A0A077Z2Q5_TRITR Loading...

ORC5 C domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2Q5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 218 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	28.6	Very low	29.8	Very low	229 Å²	229	103.3 Å²	103.3	100%	1.128	53%	0.529	S	S	*	.				0	0.3	0	-147.5	168	155.9	0	0	114.1
2	Y	26.1	Very low	30	Very low	202 Å²	202	101.3 Å²	101.3	79%	0.792	52%	0.52	S	S	*	.			trans	-101.6	-2.3	-177.8	-90.9	-92.4	0	0	0	115.8
3	V	28.8	Very low	30.6	Very low	61 Å²	61	103.8 Å²	103.8	37%	0.37	53%	0.525	S	S	.	.	S	Bend	trans	-105.5	-19.6	-166.6	-170	0	0	0	0	114.6	L5 T6 V119	V3-L5 PolarHBondContact O-N 3.02Å; V3-T6 PolarHBondContact O-OG1 3.02Å; V3-V119 HydrophobicContact CB-CG2 4.16Å; V3-V119 HydrophobicContact CG1-CG2 3.45Å; V3-V119 VanDerWaalsContact CG1-CG2 3.45Å; V3-V119 HydrophobicContact CG2-CG2 4.11Å
4	Q	27.7	Very low	31.3	Very low	148 Å²	148	99.9 Å²	99.9	69%	0.692	51%	0.506	S	S	*	.	H	α-helix	trans	-61.1	-40.2	165	-129.7	90.6	-14.2	0	0	109.9	T6 V7 D8	Q4-T6 VanDerWaalsContact C-N 3.32Å; Q4-T6 PolarHBondContact O-N 3.08Å; Q4-V7 PolarHBondContact O-N 2.9Å; Q4-D8 WeakPolarHBondContact CG-OD2 3.46Å; Q4-D8 VanDerWaalsContact O-CB 3.28Å; Q4-D8 WeakPolarHBondContact O-CB 3.36Å; Q4-D8 PolarHBondContact O-N 2.91Å; Q4-D8 VanDerWaalsContact O-OD2 3.11Å
5	L	25.5	Very low	31.9	Very low	94 Å²	94	100.4 Å²	100.4	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-57.3	-34.2	-178.7	-82.7	140.2	0	0	0	113.9	V3 V9	V3-L5 PolarHBondContact O-N 3.02Å; L5-V9 WeakPolarHBondContact O-CA 3.42Å; L5-V9 WeakPolarHBondContact O-CB 2.97Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.4Å
6	T	30.2	Very low	32.4	Very low	81 Å²	81	102.7 Å²	102.7	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-78.9	-36.3	-177.6	49.6	0	0	0	0	112.8	V3 Q4 I10	V3-T6 PolarHBondContact O-OG1 3.02Å; Q4-T6 VanDerWaalsContact C-N 3.32Å; Q4-T6 PolarHBondContact O-N 3.08Å; T6-I10 WeakPolarHBondContact O-CB 3.38Å; T6-I10 WeakPolarHBondContact O-CD1 3.36Å; T6-I10 WeakPolarHBondContact O-CG1 3.44Å; T6-I10 PolarHBondContact O-N 3.2Å
7	V	33.1	Very low	33	Very low	67 Å²	67	102.3 Å²	102.3	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-72.6	-41.7	174.6	-177.4	0	0	0	0	110.2	Q4 C11	Q4-V7 PolarHBondContact O-N 2.9Å; V7-C11 WeakPolarHBondContact O-CB 3.4Å; V7-C11 PolarHBondContact O-N 3.48Å; V7-C11 PolarHBondContact O-SG 3.35Å
8	D	28.4	Very low	33.7	Very low	80 Å²	80	97.9 Å²	97.9	43%	0.428	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-39.3	176.5	-65.2	-27.2	0	0	0	111.2	Q4 C11 L12	Q4-D8 WeakPolarHBondContact CG-OD2 3.46Å; Q4-D8 VanDerWaalsContact O-CB 3.28Å; Q4-D8 WeakPolarHBondContact O-CB 3.36Å; Q4-D8 PolarHBondContact O-N 2.91Å; Q4-D8 VanDerWaalsContact O-OD2 3.11Å; D8-C11 PolarHBondContact O-N 2.91Å; D8-L12 HydrophobicContact CB-CD1 4.48Å; D8-L12 WeakPolarHBondContact O-CA 3.45Å; D8-L12 WeakPolarHBondContact O-CB 3.31Å; D8-L12 WeakPolarHBondContact O-CD1 3.5Å; D8-L12 WeakPolarHBondContact O-CG 3.35Å; D8-L12 PolarHBondContact O-N 3.36Å
9	V	31.6	Very low	34.5	Very low	79 Å²	79	98 Å²	98	48%	0.479	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-38.9	176.5	169	0	0	0	0	111.4	L5 K13	L5-V9 WeakPolarHBondContact O-CA 3.42Å; L5-V9 WeakPolarHBondContact O-CB 2.97Å; L5-V9 WeakPolarHBondContact O-CG2 3.46Å; L5-V9 PolarHBondContact O-N 3.4Å; V9-K13 WeakPolarHBondContact O-CB 3.5Å; V9-K13 PolarHBondContact O-N 2.72Å
10	I	35	Very low	35.2	Very low	63 Å²	63	96.7 Å²	96.7	32%	0.323	49%	0.487	S	S	.	.	H	α-helix	trans	-69.8	-39.1	175.1	-67	166.5	0	0	0	110.2	T6 L14 Y181	T6-I10 WeakPolarHBondContact O-CB 3.38Å; T6-I10 WeakPolarHBondContact O-CD1 3.36Å; T6-I10 WeakPolarHBondContact O-CG1 3.44Å; T6-I10 PolarHBondContact O-N 3.2Å; I10-L14 HydrophobicContact CG2-CD1 3.95Å; I10-L14 WeakPolarHBondContact O-CB 3.35Å; I10-L14 WeakPolarHBondContact O-CD1 3.47Å; I10-L14 PolarHBondContact O-N 2.76Å; I10-Y181 HydrophobicContact CD1-CE2 4.34Å
11	C	33.6	Very low	35.6	Very low	32 Å²	32	96 Å²	96	22%	0.216	48%	0.481	C	S	.	.	H	α-helix	trans	-68.2	-42	175.5	-71.3	0	0	0	0	112.7	V7 D8 L14 E15 R205	V7-C11 WeakPolarHBondContact O-CB 3.4Å; V7-C11 PolarHBondContact O-N 3.48Å; V7-C11 PolarHBondContact O-SG 3.35Å; D8-C11 PolarHBondContact O-N 2.91Å; C11-L14 PolarHBondContact O-N 3.44Å; C11-E15 WeakPolarHBondContact O-CB 3.43Å; C11-E15 WeakPolarHBondContact O-CG 3.23Å; C11-E15 PolarHBondContact O-N 3.16Å; C11-R205 VanDerWaalsContact CB-NH2 3.29Å; C11-R205 PolarHBondContact SG-NH2 2.88Å
12	L	31.6	Very low	36.4	Very low	79 Å²	79	87 Å²	87	41%	0.414	44%	0.438	S	S	.	.	H	α-helix	trans	-68.9	-34.4	174.7	-81.3	160.3	0	0	0	111.7	D8 K16	D8-L12 HydrophobicContact CB-CD1 4.48Å; D8-L12 WeakPolarHBondContact O-CA 3.45Å; D8-L12 WeakPolarHBondContact O-CB 3.31Å; D8-L12 WeakPolarHBondContact O-CD1 3.5Å; D8-L12 WeakPolarHBondContact O-CG 3.35Å; D8-L12 PolarHBondContact O-N 3.36Å; L12-K16 WeakPolarHBondContact O-CB 3Å; L12-K16 WeakPolarHBondContact O-CG 3.22Å; L12-K16 PolarHBondContact O-N 3.16Å
13	K	37.9	Very low	37.7	Very low	134 Å²	134	83.9 Å²	83.9	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-74	-36.8	175.6	-159.9	75.4	179.6	-176.7	0	110.5	V9 N17	V9-K13 WeakPolarHBondContact O-CB 3.5Å; V9-K13 PolarHBondContact O-N 2.72Å; K13-N17 WeakPolarHBondContact O-CB 3.43Å; K13-N17 PolarHBondContact O-N 3.3Å; K13-N17 VanDerWaalsContact O-N 3.07Å; K13-N17 PolarHBondContact O-ND2 3.35Å
14	L	40.9	Very low	38.9	Very low	50 Å²	50	85 Å²	85	26%	0.262	45%	0.445	S	S	.	.	H	α-helix	trans	-64.3	-47.2	168.2	-105	104.8	0	0	0	111.2	I10 C11 N17 L18 F201	I10-L14 HydrophobicContact CG2-CD1 3.95Å; I10-L14 WeakPolarHBondContact O-CB 3.35Å; I10-L14 WeakPolarHBondContact O-CD1 3.47Å; I10-L14 PolarHBondContact O-N 2.76Å; C11-L14 PolarHBondContact O-N 3.44Å; L14-N17 CarbonylContact O-C 3.56Å; L14-N17 PolarHBondContact O-N 3.38Å; L14-L18 VanDerWaalsContact O-CB 3.26Å; L14-L18 WeakPolarHBondContact O-CB 3.3Å; L14-L18 PolarHBondContact O-N 3.49Å; L14-F201 HydrophobicContact CD1-CE1 4.02Å; L14-F201 HydrophobicContact CD1-CZ 3.57Å; L14-F201 HydrophobicContact CD2-CE1 3.73Å; L14-F201 HydrophobicContact CD2-CZ 3.96Å; L14-F201 HydrophobicContact CG-CZ 4.43Å
15	E	39.5	Very low	39.8	Very low	107 Å²	107	81 Å²	81	50%	0.5	43%	0.429	S	S	.	.	H	α-helix	trans	-62.6	-49.7	179.1	-86.1	177	164.2	0	0	111.4	C11 N17 L18 Q19	C11-E15 WeakPolarHBondContact O-CB 3.43Å; C11-E15 WeakPolarHBondContact O-CG 3.23Å; C11-E15 PolarHBondContact O-N 3.16Å; E15-N17 PolarHBondContact O-N 3.42Å; E15-L18 CarbonylContact O-C 3.5Å; E15-L18 PolarHBondContact O-N 2.92Å; E15-Q19 WeakPolarHBondContact O-CA 3.32Å; E15-Q19 VanDerWaalsContact O-CB 3.22Å; E15-Q19 WeakPolarHBondContact O-CB 3.46Å; E15-Q19 PolarHBondContact O-N 3.46Å
16	K	40	Very low	41	Very low	137 Å²	137	78.9 Å²	78.9	60%	0.596	43%	0.43	S	S	*	.	H	α-helix	trans	-62.3	-30.4	177.2	-72.6	175	-180	-174	0	113.2	L12 P20	L12-K16 WeakPolarHBondContact O-CB 3Å; L12-K16 WeakPolarHBondContact O-CG 3.22Å; L12-K16 PolarHBondContact O-N 3.16Å; K16-P20 WeakPolarHBondContact O-CD 3.48Å
17	N	42.9	Very low	41.7	Very low	96 Å²	96	81.8 Å²	81.8	51%	0.513	44%	0.442	S	S	.	.	H	α-helix	trans	-82.5	-27.5	173.8	-74.1	-28.4	0	0	0	112.5	K13 L14 E15 F21	K13-N17 WeakPolarHBondContact O-CB 3.43Å; K13-N17 PolarHBondContact O-N 3.3Å; K13-N17 VanDerWaalsContact O-N 3.07Å; K13-N17 PolarHBondContact O-ND2 3.35Å; L14-N17 CarbonylContact O-C 3.56Å; L14-N17 PolarHBondContact O-N 3.38Å; E15-N17 PolarHBondContact O-N 3.42Å; N17-F21 WeakPolarHBondContact O-CD2 3.23Å
18	L	45.7	Very low	42.6	Very low	24 Å²	24	81.5 Å²	81.5	13%	0.126	44%	0.44	C	S	.	.	H	α-helix	trans	-80.4	-27.8	174.1	-121.5	86.5	0	0	0	112.1	L14 E15 F21 L22 L47	L14-L18 VanDerWaalsContact O-CB 3.26Å; L14-L18 WeakPolarHBondContact O-CB 3.3Å; L14-L18 PolarHBondContact O-N 3.49Å; E15-L18 CarbonylContact O-C 3.5Å; E15-L18 PolarHBondContact O-N 2.92Å; L18-F21 CarbonylContact O-C 3.44Å; L18-F21 VanDerWaalsContact O-CA 3.29Å; L18-F21 WeakPolarHBondContact O-CA 3.43Å; L18-F21 VanDerWaalsContact O-CB 3.24Å; L18-F21 WeakPolarHBondContact O-CB 3.36Å; L18-F21 PolarHBondContact O-N 3.28Å; L18-L22 HydrophobicContact CB-CD1 4.35Å; L18-L22 HydrophobicContact CD2-CD1 4.31Å; L18-L22 HydrophobicContact CD2-CG 4.39Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 3.29Å; L18-L47 HydrophobicContact CD2-CD1 4.1Å
19	Q	48.5	Very low	43.6	Very low	99 Å²	99	82.2 Å²	82.2	46%	0.463	45%	0.452	S	S	.	.	H	α-helix	trans	-57.3	-46.9	-173.7	-162.7	171.7	-37.9	0	0	112.7	E15 F21 L22 E23	E15-Q19 WeakPolarHBondContact O-CA 3.32Å; E15-Q19 VanDerWaalsContact O-CB 3.22Å; E15-Q19 WeakPolarHBondContact O-CB 3.46Å; E15-Q19 PolarHBondContact O-N 3.46Å; Q19-F21 PolarHBondContact O-N 2.94Å; Q19-L22 PolarHBondContact O-N 3.25Å; Q19-L22 VanDerWaalsContact O-N 3.12Å; Q19-E23 WeakPolarHBondContact CG-OE1 3.45Å; Q19-E23 PolarHBondContact NE2-OE1 3.49Å; Q19-E23 WeakPolarHBondContact O-CB 3.23Å; Q19-E23 VanDerWaalsContact O-CG 3.31Å; Q19-E23 WeakPolarHBondContact O-CG 3.44Å; Q19-E23 PolarHBondContact O-N 3.24Å
20	P	47.8	Very low	44.1	Very low	71 Å²	71	82.8 Å²	82.8	46%	0.461	46%	0.464	S	S	.	.	H	α-helix	trans	-63.2	-25	171.9	23.2	-33.4	0	0	0	113.3	K16 A24	K16-P20 WeakPolarHBondContact O-CD 3.48Å; P20-A24 VanDerWaalsContact O-CB 3.28Å; P20-A24 WeakPolarHBondContact O-CB 3.49Å; P20-A24 PolarHBondContact O-N 3.29Å; P20-A24 VanDerWaalsContact O-N 3.14Å
21	F	45.4	Very low	44.4	Very low	83 Å²	83	83.7 Å²	83.7	36%	0.364	47%	0.469	S	S	.	.	H	α-helix	trans	-78.4	-33.5	173.2	-71.6	-77.2	0	0	0	113.3	N17 L18 Q19 L25 S54	N17-F21 WeakPolarHBondContact O-CD2 3.23Å; L18-F21 CarbonylContact O-C 3.44Å; L18-F21 VanDerWaalsContact O-CA 3.29Å; L18-F21 WeakPolarHBondContact O-CA 3.43Å; L18-F21 VanDerWaalsContact O-CB 3.24Å; L18-F21 WeakPolarHBondContact O-CB 3.36Å; L18-F21 PolarHBondContact O-N 3.28Å; Q19-F21 PolarHBondContact O-N 2.94Å; F21-L25 WeakPolarHBondContact O-CD1 3.24Å; F21-L25 WeakPolarHBondContact O-CG 3.36Å; F21-L25 PolarHBondContact O-N 3.13Å; F21-S54 WeakPolarHBondContact CE1-OG 3.04Å; F21-S54 WeakPolarHBondContact CZ-OG 3.4Å
22	L	45.3	Very low	44.9	Very low	41 Å²	41	87.1 Å²	87.1	22%	0.215	49%	0.494	C	S	.	.	H	α-helix	trans	-71.3	-38.5	174.9	-69.9	169.8	0	0	0	110.7	L18 Q19 L25 V28 V43 L47	L18-L22 HydrophobicContact CB-CD1 4.35Å; L18-L22 HydrophobicContact CD2-CD1 4.31Å; L18-L22 HydrophobicContact CD2-CG 4.39Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 3.29Å; Q19-L22 PolarHBondContact O-N 3.25Å; Q19-L22 VanDerWaalsContact O-N 3.12Å; L22-L25 PolarHBondContact O-N 2.94Å; L22-V28 WeakPolarHBondContact O-CG2 3.49Å; L22-V43 HydrophobicContact CD2-CG1 4.5Å; L22-L47 HydrophobicContact CD2-CD1 4.22Å; L22-L47 HydrophobicContact CD2-CD2 4.28Å
23	E	53	Low	45.4	Very low	135 Å²	135	91.9 Å²	91.9	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-68.3	-34	174.1	-70	167.4	-173.7	0	0	111.7	Q19 L25	Q19-E23 WeakPolarHBondContact CG-OE1 3.45Å; Q19-E23 PolarHBondContact NE2-OE1 3.49Å; Q19-E23 WeakPolarHBondContact O-CB 3.23Å; Q19-E23 VanDerWaalsContact O-CG 3.31Å; Q19-E23 WeakPolarHBondContact O-CG 3.44Å; Q19-E23 PolarHBondContact O-N 3.24Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 3.49Å
24	A	53	Low	45.5	Very low	84 Å²	84	89.8 Å²	89.8	69%	0.694	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-15.7	175.2	0	0	0	0	0	114.6	P20 G26	P20-A24 VanDerWaalsContact O-CB 3.28Å; P20-A24 WeakPolarHBondContact O-CB 3.49Å; P20-A24 PolarHBondContact O-N 3.29Å; P20-A24 VanDerWaalsContact O-N 3.14Å; A24-G26 VanDerWaalsContact C-N 3.32Å
25	L	46.9	Very low	45.4	Very low	66 Å²	66	97.6 Å²	97.6	35%	0.346	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.6	-178.5	-87.8	163.8	0	0	0	114.1	F21 L22 E23 L47 Q50	F21-L25 WeakPolarHBondContact O-CD1 3.24Å; F21-L25 WeakPolarHBondContact O-CG 3.36Å; F21-L25 PolarHBondContact O-N 3.13Å; L22-L25 PolarHBondContact O-N 2.94Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 3.49Å; L25-L47 HydrophobicContact CD1-CD2 3.48Å; L25-L47 VanDerWaalsContact CD1-CD2 3.48Å; L25-L47 HydrophobicContact CD1-CG 4.08Å; L25-Q50 HydrophobicContact CD2-CG 4.13Å
26	G	51.1	Low	45.6	Very low	49 Å²	49	99.1 Å²	99.1	51%	0.505	55%	0.552	S	S	.	*			trans	73.5	162.4	-175.9	0	0	0	0	0	112.7	A24 V28	A24-G26 VanDerWaalsContact C-N 3.32Å; G26-V28 WeakPolarHBondContact O-CG2 3.42Å; G26-V28 PolarHBondContact O-N 3.22Å
27	D	43.8	Very low	45.6	Very low	141 Å²	141	96.8 Å²	96.8	75%	0.754	57%	0.566	S	S	*	*			trans	-25.3	87.4	-167.9	-89.9	-46.4	0	0	0	116.9	S29	D27-S29 WeakPolarHBondContact CB-OG 3.33Å; D27-S29 PolarHBondContact O-N 2.94Å; D27-S29 PolarHBondContact OD1-OG 3.48Å
28	V	52.7	Low	45.6	Very low	61 Å²	61	94.3 Å²	94.3	37%	0.37	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-71.3	-10.7	171.3	-168.3	0	0	0	0	111.2	L22 G26 A30 L31	L22-V28 WeakPolarHBondContact O-CG2 3.49Å; G26-V28 WeakPolarHBondContact O-CG2 3.42Å; G26-V28 PolarHBondContact O-N 3.22Å; V28-A30 PolarHBondContact O-N 3.49Å; V28-L31 HydrophobicContact CG1-CD1 4.43Å; V28-L31 PolarHBondContact O-N 3.01Å
29	S	48.6	Very low	45.9	Very low	96 Å²	96	96.3 Å²	96.3	67%	0.671	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-58.6	-21.8	174.1	49.1	0	0	0	0	113.9	D27	D27-S29 WeakPolarHBondContact CB-OG 3.33Å; D27-S29 PolarHBondContact O-N 2.94Å; D27-S29 PolarHBondContact OD1-OG 3.48Å
30	A	43.2	Very low	46.1	Very low	90 Å²	90	94.1 Å²	94.1	74%	0.744	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-82.5	-9.5	174.3	0	0	0	0	0	114.3	V28 S32	V28-A30 PolarHBondContact O-N 3.49Å; A30-S32 PolarHBondContact O-N 3.19Å
31	L	41.8	Very low	46.1	Very low	82 Å²	82	93.7 Å²	93.7	43%	0.429	56%	0.561	S	S	.	*	S	Bend	trans	-102.1	67.2	-179	-72	151.8	0	0	0	109.1	V28 E33 V43	V28-L31 HydrophobicContact CG1-CD1 4.43Å; V28-L31 PolarHBondContact O-N 3.01Å; L31-E33 PolarHBondContact O-N 3.25Å; L31-E33 VanDerWaalsContact O-N 3.17Å; L31-V43 HydrophobicContact CB-CG2 4.47Å; L31-V43 HydrophobicContact CD1-CG2 3.98Å; L31-V43 HydrophobicContact CD2-CG2 4.28Å; L31-V43 HydrophobicContact CG-CG2 4.48Å
32	S	43.4	Very low	46.3	Very low	104 Å²	104	98.5 Å²	98.5	73%	0.727	58%	0.577	S	S	*	*			trans	-30.3	117.8	177.7	168.5	0	0	0	0	112.5	A30 T34	A30-S32 PolarHBondContact O-N 3.19Å; S32-T34 PolarHBondContact O-N 3.4Å
33	E	42.1	Very low	46.8	Very low	179 Å²	179	97.2 Å²	97.2	84%	0.836	57%	0.571	S	S	*	*			trans	-48.1	102.7	165.8	-61.4	173.3	162.1	0	0	109.4	L31 K35	L31-E33 PolarHBondContact O-N 3.25Å; L31-E33 VanDerWaalsContact O-N 3.17Å; E33-K35 PolarHBondContact O-N 3.17Å
34	T	39.6	Very low	46.7	Very low	91 Å²	91	95.5 Å²	95.5	56%	0.558	56%	0.558	S	S	*	*			trans	-62.7	127.6	155.1	51.3	0	0	0	0	106.1	S32 E36	S32-T34 PolarHBondContact O-N 3.4Å; T34-E36 PolarHBondContact O-N 2.86Å
35	K	40	Very low	46.6	Very low	214 Å²	214	97 Å²	97	93%	0.93	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	19.9	-173.4	-71.1	-175.2	170.6	-178.4	0	117.4	E33	E33-K35 PolarHBondContact O-N 3.17Å
