A0A077ZGV6_TRITR Loading...

Amine oxidase

AlphaFold DB , UniProt , Accession A0A077ZGV6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 176 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	55.8	Low	194 Å²	194	93.9 Å²	93.9	96%	0.956	55%	0.551	S	S	*	*				0	129.5	0	-68.9	-160	-178.2	0	0	107	V3	M1-V3 PolarHBondContact O-N 3.47Å
2	S	53.1	Low	55.8	Low	75 Å²	75	91.9 Å²	91.9	52%	0.524	54%	0.541	S	S	.	.			trans	-72	128.2	178.4	54.9	0	0	0	0	109.1	P4 V5	S2-P4 VanDerWaalsContact C-N 3.27Å; S2-P4 WeakPolarHBondContact O-CD 3.32Å; S2-P4 VanDerWaalsContact O-N 3.09Å; S2-V5 PolarHBondContact O-N 3.05Å; S2-V5 VanDerWaalsContact O-N 3.09Å
3	V	56.9	Low	55.7	Low	111 Å²	111	96.2 Å²	96.2	67%	0.673	55%	0.548	S	S	*	.	H	α-helix	trans	-41.8	-37.5	-179.9	-177.5	0	0	0	0	115.3	M1 V5 L6	M1-V3 PolarHBondContact O-N 3.47Å; V3-V5 VanDerWaalsContact C-N 3.29Å; V3-V5 PolarHBondContact O-N 2.95Å; V3-L6 PolarHBondContact O-N 3.31Å
4	P	54.5	Low	55.4	Low	83 Å²	83	100.2 Å²	100.2	54%	0.539	56%	0.56	S	S	.	*	H	α-helix	trans	-61.7	-30.3	179.6	20.8	-35.5	0	0	0	114.8	S2 L6 V7 F8	S2-P4 VanDerWaalsContact C-N 3.27Å; S2-P4 WeakPolarHBondContact O-CD 3.32Å; S2-P4 VanDerWaalsContact O-N 3.09Å; P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 3.24Å; P4-V7 PolarHBondContact O-N 3.43Å; P4-F8 PolarHBondContact O-N 3.08Å
5	V	53.2	Low	55.2	Low	79 Å²	79	99.5 Å²	99.5	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-70.3	-34.1	-177.4	-178	0	0	0	0	111.2	S2 V3 F8 V9	S2-V5 PolarHBondContact O-N 3.05Å; S2-V5 VanDerWaalsContact O-N 3.09Å; V3-V5 VanDerWaalsContact C-N 3.29Å; V3-V5 PolarHBondContact O-N 2.95Å; V5-F8 PolarHBondContact O-N 3.17Å; V5-V9 WeakPolarHBondContact O-CG2 3.48Å; V5-V9 PolarHBondContact O-N 2.99Å
6	L	56.3	Low	54.9	Low	107 Å²	107	99.1 Å²	99.1	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-69.9	-37.1	178.9	-84.3	160.2	0	0	0	112.3	V3 P4 F8 V9 A10	V3-L6 PolarHBondContact O-N 3.31Å; P4-L6 VanDerWaalsContact C-N 3.33Å; P4-L6 PolarHBondContact O-N 3.24Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.02Å; L6-V9 PolarHBondContact O-N 2.95Å; L6-A10 WeakPolarHBondContact O-CB 3.33Å; L6-A10 PolarHBondContact O-N 3.44Å
7	V	59.8	Low	54.9	Low	92 Å²	92	101.8 Å²	101.8	56%	0.558	57%	0.571	S	S	*	*	H	α-helix	trans	-65.8	-37.3	178	-178.9	0	0	0	0	111	P4 T11	P4-V7 PolarHBondContact O-N 3.43Å; V7-T11 WeakPolarHBondContact O-CG2 3.43Å; V7-T11 PolarHBondContact O-N 3.04Å; V7-T11 VanDerWaalsContact O-N 3.15Å; V7-T11 PolarHBondContact O-OG1 3.22Å
8	F	56.8	Low	54.8	Low	84 Å²	84	100.4 Å²	100.4	37%	0.368	57%	0.569	S	S	.	*	H	α-helix	trans	-71.1	-38.5	178	-164.1	-97.1	0	0	0	113.1	P4 V5 L6 T11 T12 L36 C39	P4-F8 PolarHBondContact O-N 3.08Å; V5-F8 PolarHBondContact O-N 3.17Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.02Å; F8-T11 PolarHBondContact O-OG1 2.95Å; F8-T11 VanDerWaalsContact O-OG1 3.07Å; F8-T12 HydrophobicContact CD1-CG2 4.38Å; F8-T12 HydrophobicContact CE1-CG2 4.1Å; F8-T12 HydrophobicContact CZ-CG2 4.44Å; F8-T12 WeakPolarHBondContact O-CG2 3.33Å; F8-T12 PolarHBondContact O-N 2.98Å; F8-T12 PolarHBondContact O-OG1 3.38Å; F8-L36 HydrophobicContact CE1-CD1 4.32Å; F8-L36 HydrophobicContact CZ-CD1 3.91Å; F8-L36 HydrophobicContact CZ-CG 4.14Å; F8-C39 HydrophobicContact CE2-CB 4.49Å
