContact O-CA 3.29Å; K94-Y104 HydrophobicContact CB-CD1 4.03Å; K94-Y104 HydrophobicContact CB-CE1 3.83Å; K94-Y104 HydrophobicContact CD-CE1 3.94Å; K94-Y104 HydrophobicContact CG-CD1 4.14Å; K94-Y104 HydrophobicContact CG-CE1 3.71Å
105	R	79.7	Confident	74.5	Confident	42 Å²	42	80.2 Å²	80.2	16%	0.158	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	153.5	177.4	76.4	177.8	-172.5	-173.7	-2.6	111.9	W59 T84 Y92 E93 V95	W59-R105 HydrophobicContact CD2-CB 4.33Å; W59-R105 HydrophobicContact CE3-CB 4Å; W59-R105 HydrophobicContact CH2-CB 3.4Å; W59-R105 VanDerWaalsContact CH2-CB 3.4Å; W59-R105 HydrophobicContact CZ2-CB 3.84Å; W59-R105 HydrophobicContact CZ3-CB 3.54Å; T84-R105 VanDerWaalsContact CG2-CA 3.5Å; Y92-R105 CarbonylContact C-O 3.41Å; Y92-R105 WeakPolarHBondContact CA-O 3.3Å; E93-R105 HydrophobicContact CG-CG 3.7Å; E93-R105 PolarHBondContact N-O 3.38Å; E93-R105 PolarHBondContact O-N 3.33Å; E93-R105 IonicContact OE1-CZ 3.07Å; E93-R105 IonicContact OE1-NE 2.65Å; E93-R105 PolarHBondContact OE1-NE 2.85Å; E93-R105 IonicContact OE1-NH2 3.47Å; E93-R105 PolarHBondContact OE1-NH2 2.98Å; V95-R105 HydrophobicContact CG1-CG 4.35Å
106	S	81.1	Confident	73.8	Confident	63 Å²	63	83.4 Å²	83.4	44%	0.441	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.7	169.8	57.5	0	0	0	0	109.6	S89 Y91	S89-S106 VanDerWaalsContact CB-CB 3.49Å; Y91-S106 WeakPolarHBondContact O-CA 3.44Å
107	C	79.3	Confident	73.4	Confident	11 Å²	11	86.8 Å²	86.8	7%	0.074	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	162.8	175.3	58.6	0	0	0	0	109.9	C70 Y91 E93	C70-C107 WeakPolarHBondContact CA-SG 3.31Å; C70-C107 HydrophobicContact CB-CB 3.91Å; C70-C107 WeakPolarHBondContact CB-SG 3.24Å; C70-C107 WeakPolarHBondContact SG-CB 3.46Å; C70-C107 CovalentContact SG-SG 2.03Å; C70-C107 PolarHBondContact SG-SG 3.19Å; Y91-C107 VanDerWaalsContact C-SG 3.56Å; Y91-C107 WeakPolarHBondContact CB-O 3.41Å; Y91-C107 PolarHBondContact O-N 2.81Å; E93-C107 HydrophobicContact CB-CB 4.36Å; E93-C107 HydrophobicContact CG-CB 3.94Å
108	Y	75.4	Confident	73	Confident	196 Å²	196	90.5 Å²	90.5	77%	0.769	48%	0.475	S	S	*	.			trans	-111.1	132.4	164.5	-65.9	-83	0	0	0	107	N110	Y108-N110 PolarHBondContact O-N 3.46Å
109	P	65.7	Low	72.4	Confident	48 Å²	48	88.5 Å²	88.5	31%	0.312	46%	0.457	S	S	.	.			trans	-61.6	109.9	177.1	25	-32.5	0	0	0	108.2	Y91 R111	Y91-P109 HydrophobicContact CD1-CG 4.29Å; Y91-P109 HydrophobicContact CD2-CG 4.09Å; Y91-P109 HydrophobicContact CE1-CG 4.08Å; Y91-P109 HydrophobicContact CE2-CG 3.87Å; Y91-P109 HydrophobicContact CG-CG 4.32Å; P109-R111 PolarHBondContact O-N 2.9Å
110	N	59.1	Low	72.1	Confident	127 Å²	127	85.1 Å²	85.1	68%	0.679	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	25.3	173.7	-167.1	24.3	0	0	0	112.3	Y108 N112	Y108-N110 PolarHBondContact O-N 3.46Å; N110-N112 PolarHBondContact O-N 2.86Å
111	R	55.2	Low	72.1	Confident	210 Å²	210	91.1 Å²	91.1	79%	0.792	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.7	177.4	-92.1	-174.4	164.4	158.4	-2.8	113.3	P109 T115	P109-R111 PolarHBondContact O-N 2.9Å; R111-T115 PolarHBondContact O-OG1 2.86Å; R111-T115 VanDerWaalsContact O-OG1 3.13Å
112	N	53.7	Low	71.9	Confident	121 Å²	121	95.5 Å²	95.5	65%	0.647	47%	0.473	S	S	*	.	H	α-helix	trans	-62.3	-42.2	-178.2	170.3	-15.4	0	0	0	113.2	N110 S116	N110-N112 PolarHBondContact O-N 2.86Å; N112-S116 WeakPolarHBondContact O-CB 3.08Å
113	Q	53.2	Low	71.8	Confident	111 Å²	111	94.6 Å²	94.6	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-78.2	-47.2	-166	-68.1	-173.4	3.6	0	0	112.9	T115 Y117	Q113-T115 PolarHBondContact O-N 3.26Å; Q113-Y117 HydrophobicContact CB-CE2 4.02Å; Q113-Y117 WeakPolarHBondContact O-CD2 3.27Å; Q113-Y117 WeakPolarHBondContact O-CE2 3.41Å; Q113-Y117 PolarHBondContact O-N 3.36Å
114	A	55.9	Low	71.9	Confident	71 Å²	71	96.9 Å²	96.9	59%	0.587	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-38.8	-171.2	0	0	0	0	0	114.2	V118	A114-V118 PolarHBondContact O-N 3.41Å
115	T	62.2	Low	72.1	Confident	95 Å²	95	97.3 Å²	97.3	58%	0.583	49%	0.491	S	S	*	.	H	α-helix	trans	-72.4	-37.3	-179.2	48.7	0	0	0	0	112.1	R111 Q113 Y117 V118 L119	R111-T115 PolarHBondContact O-OG1 2.86Å; R111-T115 VanDerWaalsContact O-OG1 3.13Å; Q113-T115 PolarHBondContact O-N 3.26Å; T115-Y117 VanDerWaalsContact C-N 3.3Å; T115-Y117 PolarHBondContact O-N 3.01Å; T115-V118 PolarHBondContact O-N 2.77Å; T115-L119 PolarHBondContact O-N 3.19Å
116	S	66.4	Low	72.4	Confident	67 Å²	67	98.4 Å²	98.4	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-60.4	-39.4	177.3	-176.9	0	0	0	0	112	N112 L120	N112-S116 WeakPolarHBondContact O-CB 3.08Å; S116-L120 PolarHBondContact O-N 3.46Å
