A0A077ZK94_TRITR Loading...

Cation ATPase N and E1-E2 ATPase domain containin g protein

AlphaFold DB , UniProt , Accession A0A077ZK94, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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	65.3	Low	77	Confident	58 Å²	58	91.5 Å²	91.5	29%	0.286	48%	0.476	S	S	.	.				0	105	0	-177.5	-174.5	-156.7	0	0	106.7	A4 K7 H15 F16	M1-A4 HydrophobicContact CB-CB 4.48Å; M1-A4 HydrophobicContact CG-CB 4.47Å; M1-A4 HydrophobicContact SD-CB 4.25Å; M1-K7 HydrophobicContact CE-CB 4.22Å; M1-K7 HydrophobicContact CE-CD 3.78Å; M1-K7 HydrophobicContact CE-CG 3.5Å; M1-K7 HydrophobicContact SD-CG 4.3Å; M1-H15 HydrophobicContact CE-CB 4.03Å; M1-H15 HydrophobicContact SD-CB 4.28Å; M1-F16 HydrophobicContact CB-CE2 4.1Å; M1-F16 HydrophobicContact CB-CZ 3.94Å
2	E	70	Confident	77.4	Confident	154 Å²	154	85.6 Å²	85.6	72%	0.72	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	142.4	174.6	-63.3	-164.3	137.2	0	0	109.5	A4 W167	E2-A4 PolarHBondContact O-N 3.09Å; E2-W167 HydrophobicContact CG-CH2 4.19Å; E2-W167 HydrophobicContact CG-CZ3 4.42Å
3	L	74.7	Confident	77.8	Confident	101 Å²	101	82.5 Å²	82.5	53%	0.529	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	30.9	179.8	-51	172.8	0	0	0	116.1	H5 T6	L3-H5 PolarHBondContact O-N 3.47Å; L3-T6 HydrophobicContact CB-CG2 4.26Å; L3-T6 PolarHBondContact O-N 3.05Å; L3-T6 PolarHBondContact O-OG1 2.94Å
4	A	73.7	Confident	78.2	Confident	5 Å²	5	83.2 Å²	83.2	4%	0.041	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-56.1	-21.6	178.3	0	0	0	0	0	114.2	M1 E2 T6 K7 N163	M1-A4 HydrophobicContact CB-CB 4.48Å; M1-A4 HydrophobicContact CG-CB 4.47Å; M1-A4 HydrophobicContact SD-CB 4.25Å; E2-A4 PolarHBondContact O-N 3.09Å; A4-T6 PolarHBondContact O-N 2.88Å; A4-K7 PolarHBondContact O-N 2.99Å; A4-N163 VanDerWaalsContact CB-ND2 3.27Å; A4-N163 WeakPolarHBondContact CB-ND2 3.41Å
5	H	77.4	Confident	78.5	Confident	148 Å²	148	84.8 Å²	84.8	69%	0.685	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-68.1	-16.4	173.9	66.8	-93	0	0	0	114.5	L3	L3-H5 PolarHBondContact O-N 3.47Å
6	T	81.1	Confident	78.7	Confident	86 Å²	86	82 Å²	82	53%	0.528	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-92.1	-7.5	177.3	64.8	0	0	0	0	113	L3 A4	L3-T6 HydrophobicContact CB-CG2 4.26Å; L3-T6 PolarHBondContact O-N 3.05Å; L3-T6 PolarHBondContact O-OG1 2.94Å; A4-T6 PolarHBondContact O-N 2.88Å
7	K	77.2	Confident	79.1	Confident	94 Å²	94	84.8 Å²	84.8	41%	0.409	45%	0.447	S	S	.	.	S	Bend	trans	-101.6	143.9	-171.8	-65.6	-77.1	176.4	-170.2	0	110.3	M1 A4 E11	M1-K7 HydrophobicContact CE-CB 4.22Å; M1-K7 HydrophobicContact CE-CD 3.78Å; M1-K7 HydrophobicContact CE-CG 3.5Å; M1-K7 HydrophobicContact SD-CG 4.3Å; A4-K7 PolarHBondContact O-N 2.99Å; K7-E11 HydrophobicContact CB-CB 4.35Å; K7-E11 HydrophobicContact CD-CB 4.27Å; K7-E11 IonicContact NZ-OE1 3.59Å
8	S	83.1	Confident	79.3	Confident	55 Å²	55	80.9 Å²	80.9	39%	0.385	43%	0.428	S	S	.	.			trans	-69	157.5	171.1	65.1	0	0	0	0	110.7	P10 E11 T12	S8-P10 VanDerWaalsContact C-N 3.35Å; S8-E11 WeakPolarHBondContact CB-OE2 3.32Å; S8-E11 PolarHBondContact N-OE2 3.08Å; S8-E11 PolarHBondContact O-N 3.18Å; S8-E11 VanDerWaalsContact OG-CG 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.47Å; S8-E11 PolarHBondContact OG-N 3.08Å; S8-E11 PolarHBondContact OG-OE2 2.81Å; S8-T12 PolarHBondContact O-N 3.08Å; S8-T12 PolarHBondContact O-OG1 2.91Å
9	I	80.7	Confident	79.5	Confident	125 Å²	125	79.8 Å²	79.8	64%	0.641	42%	0.422	S	S	*	.	H	α-helix	trans	-54.5	-46.7	177.3	-58.8	171.6	0	0	0	111.1	E11 T12 L13	I9-E11 PolarHBondContact O-N 3.12Å; I9-T12 PolarHBondContact O-N 3.25Å; I9-L13 HydrophobicContact CG2-CD1 3.93Å; I9-L13 HydrophobicContact CG2-CG 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.43Å; I9-L13 PolarHBondContact O-N 2.82Å
10	P	82.1	Confident	79.4	Confident	92 Å²	92	79.5 Å²	79.5	60%	0.597	43%	0.427	S	S	*	.	H	α-helix	trans	-62.7	-37.9	177.9	-23.1	35.3	0	0	0	113.7	S8 T12 S14	S8-P10 VanDerWaalsContact C-N 3.35Å; P10-T12 VanDerWaalsContact C-N 3.31Å; P10-T12 PolarHBondContact O-N 2.74Å; P10-S14 WeakPolarHBondContact O-CB 3.4Å; P10-S14 PolarHBondContact O-N 3.19Å
11	E	82.3	Confident	79.4	Confident	89 Å²	89	83.4 Å²	83.4	42%	0.416	44%	0.442	S	S	.	.	H	α-helix	trans	-64.5	-37.6	175.8	-74.2	171.8	116.3	0	0	111.8	K7 S8 I9 H15	K7-E11 HydrophobicContact CB-CB 4.35Å; K7-E11 HydrophobicContact CD-CB 4.27Å; K7-E11 IonicContact NZ-OE1 3.59Å; S8-E11 WeakPolarHBondContact CB-OE2 3.32Å; S8-E11 PolarHBondContact N-OE2 3.08Å; S8-E11 PolarHBondContact O-N 3.18Å; S8-E11 VanDerWaalsContact OG-CG 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.47Å; S8-E11 PolarHBondContact OG-N 3.08Å; S8-E11 PolarHBondContact OG-OE2 2.81Å; I9-E11 PolarHBondContact O-N 3.12Å; E11-H15 WeakPolarHBondContact O-CB 3.43Å; E11-H15 PolarHBondContact O-N 2.89Å
12	T	81.8	Confident	80.3	Confident	20 Å²	20	88.4 Å²	88.4	12%	0.123	46%	0.458	C	S	.	.	H	α-helix	trans	-69.5	-46.2	179.3	-53.5	0	0	0	0	110.6	S8 I9 P10 S14 H15 F16	S8-T12 PolarHBondContact O-N 3.08Å; S8-T12 PolarHBondContact O-OG1 2.91Å; I9-T12 PolarHBondContact O-N 3.25Å; P10-T12 VanDerWaalsContact C-N 3.31Å; P10-T12 PolarHBondContact O-N 2.74Å; T12-S14 VanDerWaalsContact C-N 3.32Å; T12-S14 PolarHBondContact O-N 2.98Å; T12-H15 PolarHBondContact O-N 3.14Å; T12-F16 HydrophobicContact CG2-CD2 4.26Å; T12-F16 HydrophobicContact CG2-CE2 4.28Å; T12-F16 WeakPolarHBondContact O-CD2 3.23Å; T12-F16 PolarHBondContact O-N 3.49Å
13	L	82.6	Confident	81.1	Confident	45 Å²	45	81 Å²	81	24%	0.236	42%	0.424	C	S	.	.	H	α-helix	trans	-60.6	-41.9	174.7	-69.8	171.2	0	0	0	111.7	I9 N17 V18	I9-L13 HydrophobicContact CG2-CD1 3.93Å; I9-L13 HydrophobicContact CG2-CG 4.35Å; I9-L13 WeakPolarHBondContact O-CG 3.43Å; I9-L13 PolarHBondContact O-N 2.82Å; L13-N17 WeakPolarHBondContact O-CA 3.41Å; L13-N17 PolarHBondContact O-N 2.8Å; L13-V18 HydrophobicContact CD2-CB 4.16Å; L13-V18 HydrophobicContact CD2-CG1 4.13Å; L13-V18 PolarHBondContact O-N 2.84Å
14	S	83.3	Confident	81.7	Confident	93 Å²	93	76.5 Å²	76.5	65%	0.65	40%	0.4	S	S	*	.	H	α-helix	trans	-66.5	-38.2	176.9	-178.2	0	0	0	0	112.3	P10 T12 F16 N17	P10-S14 WeakPolarHBondContact O-CB 3.4Å; P10-S14 PolarHBondContact O-N 3.19Å; T12-S14 VanDerWaalsContact C-N 3.32Å; T12-S14 PolarHBondContact O-N 2.98Å; S14-F16 PolarHBondContact O-N 3.17Å; S14-N17 PolarHBondContact O-N 3.44Å
15	H	82.9	Confident	82.5	Confident	107 Å²	107	77.5 Å²	77.5	50%	0.495	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-41.7	178.4	-176.5	76.8	0	0	0	112.6	M1 E11 T12	M1-H15 HydrophobicContact CE-CB 4.03Å; M1-H15 HydrophobicContact SD-CB 4.28Å; E11-H15 WeakPolarHBondContact O-CB 3.43Å; E11-H15 PolarHBondContact O-N 2.89Å; T12-H15 PolarHBondContact O-N 3.14Å
16	F	81.6	Confident	83	Confident	40 Å²	40	74.6 Å²	74.6	18%	0.175	40%	0.396	C	S	.	.	H	α-helix	trans	-89.8	-3.2	177.6	-68	-74.1	0	0	0	113.4	M1 T12 S14 V18 P146	M1-F16 HydrophobicContact CB-CE2 4.1Å; M1-F16 HydrophobicContact CB-CZ 3.94Å; T12-F16 HydrophobicContact CG2-CD2 4.26Å; T12-F16 HydrophobicContact CG2-CE2 4.28Å; T12-F16 WeakPolarHBondContact O-CD2 3.23Å; T12-F16 PolarHBondContact O-N 3.49Å; S14-F16 PolarHBondContact O-N 3.17Å; F16-V18 VanDerWaalsContact C-N 3.3Å; F16-V18 HydrophobicContact CB-CG2 3.53Å; F16-V18 PolarHBondContact O-N 2.89Å; F16-P146 HydrophobicContact CE1-CB 3.82Å; F16-P146 HydrophobicContact CZ-CB 4.21Å
17	N	85	Confident	83.4	Confident	129 Å²	129	74 Å²	74	69%	0.69	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	47.7	-174.6	-162.6	33.4	0	0	0	112.2	L13 S14 Q28	L13-N17 WeakPolarHBondContact O-CA 3.41Å; L13-N17 PolarHBondContact O-N 2.8Å; S14-N17 PolarHBondContact O-N 3.44Å; N17-Q28 PolarHBondContact O-NE2 2.79Å
18	V	82.8	Confident	84	Confident	15 Å²	15	71.5 Å²	71.5	9%	0.091	39%	0.39	C	S	.	.			trans	-104.1	135.2	-175.7	176.6	0	0	0	0	109.8	L13 F16 L24 G147 I149	L13-V18 HydrophobicContact CD2-CB 4.16Å; L13-V18 HydrophobicContact CD2-CG1 4.13Å; L13-V18 PolarHBondContact O-N 2.84Å; F16-V18 VanDerWaalsContact C-N 3.3Å; F16-V18 HydrophobicContact CB-CG2 3.53Å; F16-V18 PolarHBondContact O-N 2.89Å; V18-L24 HydrophobicContact CG2-CD2 3.36Å; V18-L24 HydrophobicContact CG2-CG 3.89Å; V18-G147 VanDerWaalsContact CG2-O 3.32Å; V18-G147 WeakPolarHBondContact CG2-O 3.45Å; V18-I149 HydrophobicContact CG1-CD1 3.78Å; V18-I149 HydrophobicContact CG1-CG1 3.89Å
19	D	82.4	Confident	84.4	Confident	60 Å²	60	69 Å²	69	32%	0.321	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-79.1	126.2	167.9	-176.6	-45.1	0	0	0	109.3	E21 R22 G23 I149	D19-E21 PolarHBondContact O-N 2.94Å; D19-E21 PolarHBondContact OD1-N 2.77Å; D19-R22 HydrophobicContact CB-CB 4.1Å; D19-R22 PolarHBondContact OD1-N 3.22Å; D19-R22 VanDerWaalsContact OD1-N 3.08Å; D19-G23 VanDerWaalsContact O-CA 3.27Å; D19-G23 WeakPolarHBondContact O-CA 3.27Å; D19-G23 PolarHBondContact O-N 2.88Å; D19-I149 VanDerWaalsContact O-CD1 3.27Å; D19-I149 WeakPolarHBondContact O-CD1 3.27Å
20	S	78.4	Confident	84.8	Confident	74 Å²	74	68 Å²	68	52%	0.517	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26	-177.5	52.8	0	0	0	0	114.6	I149	S20-I149 VanDerWaalsContact O-CD1 3.32Å; S20-I149 WeakPolarHBondContact O-CD1 3.32Å
21	E	80	Confident	85.2	Confident	162 Å²	162	70.4 Å²	70.4	76%	0.757	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-35.2	-178.5	-64	-171	165.2	0	0	112.2	D19 I129	D19-E21 PolarHBondContact O-N 2.94Å; D19-E21 PolarHBondContact OD1-N 2.77Å; E21-I129 WeakPolarHBondContact O-CG2 3.27Å
22	R	82.7	Confident	85.5	Confident	162 Å²	162	66.6 Å²	66.6	61%	0.611	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-18.8	-175.4	-52.9	-179	175.1	174.1	0.3	113.7	D19 R130 Q131	D19-R22 HydrophobicContact CB-CB 4.1Å; D19-R22 PolarHBondContact OD1-N 3.22Å; D19-R22 VanDerWaalsContact OD1-N 3.08Å; R22-R130 CarbonylContact O-C 3.49Å; R22-R130 WeakPolarHBondContact O-CA 3.41Å; R22-Q131 HydrophobicContact CB-CG 3.82Å; R22-Q131 WeakPolarHBondContact O-CA 3.14Å; R22-Q131 WeakPolarHBondContact O-CG 3.27Å; R22-Q131 PolarHBondContact O-N 3.27Å
23	G	87.3	Confident	85.9	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	70.4	-159.5	-176.1	0	0	0	0	0	113.8	D19 I129 Q131	D19-G23 VanDerWaalsContact O-CA 3.27Å; D19-G23 WeakPolarHBondContact O-CA 3.27Å; D19-G23 PolarHBondContact O-N 2.88Å; G23-I129 WeakPolarHBondContact CA-O 3.27Å; G23-Q131 VanDerWaalsContact O-CG 3.27Å; G23-Q131 WeakPolarHBondContact O-CG 3.45Å; G23-Q131 PolarHBondContact O-NE2 3.37Å; G23-Q131 VanDerWaalsContact O-NE2 3.14Å