9	V	59.9	Low	54.4	Low	78 Å²	78	98.1 Å²	98.1	47%	0.473	57%	0.569	S	S	.	*	H	α-helix	trans	-70.7	-34.6	176.6	176.1	0	0	0	0	111.6	V5 L6 T12 K13	V5-V9 WeakPolarHBondContact O-CG2 3.48Å; V5-V9 PolarHBondContact O-N 2.99Å; L6-V9 PolarHBondContact O-N 2.95Å; V9-T12 WeakPolarHBondContact CA-OG1 3.4Å; V9-T12 PolarHBondContact O-OG1 2.86Å; V9-T12 VanDerWaalsContact O-OG1 3.09Å; V9-K13 PolarHBondContact O-N 2.94Å
10	A	57.3	Low	54	Low	61 Å²	61	100.4 Å²	100.4	50%	0.504	58%	0.58	S	S	.	*	H	α-helix	trans	-68.6	-43	177.7	0	0	0	0	0	112.3	L6 K13 Q14	L6-A10 WeakPolarHBondContact O-CB 3.33Å; L6-A10 PolarHBondContact O-N 3.44Å; A10-K13 PolarHBondContact O-N 3.09Å; A10-Q14 PolarHBondContact O-N 3.01Å
11	T	57.7	Low	53.7	Low	69 Å²	69	104.5 Å²	104.5	42%	0.423	59%	0.593	S	S	.	*	H	α-helix	trans	-68.7	-36.7	-179.8	47.7	0	0	0	0	112.6	V7 F8 Q14 L15	V7-T11 WeakPolarHBondContact O-CG2 3.43Å; V7-T11 PolarHBondContact O-N 3.04Å; V7-T11 VanDerWaalsContact O-N 3.15Å; V7-T11 PolarHBondContact O-OG1 3.22Å; F8-T11 PolarHBondContact O-OG1 2.95Å; F8-T11 VanDerWaalsContact O-OG1 3.07Å; T11-Q14 PolarHBondContact O-N 2.96Å; T11-L15 PolarHBondContact O-N 2.9Å; T11-L15 VanDerWaalsContact O-N 3.17Å
12	T	55.3	Low	53.9	Low	70 Å²	70	100.8 Å²	100.8	43%	0.429	58%	0.577	S	S	.	*	H	α-helix	trans	-69.6	-32.8	176.1	49	0	0	0	0	113	F8 V9 L15 S16	F8-T12 HydrophobicContact CD1-CG2 4.38Å; F8-T12 HydrophobicContact CE1-CG2 4.1Å; F8-T12 HydrophobicContact CZ-CG2 4.44Å; F8-T12 WeakPolarHBondContact O-CG2 3.33Å; F8-T12 PolarHBondContact O-N 2.98Å; F8-T12 PolarHBondContact O-OG1 3.38Å; V9-T12 WeakPolarHBondContact CA-OG1 3.4Å; V9-T12 PolarHBondContact O-OG1 2.86Å; V9-T12 VanDerWaalsContact O-OG1 3.09Å; T12-L15 PolarHBondContact O-N 3.09Å; T12-S16 PolarHBondContact O-N 2.73Å
13	K	54.7	Low	53.9	Low	147 Å²	147	103 Å²	103	64%	0.639	59%	0.592	S	S	*	*	H	α-helix	trans	-67.6	-38.2	171.5	-85.1	-154.8	174.4	-170.5	0	113.1	V9 A10 L15 S16 I17	V9-K13 PolarHBondContact O-N 2.94Å; A10-K13 PolarHBondContact O-N 3.09Å; K13-L15 VanDerWaalsContact C-N 3.33Å; K13-L15 PolarHBondContact O-N 2.83Å; K13-S16 PolarHBondContact O-N 2.81Å; K13-I17 WeakPolarHBondContact O-CG1 3.5Å; K13-I17 PolarHBondContact O-N 3.17Å
14	Q	51.4	Low	54	Low	153 Å²	153	102.1 Å²	102.1	72%	0.715	58%	0.577	S	S	*	*	H	α-helix	trans	-64.8	-37.7	175.2	-80.3	-165.6	-10.3	0	0	112.2	A10 T11 S16 I17	A10-Q14 PolarHBondContact O-N 3.01Å; T11-Q14 PolarHBondContact O-N 2.96Å; Q14-S16 VanDerWaalsContact C-N 3.31Å; Q14-S16 PolarHBondContact O-N 3.27Å; Q14-I17 PolarHBondContact O-N 2.99Å
15	L	52.1	Low	54.8	Low	89 Å²	89	101.3 Å²	101.3	47%	0.466	57%	0.573	S	S	.	*	H	α-helix	trans	-65.8	-33.5	176.7	-122.9	91.5	0	0	0	112.9	T11 T12 K13 L32	T11-L15 PolarHBondContact O-N 2.9Å; T11-L15 VanDerWaalsContact O-N 3.17Å; T12-L15 PolarHBondContact O-N 3.09Å; K13-L15 VanDerWaalsContact C-N 3.33Å; K13-L15 PolarHBondContact O-N 2.83Å; L15-L32 HydrophobicContact CD2-CD1 4.22Å