117	Y	74.5	Confident	72.6	Confident	127 Å²	127	97.3 Å²	97.3	50%	0.498	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-48	177.4	-64.9	-59.3	0	0	0	112	Q113 T115 L119 L120 W121	Q113-Y117 HydrophobicContact CB-CE2 4.02Å; Q113-Y117 WeakPolarHBondContact O-CD2 3.27Å; Q113-Y117 WeakPolarHBondContact O-CE2 3.41Å; Q113-Y117 PolarHBondContact O-N 3.36Å; T115-Y117 VanDerWaalsContact C-N 3.3Å; T115-Y117 PolarHBondContact O-N 3.01Å; Y117-L119 VanDerWaalsContact C-N 3.26Å; Y117-L119 PolarHBondContact O-N 2.98Å; Y117-L120 WeakPolarHBondContact O-CB 3.47Å; Y117-L120 PolarHBondContact O-N 3.45Å; Y117-W121 PolarHBondContact O-N 3.47Å
118	V	75.9	Confident	73.1	Confident	80 Å²	80	100 Å²	100	49%	0.485	51%	0.51	S	S	.	.	H	α-helix	trans	-57.8	-40.9	-176	173.4	0	0	0	0	111.5	A114 T115 W121 F122	A114-V118 PolarHBondContact O-N 3.41Å; T115-V118 PolarHBondContact O-N 2.77Å; V118-W121 WeakPolarHBondContact O-CB 3.45Å; V118-W121 PolarHBondContact O-N 2.79Å; V118-F122 HydrophobicContact CG1-CD2 3.78Å; V118-F122 HydrophobicContact CG1-CE2 3.43Å; V118-F122 VanDerWaalsContact CG1-CE2 3.43Å; V118-F122 WeakPolarHBondContact O-CD2 3.46Å; V118-F122 PolarHBondContact O-N 2.89Å
119	L	74	Confident	73.7	Confident	38 Å²	38	96.4 Å²	96.4	20%	0.199	50%	0.504	C	S	.	.	H	α-helix	trans	-62.1	-50.1	173.9	-174.7	89	0	0	0	111.7	V24 E28 T115 Y117 W121 F122 L123	V24-L119 HydrophobicContact CG1-CD1 3.49Å; V24-L119 VanDerWaalsContact CG1-CD1 3.49Å; E28-L119 WeakPolarHBondContact OE1-CD1 3.42Å; E28-L119 VanDerWaalsContact OE1-CD2 3.24Å; E28-L119 WeakPolarHBondContact OE1-CD2 3.33Å; E28-L119 WeakPolarHBondContact OE1-CG 3.22Å; E28-L119 WeakPolarHBondContact OE2-CD2 3.22Å; T115-L119 PolarHBondContact O-N 3.19Å; Y117-L119 VanDerWaalsContact C-N 3.26Å; Y117-L119 PolarHBondContact O-N 2.98Å; L119-W121 PolarHBondContact O-N 2.94Å; L119-F122 WeakPolarHBondContact O-CA 3.23Å; L119-F122 PolarHBondContact O-N 3.42Å; L119-L123 HydrophobicContact CD2-CD1 3.73Å; L119-L123 HydrophobicContact CD2-CG 4.48Å; L119-L123 HydrophobicContact CG-CD1 3.99Å; L119-L123 HydrophobicContact CG-CG 4.21Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 3.44Å
120	L	79.6	Confident	74.6	Confident	111 Å²	111	96.3 Å²	96.3	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-56.1	-38.8	178.7	-178.3	65.5	0	0	0	111.3	S116 Y117 L123 S124	S116-L120 PolarHBondContact O-N 3.46Å; Y117-L120 WeakPolarHBondContact O-CB 3.47Å; Y117-L120 PolarHBondContact O-N 3.45Å; L120-L123 PolarHBondContact O-N 3.23Å; L120-S124 VanDerWaalsContact O-CB 3.26Å; L120-S124 WeakPolarHBondContact O-CB 3.29Å; L120-S124 PolarHBondContact O-N 3.26Å
121	W	83.5	Confident	76	Confident	182 Å²	182	96.7 Å²	96.7	69%	0.689	50%	0.496	S	S	*	.	H	α-helix	trans	-59.3	-49	172.5	-79.3	104.5	0	0	0	111.8	Y117 V118 L119 S124 L125	Y117-W121 PolarHBondContact O-N 3.47Å; V118-W121 WeakPolarHBondContact O-CB 3.45Å; V118-W121 PolarHBondContact O-N 2.79Å; L119-W121 PolarHBondContact O-N 2.94Å; W121-S124 PolarHBondContact O-N 3.03Å; W121-L125 WeakPolarHBondContact O-CG 3.25Å; W121-L125 PolarHBondContact O-N 2.94Å
122	F	82.7	Confident	77.6	Confident	119 Å²	119	90 Å²	90	52%	0.522	48%	0.481	S	S	.	.	H	α-helix	trans	-63.5	-43.1	177.2	-77.2	-64.6	0	0	0	112.9	V118 L119 S124 L125 I126	V118-F122 HydrophobicContact CG1-CD2 3.78Å; V118-F122 HydrophobicContact CG1-CE2 3.43Å; V118-F122 VanDerWaalsContact CG1-CE2 3.43Å; V118-F122 WeakPolarHBondContact O-CD2 3.46Å; V118-F122 PolarHBondContact O-N 2.89Å; L119-F122 WeakPolarHBondContact O-CA 3.23Å; L119-F122 PolarHBondContact O-N 3.42Å; F122-S124 VanDerWaalsContact C-N 3.35Å; F122-S124 PolarHBondContact O-N 3.46Å; F122-L125 PolarHBondContact O-N 3.39Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.24Å; F122-I126 PolarHBondContact O-N 3.23Å
123	L	82.3	Confident	79.2	Confident	53 Å²	53	88.5 Å²	88.5	28%	0.277	47%	0.469	S	S	.	.	H	α-helix	trans	-63.2	-41.1	177.9	-67.2	177.9	0	0	0	112	L21 L119 L120 S127	L21-L123 HydrophobicContact CD2-CD2 3.16Å; L119-L123 HydrophobicContact CD2-CD1 3.73Å; L119-L123 HydrophobicContact CD2-CG 4.48Å; L119-L123 HydrophobicContact CG-CD1 3.99Å; L119-L123 HydrophobicContact CG-CG 4.21Å; L119-L123 WeakPolarHBondContact O-CG 3.31Å; L119-L123 PolarHBondContact O-N 3.44Å; L120-L123 PolarHBondContact O-N 3.23Å; L123-S127 VanDerWaalsContact O-CB 3.26Å; L123-S127 WeakPolarHBondContact O-CB 3.39Å; L123-S127 PolarHBondContact O-N 3.48Å; L123-S127 PolarHBondContact O-OG 3.41Å
124	S	87.2	Confident	80.7	Confident	71 Å²	71	86.1 Å²	86.1	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-62.5	-44.5	175	-175.5	0	0	0	0	111.6	L120 W121 F122 S127 S128	L120-S124 VanDerWaalsContact O-CB 3.26Å; L120-S124 WeakPolarHBondContact O-CB 3.29Å; L120-S124 PolarHBondContact O-N 3.26Å; W121-S124 PolarHBondContact O-N 3.03Å; F122-S124 VanDerWaalsContact C-N 3.35Å; F122-S124 PolarHBondContact O-N 3.46Å; S124-S127 PolarHBondContact O-OG 3.27Å; S124-S128 VanDerWaalsContact O-CB 3.28Å; S124-S128 WeakPolarHBondContact O-CB 3.42Å; S124-S128 PolarHBondContact O-N 2.85Å