24	L	87.3	Confident	86.3	Confident	6 Å²	6	70 Å²	70	3%	0.031	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-73.9	144.1	179.5	-73.8	175.1	0	0	0	112.1	V18 Q28 V29 R130 Q131 V145 D148	V18-L24 HydrophobicContact CG2-CD2 3.36Å; V18-L24 HydrophobicContact CG2-CG 3.89Å; L24-Q28 HydrophobicContact CB-CB 4.46Å; L24-Q28 HydrophobicContact CD2-CB 3.77Å; L24-Q28 HydrophobicContact CD2-CG 4.35Å; L24-V29 HydrophobicContact CB-CG2 3.88Å; L24-V29 HydrophobicContact CD1-CG2 4.25Å; L24-R130 WeakPolarHBondContact O-CA 3.32Å; L24-Q131 PolarHBondContact O-N 2.82Å; L24-V145 HydrophobicContact CD1-CG2 3.66Å; L24-D148 HydrophobicContact CD1-CB 4.48Å
25	S	89.6	Confident	86.6	Confident	26 Å²	26	72.8 Å²	72.8	18%	0.182	38%	0.38	C	S	.	.			trans	-75.2	155.5	166.4	64	0	0	0	0	111.4	A27 Q28 V29	S25-A27 PolarHBondContact O-N 2.6Å; S25-Q28 PolarHBondContact O-N 3.3Å; S25-Q28 VanDerWaalsContact OG-CG 3.3Å; S25-Q28 WeakPolarHBondContact OG-CG 3.43Å; S25-Q28 PolarHBondContact OG-N 3.33Å; S25-Q28 PolarHBondContact OG-OE1 3.03Å; S25-V29 WeakPolarHBondContact O-CG2 3.44Å; S25-V29 PolarHBondContact O-N 2.9Å
26	D	88.6	Confident	86.8	Confident	87 Å²	87	72.9 Å²	72.9	47%	0.465	38%	0.377	S	S	.	.	H	α-helix	trans	-57.2	-34.9	176.8	-67.2	-19.1	0	0	0	112	Q28 V29 E30 S132	D26-Q28 PolarHBondContact O-N 2.98Å; D26-V29 PolarHBondContact O-N 3.03Å; D26-E30 WeakPolarHBondContact O-CG 3.26Å; D26-E30 PolarHBondContact O-N 3.26Å; D26-S132 VanDerWaalsContact CG-CB 3.44Å; D26-S132 WeakPolarHBondContact OD1-CB 3.32Å; D26-S132 PolarHBondContact OD1-OG 3.2Å; D26-S132 WeakPolarHBondContact OD2-CB 3.46Å; D26-S132 PolarHBondContact OD2-OG 3.39Å
27	A	90.4	Very high	87.1	Confident	74 Å²	74	72.5 Å²	72.5	61%	0.612	39%	0.385	S	S	*	.	H	α-helix	trans	-63.5	-41	175.6	0	0	0	0	0	112.4	S25 Q31	S25-A27 PolarHBondContact O-N 2.6Å; A27-Q31 WeakPolarHBondContact O-CB 3.35Å; A27-Q31 PolarHBondContact O-N 2.89Å
28	Q	90	Very high	87.2	Confident	40 Å²	40	71.8 Å²	71.8	19%	0.187	37%	0.373	C	S	.	.	H	α-helix	trans	-70	-34.3	175.4	-69.7	166.9	-66.5	0	0	111.8	N17 L24 S25 D26 Q31 G32	N17-Q28 PolarHBondContact O-NE2 2.79Å; L24-Q28 HydrophobicContact CB-CB 4.46Å; L24-Q28 HydrophobicContact CD2-CB 3.77Å; L24-Q28 HydrophobicContact CD2-CG 4.35Å; S25-Q28 PolarHBondContact O-N 3.3Å; S25-Q28 VanDerWaalsContact OG-CG 3.3Å; S25-Q28 WeakPolarHBondContact OG-CG 3.43Å; S25-Q28 PolarHBondContact OG-N 3.33Å; S25-Q28 PolarHBondContact OG-OE1 3.03Å; D26-Q28 PolarHBondContact O-N 2.98Å; Q28-Q31 PolarHBondContact O-N 3.21Å; Q28-G32 PolarHBondContact O-N 3.46Å
29	V	89.7	Confident	87.3	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.012	38%	0.38	C	S	.	.	H	α-helix	trans	-65.3	-47.3	175.9	174.3	0	0	0	0	110.9	L24 S25 D26 Q31 G32 R33 V145	L24-V29 HydrophobicContact CB-CG2 3.88Å; L24-V29 HydrophobicContact CD1-CG2 4.25Å; S25-V29 WeakPolarHBondContact O-CG2 3.44Å; S25-V29 PolarHBondContact O-N 2.9Å; D26-V29 PolarHBondContact O-N 3.03Å; V29-Q31 VanDerWaalsContact C-N 3.34Å; V29-Q31 PolarHBondContact O-N 3.18Å; V29-G32 PolarHBondContact O-N 3.41Å; V29-R33 WeakPolarHBondContact O-CB 3.42Å; V29-R33 PolarHBondContact O-N 3.47Å; V29-V145 HydrophobicContact CB-CG2 4.42Å; V29-V145 HydrophobicContact CG1-CG1 4.34Å; V29-V145 HydrophobicContact CG1-CG2 4.23Å; V29-V145 HydrophobicContact CG2-CG2 4.23Å
30	E	90.7	Very high	86.9	Confident	106 Å²	106	74.7 Å²	74.7	50%	0.495	39%	0.385	S	S	.	.	H	α-helix	trans	-63.6	-40	176.5	-68.3	-53.3	135.1	0	0	111.6	D26 R33 A34	D26-E30 WeakPolarHBondContact O-CG 3.26Å; D26-E30 PolarHBondContact O-N 3.26Å; E30-R33 VanDerWaalsContact CD-NH1 3.31Å; E30-R33 PolarHBondContact O-N 3.45Å; E30-R33 IonicContact OE1-CZ 3.73Å; E30-R33 IonicContact OE1-NH1 3.7Å; E30-R33 PolarHBondContact OE1-NH1 2.88Å; E30-R33 IonicContact OE1-NH2 3.64Å; E30-R33 IonicContact OE2-NH1 2.73Å; E30-R33 PolarHBondContact OE2-NH1 3.24Å; E30-A34 WeakPolarHBondContact O-CB 3.42Å; E30-A34 PolarHBondContact O-N 3.3Å
31	Q	90.9	Very high	86.5	Confident	142 Å²	142	75.1 Å²	75.1	66%	0.664	38%	0.381	S	S	*	.	H	α-helix	trans	-64.3	-42.1	174.2	-172.7	-179.8	29.7	0	0	112.1	A27 Q28 V29 A34 K35	A27-Q31 WeakPolarHBondContact O-CB 3.35Å; A27-Q31 PolarHBondContact O-N 2.89Å; Q28-Q31 PolarHBondContact O-N 3.21Å; V29-Q31 VanDerWaalsContact C-N 3.34Å; V29-Q31 PolarHBondContact O-N 3.18Å; Q31-A34 PolarHBondContact O-N 2.97Å; Q31-K35 WeakPolarHBondContact O-CB 3.06Å; Q31-K35 PolarHBondContact O-N 2.97Å
32	G	88.5	Confident	86	Confident	9 Å²	9	71.9 Å²	71.9	9%	0.093	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-46.7	175.8	0	0	0	0	0	111.3	Q28 V29 A34 K35 Y36	Q28-G32 PolarHBondContact O-N 3.46Å; V29-G32 PolarHBondContact O-N 3.41Å; G32-A34 PolarHBondContact O-N 3.43Å; G32-K35 PolarHBondContact O-N 2.93Å; G32-K35 VanDerWaalsContact O-N 3.14Å; G32-Y36 WeakPolarHBondContact O-CB 3.19Å; G32-Y36 WeakPolarHBondContact O-CD2 3.27Å; G32-Y36 PolarHBondContact O-N 3.14Å
33	R	89.9	Confident	85.2	Confident	43 Å²	43	68.2 Å²	68.2	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-40.9	177.5	-170.6	-176.9	-64.4	140.9	3.4	111.9	V29 E30 K35 G37 Y38 V145	V29-R33 WeakPolarHBondContact O-CB 3.42Å; V29-R33 PolarHBondContact O-N 3.47Å; E30-R33 VanDerWaalsContact CD-NH1 3.31Å; E30-R33 PolarHBondContact O-N 3.45Å; E30-R33 IonicContact OE1-CZ 3.73Å; E30-R33 IonicContact OE1-NH1 3.7Å; E30-R33 PolarHBondContact OE1-NH1 2.88Å; E30-R33 IonicContact OE1-NH2 3.64Å; E30-R33 IonicContact OE2-NH1 2.73Å; E30-R33 PolarHBondContact OE2-NH1 3.24Å; R33-K35 PolarHBondContact O-N 3.04Å; R33-G37 VanDerWaalsContact O-CA 3.27Å; R33-G37 WeakPolarHBondContact O-CA 3.21Å; R33-G37 PolarHBondContact O-N 2.87Å; R33-Y38 HydrophobicContact CG-CE1 4.43Å; R33-V145 HydrophobicContact CB-CG1 4.08Å
34	A	90.6	Very high	84.2	Confident	92 Å²	92	75.8 Å²	75.8	76%	0.76	41%	0.414	S	S	*	.	H	α-helix	trans	-64.9	-29.9	175.6	0	0	0	0	0	112.7	E30 Q31 G32	E30-A34 WeakPolarHBondContact O-CB 3.42Å; E30-A34 PolarHBondContact O-N 3.3Å; Q31-A34 PolarHBondContact O-N 2.97Å; G32-A34 PolarHBondContact O-N 3.43Å
35	K	89.2	Confident	83.2	Confident	152 Å²	152	84.4 Å²	84.4	66%	0.661	45%	0.454	S	S	*	.	H	α-helix	trans	-88.2	-38.2	-178.5	-175.2	175.5	178.8	-172.9	0	113.8	Q31 G32 R33	Q31-K35 WeakPolarHBondContact O-CB 3.06Å; Q31-K35 PolarHBondContact O-N 2.97Å; G32-K35 PolarHBondContact O-N 2.93Å; G32-K35 VanDerWaalsContact O-N 3.14Å; R33-K35 PolarHBondContact O-N 3.04Å
36	Y	86.7	Confident	82.1	Confident	109 Å²	109	85.6 Å²	85.6	43%	0.427	47%	0.47	S	S	.	.	H	α-helix	trans	-111.7	-12.6	-170.2	-60.4	-68.8	0	0	0	113.6	G32 P146	G32-Y36 WeakPolarHBondContact O-CB 3.19Å; G32-Y36 WeakPolarHBondContact O-CD2 3.27Å; G32-Y36 PolarHBondContact O-N 3.14Å; Y36-P146 HydrophobicContact CD1-CG 4.21Å; Y36-P146 HydrophobicContact CD2-CB 4.28Å; Y36-P146 HydrophobicContact CD2-CG 3.75Å; Y36-P146 HydrophobicContact CE2-CB 4.28Å; Y36-P146 HydrophobicContact CE2-CG 4.2Å; Y36-P146 HydrophobicContact CG-CG 3.78Å
37	G	88.7	Confident	81.6	Confident	33 Å²	33	85.2 Å²	85.2	34%	0.34	47%	0.465	S	S	.	.			trans	80.9	-167.7	-174.3	0	0	0	0	0	113.3	R33	R33-G37 VanDerWaalsContact O-CA 3.27Å; R33-G37 WeakPolarHBondContact O-CA 3.21Å; R33-G37 PolarHBondContact O-N 2.87Å
38	Y	86.5	Confident	81.4	Confident	113 Å²	113	87.1 Å²	87.1	44%	0.443	46%	0.461	S	S	.	.			trans	-80.5	149.6	171.6	-70.3	-80.8	0	0	0	110.3	R33 E40 R142	R33-Y38 HydrophobicContact CG-CE1 4.43Å; Y38-E40 PolarHBondContact O-N 3.02Å; Y38-R142 WeakPolarHBondContact CA-O 3.2Å; Y38-R142 HydrophobicContact CD1-CG 4.49Å; Y38-R142 WeakPolarHBondContact CD1-O 3.45Å
39	N	84.4	Confident	81.2	Confident	43 Å²	43	88.7 Å²	88.7	23%	0.23	47%	0.47	C	S	.	.	S	Bend	trans	-81.2	66.2	174.1	175.8	41.6	0	0	0	110.6	A141 R142 L144 I166	N39-A141 PolarHBondContact ND2-O 3.3Å; N39-A141 VanDerWaalsContact ND2-O 3.07Å; N39-R142 PolarHBondContact N-O 2.88Å; N39-R142 WeakPolarHBondContact O-CA 3.34Å; N39-L144 HydrophobicContact CB-CB 4.1Å; N39-L144 WeakPolarHBondContact CB-O 3.39Å; N39-I166 HydrophobicContact CB-CG2 4.49Å; N39-I166 WeakPolarHBondContact OD1-CG2 3.09Å
40	E	74.9	Confident	81	Confident	93 Å²	93	95.3 Å²	95.3	44%	0.435	50%	0.495	S	S	.	.	S	Bend	trans	-134.6	140.6	175.7	61.1	-167.4	-175.4	0	0	108.8	Y38 R142	Y38-E40 PolarHBondContact O-N 3.02Å; E40-R142 HydrophobicContact CB-CB 4.38Å
41	L	70.8	Confident	81	Confident	83 Å²	83	93.5 Å²	93.5	44%	0.435	49%	0.487	S	S	.	.			trans	-64.3	138	170	-73.5	172.7	0	0	0	108.9	A43 E122	L41-A43 PolarHBondContact O-N 3.12Å; L41-E122 WeakPolarHBondContact CD1-OE1 3.36Å; L41-E122 WeakPolarHBondContact CG-OE1 3.46Å
42	P	68.3	Low	80.8	Confident	95 Å²	95	86.9 Å²	86.9	62%	0.617	46%	0.456	S	S	*	.			trans	-54.2	129.5	176.1	22	-31.2	0	0	0	109.5	E44 K119	P42-E44 PolarHBondContact O-N 3.28Å; P42-K119 PolarHBondContact O-NZ 3.07Å
43	A	66.5	Low	80.7	Confident	85 Å²	85	89.6 Å²	89.6	70%	0.702	47%	0.467	S	S	*	.			trans	-72	100.9	169.5	0	0	0	0	0	107.2	L41 E45	L41-A43 PolarHBondContact O-N 3.12Å; A43-E45 PolarHBondContact O-N 3.18Å
44	E	65.3	Low	80.7	Confident	158 Å²	158	92.4 Å²	92.4	74%	0.738	49%	0.485	S	S	*	.			trans	-58.8	123	162.6	-70.9	-171.8	163.9	0	0	107.5	P42 G46	P42-E44 PolarHBondContact O-N 3.28Å; E44-G46 PolarHBondContact O-N 3.13Å
45	E	66.3	Low	80.6	Confident	187 Å²	187	92 Å²	92	87%	0.874	47%	0.467	S	S	*	.			trans	-62.9	105.9	171.2	-67.2	-173.4	173	0	0	106.9	A43 K47	A43-E45 PolarHBondContact O-N 3.18Å; E45-K47 PolarHBondContact O-N 2.73Å
46	G	67.4	Low	80.5	Confident	51 Å²	51	87.6 Å²	87.6	53%	0.526	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-52.4	126.9	177.1	0	0	0	0	0	109.6	E44 Q48	E44-G46 PolarHBondContact O-N 3.13Å; G46-Q48 PolarHBondContact O-N 2.94Å
47	K	78.6	Confident	80.5	Confident	79 Å²	79	85.6 Å²	85.6	34%	0.343	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-66.7	139.6	-175.6	-70.1	177.6	-177.8	177.1	0	109.4	E45 L52 E55 E112	E45-K47 PolarHBondContact O-N 2.73Å; K47-L52 HydrophobicContact CB-CD2 3.58Å; K47-L52 HydrophobicContact CB-CG 3.8Å; K47-L52 HydrophobicContact CD-CD2 3.6Å; K47-L52 HydrophobicContact CG-CD2 4.24Å; K47-E55 WeakPolarHBondContact CD-OE1 3.48Å; K47-E55 VanDerWaalsContact CE-OE1 3.27Å; K47-E55 WeakPolarHBondContact CE-OE1 3.47Å; K47-E55 IonicContact NZ-OE1 3.47Å; K47-E55 PolarHBondContact NZ-OE1 2.95Å; K47-E55 IonicContact NZ-OE2 3.64Å; K47-E55 PolarHBondContact NZ-OE2 3.47Å; K47-E112 PolarHBondContact N-OE1 2.8Å