16	S	51	Low	55.7	Low	94 Å²	94	101.4 Å²	101.4	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-75.3	-24.2	-178.6	-175.1	0	0	0	0	114	T12 K13 Q14	T12-S16 PolarHBondContact O-N 2.73Å; K13-S16 PolarHBondContact O-N 2.81Å; Q14-S16 VanDerWaalsContact C-N 3.31Å; Q14-S16 PolarHBondContact O-N 3.27Å
17	I	54.1	Low	56.7	Low	144 Å²	144	99.7 Å²	99.7	74%	0.738	58%	0.58	S	S	*	*	H	α-helix	trans	-83.2	-19.1	-177.2	-63.9	165.8	0	0	0	111.4	K13 Q14 G19	K13-I17 WeakPolarHBondContact O-CG1 3.5Å; K13-I17 PolarHBondContact O-N 3.17Å; Q14-I17 PolarHBondContact O-N 2.99Å; I17-G19 PolarHBondContact O-N 3.28Å
18	S	53.5	Low	57.5	Low	78 Å²	78	98.1 Å²	98.1	55%	0.545	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	14.8	173.3	-179.9	0	0	0	0	113.5	N20	S18-N20 VanDerWaalsContact C-N 3.29Å; S18-N20 PolarHBondContact O-N 3.27Å; S18-N20 VanDerWaalsContact O-N 3.08Å
19	G	46.7	Very low	58.7	Low	55 Å²	55	99.8 Å²	99.8	57%	0.567	58%	0.577	S	S	*	*			trans	-80.2	26	-164.6	0	0	0	0	0	117.6	I17	I17-G19 PolarHBondContact O-N 3.28Å
20	N	46.3	Very low	59.6	Low	145 Å²	145	98.2 Å²	98.2	78%	0.775	57%	0.572	S	S	*	*	S	Bend	trans	-106.6	104.7	173.8	-65.6	-9.2	0	0	0	108.9	S18	S18-N20 VanDerWaalsContact C-N 3.29Å; S18-N20 PolarHBondContact O-N 3.27Å; S18-N20 VanDerWaalsContact O-N 3.08Å
21	H	48.2	Very low	60.9	Low	187 Å²	187	101.1 Å²	101.1	87%	0.866	58%	0.577	S	S	*	*	S	Bend	trans	87.8	19.7	165.7	-66.9	-84	0	0	0	121.6
22	L	52.1	Low	62.3	Low	116 Å²	116	101.4 Å²	101.4	61%	0.607	58%	0.575	S	S	*	*			trans	-104.7	95.1	167.9	-77.8	146.8	0	0	0	110.4	Y24	L22-Y24 HydrophobicContact CB-CE2 4.37Å; L22-Y24 WeakPolarHBondContact O-CD2 3.31Å; L22-Y24 PolarHBondContact O-N 3.04Å
23	S	54.1	Low	63.9	Low	122 Å²	122	103.9 Å²	103.9	85%	0.853	59%	0.585	S	S	*	*			trans	-57.1	85.8	158.7	-56.3	0	0	0	0	107.8	S25	S23-S25 PolarHBondContact O-N 2.81Å; S23-S25 VanDerWaalsContact O-N 3.1Å
24	Y	58.7	Low	65.6	Low	92 Å²	92	104.4 Å²	104.4	36%	0.361	59%	0.588	S	S	.	*			trans	-56.4	119.6	176.4	-84.6	-76.2	0	0	0	108.1	L22 A26 L28	L22-Y24 HydrophobicContact CB-CE2 4.37Å; L22-Y24 WeakPolarHBondContact O-CD2 3.31Å; L22-Y24 PolarHBondContact O-N 3.04Å; Y24-A26 PolarHBondContact O-N 2.77Å; Y24-L28 HydrophobicContact CD1-CB 3.92Å; Y24-L28 HydrophobicContact CD1-CD1 3.65Å; Y24-L28 HydrophobicContact CD1-CD2 3.3Å; Y24-L28 HydrophobicContact CD1-CG 3.76Å; Y24-L28 HydrophobicContact CE1-CD1 3.66Å; Y24-L28 HydrophobicContact CE1-CD2 3.31Å; Y24-L28 HydrophobicContact CE1-CG 4Å; Y24-L28 HydrophobicContact CG-CD2 4.4Å
25	S	70.7	Confident	67.4	Low	65 Å²	65	101.8 Å²	101.8	46%	0.455	58%	0.578	S	S	.	*			trans	-54.9	143.4	172.7	58.3	0	0	0	0	108.4	S23 S27 L28 Q29	S23-S25 PolarHBondContact O-N 2.81Å; S23-S25 VanDerWaalsContact O-N 3.1Å; S25-S27 PolarHBondContact O-N 2.7Å; S25-S27 PolarHBondContact OG-OG 2.91Å; S25-L28 PolarHBondContact O-N 2.97Å; S25-Q29 PolarHBondContact O-N 3.32Å
26	A	72.3	Confident	69.2	Low	81 Å²	81	101.1 Å²	101.1	67%	0.669	57%	0.574	S	S	*	*	H	α-helix	trans	-50.1	-27.5	177.4	0	0	0	0	0	112.4	Y24 A30	Y24-A26 PolarHBondContact O-N 2.77Å; A26-A30 WeakPolarHBondContact O-CB 3.37Å; A26-A30 PolarHBondContact O-N 3.31Å