125	L	88.3	Confident	82.3	Confident	101 Å²	101	87.2 Å²	87.2	53%	0.529	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-46.8	176.9	-72.8	176	0	0	0	112.5	W121 F122 S128 L129	W121-L125 WeakPolarHBondContact O-CG 3.25Å; W121-L125 PolarHBondContact O-N 2.94Å; F122-L125 PolarHBondContact O-N 3.39Å; L125-S128 PolarHBondContact O-N 2.93Å; L125-L129 WeakPolarHBondContact O-CG 3.35Å; L125-L129 PolarHBondContact O-N 3.5Å
126	I	84.9	Confident	83.4	Confident	65 Å²	65	88.3 Å²	88.3	33%	0.333	46%	0.455	S	S	.	.	H	α-helix	trans	-67.5	-42.6	-178.2	-59.8	162	0	0	0	110.6	F17 F122 S128 L129 I130	F17-I126 HydrophobicContact CD2-CG2 3.79Å; F17-I126 HydrophobicContact CE2-CB 4.06Å; F17-I126 HydrophobicContact CE2-CG2 3.2Å; F17-I126 HydrophobicContact CZ-CG2 3.98Å; F122-I126 VanDerWaalsContact O-CG1 3.24Å; F122-I126 WeakPolarHBondContact O-CG1 3.24Å; F122-I126 PolarHBondContact O-N 3.23Å; I126-S128 VanDerWaalsContact C-N 3.34Å; I126-S128 PolarHBondContact O-N 3.47Å; I126-L129 PolarHBondContact O-N 3.47Å; I126-I130 HydrophobicContact CG2-CD1 3.84Å; I126-I130 HydrophobicContact CG2-CG1 4.39Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.22Å; I126-I130 PolarHBondContact O-N 3.27Å
127	S	85.6	Confident	84.2	Confident	40 Å²	40	90.7 Å²	90.7	28%	0.28	45%	0.454	S	S	.	.	H	α-helix	trans	-61.6	-43.1	176.1	60	0	0	0	0	111.2	L123 S124 L129 I130 F131	L123-S127 VanDerWaalsContact O-CB 3.26Å; L123-S127 WeakPolarHBondContact O-CB 3.39Å; L123-S127 PolarHBondContact O-N 3.48Å; L123-S127 PolarHBondContact O-OG 3.41Å; S124-S127 PolarHBondContact O-OG 3.27Å; S127-L129 VanDerWaalsContact C-N 3.35Å; S127-L129 PolarHBondContact O-N 2.83Å; S127-I130 PolarHBondContact O-N 2.88Å; S127-F131 WeakPolarHBondContact O-CD2 3.37Å; S127-F131 PolarHBondContact O-N 3.48Å
128	S	89.6	Confident	84.9	Confident	66 Å²	66	93.4 Å²	93.4	46%	0.462	46%	0.464	S	S	.	.	H	α-helix	trans	-57.6	-43.8	174.5	-177.9	0	0	0	0	112.7	S124 L125 I126 F131 S132	S124-S128 VanDerWaalsContact O-CB 3.28Å; S124-S128 WeakPolarHBondContact O-CB 3.42Å; S124-S128 PolarHBondContact O-N 2.85Å; L125-S128 PolarHBondContact O-N 2.93Å; I126-S128 VanDerWaalsContact C-N 3.34Å; I126-S128 PolarHBondContact O-N 3.47Å; S128-F131 PolarHBondContact O-N 3.48Å; S128-S132 VanDerWaalsContact O-CB 3.27Å; S128-S132 WeakPolarHBondContact O-CB 3.32Å; S128-S132 PolarHBondContact O-N 3.43Å; S128-S132 PolarHBondContact O-OG 2.9Å
129	L	87.8	Confident	85.3	Confident	122 Å²	122	92 Å²	92	64%	0.639	46%	0.457	S	S	*	.	H	α-helix	trans	-62.9	-43.1	175.9	-73	170.6	0	0	0	112.1	L125 I126 S127 S132 F133	L125-L129 WeakPolarHBondContact O-CG 3.35Å; L125-L129 PolarHBondContact O-N 3.5Å; I126-L129 PolarHBondContact O-N 3.47Å; S127-L129 VanDerWaalsContact C-N 3.35Å; S127-L129 PolarHBondContact O-N 2.83Å; L129-S132 PolarHBondContact O-N 2.79Å; L129-F133 WeakPolarHBondContact O-CB 3.41Å; L129-F133 PolarHBondContact O-N 3.34Å
130	I	86.1	Confident	86	Confident	46 Å²	46	93.1 Å²	93.1	24%	0.236	46%	0.463	C	S	.	.	H	α-helix	trans	-64.7	-47.8	178.4	-68.3	167.1	0	0	0	110.5	F17 I126 S127 S132 F133 L134	F17-I130 HydrophobicContact CB-CD1 4.18Å; F17-I130 HydrophobicContact CD1-CD1 3.44Å; F17-I130 VanDerWaalsContact CD1-CD1 3.44Å; F17-I130 HydrophobicContact CD2-CD1 3.43Å; F17-I130 VanDerWaalsContact CD2-CD1 3.43Å; F17-I130 HydrophobicContact CE1-CD1 3.49Å; F17-I130 VanDerWaalsContact CE1-CD1 3.49Å; F17-I130 HydrophobicContact CE2-CD1 3.53Å; F17-I130 HydrophobicContact CG-CD1 3.38Å; F17-I130 HydrophobicContact CZ-CD1 3.52Å; I126-I130 HydrophobicContact CG2-CD1 3.84Å; I126-I130 HydrophobicContact CG2-CG1 4.39Å; I126-I130 VanDerWaalsContact O-CG1 3.31Å; I126-I130 WeakPolarHBondContact O-CG1 3.22Å; I126-I130 PolarHBondContact O-N 3.27Å; S127-I130 PolarHBondContact O-N 2.88Å; I130-S132 VanDerWaalsContact C-N 3.34Å; I130-S132 PolarHBondContact O-N 3.45Å; I130-F133 PolarHBondContact O-N 2.85Å; I130-L134 HydrophobicContact CG2-CD1 3.9Å; I130-L134 HydrophobicContact CG2-CG 4.32Å; I130-L134 WeakPolarHBondContact O-CB 3.37Å; I130-L134 VanDerWaalsContact O-CG 3.25Å; I130-L134 WeakPolarHBondContact O-CG 3.44Å; I130-L134 PolarHBondContact O-N 3.41Å
131	F	87.9	Confident	86.2	Confident	134 Å²	134	92 Å²	92	59%	0.588	45%	0.452	S	S	*	.	H	α-helix	trans	-61.1	-44.1	177.2	-80.3	-66.4	0	0	0	111.4	S127 S128 F133 L134 V135	S127-F131 WeakPolarHBondContact O-CD2 3.37Å; S127-F131 PolarHBondContact O-N 3.48Å; S128-F131 PolarHBondContact O-N 3.48Å; F131-F133 VanDerWaalsContact C-N 3.33Å; F131-F133 PolarHBondContact O-N 3.24Å; F131-L134 PolarHBondContact O-N 3.5Å; F131-V135 WeakPolarHBondContact O-CB 3.3Å; F131-V135 VanDerWaalsContact O-CG2 3.24Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 3.07Å