36	E	42	Very low	47	Very low	139 Å²	139	96.4 Å²	96.4	65%	0.65	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.4	49.4	-177.7	-64.1	-169.3	162.4	0	0	112.8	T34 A38 R206	T34-E36 PolarHBondContact O-N 2.86Å; E36-A38 WeakPolarHBondContact O-CB 3.3Å; E36-A38 PolarHBondContact O-N 2.98Å; E36-R206 PolarHBondContact O-NH1 2.84Å
37	G	41.9	Very low	47.2	Very low	87 Å²	87	94.1 Å²	94.1	90%	0.897	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	27.2	163.4	0	0	0	0	0	116.4
38	A	42.5	Very low	47.7	Very low	45 Å²	45	90.1 Å²	90.1	37%	0.372	50%	0.504	S	S	.	.			trans	-110	114.2	-173.6	0	0	0	0	0	108.6	E36 S40	E36-A38 WeakPolarHBondContact O-CB 3.3Å; E36-A38 PolarHBondContact O-N 2.98Å; A38-S40 PolarHBondContact O-N 3.16Å; A38-S40 VanDerWaalsContact O-N 3.13Å
39	L	52.2	Low	47.8	Very low	66 Å²	66	90.9 Å²	90.9	35%	0.346	51%	0.51	S	S	.	.			trans	-57.6	116.4	163.8	-79.1	160.2	0	0	0	108.3	V43 W44	L39-V43 HydrophobicContact CD2-CB 4.25Å; L39-V43 HydrophobicContact CD2-CG1 3.65Å; L39-W44 VanDerWaalsContact CB-NE1 3.27Å; L39-W44 HydrophobicContact CD1-CZ2 3.78Å
40	S	51.1	Low	47.8	Very low	53 Å²	53	90.1 Å²	90.1	37%	0.371	50%	0.496	S	S	.	.			trans	-55.4	144.7	177.6	171.1	0	0	0	0	110.6	A38 R42 V43 W44	A38-S40 PolarHBondContact O-N 3.16Å; A38-S40 VanDerWaalsContact O-N 3.13Å; S40-R42 PolarHBondContact O-N 2.78Å; S40-V43 WeakPolarHBondContact O-CA 3.41Å; S40-V43 WeakPolarHBondContact O-CB 3.44Å; S40-V43 PolarHBondContact O-N 2.98Å; S40-W44 PolarHBondContact O-N 3.24Å
41	T	48.9	Very low	48.1	Very low	61 Å²	61	89.5 Å²	89.5	37%	0.374	48%	0.48	S	S	.	.	H	α-helix	trans	-53.7	-26.9	177.5	48.2	0	0	0	0	112.7	R45	T41-R45 WeakPolarHBondContact O-CG 3.11Å; T41-R45 PolarHBondContact O-N 3.47Å; T41-R45 VanDerWaalsContact O-N 3.16Å
42	R	49.8	Very low	48.4	Very low	185 Å²	185	91.1 Å²	91.1	70%	0.698	48%	0.483	S	S	*	.	H	α-helix	trans	-66.1	-41.6	172.7	-69.5	-176.6	168	-177	-4.5	112.8	S40 R45 A46	S40-R42 PolarHBondContact O-N 2.78Å; R42-R45 PolarHBondContact O-N 2.9Å; R42-A46 PolarHBondContact O-N 2.77Å
43	V	54.7	Low	48.5	Very low	14 Å²	14	93.3 Å²	93.3	9%	0.085	48%	0.48	C	S	.	.	H	α-helix	trans	-67.3	-42.3	178.7	-174.1	0	0	0	0	110.3	L22 L31 L39 S40 R45 A46 L47	L22-V43 HydrophobicContact CD2-CG1 4.5Å; L31-V43 HydrophobicContact CB-CG2 4.47Å; L31-V43 HydrophobicContact CD1-CG2 3.98Å; L31-V43 HydrophobicContact CD2-CG2 4.28Å; L31-V43 HydrophobicContact CG-CG2 4.48Å; L39-V43 HydrophobicContact CD2-CB 4.25Å; L39-V43 HydrophobicContact CD2-CG1 3.65Å; S40-V43 WeakPolarHBondContact O-CA 3.41Å; S40-V43 WeakPolarHBondContact O-CB 3.44Å; S40-V43 PolarHBondContact O-N 2.98Å; V43-R45 PolarHBondContact O-N 2.95Å; V43-A46 PolarHBondContact O-N 2.73Å; V43-L47 HydrophobicContact CG1-CD1 3.9Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 WeakPolarHBondContact O-CG 3.34Å; V43-L47 PolarHBondContact O-N 3.02Å
44	W	50.8	Low	48.5	Very low	98 Å²	98	86.2 Å²	86.2	37%	0.371	45%	0.45	S	S	.	.	H	α-helix	trans	-60.2	-42.6	174.8	-81	107.4	0	0	0	113.1	L39 S40 A46 L47 Q48	L39-W44 VanDerWaalsContact CB-NE1 3.27Å; L39-W44 HydrophobicContact CD1-CZ2 3.78Å; S40-W44 PolarHBondContact O-N 3.24Å; W44-A46 VanDerWaalsContact C-N 3.34Å; W44-A46 PolarHBondContact O-N 3.26Å; W44-L47 PolarHBondContact O-N 3.34Å; W44-Q48 PolarHBondContact O-N 3.13Å; W44-Q48 VanDerWaalsContact O-N 3.14Å
45	R	52.3	Low	48.7	Very low	115 Å²	115	83.8 Å²	83.8	43%	0.434	44%	0.44	S	S	.	.	H	α-helix	trans	-66.2	-35.4	175.9	-73.8	-176.2	-161.9	131.1	9.7	112.9	T41 R42 V43 L47 P49 D212	T41-R45 WeakPolarHBondContact O-CG 3.11Å; T41-R45 PolarHBondContact O-N 3.47Å; T41-R45 VanDerWaalsContact O-N 3.16Å; R42-R45 PolarHBondContact O-N 2.9Å; V43-R45 PolarHBondContact O-N 2.95Å; R45-L47 VanDerWaalsContact C-N 3.34Å; R45-P49 WeakPolarHBondContact O-CD 3.48Å; R45-D212 IonicContact CZ-OD1 2.65Å; R45-D212 IonicContact NE-OD1 3.16Å; R45-D212 IonicContact NH2-OD1 3.54Å; R45-D212 PolarHBondContact NH2-OD1 3.06Å
46	A	55.4	Low	48.5	Very low	54 Å²	54	76.1 Å²	76.1	45%	0.446	42%	0.421	S	S	.	.	H	α-helix	trans	-70.6	-30.8	175.6	0	0	0	0	0	112.5	R42 V43 W44 P49	R42-A46 PolarHBondContact O-N 2.77Å; V43-A46 PolarHBondContact O-N 2.73Å; W44-A46 VanDerWaalsContact C-N 3.34Å; W44-A46 PolarHBondContact O-N 3.26Å; A46-P49 WeakPolarHBondContact O-CD 3.47Å
47	L	54.8	Low	48.4	Very low	2 Å²	2	74.1 Å²	74.1	1%	0.01	42%	0.422	C	S	.	.	H	α-helix	trans	-77.4	-27.8	178.1	-78.9	163.2	0	0	0	113.6	L18 L22 L25 V43 W44 R45 Q50 L51	L18-L47 HydrophobicContact CD2-CD1 4.1Å; L22-L47 HydrophobicContact CD2-CD1 4.22Å; L22-L47 HydrophobicContact CD2-CD2 4.28Å; L25-L47 HydrophobicContact CD1-CD2 3.48Å; L25-L47 VanDerWaalsContact CD1-CD2 3.48Å; L25-L47 HydrophobicContact CD1-CG 4.08Å; V43-L47 HydrophobicContact CG1-CD1 3.9Å; V43-L47 WeakPolarHBondContact O-CB 3.38Å; V43-L47 WeakPolarHBondContact O-CG 3.34Å; V43-L47 PolarHBondContact O-N 3.02Å; W44-L47 PolarHBondContact O-N 3.34Å; R45-L47 VanDerWaalsContact C-N 3.34Å; L47-Q50 PolarHBondContact O-N 3.25Å; L47-Q50 VanDerWaalsContact O-N 3.15Å; L47-L51 HydrophobicContact CB-CD1 4.24Å; L47-L51 WeakPolarHBondContact O-CG 3.36Å; L47-L51 PolarHBondContact O-N 3.49Å
48	Q	54.5	Low	48.1	Very low	57 Å²	57	75.6 Å²	75.6	27%	0.266	41%	0.409	S	S	.	.	H	α-helix	trans	-50.1	-54.3	-177.5	-88.9	-179.5	-66.9	0	0	113	W44 Q50 L51 F52	W44-Q48 PolarHBondContact O-N 3.13Å; W44-Q48 VanDerWaalsContact O-N 3.14Å; Q48-Q50 VanDerWaalsContact C-N 3.28Å; Q48-Q50 PolarHBondContact O-N 2.93Å; Q48-L51 PolarHBondContact O-N 3.2Å; Q48-F52 WeakPolarHBondContact O-CD2 3.37Å; Q48-F52 PolarHBondContact O-N 3.02Å
49	P	53.3	Low	47.7	Very low	76 Å²	76	82.9 Å²	82.9	49%	0.494	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-32.3	-178	-19.4	31.8	0	0	0	113.4	R45 A46 K53	R45-P49 WeakPolarHBondContact O-CD 3.48Å; A46-P49 WeakPolarHBondContact O-CD 3.47Å; P49-K53 PolarHBondContact O-N 3.28Å
50	Q	48.9	Very low	47	Very low	80 Å²	80	84.6 Å²	84.6	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-75.1	-39.1	179.8	-59.5	-66.8	3.3	0	0	111.2	L25 L47 Q48 K53 S54	L25-Q50 HydrophobicContact CD2-CG 4.13Å; L47-Q50 PolarHBondContact O-N 3.25Å; L47-Q50 VanDerWaalsContact O-N 3.15Å; Q48-Q50 VanDerWaalsContact C-N 3.28Å; Q48-Q50 PolarHBondContact O-N 2.93Å; Q50-K53 PolarHBondContact O-N 3.05Å; Q50-S54 WeakPolarHBondContact O-CB 3.41Å; Q50-S54 PolarHBondContact O-N 3.22Å; Q50-S54 PolarHBondContact O-OG 3.03Å
51	L	50.9	Low	46.1	Very low	78 Å²	78	87 Å²	87	41%	0.408	46%	0.463	S	S	.	.	H	α-helix	trans	-60.1	-44.5	171.6	-76.9	165.1	0	0	0	111.3	L47 Q48 S54 A55	L47-L51 HydrophobicContact CB-CD1 4.24Å; L47-L51 WeakPolarHBondContact O-CG 3.36Å; L47-L51 PolarHBondContact O-N 3.49Å; Q48-L51 PolarHBondContact O-N 3.2Å; L51-S54 PolarHBondContact O-N 3.05Å; L51-A55 WeakPolarHBondContact O-CB 3.36Å; L51-A55 PolarHBondContact O-N 3.45Å
52	F	46.4	Very low	45.3	Very low	115 Å²	115	91.7 Å²	91.7	50%	0.504	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-39.2	175.2	-77.8	-65.3	0	0	0	112.7	Q48 G56	Q48-F52 WeakPolarHBondContact O-CD2 3.37Å; Q48-F52 PolarHBondContact O-N 3.02Å; F52-G56 PolarHBondContact O-N 3.03Å
53	K	47	Very low	44.6	Very low	150 Å²	150	89 Å²	89	65%	0.652	49%	0.49	S	S	*	.	H	α-helix	trans	-66.3	-43.2	175.4	-86.3	-177.5	175.5	-178.2	0	112.9	P49 Q50 G56 S57	P49-K53 PolarHBondContact O-N 3.28Å; Q50-K53 PolarHBondContact O-N 3.05Å; K53-G56 PolarHBondContact O-N 3.39Å; K53-S57 PolarHBondContact O-N 2.95Å
54	S	41.1	Very low	44	Very low	31 Å²	31	93.4 Å²	93.4	22%	0.217	52%	0.517	C	S	.	.	H	α-helix	trans	-77.2	-29.8	-177.1	-64.3	0	0	0	0	113.6	F21 Q50 L51 G56 S57 L58	F21-S54 WeakPolarHBondContact CE1-OG 3.04Å; F21-S54 WeakPolarHBondContact CZ-OG 3.4Å; Q50-S54 WeakPolarHBondContact O-CB 3.41Å; Q50-S54 PolarHBondContact O-N 3.22Å; Q50-S54 PolarHBondContact O-OG 3.03Å; L51-S54 PolarHBondContact O-N 3.05Å; S54-G56 PolarHBondContact O-N 3.18Å; S54-S57 PolarHBondContact O-N 3.01Å; S54-S57 VanDerWaalsContact O-N 3.11Å; S54-L58 PolarHBondContact O-N 3.49Å
55	A	44.4	Very low	43.5	Very low	40 Å²	40	94.6 Å²	94.6	33%	0.331	53%	0.534	S	S	.	.	H	α-helix	trans	-59.5	-33.2	166.5	0	0	0	0	0	111.8	L51 S57	L51-A55 WeakPolarHBondContact O-CB 3.36Å; L51-A55 PolarHBondContact O-N 3.45Å; A55-S57 VanDerWaalsContact C-N 3.34Å; A55-S57 PolarHBondContact O-N 3.16Å
56	G	36	Very low	43.3	Very low	52 Å²	52	96.1 Å²	96.1	54%	0.536	55%	0.547	S	S	.	.	H	α-helix	trans	-70.7	-21.6	174.1	0	0	0	0	0	115.2	F52 K53 S54	F52-G56 PolarHBondContact O-N 3.03Å; K53-G56 PolarHBondContact O-N 3.39Å; S54-G56 PolarHBondContact O-N 3.18Å
57	S	38.4	Very low	43.3	Very low	97 Å²	97	96.6 Å²	96.6	68%	0.678	54%	0.537	S	S	*	.	H	α-helix	trans	-104.7	-3.7	-170.7	-166.5	0	0	0	0	115.2	K53 S54 A55 Q59	K53-S57 PolarHBondContact O-N 2.95Å; S54-S57 PolarHBondContact O-N 3.01Å; S54-S57 VanDerWaalsContact O-N 3.11Å; A55-S57 VanDerWaalsContact C-N 3.34Å; A55-S57 PolarHBondContact O-N 3.16Å; S57-Q59 PolarHBondContact O-N 2.86Å
58	L	36.9	Very low	43.8	Very low	118 Å²	118	104.8 Å²	104.8	62%	0.618	58%	0.575	S	S	*	*			trans	-78	101.5	174	-109.4	79.7	0	0	0	110.4	S54 V60	S54-L58 PolarHBondContact O-N 3.49Å; L58-V60 HydrophobicContact CB-CG2 4.37Å; L58-V60 HydrophobicContact CD2-CG2 4.32Å; L58-V60 PolarHBondContact O-N 3.4Å
59	Q	33.5	Very low	44.7	Very low	198 Å²	198	103 Å²	103	93%	0.925	57%	0.567	S	S	*	*			trans	-74.4	110.4	160.9	-66.2	-176.9	-14.5	0	0	107.8	S57	S57-Q59 PolarHBondContact O-N 2.86Å
60	V	37.9	Very low	46	Very low	102 Å²	102	103 Å²	103	62%	0.618	57%	0.567	S	S	*	*			trans	-106.2	133.6	176.6	179.9	0	0	0	0	108	L58	L58-V60 HydrophobicContact CB-CG2 4.37Å; L58-V60 HydrophobicContact CD2-CG2 4.32Å; L58-V60 PolarHBondContact O-N 3.4Å
61	P	31.4	Very low	47.6	Very low	105 Å²	105	103 Å²	103	68%	0.682	57%	0.569	S	S	*	*			trans	-62.1	136.1	-174	-17	29.3	0	0	0	112.5	T63	P61-T63 VanDerWaalsContact C-N 3.29Å; P61-T63 PolarHBondContact O-N 3.11Å
62	D	32.6	Very low	49.1	Very low	158 Å²	158	102.4 Å²	102.4	85%	0.845	57%	0.566	S	S	*	*	S	Bend	trans	-62.9	71.5	-178.1	-70.2	-44.8	0	0	0	114.2
63	T	34.4	Very low	51	Low	129 Å²	129	97.1 Å²	97.1	79%	0.791	54%	0.544	S	S	*	.			trans	-125.4	53.4	164.6	54.5	0	0	0	0	109.8	P61 V65	P61-T63 VanDerWaalsContact C-N 3.29Å; P61-T63 PolarHBondContact O-N 3.11Å; T63-V65 PolarHBondContact O-N 3.29Å
64	V	42.7	Very low	52.8	Low	107 Å²	107	91 Å²	91	65%	0.648	52%	0.517	S	S	*	.			trans	-83	97.2	178.1	-173.4	0	0	0	0	108.3	E66	V64-E66 VanDerWaalsContact C-N 3.31Å; V64-E66 HydrophobicContact CG1-CG 4.27Å; V64-E66 PolarHBondContact O-N 3.23Å
65	V	41.3	Very low	54.9	Low	123 Å²	123	90.6 Å²	90.6	75%	0.745	51%	0.512	S	S	*	.			trans	-64.3	101.4	153.9	178.8	0	0	0	0	105.4	T63 W67	T63-V65 PolarHBondContact O-N 3.29Å; V65-W67 PolarHBondContact O-N 3.02Å
66	E	48.1	Very low	57	Low	147 Å²	147	88.7 Å²	88.7	69%	0.687	50%	0.496	S	S	*	.			trans	-57.7	113.4	178.5	-69.8	-154.8	156	0	0	109.4	V64 E68	V64-E66 VanDerWaalsContact C-N 3.31Å; V64-E66 HydrophobicContact CG1-CG 4.27Å; V64-E66 PolarHBondContact O-N 3.23Å; E66-E68 VanDerWaalsContact C-N 3.32Å; E66-E68 HydrophobicContact CB-CG 4.43Å; E66-E68 PolarHBondContact O-N 3.47Å; E66-E68 VanDerWaalsContact O-N 3.08Å
67	W	53.8	Low	59.4	Low	64 Å²	64	86.4 Å²	86.4	24%	0.242	47%	0.471	C	S	.	.			trans	-75.7	93.5	164.6	-82.5	46.4	0	0	0	107	V65 L69 K74 Y160 T183 K186 I187	V65-W67 PolarHBondContact O-N 3.02Å; W67-L69 HydrophobicContact CE3-CD1 4.08Å; W67-L69 PolarHBondContact O-N 3.42Å; W67-K74 WeakPolarHBondContact O-CE 3.22Å; W67-K74 PolarHBondContact O-NZ 3.34Å; W67-Y160 HydrophobicContact CH2-CE1 4.23Å; W67-Y160 AromaticContact CZ3-CE1 3.76Å; W67-Y160 HydrophobicContact CZ3-CE1 3.76Å; W67-Y160 AromaticContact CZ3-CZ 3.77Å; W67-Y160 WeakPolarHBondContact CZ3-OH 3.33Å; W67-T183 HydrophobicContact CE3-CG2 4.46Å; W67-T183 HydrophobicContact CH2-CG2 3.47Å; W67-T183 VanDerWaalsContact CH2-CG2 3.47Å; W67-T183 HydrophobicContact CZ3-CG2 3.3Å; W67-K186 HydrophobicContact CH2-CD 4.39Å; W67-K186 HydrophobicContact CZ2-CB 4.49Å; W67-K186 HydrophobicContact CZ2-CD 3.51Å; W67-I187 HydrophobicContact CE3-CG1 4.4Å
68	E	66.6	Low	61.6	Low	174 Å²	174	82.1 Å²	82.1	81%	0.813	44%	0.441	S	S	*	.			trans	-67.1	38.9	-177.5	-63.5	-175	160	0	0	114.2	E66	E66-E68 VanDerWaalsContact C-N 3.32Å; E66-E68 HydrophobicContact CB-CG 4.43Å; E66-E68 PolarHBondContact O-N 3.47Å; E66-E68 VanDerWaalsContact O-N 3.08Å
69	L	72.5	Confident	64	Low	20 Å²	20	76.5 Å²	76.5	11%	0.105	41%	0.411	C	S	.	.			trans	-86.5	135.5	168.8	-76.4	104.3	0	0	0	110.5	W67 A73 K74 L155 L158 Y160	W67-L69 HydrophobicContact CE3-CD1 4.08Å; W67-L69 PolarHBondContact O-N 3.42Å; L69-A73 HydrophobicContact CB-CB 4.31Å; L69-A73 HydrophobicContact CD2-CB 4.11Å; L69-K74 HydrophobicContact CB-CG 4.04Å; L69-K74 WeakPolarHBondContact O-CE 3.32Å; L69-L155 HydrophobicContact CD2-CD2 3.64Å; L69-L158 HydrophobicContact CD2-CD1 4.12Å; L69-Y160 HydrophobicContact CD1-CE2 4.02Å; L69-Y160 HydrophobicContact CD2-CD2 4.24Å; L69-Y160 HydrophobicContact CD2-CE2 3.87Å
70	P	81.9	Confident	66.7	Low	75 Å²	75	67.1 Å²	67.1	49%	0.487	37%	0.367	S	S	.	.			trans	-51.6	147	170.8	-26.9	34.1	0	0	0	111.7	L72 A73 K74 L151	P70-L72 PolarHBondContact O-N 2.9Å; P70-A73 HydrophobicContact CB-CB 4.26Å; P70-A73 WeakPolarHBondContact O-CA 3.13Å; P70-A73 VanDerWaalsContact O-CB 3.3Å; P70-A73 WeakPolarHBondContact O-CB 3.24Å; P70-A73 PolarHBondContact O-N 3.43Å; P70-K74 PolarHBondContact O-N 2.9Å; P70-L151 HydrophobicContact CB-CD2 4.43Å; P70-L151 HydrophobicContact CG-CD2 4.21Å
71	L	81.1	Confident	69.1	Low	81 Å²	81	62.4 Å²	62.4	42%	0.424	34%	0.338	S	S	.	.	H	α-helix	trans	-54.4	-42	-177	-177.9	65.5	0	0	0	112.4	A73 K74 F75 F192 L193	L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 3.3Å; L71-K74 WeakPolarHBondContact O-CB 3.12Å; L71-K74 PolarHBondContact O-N 3.47Å; L71-F75 HydrophobicContact CD1-CD2 4.41Å; L71-F75 HydrophobicContact CD1-CE2 3.87Å; L71-F75 HydrophobicContact CD2-CE2 4.11Å; L71-F75 HydrophobicContact CG-CD2 4.08Å; L71-F75 HydrophobicContact CG-CE2 3.68Å; L71-F75 VanDerWaalsContact O-CD2 3.24Å; L71-F75 WeakPolarHBondContact O-CD2 3.29Å; L71-F75 PolarHBondContact O-N 3.43Å; L71-F75 VanDerWaalsContact O-N 3.12Å; L71-F192 HydrophobicContact CD1-CB 3.83Å; L71-F192 HydrophobicContact CD1-CG 4.49Å; L71-L193 HydrophobicContact CD1-CD2 4.24Å
72	L	83.9	Confident	71.5	Confident	65 Å²	65	57.4 Å²	57.4	34%	0.34	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-37.3	175.9	-63.1	178.2	0	0	0	112.3	P70 K74 F75 L76 F134 L142 L151	P70-L72 PolarHBondContact O-N 2.9Å; L72-K74 VanDerWaalsContact C-N 3.32Å; L72-K74 PolarHBondContact O-N 3.31Å; L72-F75 PolarHBondContact O-N 3.11Å; L72-L76 WeakPolarHBondContact O-CB 3.4Å; L72-L76 WeakPolarHBondContact O-CG 3.48Å; L72-L76 PolarHBondContact O-N 3.09Å; L72-F134 HydrophobicContact CD2-CE2 4.45Å; L72-F134 HydrophobicContact CD2-CZ 4.14Å; L72-L142 HydrophobicContact CD2-CD1 4.48Å; L72-L151 HydrophobicContact CB-CD1 3.63Å; L72-L151 HydrophobicContact CD1-CD1 4.38Å