48	Q	85.6	Confident	80.6	Confident	115 Å²	115	89.3 Å²	89.3	54%	0.537	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-67.1	146.1	177.5	-60.3	-175	18.3	0	0	109.6	G46 W50 Q51 L52	G46-Q48 PolarHBondContact O-N 2.94Å; Q48-W50 HydrophobicContact CB-CG 4.49Å; Q48-W50 PolarHBondContact O-N 2.87Å; Q48-Q51 HydrophobicContact CB-CG 4.25Å; Q48-Q51 WeakPolarHBondContact O-CA 3.4Å; Q48-Q51 VanDerWaalsContact O-CB 3.31Å; Q48-Q51 WeakPolarHBondContact O-CB 3.47Å; Q48-Q51 PolarHBondContact O-N 2.98Å; Q48-L52 PolarHBondContact O-N 3.3Å
49	L	84.7	Confident	80.7	Confident	72 Å²	72	87.8 Å²	87.8	38%	0.377	46%	0.455	S	S	.	.	H	α-helix	trans	-52.5	-37.3	-175.3	-171.9	62.3	0	0	0	113.4	L52 I53 V105 R109	L49-L52 PolarHBondContact O-N 3.28Å; L49-I53 HydrophobicContact CG-CD1 4.14Å; L49-I53 WeakPolarHBondContact O-CD1 3.47Å; L49-I53 WeakPolarHBondContact O-CG1 3.3Å; L49-I53 PolarHBondContact O-N 3.18Å; L49-V105 HydrophobicContact CD1-CG1 3.27Å; L49-R109 VanDerWaalsContact CD1-CZ 3.5Å
50	W	87.3	Confident	81.1	Confident	141 Å²	141	91.7 Å²	91.7	53%	0.534	48%	0.475	S	S	.	.	H	α-helix	trans	-71.1	-31.9	177.5	67.8	-92.6	0	0	0	112.7	Q48 I53 L54	Q48-W50 HydrophobicContact CB-CG 4.49Å; Q48-W50 PolarHBondContact O-N 2.87Å; W50-I53 PolarHBondContact O-N 2.73Å; W50-L54 HydrophobicContact CE3-CD1 3.56Å; W50-L54 HydrophobicContact CE3-CG 4.42Å; W50-L54 HydrophobicContact CZ3-CD1 3.65Å; W50-L54 VanDerWaalsContact O-CG 3.31Å; W50-L54 WeakPolarHBondContact O-CG 3.11Å; W50-L54 PolarHBondContact O-N 3.11Å
51	Q	89.8	Confident	81.9	Confident	69 Å²	69	93 Å²	93	32%	0.322	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-46.5	173.4	-66.3	173.5	-35	0	0	109.6	Q48 I53 L54 E55	Q48-Q51 HydrophobicContact CB-CG 4.25Å; Q48-Q51 WeakPolarHBondContact O-CA 3.4Å; Q48-Q51 VanDerWaalsContact O-CB 3.31Å; Q48-Q51 WeakPolarHBondContact O-CB 3.47Å; Q48-Q51 PolarHBondContact O-N 2.98Å; Q51-I53 VanDerWaalsContact C-N 3.31Å; Q51-I53 PolarHBondContact O-N 3.14Å; Q51-L54 PolarHBondContact O-N 3.01Å; Q51-L54 VanDerWaalsContact O-N 3.15Å; Q51-E55 WeakPolarHBondContact O-CG 3.32Å; Q51-E55 PolarHBondContact O-N 3.19Å
52	L	86.9	Confident	82.9	Confident	3 Å²	3	89.9 Å²	89.9	2%	0.016	47%	0.469	C	S	.	.	H	α-helix	trans	-57.8	-43.6	175.1	-66.5	179.6	0	0	0	112	K47 Q48 L49 E55 Q56 V105 E108	K47-L52 HydrophobicContact CB-CD2 3.58Å; K47-L52 HydrophobicContact CB-CG 3.8Å; K47-L52 HydrophobicContact CD-CD2 3.6Å; K47-L52 HydrophobicContact CG-CD2 4.24Å; Q48-L52 PolarHBondContact O-N 3.3Å; L49-L52 PolarHBondContact O-N 3.28Å; L52-E55 PolarHBondContact O-N 2.99Å; L52-Q56 WeakPolarHBondContact O-CG 2.92Å; L52-Q56 PolarHBondContact O-N 2.91Å; L52-V105 HydrophobicContact CB-CG2 4Å; L52-E108 HydrophobicContact CD1-CB 4.42Å; L52-E108 HydrophobicContact CD1-CG 4.38Å; L52-E108 HydrophobicContact CD2-CB 4.25Å; L52-E108 HydrophobicContact CD2-CG 3.68Å
53	I	87.1	Confident	84	Confident	65 Å²	65	89.8 Å²	89.8	33%	0.333	46%	0.459	S	S	.	.	H	α-helix	trans	-61.7	-47	176	-69.6	164.4	0	0	0	110.7	L49 W50 Q51 E55 Q56 F57 V105	L49-I53 HydrophobicContact CG-CD1 4.14Å; L49-I53 WeakPolarHBondContact O-CD1 3.47Å; L49-I53 WeakPolarHBondContact O-CG1 3.3Å; L49-I53 PolarHBondContact O-N 3.18Å; W50-I53 PolarHBondContact O-N 2.73Å; Q51-I53 VanDerWaalsContact C-N 3.31Å; Q51-I53 PolarHBondContact O-N 3.14Å; I53-E55 VanDerWaalsContact C-N 3.32Å; I53-E55 PolarHBondContact O-N 3.46Å; I53-Q56 WeakPolarHBondContact O-CB 3.29Å; I53-Q56 PolarHBondContact O-N 3.11Å; I53-F57 HydrophobicContact CG2-CD2 4.35Å; I53-F57 HydrophobicContact CG2-CE2 3.76Å; I53-F57 WeakPolarHBondContact O-CD2 3.46Å; I53-V105 HydrophobicContact CG1-CG2 3.74Å
54	L	88.7	Confident	85.3	Confident	103 Å²	103	90.4 Å²	90.4	54%	0.539	45%	0.449	S	S	.	.	H	α-helix	trans	-63.3	-36.6	179.5	-73.7	178.2	0	0	0	112.7	W50 Q51 Q56 F57 D58	W50-L54 HydrophobicContact CE3-CD1 3.56Å; W50-L54 HydrophobicContact CE3-CG 4.42Å; W50-L54 HydrophobicContact CZ3-CD1 3.65Å; W50-L54 VanDerWaalsContact O-CG 3.31Å; W50-L54 WeakPolarHBondContact O-CG 3.11Å; W50-L54 PolarHBondContact O-N 3.11Å; Q51-L54 PolarHBondContact O-N 3.01Å; Q51-L54 VanDerWaalsContact O-N 3.15Å; L54-Q56 PolarHBondContact O-N 3.44Å; L54-F57 PolarHBondContact O-N 3.48Å; L54-D58 PolarHBondContact O-N 2.96Å
55	E	88.3	Confident	86.5	Confident	82 Å²	82	86.1 Å²	86.1	38%	0.383	43%	0.431	S	S	.	.	H	α-helix	trans	-60.9	-34.1	175.6	-75.7	179.3	178.8	0	0	112.1	K47 Q51 L52 I53 F57 D58	K47-E55 WeakPolarHBondContact CD-OE1 3.48Å; K47-E55 VanDerWaalsContact CE-OE1 3.27Å; K47-E55 WeakPolarHBondContact CE-OE1 3.47Å; K47-E55 IonicContact NZ-OE1 3.47Å; K47-E55 PolarHBondContact NZ-OE1 2.95Å; K47-E55 IonicContact NZ-OE2 3.64Å; K47-E55 PolarHBondContact NZ-OE2 3.47Å; Q51-E55 WeakPolarHBondContact O-CG 3.32Å; Q51-E55 PolarHBondContact O-N 3.19Å; L52-E55 PolarHBondContact O-N 2.99Å; I53-E55 VanDerWaalsContact C-N 3.32Å; I53-E55 PolarHBondContact O-N 3.46Å; E55-F57 PolarHBondContact O-N 3.15Å; E55-D58 WeakPolarHBondContact O-CB 3.4Å; E55-D58 PolarHBondContact O-N 3.35Å
56	Q	86.7	Confident	87.8	Confident	61 Å²	61	80.6 Å²	80.6	29%	0.285	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-22.7	174.6	-58.8	-59.4	-49	0	0	112.8	L52 I53 L54 V62 A101	L52-Q56 WeakPolarHBondContact O-CG 2.92Å; L52-Q56 PolarHBondContact O-N 2.91Å; I53-Q56 WeakPolarHBondContact O-CB 3.29Å; I53-Q56 PolarHBondContact O-N 3.11Å; L54-Q56 PolarHBondContact O-N 3.44Å; Q56-V62 WeakPolarHBondContact O-CG1 3.26Å; Q56-V62 WeakPolarHBondContact O-CG2 2.91Å; Q56-A101 HydrophobicContact CB-CB 4.12Å; Q56-A101 HydrophobicContact CG-CB 4.41Å
57	F	88.3	Confident	89	Confident	66 Å²	66	83.6 Å²	83.6	29%	0.289	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-6.3	174.2	-65.2	-82	0	0	0	113.6	I53 L54 E55 D59 V62 K63 L97	I53-F57 HydrophobicContact CG2-CD2 4.35Å; I53-F57 HydrophobicContact CG2-CE2 3.76Å; I53-F57 WeakPolarHBondContact O-CD2 3.46Å; L54-F57 PolarHBondContact O-N 3.48Å; E55-F57 PolarHBondContact O-N 3.15Å; F57-D59 VanDerWaalsContact C-N 3.34Å; F57-V62 HydrophobicContact CD1-CG1 3.95Å; F57-K63 WeakPolarHBondContact O-CG 3.47Å; F57-L97 HydrophobicContact CE1-CB 4.44Å
58	D	89.7	Confident	89.7	Confident	111 Å²	111	81.8 Å²	81.8	59%	0.594	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-16.8	179.9	-157.2	37.7	0	0	0	112.8	L54 E55 K63	L54-D58 PolarHBondContact O-N 2.96Å; E55-D58 WeakPolarHBondContact O-CB 3.4Å; E55-D58 PolarHBondContact O-N 3.35Å; D58-K63 VanDerWaalsContact O-CE 3.32Å; D58-K63 WeakPolarHBondContact O-CE 3.42Å; D58-K63 PolarHBondContact O-NZ 3.04Å; D58-K63 WeakPolarHBondContact OD1-CE 3.4Å; D58-K63 IonicContact OD1-NZ 2.94Å; D58-K63 PolarHBondContact OD1-NZ 3.23Å
59	D	90.2	Very high	90	Very high	82 Å²	82	76.9 Å²	76.9	44%	0.439	39%	0.389	S	S	.	.	S	Bend	trans	-60.2	136.7	176.1	-179.6	-89.1	0	0	0	112.3	F57 L61 V62 K63	F57-D59 VanDerWaalsContact C-N 3.34Å; D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 2.87Å; D59-L61 WeakPolarHBondContact OD1-CA 3.31Å; D59-L61 VanDerWaalsContact OD1-CB 3.23Å; D59-L61 WeakPolarHBondContact OD1-CB 3.41Å; D59-L61 PolarHBondContact OD1-N 2.8Å; D59-V62 HydrophobicContact CB-CB 4.09Å; D59-V62 HydrophobicContact CB-CG2 3.95Å; D59-V62 PolarHBondContact O-N 2.78Å; D59-V62 PolarHBondContact OD1-N 2.99Å; D59-V62 VanDerWaalsContact OD1-N 3.11Å; D59-K63 WeakPolarHBondContact O-CG 3.47Å; D59-K63 PolarHBondContact O-N 3.5Å
60	L	92.1	Very high	90.3	Very high	124 Å²	124	77.4 Å²	77.4	65%	0.649	40%	0.395	S	S	*	.	H	α-helix	trans	-61.1	-40.7	-176.5	-179	65.4	0	0	0	112.3	K63 I64	L60-K63 PolarHBondContact O-N 3.1Å; L60-I64 HydrophobicContact CG-CD1 4.37Å; L60-I64 VanDerWaalsContact O-CG1 3.32Å; L60-I64 WeakPolarHBondContact O-CG1 3.15Å; L60-I64 PolarHBondContact O-N 3.4Å; L60-I64 VanDerWaalsContact O-N 3.09Å
61	L	91.1	Very high	90.6	Very high	120 Å²	120	74.2 Å²	74.2	63%	0.628	39%	0.391	S	S	*	.	H	α-helix	trans	-69	-39	179	-58.3	176.7	0	0	0	110.5	D59 I64 L65	D59-L61 VanDerWaalsContact C-N 3.34Å; D59-L61 PolarHBondContact O-N 2.87Å; D59-L61 WeakPolarHBondContact OD1-CA 3.31Å; D59-L61 VanDerWaalsContact OD1-CB 3.23Å; D59-L61 WeakPolarHBondContact OD1-CB 3.41Å; D59-L61 PolarHBondContact OD1-N 2.8Å; L61-I64 PolarHBondContact O-N 3.26Å; L61-L65 PolarHBondContact O-N 3.47Å
62	V	91.2	Very high	90.7	Very high	19 Å²	19	71.6 Å²	71.6	12%	0.115	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-41.3	174.9	174.5	0	0	0	0	111.5	Q56 F57 D59 I64 L65 L66 L97	Q56-V62 WeakPolarHBondContact O-CG1 3.26Å; Q56-V62 WeakPolarHBondContact O-CG2 2.91Å; F57-V62 HydrophobicContact CD1-CG1 3.95Å; D59-V62 HydrophobicContact CB-CB 4.09Å; D59-V62 HydrophobicContact CB-CG2 3.95Å; D59-V62 PolarHBondContact O-N 2.78Å; D59-V62 PolarHBondContact OD1-N 2.99Å; D59-V62 VanDerWaalsContact OD1-N 3.11Å; V62-I64 VanDerWaalsContact C-N 3.31Å; V62-I64 PolarHBondContact O-N 3.47Å; V62-L65 WeakPolarHBondContact O-CB 3.32Å; V62-L65 PolarHBondContact O-N 3.01Å; V62-L66 WeakPolarHBondContact O-CB 3.47Å; V62-L66 PolarHBondContact O-N 3.25Å; V62-L97 HydrophobicContact CG1-CD2 3.83Å
63	K	92.6	Very high	90.8	Very high	93 Å²	93	76.2 Å²	76.2	40%	0.404	40%	0.401	S	S	.	.	H	α-helix	trans	-60.7	-39.4	173.8	-75.4	170.7	176.7	154.3	0	112.5	F57 D58 D59 L60 L66 L67	F57-K63 WeakPolarHBondContact O-CG 3.47Å; D58-K63 VanDerWaalsContact O-CE 3.32Å; D58-K63 WeakPolarHBondContact O-CE 3.42Å; D58-K63 PolarHBondContact O-NZ 3.04Å; D58-K63 WeakPolarHBondContact OD1-CE 3.4Å; D58-K63 IonicContact OD1-NZ 2.94Å; D58-K63 PolarHBondContact OD1-NZ 3.23Å; D59-K63 WeakPolarHBondContact O-CG 3.47Å; D59-K63 PolarHBondContact O-N 3.5Å; L60-K63 PolarHBondContact O-N 3.1Å; K63-L66 PolarHBondContact O-N 2.92Å; K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 PolarHBondContact O-N 3.24Å
64	I	93.4	Very high	91	Very high	98 Å²	98	76.2 Å²	76.2	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-64.5	-44.1	174.9	-67.8	165.9	0	0	0	110.6	L60 L61 V62 L66 L67 A68	L60-I64 HydrophobicContact CG-CD1 4.37Å; L60-I64 VanDerWaalsContact O-CG1 3.32Å; L60-I64 WeakPolarHBondContact O-CG1 3.15Å; L60-I64 PolarHBondContact O-N 3.4Å; L60-I64 VanDerWaalsContact O-N 3.09Å; L61-I64 PolarHBondContact O-N 3.26Å; V62-I64 VanDerWaalsContact C-N 3.31Å; V62-I64 PolarHBondContact O-N 3.47Å; I64-L66 VanDerWaalsContact C-N 3.35Å; I64-L67 WeakPolarHBondContact O-CB 3.13Å; I64-L67 PolarHBondContact O-N 3.11Å; I64-A68 PolarHBondContact O-N 3.3Å
65	L	91.5	Very high	91	Very high	67 Å²	67	76.5 Å²	76.5	35%	0.351	41%	0.405	S	S	.	.	H	α-helix	trans	-63.3	-40.1	175.9	-78	158.3	0	0	0	112.2	L61 V62 A68 A69 L97	L61-L65 PolarHBondContact O-N 3.47Å; V62-L65 WeakPolarHBondContact O-CB 3.32Å; V62-L65 PolarHBondContact O-N 3.01Å; L65-A68 PolarHBondContact O-N 3.5Å; L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 2.67Å; L65-L97 HydrophobicContact CB-CD2 3.95Å; L65-L97 HydrophobicContact CD1-CD2 4.25Å