27	S	77.2	Confident	71	Confident	72 Å²	72	100.5 Å²	100.5	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-63.7	-40.8	173.8	59.8	0	0	0	0	114.1	S25 A30 M31	S25-S27 PolarHBondContact O-N 2.7Å; S25-S27 PolarHBondContact OG-OG 2.91Å; S27-A30 PolarHBondContact O-N 2.92Å; S27-M31 WeakPolarHBondContact O-CG 3.4Å; S27-M31 PolarHBondContact O-N 3.28Å
28	L	77.6	Confident	72.8	Confident	58 Å²	58	99.3 Å²	99.3	30%	0.304	56%	0.561	S	S	.	*	H	α-helix	trans	-74.8	-38.3	-178.9	-158.6	153.9	0	0	0	110.5	Y24 S25 A30 M31 L32	Y24-L28 HydrophobicContact CD1-CB 3.92Å; Y24-L28 HydrophobicContact CD1-CD1 3.65Å; Y24-L28 HydrophobicContact CD1-CD2 3.3Å; Y24-L28 HydrophobicContact CD1-CG 3.76Å; Y24-L28 HydrophobicContact CE1-CD1 3.66Å; Y24-L28 HydrophobicContact CE1-CD2 3.31Å; Y24-L28 HydrophobicContact CE1-CG 4Å; Y24-L28 HydrophobicContact CG-CD2 4.4Å; S25-L28 PolarHBondContact O-N 2.97Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.37Å; L28-M31 PolarHBondContact O-N 3.35Å; L28-L32 HydrophobicContact CD2-CD1 3.47Å; L28-L32 VanDerWaalsContact CD2-CD1 3.47Å; L28-L32 HydrophobicContact CD2-CG 3.85Å; L28-L32 WeakPolarHBondContact O-CG 3.48Å; L28-L32 PolarHBondContact O-N 3.22Å
29	Q	80.9	Confident	74.5	Confident	119 Å²	119	97.8 Å²	97.8	56%	0.556	55%	0.55	S	S	*	.	H	α-helix	trans	-59.9	-44	170.4	-67.5	-173.9	-19.8	0	0	111.7	S25 M31 L32 L33	S25-Q29 PolarHBondContact O-N 3.32Å; Q29-M31 PolarHBondContact O-N 2.76Å; Q29-L32 PolarHBondContact O-N 3.48Å; Q29-L33 WeakPolarHBondContact O-CB 3.24Å; Q29-L33 PolarHBondContact O-N 3.33Å
30	A	80	Confident	76.4	Confident	46 Å²	46	99.5 Å²	99.5	38%	0.38	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-38.8	176.7	0	0	0	0	0	112.6	A26 S27 L28 L33 K34	A26-A30 WeakPolarHBondContact O-CB 3.37Å; A26-A30 PolarHBondContact O-N 3.31Å; S27-A30 PolarHBondContact O-N 2.92Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.37Å; A30-L33 PolarHBondContact O-N 2.92Å; A30-K34 VanDerWaalsContact O-CG 3.31Å; A30-K34 WeakPolarHBondContact O-CG 3.48Å; A30-K34 PolarHBondContact O-N 3.42Å
31	M	85.2	Confident	78.4	Confident	122 Å²	122	95.8 Å²	95.8	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-44.1	175	-77.7	-163.9	-67.4	0	0	112.1	S27 L28 Q29 L33 K34 L35	S27-M31 WeakPolarHBondContact O-CG 3.4Å; S27-M31 PolarHBondContact O-N 3.28Å; L28-M31 PolarHBondContact O-N 3.35Å; Q29-M31 PolarHBondContact O-N 2.76Å; M31-L33 VanDerWaalsContact C-N 3.3Å; M31-L33 PolarHBondContact O-N 2.78Å; M31-K34 PolarHBondContact O-N 3.24Å; M31-L35 WeakPolarHBondContact O-CB 3.33Å; M31-L35 PolarHBondContact O-N 3Å
32	L	85.2	Confident	80.1	Confident	75 Å²	75	89.7 Å²	89.7	39%	0.393	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-40.4	176.3	-73.8	171.7	0	0	0	111.5	L15 L28 Q29 L35 L36	L15-L32 HydrophobicContact CD2-CD1 4.22Å; L28-L32 HydrophobicContact CD2-CD1 3.47Å; L28-L32 VanDerWaalsContact CD2-CD1 3.47Å; L28-L32 HydrophobicContact CD2-CG 3.85Å; L28-L32 WeakPolarHBondContact O-CG 3.48Å; L28-L32 PolarHBondContact O-N 3.22Å; Q29-L32 PolarHBondContact O-N 3.48Å; L32-L35 PolarHBondContact O-N 3.25Å; L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 PolarHBondContact O-N 2.69Å