73	A	86.3	Confident	74.2	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-36.7	175.3	0	0	0	0	0	111.7	L69 P70 L71 L76 L77 L151 L155	L69-A73 HydrophobicContact CB-CB 4.31Å; L69-A73 HydrophobicContact CD2-CB 4.11Å; P70-A73 HydrophobicContact CB-CB 4.26Å; P70-A73 WeakPolarHBondContact O-CA 3.13Å; P70-A73 VanDerWaalsContact O-CB 3.3Å; P70-A73 WeakPolarHBondContact O-CB 3.24Å; P70-A73 PolarHBondContact O-N 3.43Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 3.3Å; A73-L76 PolarHBondContact O-N 3.42Å; A73-L77 WeakPolarHBondContact O-CB 3.39Å; A73-L77 PolarHBondContact O-N 3.12Å; A73-L151 HydrophobicContact CB-CD2 4.32Å; A73-L155 HydrophobicContact CB-CD2 4.41Å
74	K	84.4	Confident	76.7	Confident	22 Å²	22	43.9 Å²	43.9	10%	0.096	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-44.5	173.7	-66.2	176.3	177.2	168.8	0	111.5	W67 L69 P70 L71 L72 L77 I78 I187 L193	W67-K74 WeakPolarHBondContact O-CE 3.22Å; W67-K74 PolarHBondContact O-NZ 3.34Å; L69-K74 HydrophobicContact CB-CG 4.04Å; L69-K74 WeakPolarHBondContact O-CE 3.32Å; P70-K74 PolarHBondContact O-N 2.9Å; L71-K74 WeakPolarHBondContact O-CB 3.12Å; L71-K74 PolarHBondContact O-N 3.47Å; L72-K74 VanDerWaalsContact C-N 3.32Å; L72-K74 PolarHBondContact O-N 3.31Å; K74-L77 PolarHBondContact O-N 3.12Å; K74-I78 WeakPolarHBondContact O-CG1 3.47Å; K74-I78 PolarHBondContact O-N 2.88Å; K74-I187 HydrophobicContact CB-CG2 4.14Å; K74-I187 HydrophobicContact CG-CG2 4.39Å; K74-L193 HydrophobicContact CB-CD1 3.88Å; K74-L193 HydrophobicContact CB-CD2 4.39Å; K74-L193 HydrophobicContact CD-CD1 4.31Å
75	F	84.1	Confident	78.6	Confident	22 Å²	22	40.1 Å²	40.1	10%	0.096	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-43	175	-76.2	-62.6	0	0	0	112.7	L71 L72 L77 I78 A79 F134 I137 V138 L193 A196	L71-F75 HydrophobicContact CD1-CD2 4.41Å; L71-F75 HydrophobicContact CD1-CE2 3.87Å; L71-F75 HydrophobicContact CD2-CE2 4.11Å; L71-F75 HydrophobicContact CG-CD2 4.08Å; L71-F75 HydrophobicContact CG-CE2 3.68Å; L71-F75 VanDerWaalsContact O-CD2 3.24Å; L71-F75 WeakPolarHBondContact O-CD2 3.29Å; L71-F75 PolarHBondContact O-N 3.43Å; L71-F75 VanDerWaalsContact O-N 3.12Å; L72-F75 PolarHBondContact O-N 3.11Å; F75-L77 VanDerWaalsContact C-N 3.29Å; F75-L77 PolarHBondContact O-N 3.19Å; F75-I78 PolarHBondContact O-N 2.91Å; F75-A79 WeakPolarHBondContact O-CB 3.47Å; F75-A79 PolarHBondContact O-N 3.16Å; F75-F134 HydrophobicContact CB-CD2 3.85Å; F75-F134 HydrophobicContact CB-CE2 3.74Å; F75-I137 HydrophobicContact CD1-CG2 3.53Å; F75-I137 HydrophobicContact CE1-CG2 3.96Å; F75-V138 HydrophobicContact CB-CG2 4.3Å; F75-V138 HydrophobicContact CD2-CG2 4.28Å; F75-V138 HydrophobicContact CG-CG2 4.18Å; F75-L193 HydrophobicContact CD1-CD2 3.51Å; F75-L193 HydrophobicContact CD2-CD2 4.16Å; F75-L193 HydrophobicContact CE1-CD2 3.26Å; F75-L193 HydrophobicContact CE2-CD2 3.94Å; F75-L193 HydrophobicContact CG-CD2 3.97Å; F75-L193 HydrophobicContact CZ-CD2 3.49Å; F75-L193 VanDerWaalsContact CZ-CD2 3.49Å; F75-A196 HydrophobicContact CD1-CB 4.41Å; F75-A196 HydrophobicContact CE1-CB 4.41Å
76	L	88.4	Confident	80.4	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-42	174.2	-77	168.7	0	0	0	111.2	L72 A73 I78 A79 A80 M130 L131 F134 I148 L151 V152 L155	L72-L76 WeakPolarHBondContact O-CB 3.4Å; L72-L76 WeakPolarHBondContact O-CG 3.48Å; L72-L76 PolarHBondContact O-N 3.09Å; A73-L76 PolarHBondContact O-N 3.42Å; L76-I78 PolarHBondContact O-N 3.28Å; L76-A79 WeakPolarHBondContact O-CB 3.42Å; L76-A79 PolarHBondContact O-N 2.86Å; L76-A80 WeakPolarHBondContact O-CB 3.26Å; L76-A80 PolarHBondContact O-N 3.04Å; L76-M130 HydrophobicContact CB-CE 3.72Å; L76-M130 HydrophobicContact CD2-CE 3.76Å; L76-M130 HydrophobicContact CG-CE 4.29Å; L76-M130 WeakPolarHBondContact O-CE 3.44Å; L76-L131 HydrophobicContact CD2-CD2 4.38Å; L76-F134 HydrophobicContact CD2-CB 4.05Å; L76-F134 HydrophobicContact CD2-CD1 4.18Å; L76-F134 HydrophobicContact CD2-CD2 3.65Å; L76-F134 HydrophobicContact CD2-CE2 4.08Å; L76-F134 HydrophobicContact CD2-CG 3.69Å; L76-F134 HydrophobicContact CG-CD2 3.77Å; L76-F134 HydrophobicContact CG-CE2 3.86Å; L76-F134 HydrophobicContact CG-CG 4.33Å; L76-I148 HydrophobicContact CD1-CG2 4.31Å; L76-I148 HydrophobicContact CD2-CG2 4.25Å; L76-L151 HydrophobicContact CD1-CB 3.73Å; L76-L151 HydrophobicContact CD1-CD1 4.23Å; L76-V152 HydrophobicContact CD1-CG2 4.19Å; L76-V152 HydrophobicContact CD2-CG2 4.31Å; L76-L155 HydrophobicContact CB-CD1 3.69Å; L76-L155 HydrophobicContact CD1-CD1 4.47Å
77	L	88.1	Confident	81.9	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-40.5	178.9	-174.5	49.7	0	0	0	112.2	A73 K74 F75 A80 Y81 L155 Y160 A179 I187	A73-L77 WeakPolarHBondContact O-CB 3.39Å; A73-L77 PolarHBondContact O-N 3.12Å; K74-L77 PolarHBondContact O-N 3.12Å; F75-L77 VanDerWaalsContact C-N 3.29Å; F75-L77 PolarHBondContact O-N 3.19Å; L77-A80 PolarHBondContact O-N 3.46Å; L77-Y81 WeakPolarHBondContact O-CB 3.49Å; L77-Y81 PolarHBondContact O-N 2.86Å; L77-L155 HydrophobicContact CB-CD2 4.4Å; L77-Y160 HydrophobicContact CD1-CG 4.39Å; L77-Y160 HydrophobicContact CD2-CD1 4.14Å; L77-Y160 HydrophobicContact CD2-CD2 4.38Å; L77-Y160 HydrophobicContact CD2-CG 4.03Å; L77-A179 HydrophobicContact CD1-CB 3.97Å; L77-I187 HydrophobicContact CD2-CD1 3.3Å; L77-I187 HydrophobicContact CG-CD1 3.93Å
78	I	84.6	Confident	83.3	Confident	7 Å²	7	30.8 Å²	30.8	4%	0.036	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-42.4	172.6	-64.6	166.8	0	0	0	110.8	K74 F75 L76 A80 Y81 I82 I137 I187 L193 A196	K74-I78 WeakPolarHBondContact O-CG1 3.47Å; K74-I78 PolarHBondContact O-N 2.88Å; F75-I78 PolarHBondContact O-N 2.91Å; L76-I78 PolarHBondContact O-N 3.28Å; I78-A80 PolarHBondContact O-N 2.9Å; I78-Y81 WeakPolarHBondContact O-CB 3.42Å; I78-Y81 PolarHBondContact O-N 3.46Å; I78-I82 HydrophobicContact CG2-CD1 3.78Å; I78-I82 HydrophobicContact CG2-CG1 4.47Å; I78-I82 WeakPolarHBondContact O-CG1 3.04Å; I78-I82 PolarHBondContact O-N 3.03Å; I78-I137 HydrophobicContact CG2-CD1 4.3Å; I78-I187 HydrophobicContact CD1-CG2 4.1Å; I78-I187 HydrophobicContact CG1-CG2 4.31Å; I78-L193 HydrophobicContact CD1-CB 4.06Å; I78-L193 HydrophobicContact CD1-CD1 3.79Å; I78-L193 HydrophobicContact CD1-CD2 4.13Å; I78-L193 HydrophobicContact CD1-CG 4.21Å; I78-A196 HydrophobicContact CD1-CB 3.94Å; I78-A196 HydrophobicContact CG2-CB 3.96Å
79	A	87.1	Confident	83.6	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-42.8	176.4	0	0	0	0	0	111.9	F75 L76 Y81 I82 A83 M130 I133 F134 I137	F75-A79 WeakPolarHBondContact O-CB 3.47Å; F75-A79 PolarHBondContact O-N 3.16Å; L76-A79 WeakPolarHBondContact O-CB 3.42Å; L76-A79 PolarHBondContact O-N 2.86Å; A79-Y81 VanDerWaalsContact C-N 3.33Å; A79-Y81 PolarHBondContact O-N 3.35Å; A79-I82 PolarHBondContact O-N 3.21Å; A79-A83 VanDerWaalsContact O-CB 3.29Å; A79-A83 WeakPolarHBondContact O-CB 3.46Å; A79-A83 PolarHBondContact O-N 3.22Å; A79-M130 HydrophobicContact CB-CG 4.31Å; A79-I133 HydrophobicContact CB-CB 4.23Å; A79-I133 HydrophobicContact CB-CG2 3.83Å; A79-F134 HydrophobicContact CB-CB 3.9Å; A79-I137 HydrophobicContact CB-CD1 4.18Å
80	A	90.2	Very high	83.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-39.9	175.2	0	0	0	0	0	112	L76 L77 I78 A83 S84 F125 M130 V161 C177	L76-A80 WeakPolarHBondContact O-CB 3.26Å; L76-A80 PolarHBondContact O-N 3.04Å; L77-A80 PolarHBondContact O-N 3.46Å; I78-A80 PolarHBondContact O-N 2.9Å; A80-A83 PolarHBondContact O-N 3.28Å; A80-S84 WeakPolarHBondContact O-CB 3.43Å; A80-S84 PolarHBondContact O-N 3.38Å; A80-S84 PolarHBondContact O-OG 3.19Å; A80-F125 HydrophobicContact CB-CZ 3.94Å; A80-M130 HydrophobicContact CB-CE 4.01Å; A80-M130 HydrophobicContact CB-SD 3.74Å; A80-V161 HydrophobicContact CB-CG2 4.1Å; A80-C177 HydrophobicContact CB-CB 4.18Å; A80-C177 WeakPolarHBondContact O-CB 3.38Å
81	Y	87.1	Confident	83.2	Confident	4 Å²	4	27 Å²	27	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-51.5	175.2	-171.8	-89.5	0	0	0	110.9	L77 I78 A79 A83 S84 Y85 H118 K184 Y200	L77-Y81 WeakPolarHBondContact O-CB 3.49Å; L77-Y81 PolarHBondContact O-N 2.86Å; I78-Y81 WeakPolarHBondContact O-CB 3.42Å; I78-Y81 PolarHBondContact O-N 3.46Å; A79-Y81 VanDerWaalsContact C-N 3.33Å; A79-Y81 PolarHBondContact O-N 3.35Å; Y81-A83 VanDerWaalsContact C-N 3.3Å; Y81-A83 PolarHBondContact O-N 3.01Å; Y81-S84 PolarHBondContact O-N 3.35Å; Y81-S84 VanDerWaalsContact O-N 3.15Å; Y81-Y85 AromaticContact CD1-CD2 3.97Å; Y81-Y85 HydrophobicContact CD1-CD2 3.97Å; Y81-Y85 HydrophobicContact CD1-CE2 4.49Å; Y81-Y85 AromaticContact CD2-CD2 3.8Å; Y81-Y85 HydrophobicContact CD2-CD2 3.8Å; Y81-Y85 AromaticContact CD2-CE2 3.51Å; Y81-Y85 HydrophobicContact CD2-CE2 3.51Å; Y81-Y85 AromaticContact CE1-CD2 3.81Å; Y81-Y85 HydrophobicContact CE1-CD2 3.81Å; Y81-Y85 HydrophobicContact CE1-CE2 4.23Å; Y81-Y85 AromaticContact CE2-CD2 3.65Å; Y81-Y85 HydrophobicContact CE2-CD2 3.65Å; Y81-Y85 AromaticContact CE2-CE2 3.2Å; Y81-Y85 HydrophobicContact CE2-CE2 3.2Å; Y81-Y85 AromaticContact CG-CD2 3.96Å; Y81-Y85 HydrophobicContact CG-CD2 3.96Å; Y81-Y85 HydrophobicContact CG-CE2 4.15Å; Y81-Y85 AromaticContact CZ-CD2 3.65Å; Y81-Y85 AromaticContact CZ-CE2 3.61Å; Y81-Y85 VanDerWaalsContact O-CD2 3.27Å; Y81-Y85 WeakPolarHBondContact O-CD2 3.41Å; Y81-Y85 PolarHBondContact O-N 3.21Å; Y81-Y85 VanDerWaalsContact O-N 3.1Å; Y81-H118 AromaticContact CZ-CE1 3.93Å; Y81-H118 PolarHBondContact OH-CE1 2.77Å; Y81-K184 HydrophobicContact CD1-CD 4.02Å; Y81-K184 HydrophobicContact CE1-CD 3.58Å; Y81-K184 HydrophobicContact CE1-CG 4.49Å; Y81-K184 HydrophobicContact CE2-CD 4.16Å; Y81-K184 HydrophobicContact CG-CD 4.48Å; Y81-Y200 HydrophobicContact CD1-CD2 4.32Å; Y81-Y200 AromaticContact CD1-CE2 3.72Å; Y81-Y200 HydrophobicContact CD1-CE2 3.72Å; Y81-Y200 HydrophobicContact CE1-CD2 4.41Å; Y81-Y200 AromaticContact CE1-CE2 3.48Å; Y81-Y200 HydrophobicContact CE1-CE2 3.48Å; Y81-Y200 VanDerWaalsContact CE1-CE2 3.48Å; Y81-Y200 AromaticContact CE1-CZ 3.61Å; Y81-Y200 WeakPolarHBondContact CE1-OH 3.08Å
82	I	83.6	Confident	82.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.4	-46.6	174.8	-71	160.2	0	0	0	110.8	I78 A79 S84 N86 F95 I133 I137 Y200	I78-I82 HydrophobicContact CG2-CD1 3.78Å; I78-I82 HydrophobicContact CG2-CG1 4.47Å; I78-I82 WeakPolarHBondContact O-CG1 3.04Å; I78-I82 PolarHBondContact O-N 3.03Å; A79-I82 PolarHBondContact O-N 3.21Å; I82-S84 VanDerWaalsContact C-N 3.31Å; I82-S84 PolarHBondContact O-N 2.92Å; I82-N86 WeakPolarHBondContact O-CB 3.4Å; I82-N86 PolarHBondContact O-N 3.4Å; I82-F95 HydrophobicContact CG2-CZ 4.17Å; I82-I133 HydrophobicContact CB-CG2 4.23Å; I82-I133 HydrophobicContact CD1-CG2 4.27Å; I82-I133 HydrophobicContact CG2-CD1 4.06Å; I82-I133 HydrophobicContact CG2-CG2 4.03Å; I82-I137 HydrophobicContact CD1-CD1 3.52Å; I82-Y200 HydrophobicContact CG1-CD2 3.73Å
83	A	87.7	Confident	81.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-34.9	-179.8	0	0	0	0	0	112.9	A79 A80 Y81 F125 R129 I133	A79-A83 VanDerWaalsContact O-CB 3.29Å; A79-A83 WeakPolarHBondContact O-CB 3.46Å; A79-A83 PolarHBondContact O-N 3.22Å; A80-A83 PolarHBondContact O-N 3.28Å; Y81-A83 VanDerWaalsContact C-N 3.3Å; Y81-A83 PolarHBondContact O-N 3.01Å; A83-F125 HydrophobicContact CB-CB 4.13Å; A83-F125 HydrophobicContact CB-CD1 3.81Å; A83-F125 HydrophobicContact CB-CD2 3.68Å; A83-F125 HydrophobicContact CB-CE1 4.14Å; A83-F125 HydrophobicContact CB-CE2 4.04Å; A83-F125 HydrophobicContact CB-CG 3.57Å; A83-F125 HydrophobicContact CB-CZ 4.25Å; A83-R129 PolarHBondContact O-NH1 3.07Å; A83-I133 HydrophobicContact CB-CD1 3.87Å
84	S	87.5	Confident	80.4	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.014	14%	0.142	C	C	.	.	H	α-helix	trans	-77.6	-38	-178.6	-58.5	0	0	0	0	113.3	A80 Y81 I82 S123 F125 C177	A80-S84 WeakPolarHBondContact O-CB 3.43Å; A80-S84 PolarHBondContact O-N 3.38Å; A80-S84 PolarHBondContact O-OG 3.19Å; Y81-S84 PolarHBondContact O-N 3.35Å; Y81-S84 VanDerWaalsContact O-N 3.15Å; I82-S84 VanDerWaalsContact C-N 3.31Å; I82-S84 PolarHBondContact O-N 2.92Å; S84-S123 WeakPolarHBondContact CA-O 3.48Å; S84-S123 VanDerWaalsContact O-CB 3.27Å; S84-S123 WeakPolarHBondContact O-CB 3.38Å; S84-S123 PolarHBondContact O-N 3.02Å; S84-F125 WeakPolarHBondContact OG-CD1 3.47Å; S84-F125 WeakPolarHBondContact OG-CE1 3.46Å; S84-C177 WeakPolarHBondContact OG-CB 3.39Å; S84-C177 PolarHBondContact OG-N 3.03Å
85	Y	82.4	Confident	79.4	Confident	29 Å²	29	31 Å²	31	11%	0.114	15%	0.145	C	C	.	.	H	α-helix	trans	-94.6	-20.6	-174.2	-70.7	-77.4	0	0	0	113.3	Y81 A117 H118 P122	Y81-Y85 AromaticContact CD1-CD2 3.97Å; Y81-Y85 HydrophobicContact CD1-CD2 3.97Å; Y81-Y85 HydrophobicContact CD1-CE2 4.49Å; Y81-Y85 AromaticContact CD2-CD2 3.8Å; Y81-Y85 HydrophobicContact CD2-CD2 3.8Å; Y81-Y85 AromaticContact CD2-CE2 3.51Å; Y81-Y85 HydrophobicContact CD2-CE2 3.51Å; Y81-Y85 AromaticContact CE1-CD2 3.81Å; Y81-Y85 HydrophobicContact CE1-CD2 3.81Å; Y81-Y85 HydrophobicContact CE1-CE2 4.23Å; Y81-Y85 AromaticContact CE2-CD2 3.65Å; Y81-Y85 HydrophobicContact CE2-CD2 3.65Å; Y81-Y85 AromaticContact CE2-CE2 3.2Å; Y81-Y85 HydrophobicContact CE2-CE2 3.2Å; Y81-Y85 AromaticContact CG-CD2 3.96Å; Y81-Y85 HydrophobicContact CG-CD2 3.96Å; Y81-Y85 HydrophobicContact CG-CE2 4.15Å; Y81-Y85 AromaticContact CZ-CD2 3.65Å; Y81-Y85 AromaticContact CZ-CE2 3.61Å; Y81-Y85 VanDerWaalsContact O-CD2 3.27Å; Y81-Y85 WeakPolarHBondContact O-CD2 3.41Å; Y81-Y85 PolarHBondContact O-N 3.21Å; Y81-Y85 VanDerWaalsContact O-N 3.1Å; Y85-A117 HydrophobicContact CD1-CB 4.37Å; Y85-A117 WeakPolarHBondContact O-CB 3.44Å; Y85-H118 AromaticContact CD1-CE1 3.33Å; Y85-H118 WeakPolarHBondContact CD1-CE1 3.41Å; Y85-H118 AromaticContact CD1-ND1 3.27Å; Y85-H118 VanDerWaalsContact CD1-ND1 3.27Å; Y85-H118 WeakPolarHBondContact CD1-ND1 3.42Å; Y85-H118 AromaticContact CE1-CE1 3.6Å; Y85-H118 AromaticContact CE1-ND1 3.15Å; Y85-H118 WeakPolarHBondContact CE1-ND1 3.48Å; Y85-H118 AromaticContact CG-CE1 3.6Å; Y85-H118 AromaticContact CZ-ND1 3.83Å; Y85-P122 HydrophobicContact CE2-CB 4.39Å
86	N	78.7	Confident	78.4	Confident	14 Å²	14	35.5 Å²	35.5	8%	0.075	17%	0.169	C	C	.	.	S	Bend	trans	-96.9	137.6	173.9	-63.4	-9	0	0	0	109.5	I82 R129	I82-N86 WeakPolarHBondContact O-CB 3.4Å; I82-N86 PolarHBondContact O-N 3.4Å; N86-R129 VanDerWaalsContact O-CZ 3.24Å; N86-R129 PolarHBondContact O-NH1 3.35Å; N86-R129 PolarHBondContact O-NH2 3.05Å
87	P	80.7	Confident	76.9	Confident	40 Å²	40	43 Å²	43	26%	0.26	20%	0.202	S	C	.	.			trans	-76.2	151.6	173.8	34.9	-37.8	0	0	0	110.6	K89 S90 W111 R129	P87-K89 PolarHBondContact O-N 2.9Å; P87-S90 PolarHBondContact O-N 2.71Å; P87-S90 PolarHBondContact O-OG 2.78Å; P87-W111 HydrophobicContact CB-CH2 4.43Å; P87-W111 HydrophobicContact CG-CH2 3.04Å; P87-W111 HydrophobicContact CG-CZ2 3.4Å; P87-W111 HydrophobicContact CG-CZ3 4.08Å; P87-R129 VanDerWaalsContact C-NH2 3.34Å; P87-R129 PolarHBondContact O-NH2 3.31Å
88	P	81.9	Confident	75.1	Confident	84 Å²	84	49.5 Å²	49.5	55%	0.545	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-25.7	-171.2	23.4	-34.8	0	0	0	114.1	S90 D91	P88-S90 PolarHBondContact O-N 3.35Å; P88-D91 WeakPolarHBondContact O-CB 3.43Å; P88-D91 PolarHBondContact O-N 2.73Å