132	S	88.5	Confident	86.5	Confident	69 Å²	69	87.6 Å²	87.6	48%	0.483	44%	0.441	S	S	.	.	H	α-helix	trans	-59.3	-44.2	176.5	-62.3	0	0	0	0	111.6	S128 L129 I130 V135 K136	S128-S132 VanDerWaalsContact O-CB 3.27Å; S128-S132 WeakPolarHBondContact O-CB 3.32Å; S128-S132 PolarHBondContact O-N 3.43Å; S128-S132 PolarHBondContact O-OG 2.9Å; L129-S132 PolarHBondContact O-N 2.79Å; I130-S132 VanDerWaalsContact C-N 3.34Å; I130-S132 PolarHBondContact O-N 3.45Å; S132-V135 PolarHBondContact O-N 3.4Å; S132-K136 WeakPolarHBondContact O-CB 3.47Å; S132-K136 PolarHBondContact O-N 3.22Å
133	F	87.1	Confident	86.8	Confident	91 Å²	91	88.5 Å²	88.5	40%	0.399	44%	0.442	S	S	.	.	H	α-helix	trans	-64.5	-43.6	176.6	-179.6	-104	0	0	0	112.8	L13 L129 I130 F131 K136 R137	L13-F133 HydrophobicContact CD1-CE1 4.29Å; L129-F133 WeakPolarHBondContact O-CB 3.41Å; L129-F133 PolarHBondContact O-N 3.34Å; I130-F133 PolarHBondContact O-N 2.85Å; F131-F133 VanDerWaalsContact C-N 3.33Å; F131-F133 PolarHBondContact O-N 3.24Å; F133-K136 PolarHBondContact O-N 2.95Å; F133-R137 VanDerWaalsContact CE1-NH1 3.3Å; F133-R137 VanDerWaalsContact CZ-NH1 3.34Å; F133-R137 PolarHBondContact O-N 3.46Å
134	L	84.5	Confident	87.1	Confident	61 Å²	61	92 Å²	92	32%	0.319	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-46.5	175.9	-74.6	173.5	0	0	0	111.7	L10 I130 F131 R137 R138	L10-L134 HydrophobicContact CD1-CD2 3.43Å; L10-L134 VanDerWaalsContact CD1-CD2 3.43Å; L10-L134 HydrophobicContact CD2-CD2 3.78Å; L10-L134 HydrophobicContact CG-CD2 4.12Å; I130-L134 HydrophobicContact CG2-CD1 3.9Å; I130-L134 HydrophobicContact CG2-CG 4.32Å; I130-L134 WeakPolarHBondContact O-CB 3.37Å; I130-L134 VanDerWaalsContact O-CG 3.25Å; I130-L134 WeakPolarHBondContact O-CG 3.44Å; I130-L134 PolarHBondContact O-N 3.41Å; F131-L134 PolarHBondContact O-N 3.5Å; L134-R137 PolarHBondContact O-N 3.18Å; L134-R138 WeakPolarHBondContact O-CB 3.46Å; L134-R138 PolarHBondContact O-N 3.44Å
135	V	89.3	Confident	87.2	Confident	94 Å²	94	94.5 Å²	94.5	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-63.4	-45.9	178.5	170	0	0	0	0	110.3	F131 S132 R137 R138 S139	F131-V135 WeakPolarHBondContact O-CB 3.3Å; F131-V135 VanDerWaalsContact O-CG2 3.24Å; F131-V135 WeakPolarHBondContact O-CG2 3.38Å; F131-V135 PolarHBondContact O-N 3.07Å; S132-V135 PolarHBondContact O-N 3.4Å; V135-R137 VanDerWaalsContact C-N 3.33Å; V135-R137 PolarHBondContact O-N 3.03Å; V135-R138 PolarHBondContact O-N 3.35Å; V135-S139 PolarHBondContact O-N 2.82Å; V135-S139 PolarHBondContact O-OG 3.05Å
136	K	85.9	Confident	87.4	Confident	117 Å²	117	94.2 Å²	94.2	51%	0.509	45%	0.454	S	S	.	.	H	α-helix	trans	-60	-43	177.8	-176.9	54.9	176.4	151.4	0	111.9	S132 F133 R138 S139 D140	S132-K136 WeakPolarHBondContact O-CB 3.47Å; S132-K136 PolarHBondContact O-N 3.22Å; F133-K136 PolarHBondContact O-N 2.95Å; K136-R138 PolarHBondContact O-N 3.32Å; K136-S139 WeakPolarHBondContact CA-OG 3.42Å; K136-S139 PolarHBondContact O-N 3.25Å; K136-S139 PolarHBondContact O-OG 3.41Å; K136-D140 WeakPolarHBondContact CE-OD1 3.47Å; K136-D140 IonicContact NZ-OD1 3.83Å; K136-D140 PolarHBondContact NZ-OD1 2.86Å; K136-D140 IonicContact NZ-OD2 2.79Å; K136-D140 WeakPolarHBondContact O-CB 3.27Å; K136-D140 PolarHBondContact O-N 3Å
137	R	83.4	Confident	87.7	Confident	118 Å²	118	94.9 Å²	94.9	45%	0.445	46%	0.456	S	S	.	.	H	α-helix	trans	-64	-42.3	175.1	-79.8	-167.4	157.2	166.2	1.8	113	F133 L134 V135 S139 D140 Y141	F133-R137 VanDerWaalsContact CE1-NH1 3.3Å; F133-R137 VanDerWaalsContact CZ-NH1 3.34Å; F133-R137 PolarHBondContact O-N 3.46Å; L134-R137 PolarHBondContact O-N 3.18Å; V135-R137 VanDerWaalsContact C-N 3.33Å; V135-R137 PolarHBondContact O-N 3.03Å; R137-S139 VanDerWaalsContact C-N 3.34Å; R137-D140 PolarHBondContact O-N 3.48Å; R137-Y141 PolarHBondContact O-N 2.75Å; R137-Y141 VanDerWaalsContact O-N 3.07Å
138	R	88.1	Confident	88	Confident	184 Å²	184	95.6 Å²	95.6	69%	0.694	46%	0.461	S	S	*	.	H	α-helix	trans	-63.9	-41.4	175.9	-179.9	177.4	175.1	156.6	-0.8	111.3	L134 V135 K136 Y141 L142	L134-R138 WeakPolarHBondContact O-CB 3.46Å; L134-R138 PolarHBondContact O-N 3.44Å; V135-R138 PolarHBondContact O-N 3.35Å; K136-R138 PolarHBondContact O-N 3.32Å; R138-Y141 PolarHBondContact O-N 2.79Å; R138-L142 HydrophobicContact CG-CD1 4.15Å; R138-L142 WeakPolarHBondContact O-CG 3.33Å; R138-L142 PolarHBondContact O-N 2.92Å