66	L	91.8	Very high	90.9	Very high	72 Å²	72	72.7 Å²	72.7	38%	0.377	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-40.9	176.2	-167.8	72.9	0	0	0	111	V62 K63 I64 A69 V70 L97	V62-L66 WeakPolarHBondContact O-CB 3.47Å; V62-L66 PolarHBondContact O-N 3.25Å; K63-L66 PolarHBondContact O-N 2.92Å; I64-L66 VanDerWaalsContact C-N 3.35Å; L66-A69 WeakPolarHBondContact O-CB 3.43Å; L66-A69 PolarHBondContact O-N 3Å; L66-V70 WeakPolarHBondContact O-CG2 3.4Å; L66-V70 PolarHBondContact O-N 3.37Å; L66-L97 HydrophobicContact CB-CD1 4.35Å; L66-L97 HydrophobicContact CD1-CD1 3.77Å
67	L	93.5	Very high	90.9	Very high	113 Å²	113	74.7 Å²	74.7	59%	0.592	40%	0.4	S	S	*	.	H	α-helix	trans	-60.8	-45.1	172.8	179.1	64.5	0	0	0	111.2	K63 I64 A69 V70 V71	K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 PolarHBondContact O-N 3.24Å; I64-L67 WeakPolarHBondContact O-CB 3.13Å; I64-L67 PolarHBondContact O-N 3.11Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-A69 PolarHBondContact O-N 2.88Å; L67-V70 PolarHBondContact O-N 3.14Å; L67-V71 WeakPolarHBondContact O-CG2 3.5Å; L67-V71 PolarHBondContact O-N 3.48Å
68	A	92.8	Very high	90.7	Very high	42 Å²	42	78.7 Å²	78.7	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-60.1	-44.3	174.7	0	0	0	0	0	111.4	I64 L65 V70 V71 S72	I64-A68 PolarHBondContact O-N 3.3Å; L65-A68 PolarHBondContact O-N 3.5Å; A68-V70 VanDerWaalsContact C-N 3.33Å; A68-V70 PolarHBondContact O-N 2.92Å; A68-V71 PolarHBondContact O-N 3.19Å; A68-S72 WeakPolarHBondContact O-CB 3.45Å; A68-S72 PolarHBondContact O-N 3.16Å; A68-S72 PolarHBondContact O-OG 2.97Å; A68-S72 VanDerWaalsContact O-OG 3.12Å
69	A	91.5	Very high	90.2	Very high	12 Å²	12	78.4 Å²	78.4	10%	0.099	41%	0.412	C	S	.	.	H	α-helix	trans	-58.8	-42.6	175.9	0	0	0	0	0	112.2	L65 L66 L67 F73 I93	L65-A69 WeakPolarHBondContact O-CB 3.35Å; L65-A69 PolarHBondContact O-N 2.67Å; L66-A69 WeakPolarHBondContact O-CB 3.43Å; L66-A69 PolarHBondContact O-N 3Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-A69 PolarHBondContact O-N 2.88Å; A69-F73 WeakPolarHBondContact O-CB 3.36Å; A69-F73 PolarHBondContact O-N 2.8Å; A69-I93 HydrophobicContact CB-CB 4.16Å; A69-I93 HydrophobicContact CB-CG2 3.72Å
70	V	92.7	Very high	89.2	Confident	82 Å²	82	81.7 Å²	81.7	50%	0.497	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-44.7	176.2	171.1	0	0	0	0	110.9	L66 L67 A68 F73 V74	L66-V70 WeakPolarHBondContact O-CG2 3.4Å; L66-V70 PolarHBondContact O-N 3.37Å; L67-V70 PolarHBondContact O-N 3.14Å; A68-V70 VanDerWaalsContact C-N 3.33Å; A68-V70 PolarHBondContact O-N 2.92Å; V70-F73 PolarHBondContact O-N 3.18Å; V70-V74 HydrophobicContact CG1-CG2 4.48Å; V70-V74 VanDerWaalsContact O-CG2 3.27Å; V70-V74 WeakPolarHBondContact O-CG2 3.36Å; V70-V74 PolarHBondContact O-N 3.06Å
71	V	93.3	Very high	88.1	Confident	74 Å²	74	82.9 Å²	82.9	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-48.5	177.3	172.6	0	0	0	0	110.8	L67 A68 F73 V74 L75	L67-V71 WeakPolarHBondContact O-CG2 3.5Å; L67-V71 PolarHBondContact O-N 3.48Å; A68-V71 PolarHBondContact O-N 3.19Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 3.06Å; V71-V74 PolarHBondContact O-N 3.46Å; V71-L75 HydrophobicContact CG1-CD1 4.02Å; V71-L75 HydrophobicContact CG1-CG 4.43Å; V71-L75 WeakPolarHBondContact O-CG 3.41Å; V71-L75 PolarHBondContact O-N 2.9Å
72	S	90.6	Very high	87.2	Confident	15 Å²	15	82.3 Å²	82.3	11%	0.105	43%	0.43	C	S	.	.	H	α-helix	trans	-60.4	-40	176.3	-61.4	0	0	0	0	111.6	A68 L75 A76	A68-S72 WeakPolarHBondContact O-CB 3.45Å; A68-S72 PolarHBondContact O-N 3.16Å; A68-S72 PolarHBondContact O-OG 2.97Å; A68-S72 VanDerWaalsContact O-OG 3.12Å; S72-L75 PolarHBondContact O-N 3.43Å; S72-A76 VanDerWaalsContact O-CB 3.3Å; S72-A76 WeakPolarHBondContact O-CB 3.21Å; S72-A76 PolarHBondContact O-N 2.73Å
73	F	90.5	Very high	86.2	Confident	99 Å²	99	87.2 Å²	87.2	43%	0.434	45%	0.451	S	S	.	.	H	α-helix	trans	-65.4	-41.7	176.4	-172.1	-98.8	0	0	0	112.4	A69 V70 V71 A76 L77 F87 P90	A69-F73 WeakPolarHBondContact O-CB 3.36Å; A69-F73 PolarHBondContact O-N 2.8Å; V70-F73 PolarHBondContact O-N 3.18Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 3.06Å; F73-A76 PolarHBondContact O-N 2.91Å; F73-L77 HydrophobicContact CD1-CD1 4.01Å; F73-L77 HydrophobicContact CD1-CG 4.42Å; F73-L77 HydrophobicContact CE1-CD1 3.7Å; F73-L77 HydrophobicContact CE1-CG 4.17Å; F73-L77 HydrophobicContact CZ-CD1 4.48Å; F73-L77 WeakPolarHBondContact O-CG 3.41Å; F73-L77 PolarHBondContact O-N 3.25Å; F73-F87 HydrophobicContact CD2-CD1 4.15Å; F73-F87 HydrophobicContact CD2-CE1 4.07Å; F73-F87 AromaticContact CE2-CD1 3.93Å; F73-F87 HydrophobicContact CE2-CD1 3.93Å; F73-F87 AromaticContact CE2-CE1 3.63Å; F73-F87 HydrophobicContact CE2-CE1 3.63Å; F73-F87 HydrophobicContact CZ-CE1 4.22Å; F73-P90 HydrophobicContact CB-CB 4.04Å; F73-P90 HydrophobicContact CB-CG 4.49Å; F73-P90 HydrophobicContact CD2-CB 4.26Å; F73-P90 HydrophobicContact CD2-CG 4.3Å
74	V	90.8	Very high	85.5	Confident	65 Å²	65	90.2 Å²	90.2	39%	0.394	47%	0.47	S	S	.	.	H	α-helix	trans	-65	-44.5	175.8	171	0	0	0	0	110.9	V70 V71 A76 L77 F78	V70-V74 HydrophobicContact CG1-CG2 4.48Å; V70-V74 VanDerWaalsContact O-CG2 3.27Å; V70-V74 WeakPolarHBondContact O-CG2 3.36Å; V70-V74 PolarHBondContact O-N 3.06Å; V71-V74 PolarHBondContact O-N 3.46Å; V74-A76 VanDerWaalsContact C-N 3.31Å; V74-A76 PolarHBondContact O-N 3.03Å; V74-L77 PolarHBondContact O-N 3.39Å; V74-F78 HydrophobicContact CG1-CD2 3.96Å; V74-F78 HydrophobicContact CG1-CE2 3.55Å; V74-F78 WeakPolarHBondContact O-CD2 3.35Å; V74-F78 PolarHBondContact O-N 3.44Å
75	L	88.7	Confident	84.9	Confident	109 Å²	109	89.8 Å²	89.8	57%	0.571	47%	0.472	S	S	*	.	H	α-helix	trans	-59.8	-42.6	175.3	-70.7	173.1	0	0	0	111.3	V71 S72 L77 F78 E79	V71-L75 HydrophobicContact CG1-CD1 4.02Å; V71-L75 HydrophobicContact CG1-CG 4.43Å; V71-L75 WeakPolarHBondContact O-CG 3.41Å; V71-L75 PolarHBondContact O-N 2.9Å; S72-L75 PolarHBondContact O-N 3.43Å; L75-L77 VanDerWaalsContact C-N 3.3Å; L75-L77 PolarHBondContact O-N 3.06Å; L75-F78 PolarHBondContact O-N 3.12Å; L75-F78 VanDerWaalsContact O-N 3.09Å; L75-E79 PolarHBondContact O-N 3.26Å
76	A	86.9	Confident	84.4	Confident	3 Å²	3	87 Å²	87	3%	0.025	46%	0.459	C	S	.	.	H	α-helix	trans	-63.3	-32.4	177.3	0	0	0	0	0	113.3	S72 F73 V74 F78 E79 A86 F87	S72-A76 VanDerWaalsContact O-CB 3.3Å; S72-A76 WeakPolarHBondContact O-CB 3.21Å; S72-A76 PolarHBondContact O-N 2.73Å; F73-A76 PolarHBondContact O-N 2.91Å; V74-A76 VanDerWaalsContact C-N 3.31Å; V74-A76 PolarHBondContact O-N 3.03Å; A76-F78 VanDerWaalsContact C-N 3.31Å; A76-F78 PolarHBondContact O-N 3.03Å; A76-E79 PolarHBondContact O-N 3.26Å; A76-A86 HydrophobicContact CB-CB 3.75Å; A76-A86 WeakPolarHBondContact CB-O 3.36Å; A76-F87 HydrophobicContact CB-CD1 4.21Å; A76-F87 HydrophobicContact CB-CE1 4.24Å
77	L	85.6	Confident	84.2	Confident	103 Å²	103	86.9 Å²	86.9	54%	0.539	46%	0.456	S	S	.	.	H	α-helix	trans	-69.6	-26.6	174.3	-72.5	174.2	0	0	0	113.3	F73 V74 L75 F87	F73-L77 HydrophobicContact CD1-CD1 4.01Å; F73-L77 HydrophobicContact CD1-CG 4.42Å; F73-L77 HydrophobicContact CE1-CD1 3.7Å; F73-L77 HydrophobicContact CE1-CG 4.17Å; F73-L77 HydrophobicContact CZ-CD1 4.48Å; F73-L77 WeakPolarHBondContact O-CG 3.41Å; F73-L77 PolarHBondContact O-N 3.25Å; V74-L77 PolarHBondContact O-N 3.39Å; L75-L77 VanDerWaalsContact C-N 3.3Å; L75-L77 PolarHBondContact O-N 3.06Å; L77-F87 HydrophobicContact CD2-CE1 4.25Å; L77-F87 HydrophobicContact CD2-CZ 3.97Å
78	F	85.2	Confident	84	Confident	149 Å²	149	85.4 Å²	85.4	65%	0.654	45%	0.451	S	S	*	.	H	α-helix	trans	-87.8	-12	177.2	-71.5	-67.4	0	0	0	113.3	V74 L75 A76 H80	V74-F78 HydrophobicContact CG1-CD2 3.96Å; V74-F78 HydrophobicContact CG1-CE2 3.55Å; V74-F78 WeakPolarHBondContact O-CD2 3.35Å; V74-F78 PolarHBondContact O-N 3.44Å; L75-F78 PolarHBondContact O-N 3.12Å; L75-F78 VanDerWaalsContact O-N 3.09Å; A76-F78 VanDerWaalsContact C-N 3.31Å; A76-F78 PolarHBondContact O-N 3.03Å; F78-H80 PolarHBondContact O-CE1 3.22Å; F78-H80 PolarHBondContact O-N 2.94Å; F78-H80 PolarHBondContact O-ND1 2.97Å
79	E	78.8	Confident	83.7	Confident	105 Å²	105	89.1 Å²	89.1	49%	0.491	46%	0.461	S	S	.	.			trans	-82.4	109.1	178.9	-158.4	162.6	-152.3	0	0	109.9	L75 A76 A86	L75-E79 PolarHBondContact O-N 3.26Å; A76-E79 PolarHBondContact O-N 3.26Å; E79-A86 HydrophobicContact CB-CB 4.22Å; E79-A86 VanDerWaalsContact OE2-CB 3.24Å; E79-A86 WeakPolarHBondContact OE2-CB 3.45Å
80	H	68.5	Low	83.6	Confident	152 Å²	152	89 Å²	89	70%	0.704	46%	0.459	S	S	*	.			trans	-88.8	-24	-172.4	-70.9	69.1	0	0	0	113.3	F78	F78-H80 PolarHBondContact O-CE1 3.22Å; F78-H80 PolarHBondContact O-N 2.94Å; F78-H80 PolarHBondContact O-ND1 2.97Å
81	D	69.2	Low	83.6	Confident	149 Å²	149	91.4 Å²	91.4	80%	0.797	46%	0.463	S	S	*	.	S	Bend	trans	-85.6	-38.1	-166	-70	-25.4	0	0	0	112.9
82	D	71.1	Confident	83.6	Confident	108 Å²	108	91.4 Å²	91.4	58%	0.578	46%	0.463	S	S	*	.			trans	-139.1	68.3	-176.4	-77.6	-49.3	0	0	0	112.7	I84 T85 A86	D82-I84 PolarHBondContact O-N 3.39Å; D82-I84 VanDerWaalsContact O-N 3.15Å; D82-T85 WeakPolarHBondContact CB-OG1 3.36Å; D82-T85 PolarHBondContact O-N 3.02Å; D82-T85 PolarHBondContact O-OG1 2.95Å; D82-T85 VanDerWaalsContact O-OG1 3.07Å; D82-A86 WeakPolarHBondContact O-CB 3.27Å; D82-A86 PolarHBondContact O-N 3.35Å; D82-A86 VanDerWaalsContact O-N 3.11Å
83	Q	71.5	Confident	83.7	Confident	121 Å²	121	91.8 Å²	91.8	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-54.6	-37.3	-178.5	-66.6	-175.8	9.3	0	0	113.3	T85 A86 F87	Q83-T85 PolarHBondContact O-N 3.22Å; Q83-A86 PolarHBondContact O-N 3.2Å; Q83-F87 HydrophobicContact CB-CE2 4.32Å; Q83-F87 WeakPolarHBondContact O-CD2 3.33Å; Q83-F87 PolarHBondContact O-N 3.42Å
84	I	77	Confident	83.7	Confident	156 Å²	156	91.2 Å²	91.2	80%	0.8	47%	0.465	S	S	*	.	H	α-helix	trans	-63.4	-42.8	-176.1	-60.8	177.1	0	0	0	111.1	D82 V88	D82-I84 PolarHBondContact O-N 3.39Å; D82-I84 VanDerWaalsContact O-N 3.15Å; I84-V88 WeakPolarHBondContact O-CG2 3.4Å
85	T	81.2	Confident	83.9	Confident	89 Å²	89	92.9 Å²	92.9	55%	0.546	47%	0.471	S	S	.	.	H	α-helix	trans	-77.9	-31.8	179.8	51.1	0	0	0	0	111.9	D82 Q83 F87 V88	D82-T85 WeakPolarHBondContact CB-OG1 3.36Å; D82-T85 PolarHBondContact O-N 3.02Å; D82-T85 PolarHBondContact O-OG1 2.95Å; D82-T85 VanDerWaalsContact O-OG1 3.07Å; Q83-T85 PolarHBondContact O-N 3.22Å; T85-F87 VanDerWaalsContact C-N 3.31Å; T85-F87 PolarHBondContact O-N 2.97Å; T85-V88 WeakPolarHBondContact O-CB 3.5Å; T85-V88 WeakPolarHBondContact O-CG2 3.49Å; T85-V88 PolarHBondContact O-N 3.02Å; T85-V88 VanDerWaalsContact O-N 3.14Å