89	K	74.3	Confident	73.3	Confident	157 Å²	157	52.5 Å²	52.5	68%	0.683	26%	0.264	S	S	*	.	H	α-helix	trans	-64.3	-26.7	177.6	-64	-172.7	178	-172.8	0	113	P87 D91	P87-K89 PolarHBondContact O-N 2.9Å; K89-D91 VanDerWaalsContact C-N 3.33Å
90	S	72.4	Confident	71.2	Confident	7 Å²	7	59.1 Å²	59.1	5%	0.049	30%	0.295	C	S	.	.	H	α-helix	trans	-77	-21.4	179	59.9	0	0	0	0	113.2	P87 P88 R92 R93 F94	P87-S90 PolarHBondContact O-N 2.71Å; P87-S90 PolarHBondContact O-OG 2.78Å; P88-S90 PolarHBondContact O-N 3.35Å; S90-R92 VanDerWaalsContact C-N 3.25Å; S90-R92 PolarHBondContact O-N 3.06Å; S90-R93 WeakPolarHBondContact O-CB 3.5Å; S90-R93 PolarHBondContact O-N 3.2Å; S90-F94 WeakPolarHBondContact O-CD2 3.33Å; S90-F94 PolarHBondContact O-N 3.46Å
91	D	73.3	Confident	69	Low	26 Å²	26	69.2 Å²	69.2	14%	0.139	34%	0.339	C	S	.	.	H	α-helix	trans	-55.7	-43	-177.7	-66.6	-1.7	0	0	0	111.3	P88 K89 R93 F94 F95 R129	P88-D91 WeakPolarHBondContact O-CB 3.43Å; P88-D91 PolarHBondContact O-N 2.73Å; K89-D91 VanDerWaalsContact C-N 3.33Å; D91-R93 PolarHBondContact O-N 2.89Å; D91-R93 VanDerWaalsContact O-N 3.16Å; D91-F94 PolarHBondContact O-N 2.65Å; D91-F95 HydrophobicContact CB-CD2 3.71Å; D91-F95 HydrophobicContact CB-CE2 4.24Å; D91-F95 VanDerWaalsContact O-CB 3.23Å; D91-F95 WeakPolarHBondContact O-CB 3.26Å; D91-F95 WeakPolarHBondContact O-CD2 3.41Å; D91-F95 PolarHBondContact O-N 2.79Å; D91-R129 IonicContact OD1-CZ 3.79Å; D91-R129 IonicContact OD1-NE 3.42Å; D91-R129 IonicContact OD1-NH2 2.77Å; D91-R129 PolarHBondContact OD1-NH2 3.3Å; D91-R129 WeakPolarHBondContact OD2-CD 3.42Å; D91-R129 WeakPolarHBondContact OD2-CG 3.37Å; D91-R129 IonicContact OD2-CZ 2.72Å; D91-R129 IonicContact OD2-NE 3.72Å; D91-R129 PolarHBondContact OD2-NE 3.06Å; D91-R129 IonicContact OD2-NH2 3.64Å; D91-R129 PolarHBondContact OD2-NH2 3.25Å
92	R	66.6	Low	67.1	Low	119 Å²	119	76.6 Å²	76.6	45%	0.449	37%	0.371	S	S	.	.	H	α-helix	trans	-59.8	-31.3	178.7	173.8	167.2	-175.2	163.1	9.7	113.9	S90 L96 E100	S90-R92 VanDerWaalsContact C-N 3.25Å; S90-R92 PolarHBondContact O-N 3.06Å; R92-L96 HydrophobicContact CB-CD1 3.86Å; R92-L96 HydrophobicContact CG-CD1 3.59Å; R92-E100 IonicContact CZ-OE2 2.78Å; R92-E100 IonicContact NH2-OE2 3.4Å; R92-E100 PolarHBondContact NH2-OE2 3.07Å
93	R	62.1	Low	65.4	Low	91 Å²	91	86.5 Å²	86.5	34%	0.343	42%	0.415	S	S	.	.	H	α-helix	trans	-75.3	-29.6	178.7	-176.7	-179.1	171.9	-160.6	-1.9	112.1	S90 D91 Q207	S90-R93 WeakPolarHBondContact O-CB 3.5Å; S90-R93 PolarHBondContact O-N 3.2Å; D91-R93 PolarHBondContact O-N 2.89Å; D91-R93 VanDerWaalsContact O-N 3.16Å; R93-Q207 VanDerWaalsContact NH2-N 3.13Å
94	F	63.1	Low	63.6	Low	12 Å²	12	90.8 Å²	90.8	5%	0.053	44%	0.437	C	S	.	.	H	α-helix	trans	-99.6	-32.8	-173.1	-64.3	-53.7	0	0	0	112.8	S90 D91 V202 C203 W213	S90-F94 WeakPolarHBondContact O-CD2 3.33Å; S90-F94 PolarHBondContact O-N 3.46Å; D91-F94 PolarHBondContact O-N 2.65Å; F94-V202 HydrophobicContact CD1-CG1 4.29Å; F94-V202 HydrophobicContact CE1-CG1 4.43Å; F94-C203 HydrophobicContact CD1-CB 4.49Å; F94-C203 HydrophobicContact CD2-CB 4.15Å; F94-C203 WeakPolarHBondContact CD2-SG 3.36Å; F94-C203 HydrophobicContact CE1-CB 4.3Å; F94-C203 HydrophobicContact CE2-CB 3.9Å; F94-C203 HydrophobicContact CG-CB 4.45Å; F94-C203 WeakPolarHBondContact CG-SG 3.42Å; F94-C203 VanDerWaalsContact CZ-CA 3.4Å; F94-C203 HydrophobicContact CZ-CB 4.02Å; F94-C203 WeakPolarHBondContact CZ-O 3.39Å; F94-W213 HydrophobicContact CB-CH2 4.16Å; F94-W213 HydrophobicContact CB-CZ2 3.61Å; F94-W213 AromaticContact CD1-CZ2 3.93Å; F94-W213 HydrophobicContact CD1-CZ2 3.93Å; F94-W213 HydrophobicContact CG-CZ2 4.21Å; F94-W213 VanDerWaalsContact O-CH2 3.22Å; F94-W213 WeakPolarHBondContact O-CH2 2.9Å; F94-W213 WeakPolarHBondContact O-CZ2 2.97Å
95	F	64.3	Low	61.7	Low	33 Å²	33	93.8 Å²	93.8	15%	0.145	46%	0.457	C	S	.	.	H	α-helix	trans	-113.5	-17.5	-163	-65.9	-42.1	0	0	0	114.8	I82 D91 I133 I136 V199 W213	I82-F95 HydrophobicContact CG2-CZ 4.17Å; D91-F95 HydrophobicContact CB-CD2 3.71Å; D91-F95 HydrophobicContact CB-CE2 4.24Å; D91-F95 VanDerWaalsContact O-CB 3.23Å; D91-F95 WeakPolarHBondContact O-CB 3.26Å; D91-F95 WeakPolarHBondContact O-CD2 3.41Å; D91-F95 PolarHBondContact O-N 2.79Å; F95-I133 HydrophobicContact CD2-CG1 4.09Å; F95-I133 HydrophobicContact CE1-CG2 4.49Å; F95-I133 HydrophobicContact CE2-CD1 4.03Å; F95-I133 HydrophobicContact CE2-CG1 3.55Å; F95-I133 HydrophobicContact CZ-CB 4.42Å; F95-I133 HydrophobicContact CZ-CD1 4.45Å; F95-I133 HydrophobicContact CZ-CG1 3.85Å; F95-I133 HydrophobicContact CZ-CG2 3.99Å; F95-I136 HydrophobicContact CB-CD1 3.29Å; F95-I136 HydrophobicContact CD1-CB 4.17Å; F95-I136 HydrophobicContact CD1-CD1 3.57Å; F95-I136 HydrophobicContact CD1-CG1 4.49Å; F95-I136 HydrophobicContact CD1-CG2 3.76Å; F95-I136 HydrophobicContact CE1-CG2 4.29Å; F95-I136 HydrophobicContact CG-CD1 3.56Å; F95-V199 HydrophobicContact CE1-CG1 3.95Å; F95-V199 HydrophobicContact CZ-CG1 4.44Å; F95-W213 HydrophobicContact CD1-CH2 4.21Å; F95-W213 HydrophobicContact CE1-CH2 4.09Å
96	L	62.8	Low	60	Low	117 Å²	117	103 Å²	103	61%	0.613	49%	0.492	S	S	*	.	S	Bend	trans	-90.9	119.5	177.7	-86	151.5	0	0	0	110.9	R92	R92-L96 HydrophobicContact CB-CD1 3.86Å; R92-L96 HydrophobicContact CG-CD1 3.59Å
97	K	56.4	Low	58.6	Low	157 Å²	157	112.6 Å²	112.6	68%	0.683	53%	0.527	S	S	*	.			trans	-63	147	170.2	-83.6	179.2	174.5	173.9	0	110.7	G99	K97-G99 VanDerWaalsContact C-N 3.35Å; K97-G99 PolarHBondContact O-N 3.4Å
98	Q	51.3	Low	57	Low	141 Å²	141	116.4 Å²	116.4	66%	0.659	54%	0.542	S	S	*	.	S	Bend	trans	-49.6	72.5	-174.9	-93.8	170.1	13.6	0	0	116.5	S210	Q98-S210 VanDerWaalsContact CG-CB 3.49Å; Q98-S210 WeakPolarHBondContact CG-OG 3.17Å; Q98-S210 VanDerWaalsContact NE2-CB 3.31Å; Q98-S210 PolarHBondContact NE2-OG 3.16Å; Q98-S210 PolarHBondContact OE1-OG 3.44Å
99	G	45.3	Very low	55.3	Low	69 Å²	69	116.6 Å²	116.6	71%	0.711	54%	0.538	S	S	*	.	S	Bend	trans	-103.9	-34.9	170.3	0	0	0	0	0	114.1	K97	K97-G99 VanDerWaalsContact C-N 3.35Å; K97-G99 PolarHBondContact O-N 3.4Å
100	E	44.7	Very low	53.9	Low	140 Å²	140	117.7 Å²	117.7	65%	0.654	54%	0.537	S	S	*	.			trans	-131.4	98.9	-169.8	-62.8	-173	158.7	0	0	111.5	R92 K102	R92-E100 IonicContact CZ-OE2 2.78Å; R92-E100 IonicContact NH2-OE2 3.4Å; R92-E100 PolarHBondContact NH2-OE2 3.07Å; E100-K102 PolarHBondContact O-N 3.5Å
101	K	43.3	Very low	52.8	Low	212 Å²	212	122.8 Å²	122.8	92%	0.922	56%	0.555	S	S	*	*			trans	-71	69.4	170.8	-65.8	177.6	-178.4	172.4	0	110.5	K103	K101-K103 PolarHBondContact O-N 3.22Å
102	K	46.4	Very low	51.6	Low	159 Å²	159	125 Å²	125	69%	0.691	59%	0.585	S	S	*	*			trans	-74.9	117.4	159.1	-86.1	-173.7	176.5	178.5	0	107.8	E100 I104	E100-K102 PolarHBondContact O-N 3.5Å; K102-I104 PolarHBondContact O-N 3.21Å
103	K	47.4	Very low	50.6	Low	208 Å²	208	125.8 Å²	125.8	90%	0.904	60%	0.598	S	S	*	*			trans	-57.3	107.3	170.9	-74.6	179.2	178	176.2	0	107.8	K101 S105	K101-K103 PolarHBondContact O-N 3.22Å; K103-S105 PolarHBondContact O-N 2.8Å
104	I	50.7	Low	50	Low	90 Å²	90	128.9 Å²	128.9	46%	0.462	61%	0.609	S	S	.	*			trans	-60.1	127.9	172.8	-62	177.6	0	0	0	107.1	K102 E108 L109	K102-I104 PolarHBondContact O-N 3.21Å; I104-E108 HydrophobicContact CG2-CB 3.46Å; I104-E108 VanDerWaalsContact CG2-CB 3.46Å; I104-E108 HydrophobicContact CG2-CG 4.41Å; I104-E108 WeakPolarHBondContact CG2-OE2 3.39Å; I104-L109 HydrophobicContact CB-CD1 4.36Å; I104-L109 HydrophobicContact CG2-CD1 3.77Å
105	S	47.2	Very low	49.5	Very low	65 Å²	65	137 Å²	137	46%	0.455	65%	0.645	S	S	.	*			trans	-63.5	144.1	179.6	170.6	0	0	0	0	109.9	K103 R107 E108 L109	K103-S105 PolarHBondContact O-N 2.8Å; S105-R107 PolarHBondContact O-N 3.08Å; S105-R107 WeakPolarHBondContact OG-CB 3.49Å; S105-R107 PolarHBondContact OG-N 3.35Å; S105-E108 PolarHBondContact N-OE2 3.41Å; S105-E108 WeakPolarHBondContact O-CB 3.46Å; S105-E108 PolarHBondContact O-N 3.13Å; S105-L109 PolarHBondContact O-N 2.8Å
106	R	47.8	Very low	49.1	Very low	223 Å²	223	138 Å²	138	84%	0.842	66%	0.656	S	S	*	*	H	α-helix	trans	-49.6	-25.8	170	-117	179.5	-72.6	174.7	-2.3	112.2	L109 R110	R106-L109 PolarHBondContact O-N 3.45Å; R106-R110 PolarHBondContact O-N 2.86Å
107	R	48.2	Very low	49.1	Very low	214 Å²	214	134.2 Å²	134.2	81%	0.808	64%	0.641	S	S	*	*	H	α-helix	trans	-70.4	-33.5	176.2	-138.9	176.4	-167.2	176.9	4.1	113.4	S105 L109 R110	S105-R107 PolarHBondContact O-N 3.08Å; S105-R107 WeakPolarHBondContact OG-CB 3.49Å; S105-R107 PolarHBondContact OG-N 3.35Å; R107-L109 VanDerWaalsContact C-N 3.34Å; R107-R110 PolarHBondContact O-N 3.4Å
108	E	48.1	Very low	49.7	Very low	121 Å²	121	130.8 Å²	130.8	57%	0.565	63%	0.628	S	S	*	*	H	α-helix	trans	-75.4	-23.9	173.7	-83.3	172.6	142.8	0	0	112.3	I104 S105 R110	I104-E108 HydrophobicContact CG2-CB 3.46Å; I104-E108 VanDerWaalsContact CG2-CB 3.46Å; I104-E108 HydrophobicContact CG2-CG 4.41Å; I104-E108 WeakPolarHBondContact CG2-OE2 3.39Å; S105-E108 PolarHBondContact N-OE2 3.41Å; S105-E108 WeakPolarHBondContact O-CB 3.46Å; S105-E108 PolarHBondContact O-N 3.13Å; E108-R110 VanDerWaalsContact C-N 3.3Å
109	L	46.4	Very low	50.5	Low	88 Å²	88	127.7 Å²	127.7	46%	0.461	62%	0.618	S	S	.	*	H	α-helix	trans	-72.4	-19.7	170.9	-88.5	84.8	0	0	0	113.4	I104 S105 R106 R107 W111	I104-L109 HydrophobicContact CB-CD1 4.36Å; I104-L109 HydrophobicContact CG2-CD1 3.77Å; S105-L109 PolarHBondContact O-N 2.8Å; R106-L109 PolarHBondContact O-N 3.45Å; R107-L109 VanDerWaalsContact C-N 3.34Å; L109-W111 PolarHBondContact O-N 3.29Å
110	R	44.9	Very low	51.7	Low	180 Å²	180	128.5 Å²	128.5	68%	0.679	62%	0.618	S	S	*	*			trans	-75.6	39.3	176.7	-61.1	-175.6	113.5	-147.8	7.4	112.5	R106 R107 E108 G112	R106-R110 PolarHBondContact O-N 2.86Å; R107-R110 PolarHBondContact O-N 3.4Å; E108-R110 VanDerWaalsContact C-N 3.3Å; R110-G112 PolarHBondContact O-N 3.29Å; R110-G112 VanDerWaalsContact O-N 3.07Å
111	W	49.2	Very low	53.2	Low	113 Å²	113	123 Å²	123	43%	0.428	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-58.9	-18.2	177.2	-167.6	-98.1	0	0	0	113.6	P87 L109 D113 R114	P87-W111 HydrophobicContact CB-CH2 4.43Å; P87-W111 HydrophobicContact CG-CH2 3.04Å; P87-W111 HydrophobicContact CG-CZ2 3.4Å; P87-W111 HydrophobicContact CG-CZ3 4.08Å; L109-W111 PolarHBondContact O-N 3.29Å; W111-D113 PolarHBondContact O-N 2.8Å; W111-R114 PolarHBondContact O-N 2.83Å
112	G	48.2	Very low	55.1	Low	73 Å²	73	114 Å²	114	75%	0.753	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-63.7	-13.7	-178.3	0	0	0	0	0	116.3	R110	R110-G112 PolarHBondContact O-N 3.29Å; R110-G112 VanDerWaalsContact O-N 3.07Å
113	D	44.5	Very low	57.1	Low	135 Å²	135	109.5 Å²	109.5	72%	0.722	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-92.8	0.6	-177.2	-80.9	-28.1	0	0	0	114.7	W111	W111-D113 PolarHBondContact O-N 2.8Å
114	R	50.7	Low	59.2	Low	156 Å²	156	100.5 Å²	100.5	59%	0.589	52%	0.516	S	S	*	.	S	Bend	trans	-95.5	121.5	176.9	-68.9	-173.6	175.7	169.8	-0.3	109.9	W111 S116	W111-R114 PolarHBondContact O-N 2.83Å; R114-S116 PolarHBondContact O-N 3.14Å
115	K	50.9	Low	61.2	Low	182 Å²	182	96.3 Å²	96.3	79%	0.791	49%	0.494	S	S	*	.			trans	-38.5	126.6	168.8	-64.2	179.7	-178.5	179.1	0	108.7	A117	K115-A117 PolarHBondContact O-N 3.28Å
116	S	56.9	Low	63.4	Low	55 Å²	55	95.4 Å²	95.4	39%	0.385	49%	0.487	S	S	.	.			trans	-45.7	132.9	-176.6	-49.3	0	0	0	0	109.9	R114 H118 V119	R114-S116 PolarHBondContact O-N 3.14Å; S116-H118 PolarHBondContact O-N 2.89Å; S116-V119 WeakPolarHBondContact O-CA 3.48Å; S116-V119 VanDerWaalsContact O-CB 3.27Å; S116-V119 WeakPolarHBondContact O-CB 2.91Å; S116-V119 PolarHBondContact O-N 3.15Å
117	A	63.1	Low	65.5	Low	37 Å²	37	85.4 Å²	85.4	31%	0.306	45%	0.45	S	S	.	.	H	α-helix	trans	-55.1	-28.8	-175.1	0	0	0	0	0	113.1	Y85 K115 V119 A120 G121	Y85-A117 HydrophobicContact CD1-CB 4.37Å; Y85-A117 WeakPolarHBondContact O-CB 3.44Å; K115-A117 PolarHBondContact O-N 3.28Å; A117-V119 PolarHBondContact O-N 3.42Å; A117-A120 PolarHBondContact O-N 2.99Å; A117-G121 PolarHBondContact O-N 3.5Å; A117-G121 VanDerWaalsContact O-N 3.14Å
118	H	67.9	Low	67.6	Low	85 Å²	85	80.3 Å²	80.3	39%	0.394	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-24.1	172.8	-65.2	-64.4	0	0	0	114.5	Y81 Y85 S116 Y200	Y81-H118 AromaticContact CZ-CE1 3.93Å; Y81-H118 PolarHBondContact OH-CE1 2.77Å; Y85-H118 AromaticContact CD1-CE1 3.33Å; Y85-H118 WeakPolarHBondContact CD1-CE1 3.41Å; Y85-H118 AromaticContact CD1-ND1 3.27Å; Y85-H118 VanDerWaalsContact CD1-ND1 3.27Å; Y85-H118 WeakPolarHBondContact CD1-ND1 3.42Å; Y85-H118 AromaticContact CE1-CE1 3.6Å; Y85-H118 AromaticContact CE1-ND1 3.15Å; Y85-H118 WeakPolarHBondContact CE1-ND1 3.48Å; Y85-H118 AromaticContact CG-CE1 3.6Å; Y85-H118 AromaticContact CZ-ND1 3.83Å; S116-H118 PolarHBondContact O-N 2.89Å; H118-Y200 PolarHBondContact NE2-OH 2.76Å
119	V	69.3	Low	69.7	Low	76 Å²	76	75.5 Å²	75.5	46%	0.461	41%	0.412	S	S	.	.	H	α-helix	trans	-78.9	-38.9	173.5	-177.8	0	0	0	0	111.5	V3 S116 A117 G121	V3-V119 HydrophobicContact CB-CG2 4.16Å; V3-V119 HydrophobicContact CG1-CG2 3.45Å; V3-V119 VanDerWaalsContact CG1-CG2 3.45Å; V3-V119 HydrophobicContact CG2-CG2 4.11Å; S116-V119 WeakPolarHBondContact O-CA 3.48Å; S116-V119 VanDerWaalsContact O-CB 3.27Å; S116-V119 WeakPolarHBondContact O-CB 2.91Å; S116-V119 PolarHBondContact O-N 3.15Å; A117-V119 PolarHBondContact O-N 3.42Å; V119-G121 PolarHBondContact O-N 3.48Å
120	A	70.6	Confident	71.8	Confident	86 Å²	86	71.3 Å²	71.3	71%	0.711	39%	0.39	S	S	*	.	H	α-helix	trans	-73.9	-17.4	179.5	0	0	0	0	0	112.4	A117	A117-A120 PolarHBondContact O-N 2.99Å
121	G	75.5	Confident	74	Confident	25 Å²	25	63.2 Å²	63.2	26%	0.258	36%	0.36	S	S	.	.			trans	82.5	172.6	-171.5	0	0	0	0	0	112.2	A117 V119 S123	A117-G121 PolarHBondContact O-N 3.5Å; A117-G121 VanDerWaalsContact O-N 3.14Å; V119-G121 PolarHBondContact O-N 3.48Å; G121-S123 PolarHBondContact O-N 3.24Å
122	P	84	Confident	75.8	Confident	24 Å²	24	60.2 Å²	60.2	16%	0.156	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-67.1	124.5	-175.8	25.5	-32.7	0	0	0	111	Y85 R176 C177	Y85-P122 HydrophobicContact CE2-CB 4.39Å; P122-R176 HydrophobicContact CB-CG 3.86Å; P122-R176 HydrophobicContact CG-CG 3.95Å; P122-R176 WeakPolarHBondContact O-CD 3.22Å; P122-R176 PolarHBondContact O-NE 2.96Å; P122-R176 PolarHBondContact O-NH1 3.42Å; P122-C177 WeakPolarHBondContact CB-O 3.26Å; P122-C177 VanDerWaalsContact CG-O 3.28Å; P122-C177 WeakPolarHBondContact CG-O 3.42Å
123	S	87.4	Confident	77.5	Confident	64 Å²	64	56.8 Å²	56.8	45%	0.448	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-76.5	147.5	176.5	-177.5	0	0	0	0	111.2	S84 G121	S84-S123 WeakPolarHBondContact CA-O 3.48Å; S84-S123 VanDerWaalsContact O-CB 3.27Å; S84-S123 WeakPolarHBondContact O-CB 3.38Å; S84-S123 PolarHBondContact O-N 3.02Å; G121-S123 PolarHBondContact O-N 3.24Å