33	L	89.4	Confident	81.7	Confident	122 Å²	122	88 Å²	88	64%	0.639	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-44.4	177.1	-146.6	99.1	0	0	0	111.3	Q29 A30 M31 L35 L36 V37	Q29-L33 WeakPolarHBondContact O-CB 3.24Å; Q29-L33 PolarHBondContact O-N 3.33Å; A30-L33 PolarHBondContact O-N 2.92Å; M31-L33 VanDerWaalsContact C-N 3.3Å; M31-L33 PolarHBondContact O-N 2.78Å; L33-L35 PolarHBondContact O-N 3.42Å; L33-L36 PolarHBondContact O-N 3.33Å; L33-V37 WeakPolarHBondContact O-CG2 3.31Å; L33-V37 PolarHBondContact O-N 2.96Å
34	K	90.5	Very high	83.1	Confident	158 Å²	158	87 Å²	87	69%	0.687	49%	0.491	S	S	*	.	H	α-helix	trans	-61.5	-43.1	176.2	-74.7	176.3	-180	-176.2	0	112	A30 M31 L36 V37 L38	A30-K34 VanDerWaalsContact O-CG 3.31Å; A30-K34 WeakPolarHBondContact O-CG 3.48Å; A30-K34 PolarHBondContact O-N 3.42Å; M31-K34 PolarHBondContact O-N 3.24Å; K34-L36 VanDerWaalsContact C-N 3.33Å; K34-V37 PolarHBondContact O-N 3.18Å; K34-L38 PolarHBondContact O-N 3.49Å
35	L	88.7	Confident	84.1	Confident	97 Å²	97	85 Å²	85	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-42.8	177.4	-171.6	71.7	0	0	0	111.1	M31 L32 L33 L38 C39	M31-L35 WeakPolarHBondContact O-CB 3.33Å; M31-L35 PolarHBondContact O-N 3Å; L32-L35 PolarHBondContact O-N 3.25Å; L33-L35 PolarHBondContact O-N 3.42Å; L35-L38 WeakPolarHBondContact O-CB 3.43Å; L35-L38 PolarHBondContact O-N 2.96Å; L35-C39 PolarHBondContact O-N 3.32Å; L35-C39 PolarHBondContact O-SG 3.47Å
36	L	90.1	Very high	84.4	Confident	76 Å²	76	84.9 Å²	84.9	40%	0.398	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-42.1	178.4	-173	143.4	0	0	0	111.8	F8 L32 L33 K34 C39 I40	F8-L36 HydrophobicContact CE1-CD1 4.32Å; F8-L36 HydrophobicContact CZ-CD1 3.91Å; F8-L36 HydrophobicContact CZ-CG 4.14Å; L32-L36 WeakPolarHBondContact O-CB 3.36Å; L32-L36 PolarHBondContact O-N 2.69Å; L33-L36 PolarHBondContact O-N 3.33Å; K34-L36 VanDerWaalsContact C-N 3.33Å; L36-C39 PolarHBondContact O-N 3.01Å; L36-I40 HydrophobicContact CD2-CD1 3.57Å; L36-I40 HydrophobicContact CG-CD1 4.4Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 2.85Å; L36-I40 VanDerWaalsContact O-N 3.07Å
37	V	90	Very high	84.3	Confident	81 Å²	81	86.3 Å²	86.3	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-46.1	174	172.8	0	0	0	0	110.8	L33 K34 C39 I40 S41	L33-V37 WeakPolarHBondContact O-CG2 3.31Å; L33-V37 PolarHBondContact O-N 2.96Å; K34-V37 PolarHBondContact O-N 3.18Å; V37-C39 VanDerWaalsContact C-N 3.34Å; V37-C39 PolarHBondContact O-N 3.44Å; V37-I40 PolarHBondContact O-N 3.15Å; V37-S41 PolarHBondContact O-N 3.35Å; V37-S41 PolarHBondContact O-OG 2.95Å
38	L	90.9	Very high	83.6	Confident	118 Å²	118	89.2 Å²	89.2	62%	0.618	50%	0.495	S	S	*	.	H	α-helix	trans	-59.2	-43.7	177.9	-168.9	80.4	0	0	0	111.9	K34 L35 S41 A42	K34-L38 PolarHBondContact O-N 3.49Å; L35-L38 WeakPolarHBondContact O-CB 3.43Å; L35-L38 PolarHBondContact O-N 2.96Å; L38-S41 PolarHBondContact O-N 2.77Å; L38-A42 WeakPolarHBondContact O-CB 3.49Å; L38-A42 PolarHBondContact O-N 3.35Å