86	A	82	Confident	84.1	Confident	9 Å²	9	91.5 Å²	91.5	7%	0.074	46%	0.464	C	S	.	.	H	α-helix	trans	-60.5	-38.4	179.4	0	0	0	0	0	112.5	A76 E79 D82 Q83 V88 P90	A76-A86 HydrophobicContact CB-CB 3.75Å; A76-A86 WeakPolarHBondContact CB-O 3.36Å; E79-A86 HydrophobicContact CB-CB 4.22Å; E79-A86 VanDerWaalsContact OE2-CB 3.24Å; E79-A86 WeakPolarHBondContact OE2-CB 3.45Å; D82-A86 WeakPolarHBondContact O-CB 3.27Å; D82-A86 PolarHBondContact O-N 3.35Å; D82-A86 VanDerWaalsContact O-N 3.11Å; Q83-A86 PolarHBondContact O-N 3.2Å; A86-V88 VanDerWaalsContact C-N 3.31Å; A86-V88 PolarHBondContact O-N 3.5Å; A86-P90 VanDerWaalsContact O-CD 3.32Å; A86-P90 WeakPolarHBondContact O-CD 3.41Å
87	F	86.6	Confident	84.3	Confident	70 Å²	70	91.6 Å²	91.6	31%	0.307	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-8.3	178.7	-70.1	-69.2	0	0	0	114.7	F73 A76 L77 Q83 T85 P90 F91	F73-F87 HydrophobicContact CD2-CD1 4.15Å; F73-F87 HydrophobicContact CD2-CE1 4.07Å; F73-F87 AromaticContact CE2-CD1 3.93Å; F73-F87 HydrophobicContact CE2-CD1 3.93Å; F73-F87 AromaticContact CE2-CE1 3.63Å; F73-F87 HydrophobicContact CE2-CE1 3.63Å; F73-F87 HydrophobicContact CZ-CE1 4.22Å; A76-F87 HydrophobicContact CB-CD1 4.21Å; A76-F87 HydrophobicContact CB-CE1 4.24Å; L77-F87 HydrophobicContact CD2-CE1 4.25Å; L77-F87 HydrophobicContact CD2-CZ 3.97Å; Q83-F87 HydrophobicContact CB-CE2 4.32Å; Q83-F87 WeakPolarHBondContact O-CD2 3.33Å; Q83-F87 PolarHBondContact O-N 3.42Å; T85-F87 VanDerWaalsContact C-N 3.31Å; T85-F87 PolarHBondContact O-N 2.97Å; F87-P90 WeakPolarHBondContact O-CD 3.37Å; F87-P90 WeakPolarHBondContact O-CG 3.36Å; F87-F91 WeakPolarHBondContact O-CB 3.36Å; F87-F91 PolarHBondContact O-N 3.3Å; F87-F91 VanDerWaalsContact O-N 3.16Å
88	V	89.9	Confident	84.6	Confident	81 Å²	81	91.6 Å²	91.6	49%	0.491	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-45	-179.1	179.7	0	0	0	0	110.7	I84 T85 A86 F91 V92	I84-V88 WeakPolarHBondContact O-CG2 3.4Å; T85-V88 WeakPolarHBondContact O-CB 3.5Å; T85-V88 WeakPolarHBondContact O-CG2 3.49Å; T85-V88 PolarHBondContact O-N 3.02Å; T85-V88 VanDerWaalsContact O-N 3.14Å; A86-V88 VanDerWaalsContact C-N 3.31Å; A86-V88 PolarHBondContact O-N 3.5Å; V88-F91 PolarHBondContact O-N 2.86Å; V88-V92 HydrophobicContact CG1-CG2 4.25Å; V88-V92 VanDerWaalsContact O-CG2 3.28Å; V88-V92 WeakPolarHBondContact O-CG2 3.39Å; V88-V92 PolarHBondContact O-N 3.45Å
89	E	86.8	Confident	85	Confident	120 Å²	120	86.7 Å²	86.7	56%	0.561	45%	0.45	S	S	*	.	H	α-helix	trans	-61.9	-56.4	-178.4	-174.7	177.5	-170.7	0	0	113.3	F91 V92 I93	E89-F91 PolarHBondContact O-N 3.42Å; E89-V92 PolarHBondContact O-N 2.76Å; E89-I93 HydrophobicContact CG-CD1 4.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.17Å; E89-I93 PolarHBondContact O-N 2.92Å; E89-I93 VanDerWaalsContact O-N 3.07Å
90	P	89.4	Confident	85.5	Confident	10 Å²	10	85.4 Å²	85.4	7%	0.065	45%	0.447	C	S	.	.	H	α-helix	trans	-62	-32	177.8	24.2	-33.7	0	0	0	112.1	F73 A86 F87 L94	F73-P90 HydrophobicContact CB-CB 4.04Å; F73-P90 HydrophobicContact CB-CG 4.49Å; F73-P90 HydrophobicContact CD2-CB 4.26Å; F73-P90 HydrophobicContact CD2-CG 4.3Å; A86-P90 VanDerWaalsContact O-CD 3.32Å; A86-P90 WeakPolarHBondContact O-CD 3.41Å; F87-P90 WeakPolarHBondContact O-CD 3.37Å; F87-P90 WeakPolarHBondContact O-CG 3.36Å; P90-L94 WeakPolarHBondContact O-CB 3.36Å; P90-L94 PolarHBondContact O-N 3.37Å
91	F	91.5	Very high	86.5	Confident	133 Å²	133	78.7 Å²	78.7	58%	0.583	42%	0.417	S	S	*	.	H	α-helix	trans	-67.2	-42.3	176	-174.5	-99.4	0	0	0	112.7	F87 V88 E89 L94 L95	F87-F91 WeakPolarHBondContact O-CB 3.36Å; F87-F91 PolarHBondContact O-N 3.3Å; F87-F91 VanDerWaalsContact O-N 3.16Å; V88-F91 PolarHBondContact O-N 2.86Å; E89-F91 PolarHBondContact O-N 3.42Å; F91-L94 PolarHBondContact O-N 2.92Å; F91-L95 HydrophobicContact CE1-CD1 4.29Å; F91-L95 WeakPolarHBondContact O-CB 3.42Å; F91-L95 PolarHBondContact O-N 3.38Å
92	V	93.4	Very high	87.5	Confident	73 Å²	73	74.4 Å²	74.4	44%	0.442	40%	0.402	S	S	.	.	H	α-helix	trans	-62.6	-44.3	175.4	168.9	0	0	0	0	110.8	V88 E89 L94 L95 I96	V88-V92 HydrophobicContact CG1-CG2 4.25Å; V88-V92 VanDerWaalsContact O-CG2 3.28Å; V88-V92 WeakPolarHBondContact O-CG2 3.39Å; V88-V92 PolarHBondContact O-N 3.45Å; E89-V92 PolarHBondContact O-N 2.76Å; V92-L94 PolarHBondContact O-N 2.78Å; V92-L95 PolarHBondContact O-N 2.9Å; V92-I96 HydrophobicContact CG1-CD1 4.06Å; V92-I96 WeakPolarHBondContact O-CG1 3.27Å; V92-I96 PolarHBondContact O-N 3.32Å
93	I	92.6	Very high	88.5	Confident	24 Å²	24	72.8 Å²	72.8	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-62	-46.1	177.5	-59.9	166.2	0	0	0	110.2	A69 E89 L95 I96 L97	A69-I93 HydrophobicContact CB-CB 4.16Å; A69-I93 HydrophobicContact CB-CG2 3.72Å; E89-I93 HydrophobicContact CG-CD1 4.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.17Å; E89-I93 PolarHBondContact O-N 2.92Å; E89-I93 VanDerWaalsContact O-N 3.07Å; I93-L95 VanDerWaalsContact C-N 3.3Å; I93-L95 PolarHBondContact O-N 3.47Å; I93-I96 PolarHBondContact O-N 3.35Å; I93-L97 HydrophobicContact CG2-CD1 4.5Å; I93-L97 WeakPolarHBondContact O-CG 3.39Å; I93-L97 PolarHBondContact O-N 3.05Å
94	L	91.8	Very high	89.4	Confident	87 Å²	87	67.4 Å²	67.4	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-40.9	177.7	-173.4	67.8	0	0	0	111.9	P90 F91 V92 L97 I98	P90-L94 WeakPolarHBondContact O-CB 3.36Å; P90-L94 PolarHBondContact O-N 3.37Å; F91-L94 PolarHBondContact O-N 2.92Å; V92-L94 PolarHBondContact O-N 2.78Å; L94-L97 PolarHBondContact O-N 2.91Å; L94-I98 HydrophobicContact CG-CD1 4.05Å; L94-I98 VanDerWaalsContact O-CG1 3.31Å; L94-I98 WeakPolarHBondContact O-CG1 3.41Å; L94-I98 PolarHBondContact O-N 2.93Å
95	L	94.1	Very high	90	Very high	100 Å²	100	60.6 Å²	60.6	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-42.9	177	-172	154.1	0	0	0	111.5	F91 V92 I93 L97 I98 A99	F91-L95 HydrophobicContact CE1-CD1 4.29Å; F91-L95 WeakPolarHBondContact O-CB 3.42Å; F91-L95 PolarHBondContact O-N 3.38Å; V92-L95 PolarHBondContact O-N 2.9Å; I93-L95 VanDerWaalsContact C-N 3.3Å; I93-L95 PolarHBondContact O-N 3.47Å; L95-L97 VanDerWaalsContact C-N 3.34Å; L95-L97 PolarHBondContact O-N 3.15Å; L95-I98 PolarHBondContact O-N 2.99Å; L95-A99 WeakPolarHBondContact O-CB 3.46Å; L95-A99 PolarHBondContact O-N 2.82Å
96	I	92.7	Very high	90.4	Very high	80 Å²	80	64.5 Å²	64.5	41%	0.41	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-43.9	175.1	-67.8	166.8	0	0	0	110.5	V92 I93 I98 A99 N100	V92-I96 HydrophobicContact CG1-CD1 4.06Å; V92-I96 WeakPolarHBondContact O-CG1 3.27Å; V92-I96 PolarHBondContact O-N 3.32Å; I93-I96 PolarHBondContact O-N 3.35Å; I96-I98 PolarHBondContact O-N 3.42Å; I96-A99 PolarHBondContact O-N 3.47Å; I96-N100 WeakPolarHBondContact O-CB 3.42Å; I96-N100 PolarHBondContact O-N 3.04Å
97	L	91.6	Very high	90.7	Very high	4 Å²	4	69.6 Å²	69.6	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-62	-43.9	177.6	-68.6	-176.4	0	0	0	112.2	F57 V62 L65 L66 I93 L94 L95 N100 A101	F57-L97 HydrophobicContact CE1-CB 4.44Å; V62-L97 HydrophobicContact CG1-CD2 3.83Å; L65-L97 HydrophobicContact CB-CD2 3.95Å; L65-L97 HydrophobicContact CD1-CD2 4.25Å; L66-L97 HydrophobicContact CB-CD1 4.35Å; L66-L97 HydrophobicContact CD1-CD1 3.77Å; I93-L97 HydrophobicContact CG2-CD1 4.5Å; I93-L97 WeakPolarHBondContact O-CG 3.39Å; I93-L97 PolarHBondContact O-N 3.05Å; L94-L97 PolarHBondContact O-N 2.91Å; L95-L97 VanDerWaalsContact C-N 3.34Å; L95-L97 PolarHBondContact O-N 3.15Å; L97-N100 PolarHBondContact O-N 3.31Å; L97-A101 WeakPolarHBondContact O-CB 3.45Å; L97-A101 PolarHBondContact O-N 3.49Å
98	I	91.7	Very high	90.8	Very high	103 Å²	103	69.8 Å²	69.8	53%	0.528	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.4	-69.1	167.2	0	0	0	110.8	L94 L95 I96 A101 A102	L94-I98 HydrophobicContact CG-CD1 4.05Å; L94-I98 VanDerWaalsContact O-CG1 3.31Å; L94-I98 WeakPolarHBondContact O-CG1 3.41Å; L94-I98 PolarHBondContact O-N 2.93Å; L95-I98 PolarHBondContact O-N 2.99Å; I96-I98 PolarHBondContact O-N 3.42Å; I98-A101 PolarHBondContact O-N 3.01Å; I98-A102 WeakPolarHBondContact O-CB 3.21Å; I98-A102 PolarHBondContact O-N 3.28Å
99	A	92.8	Very high	90.6	Very high	46 Å²	46	71.8 Å²	71.8	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-61.9	-45.4	178.1	0	0	0	0	0	111.4	L95 I96 A102 V103	L95-A99 WeakPolarHBondContact O-CB 3.46Å; L95-A99 PolarHBondContact O-N 2.82Å; I96-A99 PolarHBondContact O-N 3.47Å; A99-A102 PolarHBondContact O-N 3.49Å; A99-V103 WeakPolarHBondContact O-CG2 3.41Å; A99-V103 PolarHBondContact O-N 2.98Å
100	N	89.8	Confident	90.6	Very high	79 Å²	79	70.8 Å²	70.8	42%	0.422	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-44.8	176.4	-73.9	-10.6	0	0	0	111.6	I96 L97 A102 V103 G104	I96-N100 WeakPolarHBondContact O-CB 3.42Å; I96-N100 PolarHBondContact O-N 3.04Å; L97-N100 PolarHBondContact O-N 3.31Å; N100-A102 VanDerWaalsContact C-N 3.33Å; N100-A102 PolarHBondContact O-N 3.5Å; N100-V103 PolarHBondContact O-N 3.04Å; N100-G104 PolarHBondContact O-N 3.25Å
101	A	90.1	Very high	90.5	Very high	10 Å²	10	72.8 Å²	72.8	8%	0.083	38%	0.383	C	S	.	.	H	α-helix	trans	-61.5	-41.5	177.3	0	0	0	0	0	111.9	Q56 L97 I98 G104 V105	Q56-A101 HydrophobicContact CB-CB 4.12Å; Q56-A101 HydrophobicContact CG-CB 4.41Å; L97-A101 WeakPolarHBondContact O-CB 3.45Å; L97-A101 PolarHBondContact O-N 3.49Å; I98-A101 PolarHBondContact O-N 3.01Å; A101-G104 PolarHBondContact O-N 3.35Å; A101-V105 WeakPolarHBondContact O-CB 3.37Å; A101-V105 WeakPolarHBondContact O-CG2 3.49Å; A101-V105 PolarHBondContact O-N 2.93Å
102	A	91.1	Very high	90.2	Very high	59 Å²	59	69.4 Å²	69.4	49%	0.488	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-43.4	177	0	0	0	0	0	112.4	I98 A99 N100 W106	I98-A102 WeakPolarHBondContact O-CB 3.21Å; I98-A102 PolarHBondContact O-N 3.28Å; A99-A102 PolarHBondContact O-N 3.49Å; N100-A102 VanDerWaalsContact C-N 3.33Å; N100-A102 PolarHBondContact O-N 3.5Å; A102-W106 WeakPolarHBondContact O-CB 3.31Å; A102-W106 PolarHBondContact O-N 3.26Å
103	V	91.5	Very high	89.8	Confident	74 Å²	74	69.2 Å²	69.2	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-44.8	176.1	172.6	0	0	0	0	111	A99 N100 W106 Q107	A99-V103 WeakPolarHBondContact O-CG2 3.41Å; A99-V103 PolarHBondContact O-N 2.98Å; N100-V103 PolarHBondContact O-N 3.04Å; V103-W106 PolarHBondContact O-N 3.21Å; V103-Q107 HydrophobicContact CG1-CG 4.44Å; V103-Q107 WeakPolarHBondContact O-CG 3.49Å; V103-Q107 PolarHBondContact O-N 3.19Å