124	A	92	Very high	79.5	Confident	19 Å²	19	50.4 Å²	50.4	16%	0.157	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-70.2	139.3	167.9	0	0	0	0	0	110.4	T164 R174 L175	A124-T164 HydrophobicContact CB-CG2 4.22Å; A124-R174 PolarHBondContact O-NH2 3.48Å; A124-L175 CarbonylContact C-O 3.59Å; A124-L175 VanDerWaalsContact CA-O 3.28Å; A124-L175 WeakPolarHBondContact CA-O 3.28Å
125	F	92.5	Very high	81	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.1	-179.1	61.9	-91.2	0	0	0	110.5	A80 A83 S84 M130 R174 L175	A80-F125 HydrophobicContact CB-CZ 3.94Å; A83-F125 HydrophobicContact CB-CB 4.13Å; A83-F125 HydrophobicContact CB-CD1 3.81Å; A83-F125 HydrophobicContact CB-CD2 3.68Å; A83-F125 HydrophobicContact CB-CE1 4.14Å; A83-F125 HydrophobicContact CB-CE2 4.04Å; A83-F125 HydrophobicContact CB-CG 3.57Å; A83-F125 HydrophobicContact CB-CZ 4.25Å; S84-F125 WeakPolarHBondContact OG-CD1 3.47Å; S84-F125 WeakPolarHBondContact OG-CE1 3.46Å; F125-M130 HydrophobicContact CD2-CB 4Å; F125-M130 HydrophobicContact CE2-CB 3.44Å; F125-M130 VanDerWaalsContact CE2-CB 3.44Å; F125-M130 HydrophobicContact CE2-CG 4.19Å; F125-M130 HydrophobicContact CE2-SD 3.81Å; F125-M130 HydrophobicContact CZ-CB 4.35Å; F125-M130 HydrophobicContact CZ-SD 4Å; F125-R174 CarbonylContact O-C 3.59Å; F125-R174 WeakPolarHBondContact O-CA 3.37Å; F125-L175 WeakPolarHBondContact CD1-O 3.27Å; F125-L175 HydrophobicContact CD2-CB 4.39Å; F125-L175 HydrophobicContact CE1-CB 4.21Å; F125-L175 WeakPolarHBondContact CE1-O 3.27Å; F125-L175 HydrophobicContact CE2-CB 3.69Å; F125-L175 HydrophobicContact CE2-CD1 4.4Å; F125-L175 HydrophobicContact CZ-CB 3.6Å; F125-L175 PolarHBondContact N-O 2.83Å; F125-L175 PolarHBondContact O-N 2.81Å
126	P	93.3	Very high	82.2	Confident	47 Å²	47	39 Å²	39	31%	0.305	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	145	176	33.4	-35.4	0	0	0	110.8	E128 R129	P126-E128 WeakPolarHBondContact CB-OE2 3.49Å; P126-E128 PolarHBondContact O-N 3.38Å; P126-R129 HydrophobicContact CG-CB 3.89Å; P126-R129 VanDerWaalsContact O-CB 3.32Å; P126-R129 WeakPolarHBondContact O-CB 3.41Å; P126-R129 PolarHBondContact O-N 2.9Å
127	L	92.5	Very high	83.1	Confident	12 Å²	12	36.7 Å²	36.7	6%	0.063	23%	0.231	C	C	.	.	H	α-helix	trans	-53.7	-39.4	-176.3	173.3	58.1	0	0	0	112.5	R129 M130 L131 F149 V152 I173 L175	L127-R129 PolarHBondContact O-N 2.89Å; L127-M130 WeakPolarHBondContact O-CB 3.27Å; L127-M130 PolarHBondContact O-N 3.39Å; L127-L131 HydrophobicContact CD1-CD1 4.31Å; L127-L131 HydrophobicContact CD1-CG 4.18Å; L127-L131 HydrophobicContact CG-CD1 4.07Å; L127-L131 HydrophobicContact CG-CG 4.4Å; L127-L131 PolarHBondContact O-N 3.48Å; L127-F149 HydrophobicContact CD2-CD1 4.18Å; L127-F149 HydrophobicContact CD2-CE1 3.88Å; L127-V152 HydrophobicContact CD1-CG1 4.17Å; L127-V152 HydrophobicContact CD1-CG2 4.42Å; L127-I173 HydrophobicContact CB-CB 4.27Å; L127-I173 HydrophobicContact CB-CG2 4.39Å; L127-I173 HydrophobicContact CD2-CB 4.46Å; L127-I173 HydrophobicContact CD2-CD1 4.23Å; L127-I173 PolarHBondContact N-O 3.32Å; L127-L175 HydrophobicContact CB-CD1 4.45Å; L127-L175 HydrophobicContact CD1-CD1 3.75Å
128	E	91.4	Very high	83.6	Confident	108 Å²	108	36.2 Å²	36.2	51%	0.505	22%	0.224	S	C	.	.	H	α-helix	trans	-57.8	-36.4	180	-58.2	74.9	-163.1	0	0	111.6	P126 L131 A132	P126-E128 WeakPolarHBondContact CB-OE2 3.49Å; P126-E128 PolarHBondContact O-N 3.38Å; E128-L131 PolarHBondContact O-N 3.49Å; E128-A132 WeakPolarHBondContact O-CB 3.41Å; E128-A132 PolarHBondContact O-N 3.21Å
129	R	92.1	Very high	83.6	Confident	19 Å²	19	34.5 Å²	34.5	7%	0.072	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-42.1	177.1	-177.7	-177.6	-177.1	-151	-8.2	111.4	A83 N86 P87 D91 P126 L127 A132 I133	A83-R129 PolarHBondContact O-NH1 3.07Å; N86-R129 VanDerWaalsContact O-CZ 3.24Å; N86-R129 PolarHBondContact O-NH1 3.35Å; N86-R129 PolarHBondContact O-NH2 3.05Å; P87-R129 VanDerWaalsContact C-NH2 3.34Å; P87-R129 PolarHBondContact O-NH2 3.31Å; D91-R129 IonicContact OD1-CZ 3.79Å; D91-R129 IonicContact OD1-NE 3.42Å; D91-R129 IonicContact OD1-NH2 2.77Å; D91-R129 PolarHBondContact OD1-NH2 3.3Å; D91-R129 WeakPolarHBondContact OD2-CD 3.42Å; D91-R129 WeakPolarHBondContact OD2-CG 3.37Å; D91-R129 IonicContact OD2-CZ 2.72Å; D91-R129 IonicContact OD2-NE 3.72Å; D91-R129 PolarHBondContact OD2-NE 3.06Å; D91-R129 IonicContact OD2-NH2 3.64Å; D91-R129 PolarHBondContact OD2-NH2 3.25Å; P126-R129 HydrophobicContact CG-CB 3.89Å; P126-R129 VanDerWaalsContact O-CB 3.32Å; P126-R129 WeakPolarHBondContact O-CB 3.41Å; P126-R129 PolarHBondContact O-N 2.9Å; L127-R129 PolarHBondContact O-N 2.89Å; R129-A132 PolarHBondContact O-N 2.7Å; R129-I133 HydrophobicContact CG-CD1 3.97Å; R129-I133 WeakPolarHBondContact O-CD1 3.13Å; R129-I133 VanDerWaalsContact O-CG1 3.23Å; R129-I133 WeakPolarHBondContact O-CG1 3.28Å; R129-I133 PolarHBondContact O-N 3.05Å
130	M	91.2	Very high	83.5	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-41.9	177.5	164.6	177.5	171.9	0	0	111.4	L76 A79 A80 F125 L127 I133 F134 V152 L155 L175	L76-M130 HydrophobicContact CB-CE 3.72Å; L76-M130 HydrophobicContact CD2-CE 3.76Å; L76-M130 HydrophobicContact CG-CE 4.29Å; L76-M130 WeakPolarHBondContact O-CE 3.44Å; A79-M130 HydrophobicContact CB-CG 4.31Å; A80-M130 HydrophobicContact CB-CE 4.01Å; A80-M130 HydrophobicContact CB-SD 3.74Å; F125-M130 HydrophobicContact CD2-CB 4Å; F125-M130 HydrophobicContact CE2-CB 3.44Å; F125-M130 VanDerWaalsContact CE2-CB 3.44Å; F125-M130 HydrophobicContact CE2-CG 4.19Å; F125-M130 HydrophobicContact CE2-SD 3.81Å; F125-M130 HydrophobicContact CZ-CB 4.35Å; F125-M130 HydrophobicContact CZ-SD 4Å; L127-M130 WeakPolarHBondContact O-CB 3.27Å; L127-M130 PolarHBondContact O-N 3.39Å; M130-I133 PolarHBondContact O-N 2.96Å; M130-F134 VanDerWaalsContact O-CB 3.23Å; M130-F134 WeakPolarHBondContact O-CB 3.08Å; M130-F134 PolarHBondContact O-N 2.91Å; M130-V152 HydrophobicContact CE-CG2 4.04Å; M130-L155 HydrophobicContact CE-CD1 4.43Å; M130-L175 HydrophobicContact SD-CD1 4.18Å
131	L	90.5	Very high	83.4	Confident	11 Å²	11	40.6 Å²	40.6	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-42.1	176.1	-64.8	174.7	0	0	0	111.7	L76 L127 E128 I133 F134 L135 I144 I148 F149	L76-L131 HydrophobicContact CD2-CD2 4.38Å; L127-L131 HydrophobicContact CD1-CD1 4.31Å; L127-L131 HydrophobicContact CD1-CG 4.18Å; L127-L131 HydrophobicContact CG-CD1 4.07Å; L127-L131 HydrophobicContact CG-CG 4.4Å; L127-L131 PolarHBondContact O-N 3.48Å; E128-L131 PolarHBondContact O-N 3.49Å; L131-I133 PolarHBondContact O-N 3.27Å; L131-F134 WeakPolarHBondContact O-CB 3.16Å; L131-F134 PolarHBondContact O-N 3.02Å; L131-L135 WeakPolarHBondContact O-CG 2.95Å; L131-L135 PolarHBondContact O-N 3.16Å; L131-I144 HydrophobicContact CB-CD1 4.17Å; L131-I144 HydrophobicContact CD1-CD1 4.25Å; L131-I144 HydrophobicContact CD1-CG2 4.27Å; L131-I148 HydrophobicContact CD2-CG2 3.79Å; L131-F149 HydrophobicContact CD1-CE1 4.01Å; L131-F149 HydrophobicContact CD1-CZ 4.13Å
132	A	86.7	Confident	83.2	Confident	49 Å²	49	42.3 Å²	42.3	41%	0.405	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-45.7	175.8	0	0	0	0	0	112.2	E128 R129 F134 L135 I136	E128-A132 WeakPolarHBondContact O-CB 3.41Å; E128-A132 PolarHBondContact O-N 3.21Å; R129-A132 PolarHBondContact O-N 2.7Å; A132-F134 VanDerWaalsContact C-N 3.34Å; A132-L135 PolarHBondContact O-N 3.29Å; A132-I136 WeakPolarHBondContact O-CD1 3.14Å; A132-I136 VanDerWaalsContact O-CG1 3.31Å; A132-I136 WeakPolarHBondContact O-CG1 3.18Å; A132-I136 PolarHBondContact O-N 3.23Å
133	I	84.9	Confident	83.1	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-42.6	176.3	-67.6	167.4	0	0	0	110.6	A79 I82 A83 F95 R129 M130 L131 I136 I137	A79-I133 HydrophobicContact CB-CB 4.23Å; A79-I133 HydrophobicContact CB-CG2 3.83Å; I82-I133 HydrophobicContact CB-CG2 4.23Å; I82-I133 HydrophobicContact CD1-CG2 4.27Å; I82-I133 HydrophobicContact CG2-CD1 4.06Å; I82-I133 HydrophobicContact CG2-CG2 4.03Å; A83-I133 HydrophobicContact CB-CD1 3.87Å; F95-I133 HydrophobicContact CD2-CG1 4.09Å; F95-I133 HydrophobicContact CE1-CG2 4.49Å; F95-I133 HydrophobicContact CE2-CD1 4.03Å; F95-I133 HydrophobicContact CE2-CG1 3.55Å; F95-I133 HydrophobicContact CZ-CB 4.42Å; F95-I133 HydrophobicContact CZ-CD1 4.45Å; F95-I133 HydrophobicContact CZ-CG1 3.85Å; F95-I133 HydrophobicContact CZ-CG2 3.99Å; R129-I133 HydrophobicContact CG-CD1 3.97Å; R129-I133 WeakPolarHBondContact O-CD1 3.13Å; R129-I133 VanDerWaalsContact O-CG1 3.23Å; R129-I133 WeakPolarHBondContact O-CG1 3.28Å; R129-I133 PolarHBondContact O-N 3.05Å; M130-I133 PolarHBondContact O-N 2.96Å; L131-I133 PolarHBondContact O-N 3.27Å; I133-I136 PolarHBondContact O-N 3.23Å; I133-I137 HydrophobicContact CG2-CD1 3.56Å; I133-I137 HydrophobicContact CG2-CG1 4.25Å; I133-I137 VanDerWaalsContact O-CG1 3.3Å; I133-I137 WeakPolarHBondContact O-CG1 2.78Å; I133-I137 PolarHBondContact O-N 3.41Å
134	F	85.7	Confident	83	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-49.8	177.7	164.2	-100.7	0	0	0	112.1	L72 F75 L76 A79 M130 L131 A132 I136 I137 V138 L142 I148	L72-F134 HydrophobicContact CD2-CE2 4.45Å; L72-F134 HydrophobicContact CD2-CZ 4.14Å; F75-F134 HydrophobicContact CB-CD2 3.85Å; F75-F134 HydrophobicContact CB-CE2 3.74Å; L76-F134 HydrophobicContact CD2-CB 4.05Å; L76-F134 HydrophobicContact CD2-CD1 4.18Å; L76-F134 HydrophobicContact CD2-CD2 3.65Å; L76-F134 HydrophobicContact CD2-CE2 4.08Å; L76-F134 HydrophobicContact CD2-CG 3.69Å; L76-F134 HydrophobicContact CG-CD2 3.77Å; L76-F134 HydrophobicContact CG-CE2 3.86Å; L76-F134 HydrophobicContact CG-CG 4.33Å; A79-F134 HydrophobicContact CB-CB 3.9Å; M130-F134 VanDerWaalsContact O-CB 3.23Å; M130-F134 WeakPolarHBondContact O-CB 3.08Å; M130-F134 PolarHBondContact O-N 2.91Å; L131-F134 WeakPolarHBondContact O-CB 3.16Å; L131-F134 PolarHBondContact O-N 3.02Å; A132-F134 VanDerWaalsContact C-N 3.34Å; F134-I136 PolarHBondContact O-N 3.01Å; F134-I137 PolarHBondContact O-N 2.87Å; F134-V138 HydrophobicContact CD2-CG2 3.96Å; F134-V138 HydrophobicContact CE1-CG2 4.41Å; F134-V138 HydrophobicContact CE2-CG2 3.6Å; F134-V138 HydrophobicContact CZ-CG2 3.86Å; F134-V138 WeakPolarHBondContact O-CG2 3.01Å; F134-V138 PolarHBondContact O-N 3.43Å; F134-L142 HydrophobicContact CE1-CD1 4.25Å; F134-L142 HydrophobicContact CZ-CD1 4.16Å; F134-I148 HydrophobicContact CE1-CD1 4.06Å
135	L	81.8	Confident	82.7	Confident	52 Å²	52	51.4 Å²	51.4	27%	0.272	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-38.1	178.3	-71.1	176.1	0	0	0	112	L131 A132 G139 L142 I144	L131-L135 WeakPolarHBondContact O-CG 2.95Å; L131-L135 PolarHBondContact O-N 3.16Å; A132-L135 PolarHBondContact O-N 3.29Å; L135-G139 PolarHBondContact O-N 3.45Å; L135-G139 VanDerWaalsContact O-N 3.13Å; L135-L142 HydrophobicContact CD2-CB 3.88Å; L135-L142 WeakPolarHBondContact CD2-O 3.31Å; L135-I144 HydrophobicContact CD1-CD1 4.12Å; L135-I144 HydrophobicContact CD1-CG1 4.3Å; L135-I144 HydrophobicContact CD2-CG1 4.48Å
136	I	77.2	Confident	82.5	Confident	48 Å²	48	57.4 Å²	57.4	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-72.5	-41	179.9	-63.9	167.8	0	0	0	111.7	F95 A132 I133 F134 V138 G139 W213	F95-I136 HydrophobicContact CB-CD1 3.29Å; F95-I136 HydrophobicContact CD1-CB 4.17Å; F95-I136 HydrophobicContact CD1-CD1 3.57Å; F95-I136 HydrophobicContact CD1-CG1 4.49Å; F95-I136 HydrophobicContact CD1-CG2 3.76Å; F95-I136 HydrophobicContact CE1-CG2 4.29Å; F95-I136 HydrophobicContact CG-CD1 3.56Å; A132-I136 WeakPolarHBondContact O-CD1 3.14Å; A132-I136 VanDerWaalsContact O-CG1 3.31Å; A132-I136 WeakPolarHBondContact O-CG1 3.18Å; A132-I136 PolarHBondContact O-N 3.23Å; I133-I136 PolarHBondContact O-N 3.23Å; F134-I136 PolarHBondContact O-N 3.01Å; I136-V138 VanDerWaalsContact C-N 3.32Å; I136-G139 PolarHBondContact O-N 3.4Å; I136-W213 HydrophobicContact CG2-CZ3 4.45Å
137	I	75.1	Confident	82.2	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-64	-40.3	177.2	-72.2	169.4	0	0	0	111.1	F75 I78 A79 I82 I133 F134 G139 A196 V199	F75-I137 HydrophobicContact CD1-CG2 3.53Å; F75-I137 HydrophobicContact CE1-CG2 3.96Å; I78-I137 HydrophobicContact CG2-CD1 4.3Å; A79-I137 HydrophobicContact CB-CD1 4.18Å; I82-I137 HydrophobicContact CD1-CD1 3.52Å; I133-I137 HydrophobicContact CG2-CD1 3.56Å; I133-I137 HydrophobicContact CG2-CG1 4.25Å; I133-I137 VanDerWaalsContact O-CG1 3.3Å; I133-I137 WeakPolarHBondContact O-CG1 2.78Å; I133-I137 PolarHBondContact O-N 3.41Å; F134-I137 PolarHBondContact O-N 2.87Å; I137-G139 VanDerWaalsContact C-N 3.29Å; I137-G139 PolarHBondContact O-N 3.33Å; I137-A196 HydrophobicContact CG2-CB 3.33Å; I137-V199 HydrophobicContact CG1-CG1 4.45Å
138	V	74.9	Confident	82.1	Confident	27 Å²	27	62 Å²	62	16%	0.164	34%	0.341	C	S	.	.	H	α-helix	trans	-69.4	-31.2	178.7	177.7	0	0	0	0	111.2	F75 F134 I136 K140 L142	F75-V138 HydrophobicContact CB-CG2 4.3Å; F75-V138 HydrophobicContact CD2-CG2 4.28Å; F75-V138 HydrophobicContact CG-CG2 4.18Å; F134-V138 HydrophobicContact CD2-CG2 3.96Å; F134-V138 HydrophobicContact CE1-CG2 4.41Å; F134-V138 HydrophobicContact CE2-CG2 3.6Å; F134-V138 HydrophobicContact CZ-CG2 3.86Å; F134-V138 WeakPolarHBondContact O-CG2 3.01Å; F134-V138 PolarHBondContact O-N 3.43Å; I136-V138 VanDerWaalsContact C-N 3.32Å; V138-K140 HydrophobicContact CG1-CB 4.25Å; V138-K140 PolarHBondContact O-N 3.07Å; V138-L142 HydrophobicContact CB-CD1 4.1Å; V138-L142 HydrophobicContact CG1-CD1 3.48Å; V138-L142 VanDerWaalsContact CG1-CD1 3.48Å; V138-L142 HydrophobicContact CG1-CG 4.09Å; V138-L142 HydrophobicContact CG2-CD1 4.21Å
139	G	67.4	Low	82	Confident	50 Å²	50	61.5 Å²	61.5	52%	0.515	34%	0.337	S	S	.	.			trans	69.9	-0.6	172.4	0	0	0	0	0	115.1	L135 I136 I137	L135-G139 PolarHBondContact O-N 3.45Å; L135-G139 VanDerWaalsContact O-N 3.13Å; I136-G139 PolarHBondContact O-N 3.4Å; I137-G139 VanDerWaalsContact C-N 3.29Å; I137-G139 PolarHBondContact O-N 3.33Å
140	K	67.4	Low	82	Confident	150 Å²	150	62.4 Å²	62.4	65%	0.652	35%	0.353	S	S	*	.	S	Bend	trans	-106.2	149.5	175.5	-63	-179.6	-178.4	179.8	0	109.8	V138 L142	V138-K140 HydrophobicContact CG1-CB 4.25Å; V138-K140 PolarHBondContact O-N 3.07Å; K140-L142 PolarHBondContact O-N 3.45Å
141	P	68.5	Low	82	Confident	139 Å²	139	63.9 Å²	63.9	90%	0.903	36%	0.36	S	S	*	.			trans	-63.5	103.3	168.7	28.1	-32.5	0	0	0	108
142	L	71.9	Confident	82	Confident	62 Å²	62	64 Å²	64	33%	0.325	36%	0.362	S	S	.	.			trans	-113.2	133	173.2	-71.6	-173.4	0	0	0	108.6	L72 F134 L135 V138 K140	L72-L142 HydrophobicContact CD2-CD1 4.48Å; F134-L142 HydrophobicContact CE1-CD1 4.25Å; F134-L142 HydrophobicContact CZ-CD1 4.16Å; L135-L142 HydrophobicContact CD2-CB 3.88Å; L135-L142 WeakPolarHBondContact CD2-O 3.31Å; V138-L142 HydrophobicContact CB-CD1 4.1Å; V138-L142 HydrophobicContact CG1-CD1 3.48Å; V138-L142 VanDerWaalsContact CG1-CD1 3.48Å; V138-L142 HydrophobicContact CG1-CG 4.09Å; V138-L142 HydrophobicContact CG2-CD1 4.21Å; K140-L142 PolarHBondContact O-N 3.45Å
143	E	81.1	Confident	82.2	Confident	168 Å²	168	63.3 Å²	63.3	79%	0.785	36%	0.359	S	S	*	.			trans	-80.7	139.4	168.1	-65.1	-177	174.9	0	0	109.2	T145	E143-T145 PolarHBondContact O-N 3.01Å