139	S	85.9	Confident	88.1	Confident	49 Å²	49	100.3 Å²	100.3	34%	0.343	47%	0.469	S	S	.	.	H	α-helix	trans	-65.1	-42.2	178.1	64.1	0	0	0	0	111.3	V135 K136 R137 Y141 L142 Y143	V135-S139 PolarHBondContact O-N 2.82Å; V135-S139 PolarHBondContact O-OG 3.05Å; K136-S139 WeakPolarHBondContact CA-OG 3.42Å; K136-S139 PolarHBondContact O-N 3.25Å; K136-S139 PolarHBondContact O-OG 3.41Å; R137-S139 VanDerWaalsContact C-N 3.34Å; S139-Y141 PolarHBondContact O-N 2.72Å; S139-L142 PolarHBondContact O-N 3.4Å; S139-Y143 VanDerWaalsContact O-CB 3.28Å; S139-Y143 WeakPolarHBondContact O-CB 3.46Å; S139-Y143 PolarHBondContact O-N 3.26Å
140	D	87.1	Confident	88.3	Confident	63 Å²	63	97.5 Å²	97.5	34%	0.337	45%	0.454	S	S	.	.	H	α-helix	trans	-64.8	-41.9	179.6	-65.6	-13.9	0	0	0	110.7	K136 R137 L142 Y143 E144	K136-D140 WeakPolarHBondContact CE-OD1 3.47Å; K136-D140 IonicContact NZ-OD1 3.83Å; K136-D140 PolarHBondContact NZ-OD1 2.86Å; K136-D140 IonicContact NZ-OD2 2.79Å; K136-D140 WeakPolarHBondContact O-CB 3.27Å; K136-D140 PolarHBondContact O-N 3Å; R137-D140 PolarHBondContact O-N 3.48Å; D140-L142 PolarHBondContact O-N 3.14Å; D140-Y143 PolarHBondContact O-N 3.29Å; D140-E144 WeakPolarHBondContact O-CG 3.44Å; D140-E144 PolarHBondContact O-N 3.17Å
141	Y	85.4	Confident	88.6	Confident	86 Å²	86	103.4 Å²	103.4	34%	0.337	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-44.2	173.6	175.6	-99.2	0	0	0	112.8	R137 R138 S139 Y143 R145	R137-Y141 PolarHBondContact O-N 2.75Å; R137-Y141 VanDerWaalsContact O-N 3.07Å; R138-Y141 PolarHBondContact O-N 2.79Å; S139-Y141 PolarHBondContact O-N 2.72Å; Y141-Y143 VanDerWaalsContact C-N 3.34Å; Y141-R145 WeakPolarHBondContact O-CG 3.39Å; Y141-R145 PolarHBondContact O-N 3.26Å; Y141-R145 PolarHBondContact OH-NH1 2.74Å
142	L	88.3	Confident	88.8	Confident	90 Å²	90	103.3 Å²	103.3	47%	0.471	47%	0.472	S	S	.	.	H	α-helix	trans	-68	-36	177.3	-73.1	170.7	0	0	0	111.8	R138 S139 D140 R145 L146	R138-L142 HydrophobicContact CG-CD1 4.15Å; R138-L142 WeakPolarHBondContact O-CG 3.33Å; R138-L142 PolarHBondContact O-N 2.92Å; S139-L142 PolarHBondContact O-N 3.4Å; D140-L142 PolarHBondContact O-N 3.14Å; L142-R145 PolarHBondContact O-N 2.81Å; L142-L146 WeakPolarHBondContact O-CB 3.42Å; L142-L146 PolarHBondContact O-N 3.34Å
143	Y	89.3	Confident	88.8	Confident	138 Å²	138	105.7 Å²	105.7	54%	0.541	48%	0.476	S	S	.	.	H	α-helix	trans	-64.3	-45.1	177.9	-174.2	-101.8	0	0	0	111.6	S139 D140 Y141 R145 L146 Q147	S139-Y143 VanDerWaalsContact O-CB 3.28Å; S139-Y143 WeakPolarHBondContact O-CB 3.46Å; S139-Y143 PolarHBondContact O-N 3.26Å; D140-Y143 PolarHBondContact O-N 3.29Å; Y141-Y143 VanDerWaalsContact C-N 3.34Å; Y143-R145 VanDerWaalsContact C-N 3.27Å; Y143-R145 PolarHBondContact O-N 2.87Å; Y143-L146 PolarHBondContact O-N 2.98Å; Y143-Q147 HydrophobicContact CD1-CG 4.03Å; Y143-Q147 HydrophobicContact CE1-CG 3.7Å; Y143-Q147 HydrophobicContact CE2-CG 4.31Å; Y143-Q147 HydrophobicContact CG-CG 4.48Å; Y143-Q147 VanDerWaalsContact CZ-NE2 3.27Å; Y143-Q147 WeakPolarHBondContact O-CB 3.28Å; Y143-Q147 WeakPolarHBondContact O-CG 3.49Å; Y143-Q147 PolarHBondContact O-N 2.88Å; Y143-Q147 PolarHBondContact OH-NE2 3.38Å
144	E	89.9	Confident	88.9	Confident	126 Å²	126	108.4 Å²	108.4	59%	0.589	49%	0.488	S	S	*	.	H	α-helix	trans	-57	-42.3	173.4	-72.8	-179.4	164.1	0	0	111.5	D140 S148	D140-E144 WeakPolarHBondContact O-CG 3.44Å; D140-E144 PolarHBondContact O-N 3.17Å; E144-S148 WeakPolarHBondContact O-CB 3.5Å; E144-S148 PolarHBondContact O-N 3.11Å
145	R	89	Confident	89	Confident	125 Å²	125	110.2 Å²	110.2	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-40.6	177	-66.7	-174.2	95.3	178.1	7.1	112.2	Y141 L142 Y143 S148 R149	Y141-R145 WeakPolarHBondContact O-CG 3.39Å; Y141-R145 PolarHBondContact O-N 3.26Å; Y141-R145 PolarHBondContact OH-NH1 2.74Å; L142-R145 PolarHBondContact O-N 2.81Å; Y143-R145 VanDerWaalsContact C-N 3.27Å; Y143-R145 PolarHBondContact O-N 2.87Å; R145-S148 PolarHBondContact O-N 3.47Å; R145-S148 PolarHBondContact O-OG 3.26Å; R145-R149 WeakPolarHBondContact O-CG 3.47Å; R145-R149 PolarHBondContact O-N 3.48Å; R145-R149 VanDerWaalsContact O-N 3.14Å
146	L	92	Very high	88.9	Confident	95 Å²	95	110.2 Å²	110.2	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-49	176.6	-179	63.9	0	0	0	110.9	L142 Y143 S148 R149 I150	L142-L146 WeakPolarHBondContact O-CB 3.42Å; L142-L146 PolarHBondContact O-N 3.34Å; Y143-L146 PolarHBondContact O-N 2.98Å; L146-S148 VanDerWaalsContact C-N 3.31Å; L146-S148 PolarHBondContact O-N 3.28Å; L146-R149 WeakPolarHBondContact O-CB 3.44Å; L146-R149 PolarHBondContact O-N 3.39Å; L146-I150 HydrophobicContact CD1-CD1 4.25Å; L146-I150 HydrophobicContact CG-CD1 3.92Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 2.93Å