104	G	89.6	Confident	89.4	Confident	8 Å²	8	70.6 Å²	70.6	8%	0.082	39%	0.386	C	S	.	.	H	α-helix	trans	-61	-46.6	178.5	0	0	0	0	0	112.4	N100 A101 W106 Q107 E108	N100-G104 PolarHBondContact O-N 3.25Å; A101-G104 PolarHBondContact O-N 3.35Å; G104-W106 VanDerWaalsContact C-N 3.32Å; G104-W106 PolarHBondContact O-N 3.38Å; G104-Q107 PolarHBondContact O-N 3.44Å; G104-E108 PolarHBondContact O-N 2.9Å
105	V	89	Confident	88.9	Confident	13 Å²	13	70.3 Å²	70.3	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-39.8	174.7	167	0	0	0	0	112.2	L49 L52 I53 A101 R109	L49-V105 HydrophobicContact CD1-CG1 3.27Å; L52-V105 HydrophobicContact CB-CG2 4Å; I53-V105 HydrophobicContact CG1-CG2 3.74Å; A101-V105 WeakPolarHBondContact O-CB 3.37Å; A101-V105 WeakPolarHBondContact O-CG2 3.49Å; A101-V105 PolarHBondContact O-N 2.93Å; V105-R109 WeakPolarHBondContact O-CB 3.49Å; V105-R109 WeakPolarHBondContact O-CG 3.49Å; V105-R109 PolarHBondContact O-N 3.35Å; V105-R109 VanDerWaalsContact O-N 3.12Å
106	W	90.1	Very high	88.4	Confident	171 Å²	171	72.1 Å²	72.1	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-67.3	-39.4	178	179.6	67.2	0	0	0	112.2	A102 V103 G104 N110	A102-W106 WeakPolarHBondContact O-CB 3.31Å; A102-W106 PolarHBondContact O-N 3.26Å; V103-W106 PolarHBondContact O-N 3.21Å; G104-W106 VanDerWaalsContact C-N 3.32Å; G104-W106 PolarHBondContact O-N 3.38Å; W106-N110 WeakPolarHBondContact O-CB 3.38Å; W106-N110 PolarHBondContact O-N 3Å
107	Q	89.4	Confident	87.9	Confident	116 Å²	116	70.3 Å²	70.3	54%	0.542	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-44.5	176	-72.9	176.1	4.3	0	0	112	V103 G104 N110 A111	V103-Q107 HydrophobicContact CG1-CG 4.44Å; V103-Q107 WeakPolarHBondContact O-CG 3.49Å; V103-Q107 PolarHBondContact O-N 3.19Å; G104-Q107 PolarHBondContact O-N 3.44Å; Q107-N110 PolarHBondContact O-N 2.98Å; Q107-A111 PolarHBondContact O-N 3.26Å
108	E	87.4	Confident	87.3	Confident	74 Å²	74	75.1 Å²	75.1	35%	0.346	41%	0.411	S	S	.	.	H	α-helix	trans	-62.6	-47.7	178.9	-163.4	77.9	-178.5	0	0	111.3	L52 G104 N110 A111 E112	L52-E108 HydrophobicContact CD1-CB 4.42Å; L52-E108 HydrophobicContact CD1-CG 4.38Å; L52-E108 HydrophobicContact CD2-CB 4.25Å; L52-E108 HydrophobicContact CD2-CG 3.68Å; G104-E108 PolarHBondContact O-N 2.9Å; E108-N110 PolarHBondContact O-N 2.96Å; E108-A111 WeakPolarHBondContact O-CA 3.31Å; E108-A111 WeakPolarHBondContact O-CB 3.14Å; E108-A111 PolarHBondContact O-N 2.8Å; E108-E112 PolarHBondContact O-N 3.11Å
109	R	85.7	Confident	86.5	Confident	123 Å²	123	73.2 Å²	73.2	46%	0.464	40%	0.399	S	S	.	.	H	α-helix	trans	-59.7	-36.2	176.8	-77.7	-178.8	163	-171	-7.3	112.8	L49 V105 A111 S113	L49-R109 VanDerWaalsContact CD1-CZ 3.5Å; V105-R109 WeakPolarHBondContact O-CB 3.49Å; V105-R109 WeakPolarHBondContact O-CG 3.49Å; V105-R109 PolarHBondContact O-N 3.35Å; V105-R109 VanDerWaalsContact O-N 3.12Å; R109-A111 VanDerWaalsContact C-N 3.34Å; R109-S113 WeakPolarHBondContact O-CB 3.43Å; R109-S113 PolarHBondContact O-N 3.2Å; R109-S113 PolarHBondContact O-OG 2.9Å
110	N	88	Confident	85.8	Confident	100 Å²	100	79 Å²	79	54%	0.535	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-34	176.8	-169.9	69	0	0	0	111.9	W106 Q107 E108 A114	W106-N110 WeakPolarHBondContact O-CB 3.38Å; W106-N110 PolarHBondContact O-N 3Å; Q107-N110 PolarHBondContact O-N 2.98Å; E108-N110 PolarHBondContact O-N 2.96Å; N110-A114 PolarHBondContact O-N 3.22Å
111	A	85.6	Confident	84.9	Confident	52 Å²	52	84.5 Å²	84.5	43%	0.43	43%	0.434	S	S	.	.	H	α-helix	trans	-69.1	-46.9	173.1	0	0	0	0	0	111.9	Q107 E108 R109 S113 A114 I115	Q107-A111 PolarHBondContact O-N 3.26Å; E108-A111 WeakPolarHBondContact O-CA 3.31Å; E108-A111 WeakPolarHBondContact O-CB 3.14Å; E108-A111 PolarHBondContact O-N 2.8Å; R109-A111 VanDerWaalsContact C-N 3.34Å; A111-S113 VanDerWaalsContact C-N 3.31Å; A111-S113 PolarHBondContact O-N 3.38Å; A111-A114 WeakPolarHBondContact O-CB 3.31Å; A111-A114 PolarHBondContact O-N 2.63Å; A111-A114 VanDerWaalsContact O-N 3.11Å; A111-I115 PolarHBondContact O-N 3.35Å
112	E	85.3	Confident	84	Confident	62 Å²	62	87.8 Å²	87.8	29%	0.29	45%	0.448	S	S	.	.	H	α-helix	trans	-57	-45	175.1	-72.8	-179.5	159.7	0	0	111.2	K47 E108 A114 I115 E116	K47-E112 PolarHBondContact N-OE1 2.8Å; E108-E112 PolarHBondContact O-N 3.11Å; E112-A114 VanDerWaalsContact C-N 3.27Å; E112-A114 PolarHBondContact O-N 2.79Å; E112-I115 PolarHBondContact O-N 3.07Å; E112-I115 VanDerWaalsContact O-N 3.16Å; E112-E116 PolarHBondContact O-N 3.19Å
113	S	85.2	Confident	83.1	Confident	68 Å²	68	89.1 Å²	89.1	48%	0.476	45%	0.452	S	S	.	.	H	α-helix	trans	-61.4	-33.9	178	-58.6	0	0	0	0	112.6	R109 A111 E116 A117	R109-S113 WeakPolarHBondContact O-CB 3.43Å; R109-S113 PolarHBondContact O-N 3.2Å; R109-S113 PolarHBondContact O-OG 2.9Å; A111-S113 VanDerWaalsContact C-N 3.31Å; A111-S113 PolarHBondContact O-N 3.38Å; S113-E116 PolarHBondContact O-N 3.42Å; S113-A117 WeakPolarHBondContact O-CB 3.37Å; S113-A117 PolarHBondContact O-N 3.37Å
114	A	84.7	Confident	82.5	Confident	54 Å²	54	93 Å²	93	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-70.2	-37.7	177	0	0	0	0	0	112.1	N110 A111 E112 L118	N110-A114 PolarHBondContact O-N 3.22Å; A111-A114 WeakPolarHBondContact O-CB 3.31Å; A111-A114 PolarHBondContact O-N 2.63Å; A111-A114 VanDerWaalsContact O-N 3.11Å; E112-A114 VanDerWaalsContact C-N 3.27Å; E112-A114 PolarHBondContact O-N 2.79Å; A114-L118 WeakPolarHBondContact O-CG 3.39Å; A114-L118 PolarHBondContact O-N 3.16Å; A114-L118 VanDerWaalsContact O-N 3.15Å
115	I	81.5	Confident	82.2	Confident	80 Å²	80	96.3 Å²	96.3	41%	0.41	48%	0.48	S	S	.	.	H	α-helix	trans	-68.2	-40.4	173.6	-62.1	-60.6	0	0	0	110.8	A111 E112 A117 L118 K119	A111-I115 PolarHBondContact O-N 3.35Å; E112-I115 PolarHBondContact O-N 3.07Å; E112-I115 VanDerWaalsContact O-N 3.16Å; I115-A117 VanDerWaalsContact C-N 3.33Å; I115-A117 PolarHBondContact O-N 3.26Å; I115-L118 HydrophobicContact CD1-CD1 4.33Å; I115-L118 WeakPolarHBondContact O-CB 3.48Å; I115-L118 PolarHBondContact O-N 2.95Å; I115-L118 VanDerWaalsContact O-N 3.11Å; I115-K119 PolarHBondContact O-N 3.31Å
116	E	82.6	Confident	82	Confident	139 Å²	139	96.4 Å²	96.4	65%	0.65	48%	0.481	S	S	*	.	H	α-helix	trans	-63.2	-40.5	176	-169.2	166.3	-151.7	0	0	111.7	E112 S113 L118 K119 E120	E112-E116 PolarHBondContact O-N 3.19Å; S113-E116 PolarHBondContact O-N 3.42Å; E116-L118 VanDerWaalsContact C-N 3.27Å; E116-L118 PolarHBondContact O-N 3.09Å; E116-K119 WeakPolarHBondContact O-CB 3.23Å; E116-K119 PolarHBondContact O-N 2.92Å; E116-K119 VanDerWaalsContact O-N 3.1Å; E116-E120 PolarHBondContact O-N 2.9Å
117	A	83.2	Confident	81.7	Confident	41 Å²	41	91.5 Å²	91.5	34%	0.339	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-33.3	172.3	0	0	0	0	0	112.7	S113 I115 E120 Y121	S113-A117 WeakPolarHBondContact O-CB 3.37Å; S113-A117 PolarHBondContact O-N 3.37Å; I115-A117 VanDerWaalsContact C-N 3.33Å; I115-A117 PolarHBondContact O-N 3.26Å; A117-E120 WeakPolarHBondContact O-CB 3.42Å; A117-E120 PolarHBondContact O-N 3.38Å; A117-Y121 WeakPolarHBondContact O-CD2 3.47Å; A117-Y121 WeakPolarHBondContact O-CE2 3.32Å
118	L	79.8	Confident	81.7	Confident	106 Å²	106	86 Å²	86	56%	0.555	44%	0.439	S	S	*	.	H	α-helix	trans	-68.5	-38.6	172.5	-71.1	173.2	0	0	0	112	A114 I115 E116 E120 Y121	A114-L118 WeakPolarHBondContact O-CG 3.39Å; A114-L118 PolarHBondContact O-N 3.16Å; A114-L118 VanDerWaalsContact O-N 3.15Å; I115-L118 HydrophobicContact CD1-CD1 4.33Å; I115-L118 WeakPolarHBondContact O-CB 3.48Å; I115-L118 PolarHBondContact O-N 2.95Å; I115-L118 VanDerWaalsContact O-N 3.11Å; E116-L118 VanDerWaalsContact C-N 3.27Å; E116-L118 PolarHBondContact O-N 3.09Å; L118-E120 VanDerWaalsContact C-N 3.25Å; L118-E120 PolarHBondContact O-N 3.43Å; L118-Y121 WeakPolarHBondContact O-CB 3.45Å; L118-Y121 PolarHBondContact O-N 3.31Å; L118-Y121 VanDerWaalsContact O-N 3.12Å
119	K	75.2	Confident	81.6	Confident	63 Å²	63	84 Å²	84	27%	0.274	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-31.7	174.8	-69.6	175.4	176.6	178.1	0	112.1	P42 I115 E116 Y121 E122	P42-K119 PolarHBondContact O-NZ 3.07Å; I115-K119 PolarHBondContact O-N 3.31Å; E116-K119 WeakPolarHBondContact O-CB 3.23Å; E116-K119 PolarHBondContact O-N 2.92Å; E116-K119 VanDerWaalsContact O-N 3.1Å; K119-Y121 PolarHBondContact O-N 2.92Å; K119-E122 WeakPolarHBondContact O-CB 3.4Å; K119-E122 PolarHBondContact O-N 3.42Å
120	E	76.8	Confident	81.7	Confident	167 Å²	167	78.9 Å²	78.9	78%	0.78	41%	0.411	S	S	*	.	H	α-helix	trans	-63.2	-24.8	174.6	-167	178.2	-177.9	0	0	113.1	E116 A117 L118 E122	E116-E120 PolarHBondContact O-N 2.9Å; A117-E120 WeakPolarHBondContact O-CB 3.42Å; A117-E120 PolarHBondContact O-N 3.38Å; L118-E120 VanDerWaalsContact C-N 3.25Å; L118-E120 PolarHBondContact O-N 3.43Å; E120-E122 VanDerWaalsContact C-N 3.3Å
121	Y	72.1	Confident	81.5	Confident	194 Å²	194	78.6 Å²	78.6	76%	0.761	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-9.7	173.4	-70.1	-81.4	0	0	0	113.7	A117 L118 K119 P123	A117-Y121 WeakPolarHBondContact O-CD2 3.47Å; A117-Y121 WeakPolarHBondContact O-CE2 3.32Å; L118-Y121 WeakPolarHBondContact O-CB 3.45Å; L118-Y121 PolarHBondContact O-N 3.31Å; L118-Y121 VanDerWaalsContact O-N 3.12Å; K119-Y121 PolarHBondContact O-N 2.92Å; Y121-P123 WeakPolarHBondContact O-CD 3.46Å
122	E	70.1	Confident	81.1	Confident	80 Å²	80	79 Å²	79	37%	0.374	41%	0.406	S	S	.	.	S	Bend	trans	-69.3	117.8	173.4	-64.9	-171.6	164	0	0	109.3	L41 K119 E120 E124	L41-E122 WeakPolarHBondContact CD1-OE1 3.36Å; L41-E122 WeakPolarHBondContact CG-OE1 3.46Å; K119-E122 WeakPolarHBondContact O-CB 3.4Å; K119-E122 PolarHBondContact O-N 3.42Å; E120-E122 VanDerWaalsContact C-N 3.3Å; E122-E124 PolarHBondContact O-N 2.83Å
123	P	72.4	Confident	80.7	Confident	87 Å²	87	80.8 Å²	80.8	57%	0.565	41%	0.413	S	S	*	.			trans	-63.8	131	-178.4	26.4	-33.1	0	0	0	109.3	Y121 M125 A141	Y121-P123 WeakPolarHBondContact O-CD 3.46Å; P123-M125 PolarHBondContact O-N 3.42Å; P123-A141 HydrophobicContact CG-CB 4.3Å; P123-A141 WeakPolarHBondContact O-CB 3.32Å
124	E	78.7	Confident	80.2	Confident	154 Å²	154	85.1 Å²	85.1	72%	0.72	44%	0.436	S	S	*	.	S	Bend	trans	-61	-33.7	177.9	-169.9	-179	179	0	0	111.4	E122 K140 A141	E122-E124 PolarHBondContact O-N 2.83Å; E124-K140 VanDerWaalsContact O-CA 3.31Å; E124-K140 WeakPolarHBondContact O-CA 3.37Å; E124-A141 PolarHBondContact O-N 3.15Å