144	I	84.1	Confident	82.4	Confident	73 Å²	73	66.6 Å²	66.6	37%	0.374	38%	0.379	S	S	.	.			trans	-77.6	93.7	177	-56.8	172.6	0	0	0	107.7	L131 L135 I148 F149	L131-I144 HydrophobicContact CB-CD1 4.17Å; L131-I144 HydrophobicContact CD1-CD1 4.25Å; L131-I144 HydrophobicContact CD1-CG2 4.27Å; L135-I144 HydrophobicContact CD1-CD1 4.12Å; L135-I144 HydrophobicContact CD1-CG1 4.3Å; L135-I144 HydrophobicContact CD2-CG1 4.48Å; I144-I148 HydrophobicContact CG2-CG2 4.46Å; I144-F149 HydrophobicContact CG2-CD2 4.27Å; I144-F149 HydrophobicContact CG2-CE2 3.52Å; I144-F149 HydrophobicContact CG2-CZ 3.82Å
145	T	87.1	Confident	82.6	Confident	57 Å²	57	66.7 Å²	66.7	35%	0.35	38%	0.38	S	S	.	.			trans	-84.5	165.2	178.1	63.3	0	0	0	0	112	E143 E147 I148 F149	E143-T145 PolarHBondContact O-N 3.01Å; T145-E147 PolarHBondContact O-N 3.2Å; T145-I148 PolarHBondContact O-N 3.03Å; T145-I148 VanDerWaalsContact O-N 3.08Å; T145-F149 WeakPolarHBondContact O-CD2 3.14Å
146	V	88.4	Confident	83.1	Confident	127 Å²	127	68.6 Å²	68.6	77%	0.77	38%	0.383	S	S	*	.	H	α-helix	trans	-56.7	-30.8	173.7	-179.1	0	0	0	0	111.7	I148 F149 G150	V146-I148 VanDerWaalsContact C-N 3.31Å; V146-I148 PolarHBondContact O-N 3.49Å; V146-F149 PolarHBondContact O-N 3.23Å; V146-G150 PolarHBondContact O-N 3.38Å
147	E	87.1	Confident	83.7	Confident	148 Å²	148	72.4 Å²	72.4	69%	0.692	41%	0.409	S	S	*	.	H	α-helix	trans	-60.8	-39	176.7	-58.4	177.2	163.9	0	0	112.2	T145 F149 G150 L151	T145-E147 PolarHBondContact O-N 3.2Å; E147-F149 VanDerWaalsContact C-N 3.34Å; E147-F149 PolarHBondContact O-N 3.07Å; E147-G150 CarbonylContact O-C 3.54Å; E147-G150 WeakPolarHBondContact O-CA 3.49Å; E147-G150 PolarHBondContact O-N 3.38Å; E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 3.4Å
148	I	89.8	Confident	84.3	Confident	6 Å²	6	76.9 Å²	76.9	3%	0.031	43%	0.432	C	S	.	.	H	α-helix	trans	-64.2	-42	177.1	-69.4	164.7	0	0	0	110.3	L76 L131 F134 I144 T145 V146 G150 L151 V152	L76-I148 HydrophobicContact CD1-CG2 4.31Å; L76-I148 HydrophobicContact CD2-CG2 4.25Å; L131-I148 HydrophobicContact CD2-CG2 3.79Å; F134-I148 HydrophobicContact CE1-CD1 4.06Å; I144-I148 HydrophobicContact CG2-CG2 4.46Å; T145-I148 PolarHBondContact O-N 3.03Å; T145-I148 VanDerWaalsContact O-N 3.08Å; V146-I148 VanDerWaalsContact C-N 3.31Å; V146-I148 PolarHBondContact O-N 3.49Å; I148-G150 VanDerWaalsContact C-N 3.33Å; I148-L151 WeakPolarHBondContact O-CB 3.15Å; I148-L151 PolarHBondContact O-N 2.83Å; I148-V152 WeakPolarHBondContact O-CG2 3.43Å; I148-V152 PolarHBondContact O-N 3.08Å
149	F	90	Very high	85	Confident	98 Å²	98	77.6 Å²	77.6	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-64.6	-38.3	173.6	-68.3	-77.5	0	0	0	111.9	L127 L131 I144 T145 V146 E147 L151 V152 G153	L127-F149 HydrophobicContact CD2-CD1 4.18Å; L127-F149 HydrophobicContact CD2-CE1 3.88Å; L131-F149 HydrophobicContact CD1-CE1 4.01Å; L131-F149 HydrophobicContact CD1-CZ 4.13Å; I144-F149 HydrophobicContact CG2-CD2 4.27Å; I144-F149 HydrophobicContact CG2-CE2 3.52Å; I144-F149 HydrophobicContact CG2-CZ 3.82Å; T145-F149 WeakPolarHBondContact O-CD2 3.14Å; V146-F149 PolarHBondContact O-N 3.23Å; E147-F149 VanDerWaalsContact C-N 3.34Å; E147-F149 PolarHBondContact O-N 3.07Å; F149-L151 VanDerWaalsContact C-N 3.35Å; F149-L151 PolarHBondContact O-N 3.2Å; F149-V152 WeakPolarHBondContact O-CB 3.49Å; F149-V152 PolarHBondContact O-N 2.85Å; F149-G153 PolarHBondContact O-N 2.93Å
150	G	90.6	Very high	86	Confident	39 Å²	39	77.4 Å²	77.4	40%	0.402	43%	0.429	S	S	.	.	H	α-helix	trans	-57.6	-44.8	171.3	0	0	0	0	0	112.4	V146 E147 I148 V152 G153 T154	V146-G150 PolarHBondContact O-N 3.38Å; E147-G150 CarbonylContact O-C 3.54Å; E147-G150 WeakPolarHBondContact O-CA 3.49Å; E147-G150 PolarHBondContact O-N 3.38Å; I148-G150 VanDerWaalsContact C-N 3.33Å; G150-V152 PolarHBondContact O-N 3.2Å; G150-G153 CarbonylContact O-C 3.48Å; G150-G153 WeakPolarHBondContact O-CA 3.24Å; G150-G153 PolarHBondContact O-N 2.97Å; G150-G153 VanDerWaalsContact O-N 3.12Å; G150-T154 PolarHBondContact O-N 2.93Å; G150-T154 PolarHBondContact O-OG1 3.5Å
151	L	91.3	Very high	87.1	Confident	30 Å²	30	70.4 Å²	70.4	16%	0.157	40%	0.399	C	S	.	.	H	α-helix	trans	-63.7	-38.3	175.4	-68.4	176.5	0	0	0	112.5	P70 L72 A73 L76 E147 I148 F149 G153 T154 L155	P70-L151 HydrophobicContact CB-CD2 4.43Å; P70-L151 HydrophobicContact CG-CD2 4.21Å; L72-L151 HydrophobicContact CB-CD1 3.63Å; L72-L151 HydrophobicContact CD1-CD1 4.38Å; A73-L151 HydrophobicContact CB-CD2 4.32Å; L76-L151 HydrophobicContact CD1-CB 3.73Å; L76-L151 HydrophobicContact CD1-CD1 4.23Å; E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 3.4Å; I148-L151 WeakPolarHBondContact O-CB 3.15Å; I148-L151 PolarHBondContact O-N 2.83Å; F149-L151 VanDerWaalsContact C-N 3.35Å; F149-L151 PolarHBondContact O-N 3.2Å; L151-G153 VanDerWaalsContact C-N 3.3Å; L151-T154 PolarHBondContact O-N 3.1Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.39Å
152	V	91.6	Very high	88.2	Confident	15 Å²	15	66 Å²	66	9%	0.091	37%	0.372	C	S	.	.	H	α-helix	trans	-62.3	-40.9	172.6	175.4	0	0	0	0	110.6	L76 L127 M130 I148 F149 G150 L155 R156 L175	L76-V152 HydrophobicContact CD1-CG2 4.19Å; L76-V152 HydrophobicContact CD2-CG2 4.31Å; L127-V152 HydrophobicContact CD1-CG1 4.17Å; L127-V152 HydrophobicContact CD1-CG2 4.42Å; M130-V152 HydrophobicContact CE-CG2 4.04Å; I148-V152 WeakPolarHBondContact O-CG2 3.43Å; I148-V152 PolarHBondContact O-N 3.08Å; F149-V152 WeakPolarHBondContact O-CB 3.49Å; F149-V152 PolarHBondContact O-N 2.85Å; G150-V152 PolarHBondContact O-N 3.2Å; V152-L155 PolarHBondContact O-N 2.84Å; V152-R156 PolarHBondContact O-N 3.13Å; V152-L175 HydrophobicContact CG1-CD1 3.96Å
153	G	90.3	Very high	89.2	Confident	33 Å²	33	64.6 Å²	64.6	34%	0.34	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-47.9	171.7	0	0	0	0	0	112.3	F149 G150 L151 L155 R156 T157	F149-G153 PolarHBondContact O-N 2.93Å; G150-G153 CarbonylContact O-C 3.48Å; G150-G153 WeakPolarHBondContact O-CA 3.24Å; G150-G153 PolarHBondContact O-N 2.97Å; G150-G153 VanDerWaalsContact O-N 3.12Å; L151-G153 VanDerWaalsContact C-N 3.3Å; G153-L155 PolarHBondContact O-N 3.18Å; G153-R156 WeakPolarHBondContact O-CA 3.19Å; G153-R156 WeakPolarHBondContact O-CB 3.49Å; G153-R156 PolarHBondContact O-N 2.96Å; G153-R156 VanDerWaalsContact O-N 3.09Å; G153-T157 PolarHBondContact O-N 2.95Å; G153-T157 PolarHBondContact O-OG1 2.98Å
154	T	90.2	Very high	89.6	Confident	72 Å²	72	59.5 Å²	59.5	44%	0.442	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-44.1	175.5	-56.7	0	0	0	0	111.8	G150 L151 R156 T157 L158	G150-T154 PolarHBondContact O-N 2.93Å; G150-T154 PolarHBondContact O-OG1 3.5Å; L151-T154 PolarHBondContact O-N 3.1Å; T154-R156 PolarHBondContact O-N 3.15Å; T154-T157 PolarHBondContact O-N 3.36Å; T154-L158 HydrophobicContact CG2-CD1 3.86Å; T154-L158 HydrophobicContact CG2-CG 4.24Å; T154-L158 WeakPolarHBondContact O-CB 3.48Å; T154-L158 VanDerWaalsContact O-CG 3.26Å; T154-L158 WeakPolarHBondContact O-CG 3.5Å; T154-L158 PolarHBondContact O-N 3.33Å
155	L	89.9	Confident	89.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-62.3	-32.2	176.3	-72.5	173.9	0	0	0	112.7	L69 A73 L76 L77 M130 L151 V152 G153 G159 Y160 V161	L69-L155 HydrophobicContact CD2-CD2 3.64Å; A73-L155 HydrophobicContact CB-CD2 4.41Å; L76-L155 HydrophobicContact CB-CD1 3.69Å; L76-L155 HydrophobicContact CD1-CD1 4.47Å; L77-L155 HydrophobicContact CB-CD2 4.4Å; M130-L155 HydrophobicContact CE-CD1 4.43Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.39Å; V152-L155 PolarHBondContact O-N 2.84Å; G153-L155 PolarHBondContact O-N 3.18Å; L155-G159 PolarHBondContact O-N 2.89Å; L155-Y160 HydrophobicContact CD2-CD2 3.9Å; L155-Y160 PolarHBondContact O-N 3.37Å; L155-V161 HydrophobicContact CB-CG2 4.25Å; L155-V161 PolarHBondContact O-N 2.85Å
156	R	90.7	Very high	89.6	Confident	93 Å²	93	60.3 Å²	60.3	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-70.1	-47.9	172.9	179	-179	163	-151.7	-13.2	111.5	V152 G153 T154 L158 G159 V161 Q163 E167	V152-R156 PolarHBondContact O-N 3.13Å; G153-R156 WeakPolarHBondContact O-CA 3.19Å; G153-R156 WeakPolarHBondContact O-CB 3.49Å; G153-R156 PolarHBondContact O-N 2.96Å; G153-R156 VanDerWaalsContact O-N 3.09Å; T154-R156 PolarHBondContact O-N 3.15Å; R156-L158 VanDerWaalsContact C-N 3.3Å; R156-L158 PolarHBondContact O-N 2.97Å; R156-G159 PolarHBondContact O-N 3.43Å; R156-V161 VanDerWaalsContact CA-O 3.31Å; R156-V161 WeakPolarHBondContact CA-O 3.41Å; R156-Q163 VanDerWaalsContact CZ-OE1 3.32Å; R156-E167 IonicContact CZ-OE1 2.7Å; R156-E167 IonicContact NH2-OE1 2.85Å; R156-E167 PolarHBondContact NH2-OE1 3.44Å; R156-E167 IonicContact NH2-OE2 3.87Å; R156-E167 PolarHBondContact NH2-OE2 2.86Å; R156-E167 VanDerWaalsContact NH2-OE2 3.16Å
157	T	89.9	Confident	89.1	Confident	128 Å²	128	60.7 Å²	60.7	79%	0.785	34%	0.342	S	S	*	.	H	α-helix	trans	-62.6	-36.6	178.6	-57	0	0	0	0	112.3	G153 T154 G159	G153-T157 PolarHBondContact O-N 2.95Å; G153-T157 PolarHBondContact O-OG1 2.98Å; T154-T157 PolarHBondContact O-N 3.36Å; T157-G159 PolarHBondContact O-N 2.82Å
158	L	88.5	Confident	88.4	Confident	99 Å²	99	59.8 Å²	59.8	52%	0.518	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-6.4	174.8	-67.1	174.8	0	0	0	113.6	L69 T154 R156 Y160	L69-L158 HydrophobicContact CD2-CD1 4.12Å; T154-L158 HydrophobicContact CG2-CD1 3.86Å; T154-L158 HydrophobicContact CG2-CG 4.24Å; T154-L158 WeakPolarHBondContact O-CB 3.48Å; T154-L158 VanDerWaalsContact O-CG 3.26Å; T154-L158 WeakPolarHBondContact O-CG 3.5Å; T154-L158 PolarHBondContact O-N 3.33Å; R156-L158 VanDerWaalsContact C-N 3.3Å; R156-L158 PolarHBondContact O-N 2.97Å; L158-Y160 VanDerWaalsContact C-N 3.34Å; L158-Y160 HydrophobicContact CB-CD2 3.62Å; L158-Y160 HydrophobicContact CB-CE2 3.7Å; L158-Y160 HydrophobicContact CD1-CD2 4.22Å; L158-Y160 HydrophobicContact CD1-CE2 3.87Å; L158-Y160 HydrophobicContact CG-CE2 4.4Å; L158-Y160 PolarHBondContact O-N 2.95Å
159	G	88.9	Confident	87.7	Confident	42 Å²	42	62.3 Å²	62.3	43%	0.433	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	8	177.5	0	0	0	0	0	115.3	L155 R156 T157	L155-G159 PolarHBondContact O-N 2.89Å; R156-G159 PolarHBondContact O-N 3.43Å; T157-G159 PolarHBondContact O-N 2.82Å
160	Y	89	Confident	86.9	Confident	45 Å²	45	64.1 Å²	64.1	18%	0.176	38%	0.377	C	S	.	.	S	Bend	trans	-74	-30.4	176	-65.7	-59.4	0	0	0	112.7	W67 L69 L77 L155 L158 L178 A179 T183	W67-Y160 HydrophobicContact CH2-CE1 4.23Å; W67-Y160 AromaticContact CZ3-CE1 3.76Å; W67-Y160 HydrophobicContact CZ3-CE1 3.76Å; W67-Y160 AromaticContact CZ3-CZ 3.77Å; W67-Y160 WeakPolarHBondContact CZ3-OH 3.33Å; L69-Y160 HydrophobicContact CD1-CE2 4.02Å; L69-Y160 HydrophobicContact CD2-CD2 4.24Å; L69-Y160 HydrophobicContact CD2-CE2 3.87Å; L77-Y160 HydrophobicContact CD1-CG 4.39Å; L77-Y160 HydrophobicContact CD2-CD1 4.14Å; L77-Y160 HydrophobicContact CD2-CD2 4.38Å; L77-Y160 HydrophobicContact CD2-CG 4.03Å; L155-Y160 HydrophobicContact CD2-CD2 3.9Å; L155-Y160 PolarHBondContact O-N 3.37Å; L158-Y160 VanDerWaalsContact C-N 3.34Å; L158-Y160 HydrophobicContact CB-CD2 3.62Å; L158-Y160 HydrophobicContact CB-CE2 3.7Å; L158-Y160 HydrophobicContact CD1-CD2 4.22Å; L158-Y160 HydrophobicContact CD1-CE2 3.87Å; L158-Y160 HydrophobicContact CG-CE2 4.4Å; L158-Y160 PolarHBondContact O-N 2.95Å; Y160-L178 PolarHBondContact O-N 3.26Å; Y160-A179 PolarHBondContact O-N 2.85Å; Y160-T183 HydrophobicContact CD1-CG2 4.03Å; Y160-T183 HydrophobicContact CE1-CG2 3.71Å
161	V	91.1	Very high	86.2	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.018	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.7	179.8	-177	0	0	0	0	108.9	A80 L155 R156 L175 R176	A80-V161 HydrophobicContact CB-CG2 4.1Å; L155-V161 HydrophobicContact CB-CG2 4.25Å; L155-V161 PolarHBondContact O-N 2.85Å; R156-V161 VanDerWaalsContact CA-O 3.31Å; R156-V161 WeakPolarHBondContact CA-O 3.41Å; V161-L175 HydrophobicContact CG1-CB 3.78Å; V161-L175 HydrophobicContact CG1-CD1 4.13Å; V161-L175 HydrophobicContact CG1-CD2 4.13Å; V161-L175 HydrophobicContact CG1-CG 4.23Å; V161-R176 CarbonylContact C-O 3.58Å; V161-R176 WeakPolarHBondContact CA-O 3.44Å
162	S	91.5	Very high	85.8	Confident	47 Å²	47	70.8 Å²	70.8	33%	0.329	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.3	176.7	173.5	0	0	0	0	110.4	L175 R176	S162-L175 CarbonylContact O-C 3.5Å; S162-L175 WeakPolarHBondContact O-CA 3.33Å; S162-R176 PolarHBondContact N-O 3.21Å; S162-R176 PolarHBondContact O-N 2.85Å
163	Q	91.7	Very high	85.7	Confident	33 Å²	33	71.7 Å²	71.7	15%	0.154	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128.3	172.2	-171.8	173.8	-4.7	0	0	109.5	R156 S165 I173 R174 L175	R156-Q163 VanDerWaalsContact CZ-OE1 3.32Å; Q163-S165 VanDerWaalsContact CG-OG 3.26Å; Q163-S165 WeakPolarHBondContact CG-OG 3.46Å; Q163-S165 PolarHBondContact NE2-OG 3.13Å; Q163-I173 HydrophobicContact CG-CG2 4.33Å; Q163-R174 WeakPolarHBondContact CA-O 3.15Å; Q163-L175 HydrophobicContact CB-CD2 4Å; Q163-L175 HydrophobicContact CG-CD2 4.24Å
164	T	90.1	Very high	85.8	Confident	60 Å²	60	75.3 Å²	75.3	37%	0.368	42%	0.415	S	S	.	.			trans	-103.8	-16.2	-179.4	56.5	0	0	0	0	112.9	A124 R174 R176	A124-T164 HydrophobicContact CB-CG2 4.22Å; T164-R174 PolarHBondContact N-O 2.91Å; T164-R174 VanDerWaalsContact OG1-CB 3.24Å; T164-R174 WeakPolarHBondContact OG1-CB 3.49Å; T164-R174 PolarHBondContact OG1-O 3.28Å; T164-R176 HydrophobicContact CG2-CB 3.94Å
165	S	86.8	Confident	85.9	Confident	19 Å²	19	72.1 Å²	72.1	13%	0.133	40%	0.396	C	S	.	.	S	Bend	trans	-81.4	159.4	170.6	57.1	0	0	0	0	110.7	Q163 E167 R174	Q163-S165 VanDerWaalsContact CG-OG 3.26Å; Q163-S165 WeakPolarHBondContact CG-OG 3.46Å; Q163-S165 PolarHBondContact NE2-OG 3.13Å; S165-E167 PolarHBondContact O-N 3.43Å; S165-R174 PolarHBondContact N-O 3.46Å; S165-R174 PolarHBondContact OG-N 3.45Å
166	N	83.7	Confident	86	Confident	129 Å²	129	76.4 Å²	76.4	69%	0.69	41%	0.412	S	S	*	.			trans	-57	135.6	168.6	-63.5	-11.1	0	0	0	110.1	C168 N169	N166-C168 PolarHBondContact O-N 3.11Å; N166-C168 VanDerWaalsContact O-N 3.16Å; N166-N169 PolarHBondContact O-N 3.15Å
167	E	77.8	Confident	86.1	Confident	135 Å²	135	72 Å²	72	63%	0.631	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24	-177	-57	-165.3	176.4	0	0	112.8	R156 S165 N169	R156-E167 IonicContact CZ-OE1 2.7Å; R156-E167 IonicContact NH2-OE1 2.85Å; R156-E167 PolarHBondContact NH2-OE1 3.44Å; R156-E167 IonicContact NH2-OE2 3.87Å; R156-E167 PolarHBondContact NH2-OE2 2.86Å; R156-E167 VanDerWaalsContact NH2-OE2 3.16Å; S165-E167 PolarHBondContact O-N 3.43Å; E167-N169 VanDerWaalsContact C-N 3.31Å; E167-N169 PolarHBondContact O-N 3.46Å
168	C	72.9	Confident	86	Confident	128 Å²	128	70.3 Å²	70.3	87%	0.865	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.4	176.9	-50.2	0	0	0	0	113.8	N166 L170	N166-C168 PolarHBondContact O-N 3.11Å; N166-C168 VanDerWaalsContact O-N 3.16Å; C168-L170 PolarHBondContact O-N 3.31Å