147	Q	91.5	Very high	88.8	Confident	79 Å²	79	108.6 Å²	108.6	37%	0.369	49%	0.492	S	S	.	.	H	α-helix	trans	-59.1	-42	177	-71.1	-64.5	-20.4	0	0	111.7	Y143 R149 I150 R151	Y143-Q147 HydrophobicContact CD1-CG 4.03Å; Y143-Q147 HydrophobicContact CE1-CG 3.7Å; Y143-Q147 HydrophobicContact CE2-CG 4.31Å; Y143-Q147 HydrophobicContact CG-CG 4.48Å; Y143-Q147 VanDerWaalsContact CZ-NE2 3.27Å; Y143-Q147 WeakPolarHBondContact O-CB 3.28Å; Y143-Q147 WeakPolarHBondContact O-CG 3.49Å; Y143-Q147 PolarHBondContact O-N 2.88Å; Y143-Q147 PolarHBondContact OH-NE2 3.38Å; Q147-R149 VanDerWaalsContact C-N 3.26Å; Q147-R149 PolarHBondContact O-N 3.32Å; Q147-I150 PolarHBondContact O-N 3.02Å; Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 2.96Å
148	S	91.9	Very high	88.7	Confident	55 Å²	55	105.9 Å²	105.9	39%	0.385	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-31	176.5	78	0	0	0	0	113.4	E144 R145 L146 K152	E144-S148 WeakPolarHBondContact O-CB 3.5Å; E144-S148 PolarHBondContact O-N 3.11Å; R145-S148 PolarHBondContact O-N 3.47Å; R145-S148 PolarHBondContact O-OG 3.26Å; L146-S148 VanDerWaalsContact C-N 3.31Å; L146-S148 PolarHBondContact O-N 3.28Å; S148-K152 VanDerWaalsContact O-CG 3.29Å; S148-K152 WeakPolarHBondContact O-CG 3.5Å; S148-K152 PolarHBondContact O-N 3.47Å
149	R	91.5	Very high	88	Confident	164 Å²	164	100.2 Å²	100.2	62%	0.619	48%	0.478	S	S	*	.	H	α-helix	trans	-77.1	-43.6	176.4	-71	178.5	-177.7	-166.9	-0.1	111.4	R145 L146 Q147 R151 K152 Q153	R145-R149 WeakPolarHBondContact O-CG 3.47Å; R145-R149 PolarHBondContact O-N 3.48Å; R145-R149 VanDerWaalsContact O-N 3.14Å; L146-R149 WeakPolarHBondContact O-CB 3.44Å; L146-R149 PolarHBondContact O-N 3.39Å; Q147-R149 VanDerWaalsContact C-N 3.26Å; Q147-R149 PolarHBondContact O-N 3.32Å; R149-R151 VanDerWaalsContact C-N 3.32Å; R149-R151 PolarHBondContact O-N 2.97Å; R149-K152 PolarHBondContact O-N 3.3Å; R149-Q153 WeakPolarHBondContact O-CG 3.4Å; R149-Q153 PolarHBondContact O-N 3.07Å; R149-Q153 VanDerWaalsContact O-N 3.11Å
150	I	92.1	Very high	87.5	Confident	64 Å²	64	101.8 Å²	101.8	33%	0.328	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-47.1	176.2	-68.5	169.8	0	0	0	109.9	L146 Q147 K152 Q153 F154	L146-I150 HydrophobicContact CD1-CD1 4.25Å; L146-I150 HydrophobicContact CG-CD1 3.92Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 2.93Å; Q147-I150 PolarHBondContact O-N 3.02Å; I150-K152 VanDerWaalsContact C-N 3.34Å; I150-K152 PolarHBondContact O-N 3.04Å; I150-Q153 WeakPolarHBondContact O-CB 3.45Å; I150-Q153 PolarHBondContact O-N 3.29Å; I150-Q153 VanDerWaalsContact O-N 3.1Å; I150-F154 HydrophobicContact CG2-CD2 3.84Å; I150-F154 HydrophobicContact CG2-CE2 3.39Å; I150-F154 HydrophobicContact CG2-CZ 4.48Å; I150-F154 WeakPolarHBondContact O-CD2 3.47Å; I150-F154 PolarHBondContact O-N 3.44Å
151	R	91.9	Very high	87	Confident	169 Å²	169	104.6 Å²	104.6	64%	0.638	50%	0.496	S	S	*	.	H	α-helix	trans	-57.6	-44	178	-165.3	179.9	-164.1	-108.7	13.1	112.7	Q147 R149 Q153 F154 E155	Q147-R151 WeakPolarHBondContact O-CB 3.42Å; Q147-R151 PolarHBondContact O-N 2.96Å; R149-R151 VanDerWaalsContact C-N 3.32Å; R149-R151 PolarHBondContact O-N 2.97Å; R151-Q153 VanDerWaalsContact C-N 3.32Å; R151-Q153 PolarHBondContact O-N 3.42Å; R151-F154 PolarHBondContact O-N 3.42Å; R151-E155 IonicContact CZ-OE1 2.86Å; R151-E155 IonicContact NE-OE1 2.74Å; R151-E155 IonicContact NH1-OE1 3.77Å; R151-E155 PolarHBondContact NH1-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CG 3.29Å; R151-E155 PolarHBondContact O-N 3.1Å
152	K	91.4	Very high	86.5	Confident	132 Å²	132	105.4 Å²	105.4	57%	0.574	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-34.7	176.8	-73.1	175.9	-178.4	-171.3	0	113	S148 R149 I150 E155 V156	S148-K152 VanDerWaalsContact O-CG 3.29Å; S148-K152 WeakPolarHBondContact O-CG 3.5Å; S148-K152 PolarHBondContact O-N 3.47Å; R149-K152 PolarHBondContact O-N 3.3Å; I150-K152 VanDerWaalsContact C-N 3.34Å; I150-K152 PolarHBondContact O-N 3.04Å; K152-E155 PolarHBondContact O-N 3.36Å; K152-V156 WeakPolarHBondContact O-CB 3.31Å; K152-V156 VanDerWaalsContact O-CG2 3.31Å; K152-V156 WeakPolarHBondContact O-CG2 3.22Å; K152-V156 PolarHBondContact O-N 3.06Å
153	Q	88.9	Confident	85.7	Confident	120 Å²	120	106.9 Å²	106.9	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-40.8	176.8	-68.4	-67.9	-38.3	0	0	111.5	R149 I150 R151 N157	R149-Q153 WeakPolarHBondContact O-CG 3.4Å; R149-Q153 PolarHBondContact O-N 3.07Å; R149-Q153 VanDerWaalsContact O-N 3.11Å; I150-Q153 WeakPolarHBondContact O-CB 3.45Å; I150-Q153 PolarHBondContact O-N 3.29Å; I150-Q153 VanDerWaalsContact O-N 3.1Å; R151-Q153 VanDerWaalsContact C-N 3.32Å; R151-Q153 PolarHBondContact O-N 3.42Å; Q153-N157 WeakPolarHBondContact O-CB 3.32Å; Q153-N157 VanDerWaalsContact O-CG 3.23Å; Q153-N157 PolarHBondContact O-N 2.79Å; Q153-N157 PolarHBondContact O-ND2 2.97Å