125	M	82.7	Confident	79.8	Confident	79 Å²	79	84.7 Å²	84.7	39%	0.389	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.8	-175.2	-57.5	-63	-71.5	0	0	112.1	P123 M138 I139 K140	P123-M125 PolarHBondContact O-N 3.42Å; M125-M138 HydrophobicContact CB-CG 3.85Å; M125-M138 HydrophobicContact CB-SD 4.18Å; M125-M138 HydrophobicContact CE-CB 4.38Å; M125-M138 HydrophobicContact CE-CG 3.71Å; M125-M138 HydrophobicContact CG-CG 4.44Å; M125-I139 CarbonylContact C-O 3.53Å; M125-I139 VanDerWaalsContact CA-O 3.26Å; M125-I139 WeakPolarHBondContact CA-O 3.45Å; M125-K140 HydrophobicContact SD-CB 4.42Å; M125-K140 HydrophobicContact SD-CG 3.83Å
126	A	84.9	Confident	79.8	Confident	14 Å²	14	84 Å²	84	12%	0.116	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.8	174.4	0	0	0	0	0	111	M138 I139 A141 L144	A126-M138 WeakPolarHBondContact O-CA 3.49Å; A126-I139 PolarHBondContact N-O 3.07Å; A126-I139 PolarHBondContact O-N 3.27Å; A126-A141 HydrophobicContact CB-CB 4.28Å; A126-L144 HydrophobicContact CB-CD1 3.68Å; A126-L144 HydrophobicContact CB-CD2 4.1Å; A126-L144 HydrophobicContact CB-CG 4.06Å
127	K	85.2	Confident	79.9	Confident	68 Å²	68	77.9 Å²	77.9	30%	0.296	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.4	172.3	-72.5	-180	178.4	-173.8	0	109.4	V136 A137 M138 V150 E151 S153	K127-V136 HydrophobicContact CB-CG1 3.61Å; K127-V136 HydrophobicContact CD-CG1 4.05Å; K127-V136 HydrophobicContact CG-CG1 3.97Å; K127-A137 CarbonylContact C-O 3.02Å; K127-A137 WeakPolarHBondContact CA-O 3.28Å; K127-M138 HydrophobicContact CG-CE 3.85Å; K127-V150 CarbonylContact O-C 3.6Å; K127-V150 WeakPolarHBondContact O-CA 3.35Å; K127-E151 HydrophobicContact CB-CB 4.09Å; K127-E151 WeakPolarHBondContact CB-O 3.49Å; K127-E151 IonicContact NZ-OE1 3.51Å; K127-E151 PolarHBondContact O-N 3.36Å; K127-S153 PolarHBondContact NZ-OG 3.21Å
128	V	88	Confident	80	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	156.8	179.6	-61.8	0	0	0	0	112.4	R130 A137 I139 L144 D148 I149 V150	V128-R130 HydrophobicContact CG2-CG 4.12Å; V128-A137 HydrophobicContact CG2-CB 4.38Å; V128-A137 PolarHBondContact N-O 3.14Å; V128-A137 PolarHBondContact O-N 3.37Å; V128-I139 HydrophobicContact CB-CD1 4.35Å; V128-I139 HydrophobicContact CG1-CD1 3.71Å; V128-I139 HydrophobicContact CG1-CG1 4.02Å; V128-I139 HydrophobicContact CG2-CD1 3.69Å; V128-I139 HydrophobicContact CG2-CG1 3.83Å; V128-I139 HydrophobicContact CG2-CG2 4Å; V128-L144 HydrophobicContact CG1-CD2 3.28Å; V128-D148 HydrophobicContact CG1-CB 4.43Å; V128-I149 CarbonylContact C-O 3.59Å; V128-I149 VanDerWaalsContact CA-O 3.27Å; V128-I149 WeakPolarHBondContact CA-O 3.34Å; V128-V150 HydrophobicContact CG1-CG1 4.1Å
129	I	86.4	Confident	80.3	Confident	33 Å²	33	76.5 Å²	76.5	17%	0.169	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.1	168	-52.4	178.6	0	0	0	107.5	E21 G23 V136 I149	E21-I129 WeakPolarHBondContact O-CG2 3.27Å; G23-I129 WeakPolarHBondContact CA-O 3.27Å; I129-V136 HydrophobicContact CG1-CG2 4.28Å; I129-I149 HydrophobicContact CB-CB 4.3Å; I129-I149 HydrophobicContact CB-CG2 4.39Å; I129-I149 HydrophobicContact CD1-CG2 4.11Å; I129-I149 HydrophobicContact CG1-CG2 4.4Å; I129-I149 PolarHBondContact N-O 2.92Å
130	R	87.3	Confident	80.8	Confident	15 Å²	15	77.8 Å²	77.8	6%	0.057	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-136.6	149.4	179.4	-71.4	-177.8	176.6	169.7	2	109.7	R22 L24 V128 S132 K133 E143 D148	R22-R130 CarbonylContact O-C 3.49Å; R22-R130 WeakPolarHBondContact O-CA 3.41Å; L24-R130 WeakPolarHBondContact O-CA 3.32Å; V128-R130 HydrophobicContact CG2-CG 4.12Å; R130-S132 PolarHBondContact O-N 3.12Å; R130-S132 VanDerWaalsContact O-N 3.12Å; R130-K133 PolarHBondContact O-N 2.86Å; R130-K133 VanDerWaalsContact O-N 3.08Å; R130-K133 VanDerWaalsContact O-O 3.07Å; R130-E143 PolarHBondContact NH2-O 3.49Å; R130-D148 IonicContact CZ-OD1 2.76Å; R130-D148 IonicContact CZ-OD2 3.92Å; R130-D148 IonicContact NE-OD1 2.63Å; R130-D148 PolarHBondContact NE-OD1 3.41Å; R130-D148 IonicContact NE-OD2 2.67Å; R130-D148 IonicContact NH2-OD1 2.78Å; R130-D148 PolarHBondContact NH2-OD1 3.34Å; R130-D148 IonicContact NH2-OD2 3.23Å; R130-D148 PolarHBondContact NH2-OD2 3.24Å
131	Q	83.1	Confident	81.3	Confident	95 Å²	95	70.2 Å²	70.2	44%	0.444	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.7	-170.4	-59.9	-172.5	-8.6	0	0	113.1	R22 G23 L24 K133	R22-Q131 HydrophobicContact CB-CG 3.82Å; R22-Q131 WeakPolarHBondContact O-CA 3.14Å; R22-Q131 WeakPolarHBondContact O-CG 3.27Å; R22-Q131 PolarHBondContact O-N 3.27Å; G23-Q131 VanDerWaalsContact O-CG 3.27Å; G23-Q131 WeakPolarHBondContact O-CG 3.45Å; G23-Q131 PolarHBondContact O-NE2 3.37Å; G23-Q131 VanDerWaalsContact O-NE2 3.14Å; L24-Q131 PolarHBondContact O-N 2.82Å; Q131-K133 VanDerWaalsContact C-N 3.31Å
132	S	78.3	Confident	81.9	Confident	59 Å²	59	66.1 Å²	66.1	41%	0.413	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-14.1	-179.1	55.1	0	0	0	0	114.2	D26 R130	D26-S132 VanDerWaalsContact CG-CB 3.44Å; D26-S132 WeakPolarHBondContact OD1-CB 3.32Å; D26-S132 PolarHBondContact OD1-OG 3.2Å; D26-S132 WeakPolarHBondContact OD2-CB 3.46Å; D26-S132 PolarHBondContact OD2-OG 3.39Å; R130-S132 PolarHBondContact O-N 3.12Å; R130-S132 VanDerWaalsContact O-N 3.12Å
133	K	77.2	Confident	82.7	Confident	100 Å²	100	64.9 Å²	64.9	44%	0.435	34%	0.344	S	S	.	.	S	Bend	trans	-120.8	132.9	-176.1	-65	-174.5	179.2	-178.8	0	110.2	R130 Q131 G135 A137	R130-K133 PolarHBondContact O-N 2.86Å; R130-K133 VanDerWaalsContact O-N 3.08Å; R130-K133 VanDerWaalsContact O-O 3.07Å; Q131-K133 VanDerWaalsContact C-N 3.31Å; K133-G135 PolarHBondContact O-N 2.93Å; K133-A137 HydrophobicContact CB-CB 4.03Å; K133-A137 HydrophobicContact CD-CB 3.16Å; K133-A137 HydrophobicContact CG-CB 4.21Å
134	V	73.5	Confident	83.5	Confident	160 Å²	160	61.6 Å²	61.6	97%	0.97	32%	0.321	S	S	*	.	S	Bend	trans	-76	107	176.8	-177.7	0	0	0	0	108.5
135	G	77.2	Confident	83.9	Confident	45 Å²	45	54.4 Å²	54.4	46%	0.464	29%	0.288	S	S	.	.	S	Bend	trans	87.7	-153.4	178.8	0	0	0	0	0	113.9	K133	K133-G135 PolarHBondContact O-N 2.93Å
136	V	80.9	Confident	84	Confident	66 Å²	66	52.6 Å²	52.6	40%	0.4	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.2	-176.8	-178.6	0	0	0	0	109.9	K127 I129 E151	K127-V136 HydrophobicContact CB-CG1 3.61Å; K127-V136 HydrophobicContact CD-CG1 4.05Å; K127-V136 HydrophobicContact CG-CG1 3.97Å; I129-V136 HydrophobicContact CG1-CG2 4.28Å; V136-E151 HydrophobicContact CG1-CB 4.44Å
137	A	84.9	Confident	83.9	Confident	9 Å²	9	52.8 Å²	52.8	7%	0.074	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.3	177.9	0	0	0	0	0	111.5	K127 V128 K133	K127-A137 CarbonylContact C-O 3.02Å; K127-A137 WeakPolarHBondContact CA-O 3.28Å; V128-A137 HydrophobicContact CG2-CB 4.38Å; V128-A137 PolarHBondContact N-O 3.14Å; V128-A137 PolarHBondContact O-N 3.37Å; K133-A137 HydrophobicContact CB-CB 4.03Å; K133-A137 HydrophobicContact CD-CB 3.16Å; K133-A137 HydrophobicContact CG-CB 4.21Å
138	M	84.8	Confident	84	Confident	112 Å²	112	50.6 Å²	50.6	55%	0.552	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.3	171.1	-160.7	162.3	-80.3	0	0	109.3	M125 A126 K127	M125-M138 HydrophobicContact CB-CG 3.85Å; M125-M138 HydrophobicContact CB-SD 4.18Å; M125-M138 HydrophobicContact CE-CB 4.38Å; M125-M138 HydrophobicContact CE-CG 3.71Å; M125-M138 HydrophobicContact CG-CG 4.44Å; A126-M138 WeakPolarHBondContact O-CA 3.49Å; K127-M138 HydrophobicContact CG-CE 3.85Å
139	I	86.6	Confident	83.8	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	163.4	177.7	63.3	166.7	0	0	0	109.3	M125 A126 V128 E143 L144	M125-I139 CarbonylContact C-O 3.53Å; M125-I139 VanDerWaalsContact CA-O 3.26Å; M125-I139 WeakPolarHBondContact CA-O 3.45Å; A126-I139 PolarHBondContact N-O 3.07Å; A126-I139 PolarHBondContact O-N 3.27Å; V128-I139 HydrophobicContact CB-CD1 4.35Å; V128-I139 HydrophobicContact CG1-CD1 3.71Å; V128-I139 HydrophobicContact CG1-CG1 4.02Å; V128-I139 HydrophobicContact CG2-CD1 3.69Å; V128-I139 HydrophobicContact CG2-CG1 3.83Å; V128-I139 HydrophobicContact CG2-CG2 4Å; I139-E143 HydrophobicContact CD1-CB 4.21Å; I139-L144 HydrophobicContact CD1-CD2 4.03Å; I139-L144 HydrophobicContact CD1-CG 4.41Å
140	K	86.7	Confident	83.6	Confident	89 Å²	89	52.1 Å²	52.1	39%	0.387	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	138.3	171.1	-65.6	-175.2	173.4	-168.5	0	109.4	E124 M125 R142 E143	E124-K140 VanDerWaalsContact O-CA 3.31Å; E124-K140 WeakPolarHBondContact O-CA 3.37Å; M125-K140 HydrophobicContact SD-CB 4.42Å; M125-K140 HydrophobicContact SD-CG 3.83Å; K140-R142 HydrophobicContact CB-CG 3.98Å; K140-R142 PolarHBondContact O-N 3.23Å; K140-E143 HydrophobicContact CB-CG 4.26Å; K140-E143 WeakPolarHBondContact O-CB 3.34Å; K140-E143 PolarHBondContact O-N 3.43Å
141	A	85.5	Confident	83.3	Confident	9 Å²	9	54 Å²	54	7%	0.074	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-61	-29.3	-178.3	0	0	0	0	0	112.9	N39 P123 E124 A126 E143 L144	N39-A141 PolarHBondContact ND2-O 3.3Å; N39-A141 VanDerWaalsContact ND2-O 3.07Å; P123-A141 HydrophobicContact CG-CB 4.3Å; P123-A141 WeakPolarHBondContact O-CB 3.32Å; E124-A141 PolarHBondContact O-N 3.15Å; A126-A141 HydrophobicContact CB-CB 4.28Å; A141-E143 PolarHBondContact O-N 3.35Å; A141-L144 HydrophobicContact CB-CD1 4.34Å; A141-L144 VanDerWaalsContact O-CB 3.26Å; A141-L144 WeakPolarHBondContact O-CB 3.45Å; A141-L144 WeakPolarHBondContact O-CD1 3.05Å; A141-L144 VanDerWaalsContact O-CG 3.29Å; A141-L144 WeakPolarHBondContact O-CG 3.45Å; A141-L144 PolarHBondContact O-N 3.11Å; A141-L144 VanDerWaalsContact O-N 3.13Å
142	R	85.8	Confident	82.8	Confident	107 Å²	107	52 Å²	52	40%	0.404	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-58.9	-24.1	172.1	77	179.3	-171.1	167.2	5.2	114.4	Y38 N39 E40 K140 L144	Y38-R142 WeakPolarHBondContact CA-O 3.2Å; Y38-R142 HydrophobicContact CD1-CG 4.49Å; Y38-R142 WeakPolarHBondContact CD1-O 3.45Å; N39-R142 PolarHBondContact N-O 2.88Å; N39-R142 WeakPolarHBondContact O-CA 3.34Å; E40-R142 HydrophobicContact CB-CB 4.38Å; K140-R142 HydrophobicContact CB-CG 3.98Å; K140-R142 PolarHBondContact O-N 3.23Å; R142-L144 VanDerWaalsContact C-N 3.31Å
143	E	87.1	Confident	82.2	Confident	55 Å²	55	52.6 Å²	52.6	26%	0.257	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-88.4	1	-178.9	-65.3	177.6	-163.5	0	0	113.4	R130 I139 K140 A141	R130-E143 PolarHBondContact NH2-O 3.49Å; I139-E143 HydrophobicContact CD1-CB 4.21Å; K140-E143 HydrophobicContact CB-CG 4.26Å; K140-E143 WeakPolarHBondContact O-CB 3.34Å; K140-E143 PolarHBondContact O-N 3.43Å; A141-E143 PolarHBondContact O-N 3.35Å