169	N	74.6	Confident	85.6	Confident	60 Å²	60	65.8 Å²	65.8	32%	0.321	36%	0.358	S	S	.	.			trans	-96.2	92.9	-179.4	-173.5	-11.4	0	0	0	109.7	N166 E167 D171 S172	N166-N169 PolarHBondContact O-N 3.15Å; E167-N169 VanDerWaalsContact C-N 3.31Å; E167-N169 PolarHBondContact O-N 3.46Å; N169-D171 PolarHBondContact OD1-N 3.3Å; N169-D171 VanDerWaalsContact OD1-N 3.16Å; N169-S172 PolarHBondContact ND2-OG 3.11Å; N169-S172 PolarHBondContact OD1-N 3.37Å; N169-S172 VanDerWaalsContact OD1-N 3.13Å; N169-S172 PolarHBondContact OD1-OG 3.46Å
170	L	73.3	Confident	84.8	Confident	135 Å²	135	67.4 Å²	67.4	71%	0.707	36%	0.359	S	S	*	.			trans	-77.3	-22.9	176.5	-64.1	175	0	0	0	112.6	C168	C168-L170 PolarHBondContact O-N 3.31Å
171	D	76.7	Confident	83.8	Confident	153 Å²	153	70.7 Å²	70.7	82%	0.818	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-25.6	-174.9	-62.9	-30.1	0	0	0	112.9	N169	N169-D171 PolarHBondContact OD1-N 3.3Å; N169-D171 VanDerWaalsContact OD1-N 3.16Å
172	S	83	Confident	82.6	Confident	56 Å²	56	76.7 Å²	76.7	39%	0.392	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	67	-179.5	72.2	0	0	0	0	112.1	N169 R174	N169-S172 PolarHBondContact ND2-OG 3.11Å; N169-S172 PolarHBondContact OD1-N 3.37Å; N169-S172 VanDerWaalsContact OD1-N 3.13Å; N169-S172 PolarHBondContact OD1-OG 3.46Å; S172-R174 PolarHBondContact O-N 2.99Å
173	I	89.5	Confident	81.6	Confident	34 Å²	34	75.2 Å²	75.2	17%	0.174	39%	0.389	C	S	.	.			trans	-69.2	119.8	177.5	-60.3	174.3	0	0	0	109.5	L127 Q163 L175	L127-I173 HydrophobicContact CB-CB 4.27Å; L127-I173 HydrophobicContact CB-CG2 4.39Å; L127-I173 HydrophobicContact CD2-CB 4.46Å; L127-I173 HydrophobicContact CD2-CD1 4.23Å; L127-I173 PolarHBondContact N-O 3.32Å; Q163-I173 HydrophobicContact CG-CG2 4.33Å; I173-L175 HydrophobicContact CG2-CD2 3.87Å; I173-L175 HydrophobicContact CG2-CG 4.07Å
174	R	92.3	Very high	80.4	Confident	109 Å²	109	74.1 Å²	74.1	41%	0.411	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.5	175.5	-62.5	-173.4	68	84.9	3.6	110.5	A124 F125 Q163 T164 S165 S172	A124-R174 PolarHBondContact O-NH2 3.48Å; F125-R174 CarbonylContact O-C 3.59Å; F125-R174 WeakPolarHBondContact O-CA 3.37Å; Q163-R174 WeakPolarHBondContact CA-O 3.15Å; T164-R174 PolarHBondContact N-O 2.91Å; T164-R174 VanDerWaalsContact OG1-CB 3.24Å; T164-R174 WeakPolarHBondContact OG1-CB 3.49Å; T164-R174 PolarHBondContact OG1-O 3.28Å; S165-R174 PolarHBondContact N-O 3.46Å; S165-R174 PolarHBondContact OG-N 3.45Å; S172-R174 PolarHBondContact O-N 2.99Å
175	L	92.7	Very high	79.3	Confident	5 Å²	5	72.4 Å²	72.4	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	160.2	-177.6	-60.5	178.8	0	0	0	111.3	A124 F125 L127 M130 V152 V161 S162 Q163 I173	A124-L175 CarbonylContact C-O 3.59Å; A124-L175 VanDerWaalsContact CA-O 3.28Å; A124-L175 WeakPolarHBondContact CA-O 3.28Å; F125-L175 WeakPolarHBondContact CD1-O 3.27Å; F125-L175 HydrophobicContact CD2-CB 4.39Å; F125-L175 HydrophobicContact CE1-CB 4.21Å; F125-L175 WeakPolarHBondContact CE1-O 3.27Å; F125-L175 HydrophobicContact CE2-CB 3.69Å; F125-L175 HydrophobicContact CE2-CD1 4.4Å; F125-L175 HydrophobicContact CZ-CB 3.6Å; F125-L175 PolarHBondContact N-O 2.83Å; F125-L175 PolarHBondContact O-N 2.81Å; L127-L175 HydrophobicContact CB-CD1 4.45Å; L127-L175 HydrophobicContact CD1-CD1 3.75Å; M130-L175 HydrophobicContact SD-CD1 4.18Å; V152-L175 HydrophobicContact CG1-CD1 3.96Å; V161-L175 HydrophobicContact CG1-CB 3.78Å; V161-L175 HydrophobicContact CG1-CD1 4.13Å; V161-L175 HydrophobicContact CG1-CD2 4.13Å; V161-L175 HydrophobicContact CG1-CG 4.23Å; S162-L175 CarbonylContact O-C 3.5Å; S162-L175 WeakPolarHBondContact O-CA 3.33Å; Q163-L175 HydrophobicContact CB-CD2 4Å; Q163-L175 HydrophobicContact CG-CD2 4.24Å; I173-L175 HydrophobicContact CG2-CD2 3.87Å; I173-L175 HydrophobicContact CG2-CG 4.07Å
176	R	92.1	Very high	78.3	Confident	91 Å²	91	75.5 Å²	75.5	34%	0.343	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	132.5	173.5	178.2	-173.2	-68.6	-128.6	7.6	108.6	P122 V161 S162 T164	P122-R176 HydrophobicContact CB-CG 3.86Å; P122-R176 HydrophobicContact CG-CG 3.95Å; P122-R176 WeakPolarHBondContact O-CD 3.22Å; P122-R176 PolarHBondContact O-NE 2.96Å; P122-R176 PolarHBondContact O-NH1 3.42Å; V161-R176 CarbonylContact C-O 3.58Å; V161-R176 WeakPolarHBondContact CA-O 3.44Å; S162-R176 PolarHBondContact N-O 3.21Å; S162-R176 PolarHBondContact O-N 2.85Å; T164-R176 HydrophobicContact CG2-CB 3.94Å
177	C	91.5	Very high	77.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.4	175.3	-169	0	0	0	0	109.9	A80 S84 P122	A80-C177 HydrophobicContact CB-CB 4.18Å; A80-C177 WeakPolarHBondContact O-CB 3.38Å; S84-C177 WeakPolarHBondContact OG-CB 3.39Å; S84-C177 PolarHBondContact OG-N 3.03Å; P122-C177 WeakPolarHBondContact CB-O 3.26Å; P122-C177 VanDerWaalsContact CG-O 3.28Å; P122-C177 WeakPolarHBondContact CG-O 3.42Å
178	L	88.6	Confident	76.7	Confident	93 Å²	93	65.5 Å²	65.5	49%	0.487	34%	0.336	S	S	.	.			trans	-103.6	-4.2	175.4	-62.6	-177.1	0	0	0	112.4	Y160 T180	Y160-L178 PolarHBondContact O-N 3.26Å; L178-T180 PolarHBondContact O-N 3.39Å
179	A	80	Confident	76.1	Confident	5 Å²	5	68.4 Å²	68.4	4%	0.041	33%	0.329	C	S	.	.			trans	-60.9	129.6	179.2	0	0	0	0	0	111.6	L77 Y160 T183	L77-A179 HydrophobicContact CD1-CB 3.97Å; Y160-A179 PolarHBondContact O-N 2.85Å; A179-T183 HydrophobicContact CB-CG2 4.02Å
180	T	72.2	Confident	75.5	Confident	75 Å²	75	68 Å²	68	46%	0.46	33%	0.327	S	S	.	.			trans	-76.7	164.7	177.8	64.5	0	0	0	0	110.4	L178 E182 T183 K184	L178-T180 PolarHBondContact O-N 3.39Å; T180-E182 PolarHBondContact O-N 2.66Å; T180-E182 VanDerWaalsContact O-N 3.16Å; T180-T183 PolarHBondContact N-OG1 3.07Å; T180-T183 VanDerWaalsContact N-OG1 3.16Å; T180-T183 WeakPolarHBondContact O-CB 3.24Å; T180-T183 PolarHBondContact O-N 2.85Å; T180-T183 VanDerWaalsContact O-N 3.09Å; T180-T183 PolarHBondContact O-OG1 2.74Å; T180-T183 PolarHBondContact OG1-N 2.76Å; T180-T183 PolarHBondContact OG1-OG1 3.29Å; T180-T183 VanDerWaalsContact OG1-OG1 3.05Å; T180-K184 PolarHBondContact O-N 3.49Å; T180-K184 VanDerWaalsContact O-N 3.13Å
181	Y	67.5	Low	74.7	Confident	114 Å²	114	69.4 Å²	69.4	45%	0.447	32%	0.322	S	S	.	.	H	α-helix	trans	-55.1	-31.1	172.4	-178.3	-95.8	0	0	0	112.1	I10 K184 A185	I10-Y181 HydrophobicContact CD1-CE2 4.34Å; Y181-K184 HydrophobicContact CD2-CD 4.49Å; Y181-K184 WeakPolarHBondContact O-CB 3.29Å; Y181-K184 PolarHBondContact O-N 3.02Å; Y181-A185 WeakPolarHBondContact O-CB 3.28Å; Y181-A185 PolarHBondContact O-N 2.87Å
182	E	67	Low	73.7	Confident	129 Å²	129	69.6 Å²	69.6	60%	0.603	32%	0.317	S	S	*	.	H	α-helix	trans	-69.3	-41.3	176.7	-59.1	-175.7	175	0	0	112.7	T180 K184 A185 K186	T180-E182 PolarHBondContact O-N 2.66Å; T180-E182 VanDerWaalsContact O-N 3.16Å; E182-K184 VanDerWaalsContact C-N 3.26Å; E182-K184 PolarHBondContact O-N 3.19Å; E182-A185 PolarHBondContact O-N 2.79Å; E182-K186 WeakPolarHBondContact O-CB 3.45Å; E182-K186 VanDerWaalsContact O-CG 3.28Å; E182-K186 WeakPolarHBondContact O-CG 3.37Å; E182-K186 PolarHBondContact O-N 3.33Å
183	T	69.1	Low	72.5	Confident	16 Å²	16	67.1 Å²	67.1	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-57.4	-46	173.7	-41.4	0	0	0	0	110	W67 Y160 A179 T180 K186 I187	W67-T183 HydrophobicContact CE3-CG2 4.46Å; W67-T183 HydrophobicContact CH2-CG2 3.47Å; W67-T183 VanDerWaalsContact CH2-CG2 3.47Å; W67-T183 HydrophobicContact CZ3-CG2 3.3Å; Y160-T183 HydrophobicContact CD1-CG2 4.03Å; Y160-T183 HydrophobicContact CE1-CG2 3.71Å; A179-T183 HydrophobicContact CB-CG2 4.02Å; T180-T183 PolarHBondContact N-OG1 3.07Å; T180-T183 VanDerWaalsContact N-OG1 3.16Å; T180-T183 WeakPolarHBondContact O-CB 3.24Å; T180-T183 PolarHBondContact O-N 2.85Å; T180-T183 VanDerWaalsContact O-N 3.09Å; T180-T183 PolarHBondContact O-OG1 2.74Å; T180-T183 PolarHBondContact OG1-N 2.76Å; T180-T183 PolarHBondContact OG1-OG1 3.29Å; T180-T183 VanDerWaalsContact OG1-OG1 3.05Å; T183-K186 PolarHBondContact O-N 2.98Å; T183-I187 HydrophobicContact CG2-CD1 4.11Å; T183-I187 WeakPolarHBondContact O-CD1 3.38Å; T183-I187 VanDerWaalsContact O-CG1 3.24Å; T183-I187 WeakPolarHBondContact O-CG1 3.16Å; T183-I187 PolarHBondContact O-N 3.17Å
184	K	67.8	Low	70.9	Confident	11 Å²	11	69 Å²	69	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-49.5	177.9	-166.4	-152.6	175.7	-123.7	0	111.2	Y81 T180 Y181 E182 K186 I187 E188	Y81-K184 HydrophobicContact CD1-CD 4.02Å; Y81-K184 HydrophobicContact CE1-CD 3.58Å; Y81-K184 HydrophobicContact CE1-CG 4.49Å; Y81-K184 HydrophobicContact CE2-CD 4.16Å; Y81-K184 HydrophobicContact CG-CD 4.48Å; T180-K184 PolarHBondContact O-N 3.49Å; T180-K184 VanDerWaalsContact O-N 3.13Å; Y181-K184 HydrophobicContact CD2-CD 4.49Å; Y181-K184 WeakPolarHBondContact O-CB 3.29Å; Y181-K184 PolarHBondContact O-N 3.02Å; E182-K184 VanDerWaalsContact C-N 3.26Å; E182-K184 PolarHBondContact O-N 3.19Å; K184-K186 VanDerWaalsContact C-N 3.28Å; K184-K186 PolarHBondContact O-N 3.29Å; K184-I187 WeakPolarHBondContact O-CB 3.18Å; K184-I187 PolarHBondContact O-N 2.96Å; K184-I187 VanDerWaalsContact O-N 3.11Å; K184-E188 WeakPolarHBondContact CD-OE1 3.34Å; K184-E188 WeakPolarHBondContact CE-OE1 3.4Å; K184-E188 WeakPolarHBondContact CG-OE1 3.28Å; K184-E188 IonicContact NZ-OE1 3.59Å; K184-E188 PolarHBondContact NZ-OE1 3.31Å; K184-E188 WeakPolarHBondContact O-CB 3.21Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.39Å
185	A	65.4	Low	68.9	Low	24 Å²	24	67.9 Å²	67.9	20%	0.198	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-33.2	176.9	0	0	0	0	0	113.3	Y181 E182 R189	Y181-A185 WeakPolarHBondContact O-CB 3.28Å; Y181-A185 PolarHBondContact O-N 2.87Å; E182-A185 PolarHBondContact O-N 2.79Å; A185-R189 WeakPolarHBondContact O-CG 3.27Å; A185-R189 PolarHBondContact O-N 3.33Å
186	K	67.6	Low	67.1	Low	83 Å²	83	67.7 Å²	67.7	36%	0.361	31%	0.308	S	S	.	.	H	α-helix	trans	-69.9	-41.4	173.7	-73.1	172.2	-176.9	176.5	0	111.7	W67 E182 T183 K184 R189	W67-K186 HydrophobicContact CH2-CD 4.39Å; W67-K186 HydrophobicContact CZ2-CB 4.49Å; W67-K186 HydrophobicContact CZ2-CD 3.51Å; E182-K186 WeakPolarHBondContact O-CB 3.45Å; E182-K186 VanDerWaalsContact O-CG 3.28Å; E182-K186 WeakPolarHBondContact O-CG 3.37Å; E182-K186 PolarHBondContact O-N 3.33Å; T183-K186 PolarHBondContact O-N 2.98Å; K184-K186 VanDerWaalsContact C-N 3.28Å; K184-K186 PolarHBondContact O-N 3.29Å; K186-R189 PolarHBondContact O-N 3.14Å
187	I	66.6	Low	65.3	Low	4 Å²	4	65.4 Å²	65.4	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-44	176.1	-69	160.5	0	0	0	110.6	W67 K74 L77 I78 T183 K184 R189 N190 L193	W67-I187 HydrophobicContact CE3-CG1 4.4Å; K74-I187 HydrophobicContact CB-CG2 4.14Å; K74-I187 HydrophobicContact CG-CG2 4.39Å; L77-I187 HydrophobicContact CD2-CD1 3.3Å; L77-I187 HydrophobicContact CG-CD1 3.93Å; I78-I187 HydrophobicContact CD1-CG2 4.1Å; I78-I187 HydrophobicContact CG1-CG2 4.31Å; T183-I187 HydrophobicContact CG2-CD1 4.11Å; T183-I187 WeakPolarHBondContact O-CD1 3.38Å; T183-I187 VanDerWaalsContact O-CG1 3.24Å; T183-I187 WeakPolarHBondContact O-CG1 3.16Å; T183-I187 PolarHBondContact O-N 3.17Å; K184-I187 WeakPolarHBondContact O-CB 3.18Å; K184-I187 PolarHBondContact O-N 2.96Å; K184-I187 VanDerWaalsContact O-N 3.11Å; I187-R189 PolarHBondContact O-N 3.22Å; I187-N190 WeakPolarHBondContact O-CB 3.14Å; I187-N190 PolarHBondContact O-N 3.32Å; I187-N190 PolarHBondContact O-ND2 3.19Å; I187-L193 HydrophobicContact CG2-CD1 3.23Å; I187-L193 WeakPolarHBondContact O-CD1 3.19Å
188	E	60.2	Low	63.4	Low	51 Å²	51	68.2 Å²	68.2	24%	0.238	32%	0.317	C	S	.	.	H	α-helix	trans	-56.6	-28.8	179	-75	164	-154.2	0	0	113.8	K184 N190 F197	K184-E188 WeakPolarHBondContact CD-OE1 3.34Å; K184-E188 WeakPolarHBondContact CE-OE1 3.4Å; K184-E188 WeakPolarHBondContact CG-OE1 3.28Å; K184-E188 IonicContact NZ-OE1 3.59Å; K184-E188 PolarHBondContact NZ-OE1 3.31Å; K184-E188 WeakPolarHBondContact O-CB 3.21Å; K184-E188 WeakPolarHBondContact O-CG 3.37Å; K184-E188 PolarHBondContact O-N 3.39Å; E188-N190 PolarHBondContact O-N 3.15Å; E188-N190 VanDerWaalsContact O-N 3.15Å; E188-F197 HydrophobicContact CG-CD2 3.69Å; E188-F197 HydrophobicContact CG-CE2 3.41Å; E188-F197 VanDerWaalsContact CG-CE2 3.41Å; E188-F197 HydrophobicContact CG-CG 4.42Å; E188-F197 HydrophobicContact CG-CZ 3.86Å; E188-F197 WeakPolarHBondContact OE1-CE2 3.22Å; E188-F197 WeakPolarHBondContact OE1-CZ 3.49Å; E188-F197 WeakPolarHBondContact OE2-CZ 3.48Å
189	R	60.5	Low	61.6	Low	189 Å²	189	64.3 Å²	64.3	71%	0.713	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.1	176.3	-70.3	177.2	-163.8	154.2	1.5	113.4	A185 K186 I187 R191	A185-R189 WeakPolarHBondContact O-CG 3.27Å; A185-R189 PolarHBondContact O-N 3.33Å; K186-R189 PolarHBondContact O-N 3.14Å; I187-R189 PolarHBondContact O-N 3.22Å; R189-R191 PolarHBondContact O-N 2.79Å
190	N	62.3	Low	60.4	Low	51 Å²	51	64.5 Å²	64.5	27%	0.273	30%	0.297	S	S	.	.	S	Bend	trans	-77.5	114.7	173.7	-66	-78.1	0	0	0	109.8	I187 E188 F192 L193	I187-N190 WeakPolarHBondContact O-CB 3.14Å; I187-N190 PolarHBondContact O-N 3.32Å; I187-N190 PolarHBondContact O-ND2 3.19Å; E188-N190 PolarHBondContact O-N 3.15Å; E188-N190 VanDerWaalsContact O-N 3.15Å; N190-F192 PolarHBondContact O-N 3.12Å; N190-L193 HydrophobicContact CB-CD1 4.39Å; N190-L193 PolarHBondContact O-N 2.89Å; N190-L193 VanDerWaalsContact O-N 3.11Å
191	R	55.8	Low	59.4	Low	164 Å²	164	63.6 Å²	63.6	62%	0.619	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-49.6	-20.6	-176.9	-67.9	-174	178.4	-158.8	-2.8	115.5	R189 L193	R189-R191 PolarHBondContact O-N 2.79Å; R191-L193 VanDerWaalsContact C-N 3.33Å; R191-L193 PolarHBondContact O-N 3.14Å
192	F	56.9	Low	58.5	Low	158 Å²	158	59.4 Å²	59.4	69%	0.693	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-77.7	-9.2	-178.6	-69.2	-79.1	0	0	0	115.1	L71 N190	L71-F192 HydrophobicContact CD1-CB 3.83Å; L71-F192 HydrophobicContact CD1-CG 4.49Å; N190-F192 PolarHBondContact O-N 3.12Å
193	L	57.5	Low	57.6	Low	3 Å²	3	54 Å²	54	2%	0.016	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-105.9	8.1	-170.5	-59.1	175.6	0	0	0	114.4	L71 K74 F75 I78 I187 N190 R191 N195 A196 F197	L71-L193 HydrophobicContact CD1-CD2 4.24Å; K74-L193 HydrophobicContact CB-CD1 3.88Å; K74-L193 HydrophobicContact CB-CD2 4.39Å; K74-L193 HydrophobicContact CD-CD1 4.31Å; F75-L193 HydrophobicContact CD1-CD2 3.51Å; F75-L193 HydrophobicContact CD2-CD2 4.16Å; F75-L193 HydrophobicContact CE1-CD2 3.26Å; F75-L193 HydrophobicContact CE2-CD2 3.94Å; F75-L193 HydrophobicContact CG-CD2 3.97Å; F75-L193 HydrophobicContact CZ-CD2 3.49Å; F75-L193 VanDerWaalsContact CZ-CD2 3.49Å; I78-L193 HydrophobicContact CD1-CB 4.06Å; I78-L193 HydrophobicContact CD1-CD1 3.79Å; I78-L193 HydrophobicContact CD1-CD2 4.13Å; I78-L193 HydrophobicContact CD1-CG 4.21Å; I187-L193 HydrophobicContact CG2-CD1 3.23Å; I187-L193 WeakPolarHBondContact O-CD1 3.19Å; N190-L193 HydrophobicContact CB-CD1 4.39Å; N190-L193 PolarHBondContact O-N 2.89Å; N190-L193 VanDerWaalsContact O-N 3.11Å; R191-L193 VanDerWaalsContact C-N 3.33Å; R191-L193 PolarHBondContact O-N 3.14Å; L193-N195 VanDerWaalsContact C-N 3.27Å; L193-N195 PolarHBondContact O-N 2.89Å; L193-A196 WeakPolarHBondContact O-CB 3.47Å; L193-A196 PolarHBondContact O-N 3.32Å; L193-A196 VanDerWaalsContact O-N 3.11Å; L193-F197 PolarHBondContact O-N 3.16Å