39	C	89.5	Confident	82.8	Confident	47 Å²	47	90.2 Å²	90.2	32%	0.318	50%	0.504	S	S	.	.	H	α-helix	trans	-62.6	-43.2	177.6	-70.3	0	0	0	0	112.2	F8 L35 L36 V37 A42 V43	F8-C39 HydrophobicContact CE2-CB 4.49Å; L35-C39 PolarHBondContact O-N 3.32Å; L35-C39 PolarHBondContact O-SG 3.47Å; L36-C39 PolarHBondContact O-N 3.01Å; V37-C39 VanDerWaalsContact C-N 3.34Å; V37-C39 PolarHBondContact O-N 3.44Å; C39-A42 PolarHBondContact O-N 3.3Å; C39-V43 WeakPolarHBondContact O-CG2 3.49Å; C39-V43 PolarHBondContact O-N 2.91Å
40	I	87.4	Confident	81.7	Confident	91 Å²	91	89.9 Å²	89.9	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-43.9	177.9	-66.2	169.7	0	0	0	110.4	L36 V37 A42 V43 L44	L36-I40 HydrophobicContact CD2-CD1 3.57Å; L36-I40 HydrophobicContact CG-CD1 4.4Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 2.85Å; L36-I40 VanDerWaalsContact O-N 3.07Å; V37-I40 PolarHBondContact O-N 3.15Å; I40-A42 VanDerWaalsContact C-N 3.34Å; I40-A42 PolarHBondContact O-N 3.47Å; I40-V43 PolarHBondContact O-N 3.37Å; I40-L44 HydrophobicContact CG2-CD1 3.94Å; I40-L44 HydrophobicContact CG2-CG 4.38Å; I40-L44 WeakPolarHBondContact O-CG 3.45Å; I40-L44 PolarHBondContact O-N 3.32Å
41	S	87.8	Confident	80.4	Confident	66 Å²	66	92.7 Å²	92.7	46%	0.462	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-41.8	176.4	-64.1	0	0	0	0	112.3	V37 L38 L44 A45	V37-S41 PolarHBondContact O-N 3.35Å; V37-S41 PolarHBondContact O-OG 2.95Å; L38-S41 PolarHBondContact O-N 2.77Å; S41-L44 PolarHBondContact O-N 2.68Å; S41-A45 WeakPolarHBondContact O-CB 3.33Å; S41-A45 PolarHBondContact O-N 3.04Å
42	A	83.6	Confident	79	Confident	60 Å²	60	93.1 Å²	93.1	50%	0.496	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-40.4	177.3	0	0	0	0	0	112.4	L38 C39 I40 A45 A46	L38-A42 WeakPolarHBondContact O-CB 3.49Å; L38-A42 PolarHBondContact O-N 3.35Å; C39-A42 PolarHBondContact O-N 3.3Å; I40-A42 VanDerWaalsContact C-N 3.34Å; I40-A42 PolarHBondContact O-N 3.47Å; A42-A45 PolarHBondContact O-N 2.97Å; A42-A46 WeakPolarHBondContact O-CB 3.49Å; A42-A46 PolarHBondContact O-N 3.41Å
43	V	86.1	Confident	77.4	Confident	79 Å²	79	95.5 Å²	95.5	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-66.4	-43.1	176.6	173	0	0	0	0	111.1	C39 I40 A46 E47	C39-V43 WeakPolarHBondContact O-CG2 3.49Å; C39-V43 PolarHBondContact O-N 2.91Å; I40-V43 PolarHBondContact O-N 3.37Å; V43-A46 PolarHBondContact O-N 3.24Å; V43-E47 WeakPolarHBondContact O-CB 3.46Å; V43-E47 PolarHBondContact O-N 2.95Å
44	L	83.7	Confident	75.7	Confident	102 Å²	102	93.2 Å²	93.2	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-41.3	177	-72.6	173.5	0	0	0	111.9	I40 S41 E47 Q48	I40-L44 HydrophobicContact CG2-CD1 3.94Å; I40-L44 HydrophobicContact CG2-CG 4.38Å; I40-L44 WeakPolarHBondContact O-CG 3.45Å; I40-L44 PolarHBondContact O-N 3.32Å; S41-L44 PolarHBondContact O-N 2.68Å; L44-E47 PolarHBondContact O-N 2.95Å; L44-Q48 WeakPolarHBondContact O-CB 3.39Å; L44-Q48 PolarHBondContact O-N 3.38Å