144	L	88	Confident	81.4	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.089	29%	0.293	C	S	.	.			trans	-66.3	141.9	172.5	-71.3	170.2	0	0	0	110.6	N39 A126 V128 I139 A141 R142 D148 V150 I166	N39-L144 HydrophobicContact CB-CB 4.1Å; N39-L144 WeakPolarHBondContact CB-O 3.39Å; A126-L144 HydrophobicContact CB-CD1 3.68Å; A126-L144 HydrophobicContact CB-CD2 4.1Å; A126-L144 HydrophobicContact CB-CG 4.06Å; V128-L144 HydrophobicContact CG1-CD2 3.28Å; I139-L144 HydrophobicContact CD1-CD2 4.03Å; I139-L144 HydrophobicContact CD1-CG 4.41Å; A141-L144 HydrophobicContact CB-CD1 4.34Å; A141-L144 VanDerWaalsContact O-CB 3.26Å; A141-L144 WeakPolarHBondContact O-CB 3.45Å; A141-L144 WeakPolarHBondContact O-CD1 3.05Å; A141-L144 VanDerWaalsContact O-CG 3.29Å; A141-L144 WeakPolarHBondContact O-CG 3.45Å; A141-L144 PolarHBondContact O-N 3.11Å; A141-L144 VanDerWaalsContact O-N 3.13Å; R142-L144 VanDerWaalsContact C-N 3.31Å; L144-D148 WeakPolarHBondContact CA-OD2 3.33Å; L144-D148 HydrophobicContact CD2-CB 4.19Å; L144-V150 HydrophobicContact CD2-CG1 3.72Å; L144-I166 HydrophobicContact CB-CD1 4.31Å
145	V	88.3	Confident	80.2	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.024	29%	0.294	C	S	.	.			trans	-126.4	152.6	174.7	-63.9	0	0	0	0	110.8	L24 V29 R33 G147 D148	L24-V145 HydrophobicContact CD1-CG2 3.66Å; V29-V145 HydrophobicContact CB-CG2 4.42Å; V29-V145 HydrophobicContact CG1-CG1 4.34Å; V29-V145 HydrophobicContact CG1-CG2 4.23Å; V29-V145 HydrophobicContact CG2-CG2 4.23Å; R33-V145 HydrophobicContact CB-CG1 4.08Å; V145-G147 PolarHBondContact O-N 3.43Å; V145-G147 VanDerWaalsContact O-N 3.14Å; V145-D148 WeakPolarHBondContact CG2-OD2 3.3Å; V145-D148 PolarHBondContact N-OD2 2.9Å; V145-D148 WeakPolarHBondContact O-CB 3.24Å; V145-D148 PolarHBondContact O-N 2.89Å
146	P	84.5	Confident	78.2	Confident	40 Å²	40	55.1 Å²	55.1	26%	0.26	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	121.6	173.8	-27.3	36.2	0	0	0	111.8	F16 Y36	F16-P146 HydrophobicContact CE1-CB 3.82Å; F16-P146 HydrophobicContact CZ-CB 4.21Å; Y36-P146 HydrophobicContact CD1-CG 4.21Å; Y36-P146 HydrophobicContact CD2-CB 4.28Å; Y36-P146 HydrophobicContact CD2-CG 3.75Å; Y36-P146 HydrophobicContact CE2-CB 4.28Å; Y36-P146 HydrophobicContact CE2-CG 4.2Å; Y36-P146 HydrophobicContact CG-CG 3.78Å
147	G	83.6	Confident	75.8	Confident	19 Å²	19	55.4 Å²	55.4	20%	0.196	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	106.3	-9.2	-176.3	0	0	0	0	0	114.8	V18 V145	V18-G147 VanDerWaalsContact CG2-O 3.32Å; V18-G147 WeakPolarHBondContact CG2-O 3.45Å; V145-G147 PolarHBondContact O-N 3.43Å; V145-G147 VanDerWaalsContact O-N 3.14Å
148	D	85.5	Confident	73.2	Confident	21 Å²	21	58.8 Å²	58.8	11%	0.112	35%	0.347	C	S	.	.			trans	-60.5	138.1	172	-89.9	-39.6	0	0	0	110.9	L24 V128 R130 L144 V145 V150	L24-D148 HydrophobicContact CD1-CB 4.48Å; V128-D148 HydrophobicContact CG1-CB 4.43Å; R130-D148 IonicContact CZ-OD1 2.76Å; R130-D148 IonicContact CZ-OD2 3.92Å; R130-D148 IonicContact NE-OD1 2.63Å; R130-D148 PolarHBondContact NE-OD1 3.41Å; R130-D148 IonicContact NE-OD2 2.67Å; R130-D148 IonicContact NH2-OD1 2.78Å; R130-D148 PolarHBondContact NH2-OD1 3.34Å; R130-D148 IonicContact NH2-OD2 3.23Å; R130-D148 PolarHBondContact NH2-OD2 3.24Å; L144-D148 WeakPolarHBondContact CA-OD2 3.33Å; L144-D148 HydrophobicContact CD2-CB 4.19Å; V145-D148 WeakPolarHBondContact CG2-OD2 3.3Å; V145-D148 PolarHBondContact N-OD2 2.9Å; V145-D148 WeakPolarHBondContact O-CB 3.24Å; V145-D148 PolarHBondContact O-N 2.89Å; D148-V150 PolarHBondContact O-N 2.91Å
149	I	84.1	Confident	70.8	Confident	32 Å²	32	62.5 Å²	62.5	16%	0.164	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	109.5	170.6	-59.8	-177.4	0	0	0	107.7	V18 D19 S20 V128 I129	V18-I149 HydrophobicContact CG1-CD1 3.78Å; V18-I149 HydrophobicContact CG1-CG1 3.89Å; D19-I149 VanDerWaalsContact O-CD1 3.27Å; D19-I149 WeakPolarHBondContact O-CD1 3.27Å; S20-I149 VanDerWaalsContact O-CD1 3.32Å; S20-I149 WeakPolarHBondContact O-CD1 3.32Å; V128-I149 CarbonylContact C-O 3.59Å; V128-I149 VanDerWaalsContact CA-O 3.27Å; V128-I149 WeakPolarHBondContact CA-O 3.34Å; I129-I149 HydrophobicContact CB-CB 4.3Å; I129-I149 HydrophobicContact CB-CG2 4.39Å; I129-I149 HydrophobicContact CD1-CG2 4.11Å; I129-I149 HydrophobicContact CG1-CG2 4.4Å; I129-I149 PolarHBondContact N-O 2.92Å
150	V	83.9	Confident	68.5	Low	34 Å²	34	65.8 Å²	65.8	21%	0.206	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	138.9	179.9	-65.8	0	0	0	0	111.3	K127 V128 L144 D148	K127-V150 CarbonylContact O-C 3.6Å; K127-V150 WeakPolarHBondContact O-CA 3.35Å; V128-V150 HydrophobicContact CG1-CG1 4.1Å; L144-V150 HydrophobicContact CD2-CG1 3.72Å; D148-V150 PolarHBondContact O-N 2.91Å
151	E	79.9	Confident	66.4	Low	55 Å²	55	68 Å²	68	26%	0.257	39%	0.387	S	S	.	.			trans	-101.9	109.6	169.9	-175.7	-178.4	89.9	0	0	109.6	K127 V136	K127-E151 HydrophobicContact CB-CB 4.09Å; K127-E151 WeakPolarHBondContact CB-O 3.49Å; K127-E151 IonicContact NZ-OE1 3.51Å; K127-E151 PolarHBondContact O-N 3.36Å; V136-E151 HydrophobicContact CG1-CB 4.44Å
152	V	73.4	Confident	64.3	Low	52 Å²	52	72.9 Å²	72.9	32%	0.315	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.6	174.4	-172.9	0	0	0	0	108.4
153	S	64.8	Low	62.1	Low	71 Å²	71	72.2 Å²	72.2	50%	0.497	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	95.9	166.9	-49.7	0	0	0	0	108.4	K127	K127-S153 PolarHBondContact NZ-OG 3.21Å
154	G	59.7	Low	60.1	Low	41 Å²	41	77.8 Å²	77.8	42%	0.423	43%	0.431	S	S	.	.			trans	-74.1	160.8	166.6	0	0	0	0	0	111.2	L156 G157	G154-L156 PolarHBondContact O-N 3.07Å; G154-G157 PolarHBondContact O-N 3.5Å
155	T	48.6	Very low	57.8	Low	160 Å²	160	80 Å²	80	98%	0.982	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-15.7	175.9	-43.7	0	0	0	0	113.8
156	L	36.3	Very low	55.5	Low	158 Å²	158	82.9 Å²	82.9	83%	0.827	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	8.2	176.9	-76.7	160.7	0	0	0	115.1	G154 V158	G154-L156 PolarHBondContact O-N 3.07Å; L156-V158 HydrophobicContact CB-CG2 4.09Å; L156-V158 PolarHBondContact O-N 3.43Å; L156-V158 VanDerWaalsContact O-N 3.09Å
157	G	29.4	Very low	53.3	Low	72 Å²	72	87.7 Å²	87.7	74%	0.742	47%	0.471	S	S	*	.			trans	64.2	17	175.6	0	0	0	0	0	114.8	G154 R159	G154-G157 PolarHBondContact O-N 3.5Å; G157-R159 PolarHBondContact O-N 3.37Å
158	V	30	Very low	50.8	Low	79 Å²	79	90 Å²	90	48%	0.479	49%	0.488	S	S	.	.			trans	-85.3	113.6	179	-169.3	0	0	0	0	109	L156 L160	L156-V158 HydrophobicContact CB-CG2 4.09Å; L156-V158 PolarHBondContact O-N 3.43Å; L156-V158 VanDerWaalsContact O-N 3.09Å; V158-L160 HydrophobicContact CG1-CD2 4.16Å; V158-L160 HydrophobicContact CG1-CG 3.87Å; V158-L160 PolarHBondContact O-N 3.45Å
159	R	34.4	Very low	48.1	Very low	190 Å²	190	93.8 Å²	93.8	72%	0.717	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	88.9	170.6	-168.1	-179.6	-175	-165.1	0.4	108.5	G157	G157-R159 PolarHBondContact O-N 3.37Å
160	L	38.8	Very low	45.8	Very low	76 Å²	76	101.2 Å²	101.2	40%	0.398	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	108.8	171.1	-73.3	170.1	0	0	0	108.6	V158 Q162	V158-L160 HydrophobicContact CG1-CD2 4.16Å; V158-L160 HydrophobicContact CG1-CG 3.87Å; V158-L160 PolarHBondContact O-N 3.45Å; L160-Q162 HydrophobicContact CB-CB 4.38Å; L160-Q162 HydrophobicContact CB-CG 4.08Å; L160-Q162 HydrophobicContact CD2-CG 4.33Å; L160-Q162 PolarHBondContact O-N 3.4Å; L160-Q162 VanDerWaalsContact O-N 3.08Å
161	I	42.3	Very low	43.9	Very low	137 Å²	137	104.6 Å²	104.6	70%	0.703	58%	0.58	S	S	*	*			trans	-78.3	81.4	158.8	-56	173.9	0	0	0	105
162	Q	42	Very low	42	Very low	111 Å²	111	107.2 Å²	107.2	52%	0.519	60%	0.597	S	S	.	*			trans	-107	130.4	177	-87.2	-170	-21.2	0	0	110.5	L160 W164	L160-Q162 HydrophobicContact CB-CB 4.38Å; L160-Q162 HydrophobicContact CB-CG 4.08Å; L160-Q162 HydrophobicContact CD2-CG 4.33Å; L160-Q162 PolarHBondContact O-N 3.4Å; L160-Q162 VanDerWaalsContact O-N 3.08Å; Q162-W164 PolarHBondContact O-N 3.21Å; Q162-W164 VanDerWaalsContact O-N 3.17Å
163	N	40.2	Very low	40.3	Very low	92 Å²	92	110.3 Å²	110.3	49%	0.492	61%	0.613	S	S	.	*			trans	-70.1	99.4	177.6	-160.5	13.7	0	0	0	108.3	A4 N165	A4-N163 VanDerWaalsContact CB-ND2 3.27Å; A4-N163 WeakPolarHBondContact CB-ND2 3.41Å; N163-N165 PolarHBondContact O-N 2.8Å
164	W	45	Very low	38.8	Very low	172 Å²	172	112.6 Å²	112.6	65%	0.652	62%	0.62	S	S	*	*			trans	-77.1	112.1	173.7	-80	78.9	0	0	0	108.9	Q162 I166	Q162-W164 PolarHBondContact O-N 3.21Å; Q162-W164 VanDerWaalsContact O-N 3.17Å; W164-I166 HydrophobicContact CB-CG1 4.39Å; W164-I166 PolarHBondContact O-N 3.39Å
165	N	38.5	Very low	37.5	Very low	64 Å²	64	117.1 Å²	117.1	34%	0.342	63%	0.632	S	S	.	*			trans	-72.9	85.1	167.4	-124.5	6.9	0	0	0	106.6	N163 W167	N163-N165 PolarHBondContact O-N 2.8Å; N165-W167 PolarHBondContact ND2-NE1 3.09Å; N165-W167 VanDerWaalsContact ND2-NE1 3.14Å; N165-W167 PolarHBondContact O-N 3.35Å; N165-W167 VanDerWaalsContact O-N 3.11Å
166	I	41.4	Very low	36.8	Very low	65 Å²	65	114.2 Å²	114.2	33%	0.333	61%	0.609	S	S	.	*			trans	-71.8	101.6	170.8	-62.3	170.3	0	0	0	106.4	N39 L144 W164	N39-I166 HydrophobicContact CB-CG2 4.49Å; N39-I166 WeakPolarHBondContact OD1-CG2 3.09Å; L144-I166 HydrophobicContact CB-CD1 4.31Å; W164-I166 HydrophobicContact CB-CG1 4.39Å; W164-I166 PolarHBondContact O-N 3.39Å
167	W	37.9	Very low	36.8	Very low	140 Å²	140	111.1 Å²	111.1	53%	0.53	59%	0.593	S	S	.	*			trans	-96.9	96.8	172.5	-66.3	94.1	0	0	0	108.3	E2 N165 V169	E2-W167 HydrophobicContact CG-CH2 4.19Å; E2-W167 HydrophobicContact CG-CZ3 4.42Å; N165-W167 PolarHBondContact ND2-NE1 3.09Å; N165-W167 VanDerWaalsContact ND2-NE1 3.14Å; N165-W167 PolarHBondContact O-N 3.35Å; N165-W167 VanDerWaalsContact O-N 3.11Å; W167-V169 HydrophobicContact CB-CG2 4.28Å; W167-V169 HydrophobicContact CD2-CG2 4.4Å; W167-V169 HydrophobicContact CE3-CG2 3.52Å; W167-V169 HydrophobicContact CZ3-CG2 4.25Å
168	A	30	Very low	37.4	Very low	68 Å²	68	114.1 Å²	114.1	56%	0.562	58%	0.581	S	S	*	*			trans	-94.9	92.6	146.5	0	0	0	0	0	105.5
169	V	30.4	Very low	38	Very low	101 Å²	101	117 Å²	117	61%	0.612	59%	0.59	S	S	*	*			trans	-83	141	166.5	177.2	0	0	0	0	105.9	W167	W167-V169 HydrophobicContact CB-CG2 4.28Å; W167-V169 HydrophobicContact CD2-CG2 4.4Å; W167-V169 HydrophobicContact CE3-CG2 3.52Å; W167-V169 HydrophobicContact CZ3-CG2 4.25Å
170	P	35.7	Very low	38.4	Very low	188 Å²	188	110.4 Å²	110.4	100%	1.221	58%	0.578	S	S	*	*			trans	-50	0	-169.1	19.6	-36.8	0	0	0	115.8

Retrieved 170 of 170 residues in 186.2 ms (Link to these results)

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