194	E	54.6	Low	56.7	Low	75 Å²	75	57.8 Å²	57.8	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-55.5	-39.7	-177.6	-66.9	-178.4	175.6	0	0	112.5	A196 F197 V198	E194-A196 PolarHBondContact O-N 3.36Å; E194-F197 WeakPolarHBondContact O-CB 3.44Å; E194-F197 PolarHBondContact O-N 3.16Å; E194-V198 PolarHBondContact O-N 3.44Å
195	N	51.8	Low	55.5	Low	85 Å²	85	61 Å²	61	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-40.4	178.7	-67.9	-14.1	0	0	0	112.9	L193 F197 V199	L193-N195 VanDerWaalsContact C-N 3.27Å; L193-N195 PolarHBondContact O-N 2.89Å; N195-F197 PolarHBondContact O-N 2.74Å; N195-V199 WeakPolarHBondContact O-CG2 3.46Å; N195-V199 PolarHBondContact O-N 2.89Å
196	A	53.7	Low	54.5	Low	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.2	-28.7	178	0	0	0	0	0	111.5	F75 I78 I137 L193 E194 V199 Y200	F75-A196 HydrophobicContact CD1-CB 4.41Å; F75-A196 HydrophobicContact CE1-CB 4.41Å; I78-A196 HydrophobicContact CD1-CB 3.94Å; I78-A196 HydrophobicContact CG2-CB 3.96Å; I137-A196 HydrophobicContact CG2-CB 3.33Å; L193-A196 WeakPolarHBondContact O-CB 3.47Å; L193-A196 PolarHBondContact O-N 3.32Å; L193-A196 VanDerWaalsContact O-N 3.11Å; E194-A196 PolarHBondContact O-N 3.36Å; A196-V199 WeakPolarHBondContact O-CB 3.31Å; A196-Y200 PolarHBondContact O-N 2.8Å; A196-Y200 VanDerWaalsContact O-N 3.08Å
197	F	55.3	Low	53.2	Low	43 Å²	43	68.2 Å²	68.2	19%	0.189	31%	0.305	C	S	.	.	H	α-helix	trans	-82.5	-37.9	-176.2	-141.9	-115.6	0	0	0	113.7	E188 L193 E194 N195 V199 Y200 F201	E188-F197 HydrophobicContact CG-CD2 3.69Å; E188-F197 HydrophobicContact CG-CE2 3.41Å; E188-F197 VanDerWaalsContact CG-CE2 3.41Å; E188-F197 HydrophobicContact CG-CG 4.42Å; E188-F197 HydrophobicContact CG-CZ 3.86Å; E188-F197 WeakPolarHBondContact OE1-CE2 3.22Å; E188-F197 WeakPolarHBondContact OE1-CZ 3.49Å; E188-F197 WeakPolarHBondContact OE2-CZ 3.48Å; L193-F197 PolarHBondContact O-N 3.16Å; E194-F197 WeakPolarHBondContact O-CB 3.44Å; E194-F197 PolarHBondContact O-N 3.16Å; N195-F197 PolarHBondContact O-N 2.74Å; F197-V199 PolarHBondContact O-N 3.34Å; F197-Y200 HydrophobicContact CE2-CD1 4.19Å; F197-Y200 HydrophobicContact CZ-CD1 4.39Å; F197-Y200 PolarHBondContact O-N 3.18Å; F197-Y200 VanDerWaalsContact O-N 3.13Å; F197-F201 AromaticContact CD1-CD2 3.68Å; F197-F201 HydrophobicContact CD1-CD2 3.68Å; F197-F201 AromaticContact CD1-CE2 3.97Å; F197-F201 HydrophobicContact CD1-CE2 3.97Å; F197-F201 AromaticContact CE1-CD2 3.52Å; F197-F201 HydrophobicContact CE1-CD2 3.52Å; F197-F201 AromaticContact CE1-CE2 3.36Å; F197-F201 HydrophobicContact CE1-CE2 3.36Å; F197-F201 HydrophobicContact CZ-CD2 4.25Å; F197-F201 HydrophobicContact CZ-CE2 4.06Å; F197-F201 WeakPolarHBondContact O-CB 3.34Å; F197-F201 PolarHBondContact O-N 3.05Å
198	V	51.6	Low	51.9	Low	59 Å²	59	69.5 Å²	69.5	36%	0.358	31%	0.313	S	S	.	.	H	α-helix	trans	-56	-46.4	168.6	177.5	0	0	0	0	108.9	E194 Y200 F201 V202 C216	E194-V198 PolarHBondContact O-N 3.44Å; V198-Y200 PolarHBondContact O-N 3.23Å; V198-F201 PolarHBondContact O-N 3.45Å; V198-V202 HydrophobicContact CG1-CG2 4.1Å; V198-V202 WeakPolarHBondContact O-CB 3.19Å; V198-V202 WeakPolarHBondContact O-CG2 3.2Å; V198-V202 PolarHBondContact O-N 3.09Å; V198-C216 HydrophobicContact CG1-CB 4.15Å; V198-C216 VanDerWaalsContact CG1-SG 3.59Å
199	V	50.9	Low	50.9	Low	11 Å²	11	70.5 Å²	70.5	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-56.6	-46.8	174.2	167.9	0	0	0	0	112.3	F95 I137 N195 A196 F197 C203 W213	F95-V199 HydrophobicContact CE1-CG1 3.95Å; F95-V199 HydrophobicContact CZ-CG1 4.44Å; I137-V199 HydrophobicContact CG1-CG1 4.45Å; N195-V199 WeakPolarHBondContact O-CG2 3.46Å; N195-V199 PolarHBondContact O-N 2.89Å; A196-V199 WeakPolarHBondContact O-CB 3.31Å; F197-V199 PolarHBondContact O-N 3.34Å; V199-C203 WeakPolarHBondContact O-CB 3.46Å; V199-C203 PolarHBondContact O-N 3Å; V199-C203 PolarHBondContact O-SG 3.02Å; V199-W213 HydrophobicContact CB-CH2 4.06Å; V199-W213 HydrophobicContact CB-CZ3 4.32Å; V199-W213 HydrophobicContact CG1-CH2 3.59Å; V199-W213 HydrophobicContact CG1-CZ3 4.16Å; V199-W213 HydrophobicContact CG2-CE3 4.47Å; V199-W213 HydrophobicContact CG2-CH2 3.73Å; V199-W213 HydrophobicContact CG2-CZ3 3.48Å; V199-W213 VanDerWaalsContact CG2-CZ3 3.48Å
200	Y	54	Low	49.8	Very low	9 Å²	9	62.5 Å²	62.5	4%	0.035	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-43.8	177.7	-177.8	-96.5	0	0	0	112.9	Y81 I82 H118 A196 F197 V198 C203 L204	Y81-Y200 HydrophobicContact CD1-CD2 4.32Å; Y81-Y200 AromaticContact CD1-CE2 3.72Å; Y81-Y200 HydrophobicContact CD1-CE2 3.72Å; Y81-Y200 HydrophobicContact CE1-CD2 4.41Å; Y81-Y200 AromaticContact CE1-CE2 3.48Å; Y81-Y200 HydrophobicContact CE1-CE2 3.48Å; Y81-Y200 VanDerWaalsContact CE1-CE2 3.48Å; Y81-Y200 AromaticContact CE1-CZ 3.61Å; Y81-Y200 WeakPolarHBondContact CE1-OH 3.08Å; I82-Y200 HydrophobicContact CG1-CD2 3.73Å; H118-Y200 PolarHBondContact NE2-OH 2.76Å; A196-Y200 PolarHBondContact O-N 2.8Å; A196-Y200 VanDerWaalsContact O-N 3.08Å; F197-Y200 HydrophobicContact CE2-CD1 4.19Å; F197-Y200 HydrophobicContact CZ-CD1 4.39Å; F197-Y200 PolarHBondContact O-N 3.18Å; F197-Y200 VanDerWaalsContact O-N 3.13Å; V198-Y200 PolarHBondContact O-N 3.23Å; Y200-C203 WeakPolarHBondContact O-CB 3.28Å; Y200-C203 PolarHBondContact O-N 3.43Å; Y200-L204 HydrophobicContact CE1-CD1 3.8Å; Y200-L204 HydrophobicContact CE1-CD2 4.32Å; Y200-L204 HydrophobicContact CE2-CD1 3.91Å; Y200-L204 VanDerWaalsContact CZ-CD1 3.45Å; Y200-L204 PolarHBondContact O-N 3.13Å; Y200-L204 WeakPolarHBondContact OH-CD1 3.2Å
201	F	51.5	Low	48.7	Very low	57 Å²	57	62.4 Å²	62.4	25%	0.25	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-43.1	179.1	-110.2	-90.1	0	0	0	112.1	L14 F197 V198 C203 L204 R205	L14-F201 HydrophobicContact CD1-CE1 4.02Å; L14-F201 HydrophobicContact CD1-CZ 3.57Å; L14-F201 HydrophobicContact CD2-CE1 3.73Å; L14-F201 HydrophobicContact CD2-CZ 3.96Å; L14-F201 HydrophobicContact CG-CZ 4.43Å; F197-F201 AromaticContact CD1-CD2 3.68Å; F197-F201 HydrophobicContact CD1-CD2 3.68Å; F197-F201 AromaticContact CD1-CE2 3.97Å; F197-F201 HydrophobicContact CD1-CE2 3.97Å; F197-F201 AromaticContact CE1-CD2 3.52Å; F197-F201 HydrophobicContact CE1-CD2 3.52Å; F197-F201 AromaticContact CE1-CE2 3.36Å; F197-F201 HydrophobicContact CE1-CE2 3.36Å; F197-F201 HydrophobicContact CZ-CD2 4.25Å; F197-F201 HydrophobicContact CZ-CE2 4.06Å; F197-F201 WeakPolarHBondContact O-CB 3.34Å; F197-F201 PolarHBondContact O-N 3.05Å; V198-F201 PolarHBondContact O-N 3.45Å; F201-C203 VanDerWaalsContact C-N 3.27Å; F201-C203 PolarHBondContact O-N 3.31Å; F201-L204 PolarHBondContact O-N 2.88Å; F201-R205 PolarHBondContact O-N 3.4Å
202	V	48.7	Very low	48.1	Very low	25 Å²	25	55.6 Å²	55.6	15%	0.152	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-41	170.4	156.4	0	0	0	0	111	F94 V198 L204 V208 W213	F94-V202 HydrophobicContact CD1-CG1 4.29Å; F94-V202 HydrophobicContact CE1-CG1 4.43Å; V198-V202 HydrophobicContact CG1-CG2 4.1Å; V198-V202 WeakPolarHBondContact O-CB 3.19Å; V198-V202 WeakPolarHBondContact O-CG2 3.2Å; V198-V202 PolarHBondContact O-N 3.09Å; V202-L204 VanDerWaalsContact C-N 3.35Å; V202-V208 HydrophobicContact CB-CG2 3.8Å; V202-V208 HydrophobicContact CG1-CB 3.45Å; V202-V208 VanDerWaalsContact CG1-CB 3.45Å; V202-V208 HydrophobicContact CG1-CG1 3.81Å; V202-V208 HydrophobicContact CG1-CG2 3.21Å; V202-V208 HydrophobicContact CG2-CG2 3.64Å; V202-W213 HydrophobicContact CG1-CZ2 3.77Å
203	C	47.8	Very low	47.1	Very low	16 Å²	16	49.1 Å²	49.1	11%	0.108	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-36.3	175.7	-71.9	0	0	0	0	113.1	F94 V199 Y200 F201	F94-C203 HydrophobicContact CD1-CB 4.49Å; F94-C203 HydrophobicContact CD2-CB 4.15Å; F94-C203 WeakPolarHBondContact CD2-SG 3.36Å; F94-C203 HydrophobicContact CE1-CB 4.3Å; F94-C203 HydrophobicContact CE2-CB 3.9Å; F94-C203 HydrophobicContact CG-CB 4.45Å; F94-C203 WeakPolarHBondContact CG-SG 3.42Å; F94-C203 VanDerWaalsContact CZ-CA 3.4Å; F94-C203 HydrophobicContact CZ-CB 4.02Å; F94-C203 WeakPolarHBondContact CZ-O 3.39Å; V199-C203 WeakPolarHBondContact O-CB 3.46Å; V199-C203 PolarHBondContact O-N 3Å; V199-C203 PolarHBondContact O-SG 3.02Å; Y200-C203 WeakPolarHBondContact O-CB 3.28Å; Y200-C203 PolarHBondContact O-N 3.43Å; F201-C203 VanDerWaalsContact C-N 3.27Å; F201-C203 PolarHBondContact O-N 3.31Å
204	L	49.5	Very low	46.1	Very low	95 Å²	95	52 Å²	52	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-81.9	-38.1	-176.3	-122.3	83.9	0	0	0	114	Y200 F201 V202	Y200-L204 HydrophobicContact CE1-CD1 3.8Å; Y200-L204 HydrophobicContact CE1-CD2 4.32Å; Y200-L204 HydrophobicContact CE2-CD1 3.91Å; Y200-L204 VanDerWaalsContact CZ-CD1 3.45Å; Y200-L204 PolarHBondContact O-N 3.13Å; Y200-L204 WeakPolarHBondContact OH-CD1 3.2Å; F201-L204 PolarHBondContact O-N 2.88Å; V202-L204 VanDerWaalsContact C-N 3.35Å
205	R	43.8	Very low	45.7	Very low	80 Å²	80	50.2 Å²	50.2	30%	0.302	26%	0.263	S	S	.	.	H	α-helix	trans	-94.3	-41.2	-162.2	-103.8	-168.3	176.5	-169.5	-1.7	117.5	C11 F201	C11-R205 VanDerWaalsContact CB-NH2 3.29Å; C11-R205 PolarHBondContact SG-NH2 2.88Å; F201-R205 PolarHBondContact O-N 3.4Å
206	R	43.8	Very low	45	Very low	141 Å²	141	47.8 Å²	47.8	53%	0.532	25%	0.252	S	S	.	.	S	Bend	trans	169.6	173.4	177.2	-105	156.4	176.5	-149.1	-1.8	112	E36 V208	E36-R206 PolarHBondContact O-NH1 2.84Å; R206-V208 PolarHBondContact O-N 2.75Å
207	Q	41.7	Very low	44.2	Very low	116 Å²	116	51.3 Å²	51.3	54%	0.542	27%	0.271	S	S	.	.			trans	-43.4	88.6	-175.1	-61.7	167.5	3.8	0	0	115.9	R93 T209	R93-Q207 VanDerWaalsContact NH2-N 3.13Å; Q207-T209 PolarHBondContact O-N 2.8Å
208	V	38.9	Very low	43.1	Very low	31 Å²	31	62.6 Å²	62.6	19%	0.188	31%	0.312	C	S	.	.			trans	-78.4	117.6	164.9	176.6	0	0	0	0	108.4	V202 R206 D212 W213	V202-V208 HydrophobicContact CB-CG2 3.8Å; V202-V208 HydrophobicContact CG1-CB 3.45Å; V202-V208 VanDerWaalsContact CG1-CB 3.45Å; V202-V208 HydrophobicContact CG1-CG1 3.81Å; V202-V208 HydrophobicContact CG1-CG2 3.21Å; V202-V208 HydrophobicContact CG2-CG2 3.64Å; R206-V208 PolarHBondContact O-N 2.75Å; V208-D212 HydrophobicContact CG1-CB 3.48Å; V208-D212 VanDerWaalsContact CG1-CB 3.48Å; V208-W213 HydrophobicContact CG1-CG 4.14Å
209	T	39.2	Very low	42.7	Very low	72 Å²	72	62.8 Å²	62.8	44%	0.442	31%	0.309	S	S	.	.			trans	-68.4	149.3	172.2	69.8	0	0	0	0	107.8	Q207 A211 D212 W213	Q207-T209 PolarHBondContact O-N 2.8Å; T209-A211 PolarHBondContact O-N 3.42Å; T209-D212 PolarHBondContact N-OD2 2.71Å; T209-D212 WeakPolarHBondContact O-CB 3.08Å; T209-D212 PolarHBondContact O-N 3.27Å; T209-D212 PolarHBondContact OG1-OD2 2.7Å; T209-W213 PolarHBondContact O-N 3.05Å
210	S	36.4	Very low	42.2	Very low	21 Å²	21	65.5 Å²	65.5	15%	0.147	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-11.8	-179.3	126.3	0	0	0	0	114.1	Q98 D212 N214	Q98-S210 VanDerWaalsContact CG-CB 3.49Å; Q98-S210 WeakPolarHBondContact CG-OG 3.17Å; Q98-S210 VanDerWaalsContact NE2-CB 3.31Å; Q98-S210 PolarHBondContact NE2-OG 3.16Å; Q98-S210 PolarHBondContact OE1-OG 3.44Å; S210-D212 VanDerWaalsContact C-N 3.33Å; S210-N214 PolarHBondContact O-N 3.23Å; S210-N214 PolarHBondContact O-ND2 3.48Å
211	A	38.5	Very low	41.6	Very low	50 Å²	50	68.6 Å²	68.6	41%	0.413	34%	0.338	S	S	.	.	H	α-helix	trans	-65.8	-38.9	170.3	0	0	0	0	0	111.4	T209 A215	T209-A211 PolarHBondContact O-N 3.42Å; A211-A215 PolarHBondContact O-N 2.89Å
212	D	43.6	Very low	41	Very low	21 Å²	21	69.3 Å²	69.3	11%	0.112	34%	0.343	C	S	.	.	H	α-helix	trans	-74.1	-29	-179.8	-56.5	-43.6	0	0	0	111.3	R45 V208 T209 S210 A215 C216	R45-D212 IonicContact CZ-OD1 2.65Å; R45-D212 IonicContact NE-OD1 3.16Å; R45-D212 IonicContact NH2-OD1 3.54Å; R45-D212 PolarHBondContact NH2-OD1 3.06Å; V208-D212 HydrophobicContact CG1-CB 3.48Å; V208-D212 VanDerWaalsContact CG1-CB 3.48Å; T209-D212 PolarHBondContact N-OD2 2.71Å; T209-D212 WeakPolarHBondContact O-CB 3.08Å; T209-D212 PolarHBondContact O-N 3.27Å; T209-D212 PolarHBondContact OG1-OD2 2.7Å; S210-D212 VanDerWaalsContact C-N 3.33Å; D212-A215 PolarHBondContact O-N 2.77Å; D212-C216 PolarHBondContact O-N 3.39Å; D212-C216 PolarHBondContact O-SG 2.79Å
213	W	36.8	Very low	40.5	Very low	21 Å²	21	72.1 Å²	72.1	8%	0.08	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-47.2	171.5	-86.4	95.9	0	0	0	113.3	F94 F95 I136 V199 V202 V208 T209 A215 C216 L217	F94-W213 HydrophobicContact CB-CH2 4.16Å; F94-W213 HydrophobicContact CB-CZ2 3.61Å; F94-W213 AromaticContact CD1-CZ2 3.93Å; F94-W213 HydrophobicContact CD1-CZ2 3.93Å; F94-W213 HydrophobicContact CG-CZ2 4.21Å; F94-W213 VanDerWaalsContact O-CH2 3.22Å; F94-W213 WeakPolarHBondContact O-CH2 2.9Å; F94-W213 WeakPolarHBondContact O-CZ2 2.97Å; F95-W213 HydrophobicContact CD1-CH2 4.21Å; F95-W213 HydrophobicContact CE1-CH2 4.09Å; I136-W213 HydrophobicContact CG2-CZ3 4.45Å; V199-W213 HydrophobicContact CB-CH2 4.06Å; V199-W213 HydrophobicContact CB-CZ3 4.32Å; V199-W213 HydrophobicContact CG1-CH2 3.59Å; V199-W213 HydrophobicContact CG1-CZ3 4.16Å; V199-W213 HydrophobicContact CG2-CE3 4.47Å; V199-W213 HydrophobicContact CG2-CH2 3.73Å; V199-W213 HydrophobicContact CG2-CZ3 3.48Å; V199-W213 VanDerWaalsContact CG2-CZ3 3.48Å; V202-W213 HydrophobicContact CG1-CZ2 3.77Å; V208-W213 HydrophobicContact CG1-CG 4.14Å; T209-W213 PolarHBondContact O-N 3.05Å; W213-A215 PolarHBondContact O-N 3.07Å; W213-C216 PolarHBondContact O-N 3.28Å; W213-C216 VanDerWaalsContact O-N 3.16Å; W213-L217 PolarHBondContact O-N 3.21Å
214	N	37	Very low	40.1	Very low	64 Å²	64	75.8 Å²	75.8	34%	0.342	37%	0.372	S	S	.	.	H	α-helix	trans	-68.3	-20.8	178.7	-73.8	-36.5	0	0	0	112.5	S210	S210-N214 PolarHBondContact O-N 3.23Å; S210-N214 PolarHBondContact O-ND2 3.48Å
215	A	44.5	Very low	39.4	Very low	37 Å²	37	74.4 Å²	74.4	31%	0.306	36%	0.363	S	S	.	.	H	α-helix	trans	-81.9	-20.2	174.3	0	0	0	0	0	113.4	A211 D212 W213	A211-A215 PolarHBondContact O-N 2.89Å; D212-A215 PolarHBondContact O-N 2.77Å; W213-A215 PolarHBondContact O-N 3.07Å
216	C	38.9	Very low	39	Very low	34 Å²	34	74 Å²	74	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-88.6	-17.1	175.4	-64.7	0	0	0	0	113.5	V198 D212 W213	V198-C216 HydrophobicContact CG1-CB 4.15Å; V198-C216 VanDerWaalsContact CG1-SG 3.59Å; D212-C216 PolarHBondContact O-N 3.39Å; D212-C216 PolarHBondContact O-SG 2.79Å; W213-C216 PolarHBondContact O-N 3.28Å; W213-C216 VanDerWaalsContact O-N 3.16Å
217	L	35	Very low	38.6	Very low	75 Å²	75	68.4 Å²	68.4	39%	0.393	35%	0.354	S	S	.	.			trans	-97	-3	-178.9	-74.1	170.3	0	0	0	113.8	W213	W213-L217 PolarHBondContact O-N 3.21Å
218	R	33.1	Very low	38.4	Very low	279 Å²	279	64.1 Å²	64.1	100%	1.053	34%	0.337	S	S	*	.			trans	-99.8	0	170.8	-70.5	-175.3	-164	-131.8	3.2	109.3

Retrieved 218 of 218 residues in 583 ms (Link to these results)

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