45	A	79.7	Confident	73.8	Confident	49 Å²	49	91 Å²	91	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-43.3	175.2	0	0	0	0	0	111.4	S41 A42 E47 Q48 V49	S41-A45 WeakPolarHBondContact O-CB 3.33Å; S41-A45 PolarHBondContact O-N 3.04Å; A42-A45 PolarHBondContact O-N 2.97Å; A45-E47 VanDerWaalsContact C-N 3.34Å; A45-E47 PolarHBondContact O-N 2.92Å; A45-Q48 PolarHBondContact O-N 2.87Å; A45-V49 WeakPolarHBondContact O-CG2 3.42Å; A45-V49 PolarHBondContact O-N 3.18Å
46	A	76.1	Confident	72.1	Confident	63 Å²	63	92.4 Å²	92.4	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-38	176.2	0	0	0	0	0	112.4	A42 V43 N50	A42-A46 WeakPolarHBondContact O-CB 3.49Å; A42-A46 PolarHBondContact O-N 3.41Å; V43-A46 PolarHBondContact O-N 3.24Å; A46-N50 VanDerWaalsContact O-CB 3.31Å; A46-N50 WeakPolarHBondContact O-CB 3.36Å; A46-N50 PolarHBondContact O-N 3.38Å
47	E	69.8	Low	70.3	Confident	112 Å²	112	92 Å²	92	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-39.1	175.6	-169.8	171.1	-172.1	0	0	111.6	V43 L44 A45 N50 M51	V43-E47 WeakPolarHBondContact O-CB 3.46Å; V43-E47 PolarHBondContact O-N 2.95Å; L44-E47 PolarHBondContact O-N 2.95Å; A45-E47 VanDerWaalsContact C-N 3.34Å; A45-E47 PolarHBondContact O-N 2.92Å; E47-N50 PolarHBondContact O-N 3.49Å; E47-M51 WeakPolarHBondContact O-CG 3.38Å; E47-M51 PolarHBondContact O-N 3.28Å
48	Q	64.1	Low	68.5	Low	132 Å²	132	92.1 Å²	92.1	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-64.9	-45.3	176.7	-169.4	174.1	-1	0	0	111.8	L44 A45 N50 M51 E52	L44-Q48 WeakPolarHBondContact O-CB 3.39Å; L44-Q48 PolarHBondContact O-N 3.38Å; A45-Q48 PolarHBondContact O-N 2.87Å; Q48-N50 VanDerWaalsContact C-N 3.32Å; Q48-N50 PolarHBondContact O-N 3.44Å; Q48-M51 PolarHBondContact O-N 3.41Å; Q48-E52 PolarHBondContact O-N 2.89Å
49	V	59.8	Low	66.6	Low	80 Å²	80	94.9 Å²	94.9	49%	0.485	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-37.4	176.1	173.7	0	0	0	0	111.4	A45 M51 E52 L53	A45-V49 WeakPolarHBondContact O-CG2 3.42Å; A45-V49 PolarHBondContact O-N 3.18Å; V49-M51 VanDerWaalsContact C-N 3.32Å; V49-M51 PolarHBondContact O-N 3.06Å; V49-E52 PolarHBondContact O-N 3.46Å; V49-L53 HydrophobicContact CG1-CD1 4.34Å; V49-L53 PolarHBondContact O-N 3.39Å; V49-L53 VanDerWaalsContact O-N 3.15Å
50	N	57.7	Low	64.9	Low	112 Å²	112	97.5 Å²	97.5	60%	0.599	55%	0.546	S	S	*	.	H	α-helix	trans	-69.4	-31	176.4	-165	42	0	0	0	112.3	A46 E47 Q48 T54	A46-N50 VanDerWaalsContact O-CB 3.31Å; A46-N50 WeakPolarHBondContact O-CB 3.36Å; A46-N50 PolarHBondContact O-N 3.38Å; E47-N50 PolarHBondContact O-N 3.49Å; Q48-N50 VanDerWaalsContact C-N 3.32Å; Q48-N50 PolarHBondContact O-N 3.44Å; N50-T54 PolarHBondContact O-N 2.99Å; N50-T54 PolarHBondContact O-OG1 2.94Å
51	M	53.5	Low	63.1	Low	105 Å²	105	99.1 Å²	99.1	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-71.3	-39.4	171.9	-71.8	-156.7	-64.6	0	0	112.1	E47 Q48 V49 L53 T54 D55	E47-M51 WeakPolarHBondContact O-CG 3.38Å; E47-M51 PolarHBondContact O-N 3.28Å; Q48-M51 PolarHBondContact O-N 3.41Å; V49-M51 VanDerWaalsContact C-N 3.32Å; V49-M51 PolarHBondContact O-N 3.06Å; M51-L53 VanDerWaalsContact C-N 3.34Å; M51-L53 PolarHBondContact O-N 3.45Å; M51-T54 WeakPolarHBondContact O-CB 3.39Å; M51-T54 PolarHBondContact O-N 3.29Å; M51-D55 PolarHBondContact O-N 3.03Å