154	F	89.2	Confident	85	Confident	148 Å²	148	109 Å²	109	65%	0.649	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-42.5	175.1	-71.2	-66.9	0	0	0	112.6	I150 R151 V156 N157 S158	I150-F154 HydrophobicContact CG2-CD2 3.84Å; I150-F154 HydrophobicContact CG2-CE2 3.39Å; I150-F154 HydrophobicContact CG2-CZ 4.48Å; I150-F154 WeakPolarHBondContact O-CD2 3.47Å; I150-F154 PolarHBondContact O-N 3.44Å; R151-F154 PolarHBondContact O-N 3.42Å; F154-V156 VanDerWaalsContact C-N 3.34Å; F154-V156 PolarHBondContact O-N 3.36Å; F154-N157 PolarHBondContact O-N 2.95Å; F154-S158 VanDerWaalsContact O-CB 3.3Å; F154-S158 WeakPolarHBondContact O-CB 3.31Å; F154-S158 PolarHBondContact O-N 3.08Å; F154-S158 PolarHBondContact O-OG 3.29Å
155	E	87.7	Confident	84.2	Confident	99 Å²	99	106.9 Å²	106.9	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-42.5	176.5	-72.1	170.6	-171.4	0	0	111.6	R151 K152 S158 P159	R151-E155 IonicContact CZ-OE1 2.86Å; R151-E155 IonicContact NE-OE1 2.74Å; R151-E155 IonicContact NH1-OE1 3.77Å; R151-E155 PolarHBondContact NH1-OE1 3.49Å; R151-E155 WeakPolarHBondContact O-CG 3.29Å; R151-E155 PolarHBondContact O-N 3.1Å; K152-E155 PolarHBondContact O-N 3.36Å; E155-S158 PolarHBondContact O-OG 3.21Å; E155-S158 VanDerWaalsContact O-OG 3.08Å; E155-P159 WeakPolarHBondContact O-CD 3.31Å
156	V	87	Confident	83.2	Confident	94 Å²	94	106.5 Å²	106.5	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-73.1	-37.5	178.8	171.9	0	0	0	0	113	K152 F154 P159	K152-V156 WeakPolarHBondContact O-CB 3.31Å; K152-V156 VanDerWaalsContact O-CG2 3.31Å; K152-V156 WeakPolarHBondContact O-CG2 3.22Å; K152-V156 PolarHBondContact O-N 3.06Å; F154-V156 VanDerWaalsContact C-N 3.34Å; F154-V156 PolarHBondContact O-N 3.36Å; V156-P159 VanDerWaalsContact O-CD 3.31Å; V156-P159 WeakPolarHBondContact O-CD 3.3Å; V156-P159 VanDerWaalsContact O-CG 3.31Å; V156-P159 WeakPolarHBondContact O-CG 3.06Å
157	N	82.6	Confident	82.2	Confident	83 Å²	83	105.1 Å²	105.1	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-80.5	-29.8	-177.5	-68.4	-15.7	0	0	0	113.1	Q153 F154 V160 E161	Q153-N157 WeakPolarHBondContact O-CB 3.32Å; Q153-N157 VanDerWaalsContact O-CG 3.23Å; Q153-N157 PolarHBondContact O-N 2.79Å; Q153-N157 PolarHBondContact O-ND2 2.97Å; F154-N157 PolarHBondContact O-N 2.95Å; N157-V160 PolarHBondContact O-N 3.37Å; N157-V160 VanDerWaalsContact O-N 3.07Å; N157-E161 PolarHBondContact O-N 3.5Å
158	S	81.3	Confident	80.7	Confident	61 Å²	61	104.1 Å²	104.1	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-54.5	-44	179.3	65.8	0	0	0	0	115.3	F154 E155 V160 N162	F154-S158 VanDerWaalsContact O-CB 3.3Å; F154-S158 WeakPolarHBondContact O-CB 3.31Å; F154-S158 PolarHBondContact O-N 3.08Å; F154-S158 PolarHBondContact O-OG 3.29Å; E155-S158 PolarHBondContact O-OG 3.21Å; E155-S158 VanDerWaalsContact O-OG 3.08Å; S158-V160 VanDerWaalsContact C-N 3.35Å; S158-V160 PolarHBondContact O-N 2.89Å; S158-N162 WeakPolarHBondContact O-CB 3.5Å; S158-N162 PolarHBondContact O-N 3.18Å; S158-N162 PolarHBondContact O-ND2 3.47Å
159	P	74.7	Confident	79.2	Confident	64 Å²	64	109.6 Å²	109.6	42%	0.416	55%	0.552	S	S	.	*	H	α-helix	trans	-68.3	-32.5	174.6	26.4	-35.4	0	0	0	112.8	E155 V156 L163	E155-P159 WeakPolarHBondContact O-CD 3.31Å; V156-P159 VanDerWaalsContact O-CD 3.31Å; V156-P159 WeakPolarHBondContact O-CD 3.3Å; V156-P159 VanDerWaalsContact O-CG 3.31Å; V156-P159 WeakPolarHBondContact O-CG 3.06Å; P159-L163 WeakPolarHBondContact O-CB 3.46Å; P159-L163 VanDerWaalsContact O-CG 3.26Å; P159-L163 WeakPolarHBondContact O-CG 3.39Å; P159-L163 PolarHBondContact O-N 3.05Å
160	V	75.2	Confident	77.6	Confident	83 Å²	83	105.7 Å²	105.7	50%	0.503	55%	0.55	S	S	.	*	H	α-helix	trans	-69.6	-41.9	177.5	-179.1	0	0	0	0	110.8	N157 S158 L163 R164	N157-V160 PolarHBondContact O-N 3.37Å; N157-V160 VanDerWaalsContact O-N 3.07Å; S158-V160 VanDerWaalsContact C-N 3.35Å; S158-V160 PolarHBondContact O-N 2.89Å; V160-L163 PolarHBondContact O-N 2.88Å; V160-R164 WeakPolarHBondContact O-CB 3.4Å; V160-R164 PolarHBondContact O-N 3.07Å
161	E	75.9	Confident	75.7	Confident	122 Å²	122	108.9 Å²	108.9	57%	0.57	57%	0.567	S	S	*	*	H	α-helix	trans	-60.6	-48	174.1	-161.9	86.3	177.5	0	0	110.5	N157 L163 R164 V165	N157-E161 PolarHBondContact O-N 3.5Å; E161-L163 VanDerWaalsContact C-N 3.33Å; E161-L163 PolarHBondContact O-N 3.06Å; E161-R164 WeakPolarHBondContact O-CB 3.5Å; E161-R164 PolarHBondContact O-N 2.77Å; E161-R164 VanDerWaalsContact O-N 3.09Å; E161-V165 WeakPolarHBondContact O-CG2 3.37Å; E161-V165 PolarHBondContact O-N 3.21Å
162	N	74.9	Confident	73.7	Confident	102 Å²	102	106.6 Å²	106.6	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-60.8	-40.4	177.8	-70.7	-25.5	0	0	0	112.2	S158 N166	S158-N162 WeakPolarHBondContact O-CB 3.5Å; S158-N162 PolarHBondContact O-N 3.18Å; S158-N162 PolarHBondContact O-ND2 3.47Å; N162-N166 WeakPolarHBondContact O-CB 3.26Å; N162-N166 VanDerWaalsContact O-CG 3.22Å; N162-N166 PolarHBondContact O-N 2.98Å; N162-N166 PolarHBondContact O-ND2 3.39Å
163	L	72.6	Confident	71.4	Confident	121 Å²	121	108.8 Å²	108.8	63%	0.634	58%	0.583	S	S	*	*	H	α-helix	trans	-65.5	-39.9	173.7	-74.5	167.7	0	0	0	111.8	P159 V160 E161 N166 S167	P159-L163 WeakPolarHBondContact O-CB 3.46Å; P159-L163 VanDerWaalsContact O-CG 3.26Å; P159-L163 WeakPolarHBondContact O-CG 3.39Å; P159-L163 PolarHBondContact O-N 3.05Å; V160-L163 PolarHBondContact O-N 2.88Å; E161-L163 VanDerWaalsContact C-N 3.33Å; E161-L163 PolarHBondContact O-N 3.06Å; L163-N166 PolarHBondContact O-N 3.47Å; L163-S167 WeakPolarHBondContact O-CB 3.42Å; L163-S167 PolarHBondContact O-N 2.86Å; L163-S167 PolarHBondContact O-OG 2.84Å
164	R	74.5	Confident	69.3	Low	183 Å²	183	107.2 Å²	107.2	69%	0.691	59%	0.586	S	S	*	*	H	α-helix	trans	-66.7	-44.8	178.8	-159.9	-174.1	-161	111.2	2.5	111.7	V160 E161 S167 G168	V160-R164 WeakPolarHBondContact O-CB 3.4Å; V160-R164 PolarHBondContact O-N 3.07Å; E161-R164 WeakPolarHBondContact O-CB 3.5Å; E161-R164 PolarHBondContact O-N 2.77Å; E161-R164 VanDerWaalsContact O-N 3.09Å; R164-S167 WeakPolarHBondContact CA-OG 3.34Å; R164-S167 PolarHBondContact O-N 3.09Å; R164-S167 PolarHBondContact O-OG 3.29Å; R164-G168 PolarHBondContact O-N 3.25Å
165	V	72	Confident	67.4	Low	82 Å²	82	105.3 Å²	105.3	50%	0.497	59%	0.591	S	S	.	*	H	α-helix	trans	-59.7	-47.3	175.1	172.9	0	0	0	0	110.1	E161 S167 G168 E169	E161-V165 WeakPolarHBondContact O-CG2 3.37Å; E161-V165 PolarHBondContact O-N 3.21Å; V165-S167 VanDerWaalsContact C-N 3.31Å; V165-S167 PolarHBondContact O-N 3.15Å; V165-G168 PolarHBondContact O-N 2.91Å; V165-E169 PolarHBondContact O-N 3.35Å; V165-E169 VanDerWaalsContact O-N 3.15Å
166	N	69.2	Low	65.7	Low	116 Å²	116	113.5 Å²	113.5	62%	0.62	63%	0.629	S	S	*	*	H	α-helix	trans	-62.7	-35.1	176.3	-72.9	-9.4	0	0	0	112.9	N162 L163	N162-N166 WeakPolarHBondContact O-CB 3.26Å; N162-N166 VanDerWaalsContact O-CG 3.22Å; N162-N166 PolarHBondContact O-N 2.98Å; N162-N166 PolarHBondContact O-ND2 3.39Å; L163-N166 PolarHBondContact O-N 3.47Å
167	S	71.2	Confident	64.6	Low	67 Å²	67	114.5 Å²	114.5	47%	0.469	63%	0.632	S	S	.	*	H	α-helix	trans	-75.6	-30.4	176.1	67.3	0	0	0	0	113.7	L163 R164 V165 S170	L163-S167 WeakPolarHBondContact O-CB 3.42Å; L163-S167 PolarHBondContact O-N 2.86Å; L163-S167 PolarHBondContact O-OG 2.84Å; R164-S167 WeakPolarHBondContact CA-OG 3.34Å; R164-S167 PolarHBondContact O-N 3.09Å; R164-S167 PolarHBondContact O-OG 3.29Å; V165-S167 VanDerWaalsContact C-N 3.31Å; V165-S167 PolarHBondContact O-N 3.15Å; S167-S170 PolarHBondContact O-OG 3.21Å; S167-S170 VanDerWaalsContact O-OG 3.1Å
168	G	59.4	Low	63.7	Low	57 Å²	57	116.1 Å²	116.1	59%	0.588	64%	0.642	S	S	*	*	H	α-helix	trans	-75.1	-29	178.8	0	0	0	0	0	113.3	R164 V165 S170	R164-G168 PolarHBondContact O-N 3.25Å; V165-G168 PolarHBondContact O-N 2.91Å; G168-S170 PolarHBondContact O-N 3.1Å
169	E	60.9	Low	62.7	Low	170 Å²	170	119.2 Å²	119.2	79%	0.794	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-6	177.8	-158.4	137.6	103.2	0	0	113.2	V165	V165-E169 PolarHBondContact O-N 3.35Å; V165-E169 VanDerWaalsContact O-N 3.15Å
170	S	56.6	Low	62	Low	83 Å²	83	122.4 Å²	122.4	58%	0.58	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	42.6	179.1	52.7	0	0	0	0	113.3	S167 G168	S167-S170 PolarHBondContact O-OG 3.21Å; S167-S170 VanDerWaalsContact O-OG 3.1Å; G168-S170 PolarHBondContact O-N 3.1Å
171	I	52	Low	61.2	Low	131 Å²	131	124.9 Å²	124.9	67%	0.672	68%	0.678	S	S	*	*			trans	-135.3	71.6	157.7	-43.4	175.4	0	0	0	111.5	F173	I171-F173 HydrophobicContact CG2-CB 4.37Å; I171-F173 PolarHBondContact O-N 3.37Å
172	P	50	Low	60.2	Low	120 Å²	120	125.1 Å²	125.1	78%	0.779	69%	0.685	S	S	*	*			trans	-73.7	103	136	25.3	-15.9	0	0	0	107.2
173	F	43.7	Very low	59.2	Low	178 Å²	178	126.7 Å²	126.7	78%	0.781	70%	0.695	S	S	*	*			trans	-54.9	143.8	171.6	-170.8	-102.6	0	0	0	111	I171	I171-F173 HydrophobicContact CG2-CB 4.37Å; I171-F173 PolarHBondContact O-N 3.37Å
174	S	45.1	Very low	58.1	Low	87 Å²	87	127.2 Å²	127.2	61%	0.608	70%	0.7	S	S	*	*			trans	-39.5	150.5	172.3	62.6	0	0	0	0	114.7
175	S	48.5	Very low	56.8	Low	108 Å²	108	122.5 Å²	122.5	76%	0.755	70%	0.701	S	S	*	*				-170.7	125.7	123	53.8	0	0	0	0	111.6
176	Q	52.5	Low	55.4	Low	271 Å²	271	126.2 Å²	126.2	100%	1.266	72%	0.719	S	S	*	*			trans	71.8	0	156	-76.3	178.3	-13.1	0	0	119.1

Retrieved 176 of 176 residues in 282.1 ms (Link to these results)

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