52	E	55	Low	61.2	Low	130 Å²	130	104.4 Å²	104.4	61%	0.607	57%	0.573	S	S	*	*	H	α-helix	trans	-62.9	-38.9	179.3	-155.2	166.6	-161.3	0	0	112	Q48 V49 T54 D55	Q48-E52 PolarHBondContact O-N 2.89Å; V49-E52 PolarHBondContact O-N 3.46Å; E52-T54 VanDerWaalsContact C-N 3.27Å; E52-T54 PolarHBondContact O-N 3.27Å; E52-D55 PolarHBondContact O-N 2.99Å
53	L	52.4	Low	59.7	Low	125 Å²	125	105.8 Å²	105.8	65%	0.654	59%	0.585	S	S	*	*	H	α-helix	trans	-67.3	-22.7	172.3	-102.7	130.4	0	0	0	114.4	V49 M51	V49-L53 HydrophobicContact CG1-CD1 4.34Å; V49-L53 PolarHBondContact O-N 3.39Å; V49-L53 VanDerWaalsContact O-N 3.15Å; M51-L53 VanDerWaalsContact C-N 3.34Å; M51-L53 PolarHBondContact O-N 3.45Å
54	T	52.9	Low	58.2	Low	74 Å²	74	105.7 Å²	105.7	45%	0.454	59%	0.585	S	S	.	*	H	α-helix	trans	-80.8	-33.5	179.6	-40.8	0	0	0	0	111.2	N50 M51 E52 S57	N50-T54 PolarHBondContact O-N 2.99Å; N50-T54 PolarHBondContact O-OG1 2.94Å; M51-T54 WeakPolarHBondContact O-CB 3.39Å; M51-T54 PolarHBondContact O-N 3.29Å; E52-T54 VanDerWaalsContact C-N 3.27Å; E52-T54 PolarHBondContact O-N 3.27Å; T54-S57 PolarHBondContact O-N 2.96Å; T54-S57 PolarHBondContact O-OG 3.49Å
55	D	51.1	Low	56.7	Low	111 Å²	111	106.9 Å²	106.9	59%	0.594	60%	0.595	S	S	*	*	H	α-helix	trans	-69.1	-35.1	-177.2	-73.1	-22.8	0	0	0	111.7	M51 E52 S57 T58	M51-D55 PolarHBondContact O-N 3.03Å; E52-D55 PolarHBondContact O-N 2.99Å; D55-S57 VanDerWaalsContact C-N 3.27Å; D55-S57 PolarHBondContact O-N 3.3Å; D55-T58 PolarHBondContact O-N 3.37Å; D55-T58 PolarHBondContact O-OG1 3.07Å
56	D	52.3	Low	55.3	Low	127 Å²	127	115.6 Å²	115.6	68%	0.679	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-68.1	-23	175	-75.9	-16.1	0	0	0	113.9	T58	D56-T58 PolarHBondContact O-N 3.32Å
57	S	52.9	Low	54	Low	67 Å²	67	120.7 Å²	120.7	47%	0.469	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-73.9	-16.1	176.8	75.8	0	0	0	0	113.3	T54 D55 F59 V60	T54-S57 PolarHBondContact O-N 2.96Å; T54-S57 PolarHBondContact O-OG 3.49Å; D55-S57 VanDerWaalsContact C-N 3.27Å; D55-S57 PolarHBondContact O-N 3.3Å; S57-F59 PolarHBondContact O-N 3.25Å; S57-V60 PolarHBondContact O-N 3.09Å
58	T	52.2	Low	53	Low	85 Å²	85	126.1 Å²	126.1	52%	0.521	65%	0.647	S	S	.	*	G	3₁₀ helix	trans	-78.4	-7.3	-179.2	65.3	0	0	0	0	113.9	D55 D56	D55-T58 PolarHBondContact O-N 3.37Å; D55-T58 PolarHBondContact O-OG1 3.07Å; D56-T58 PolarHBondContact O-N 3.32Å
59	F	50.2	Low	52.4	Low	175 Å²	175	127.9 Å²	127.9	77%	0.768	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-90.5	-13.1	174.2	-95.5	-85.6	0	0	0	114.7	S57	S57-F59 PolarHBondContact O-N 3.25Å
60	V	54.3	Low	52.2	Low	103 Å²	103	130.1 Å²	130.1	62%	0.624	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-24.8	179.9	-177.9	0	0	0	0	112.2	S57 T64	S57-V60 PolarHBondContact O-N 3.09Å; V60-T64 PolarHBondContact O-OG1 3.47Å
61	D	49.6	Very low	52.1	Low	124 Å²	124	130.7 Å²	130.7	66%	0.663	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-10.2	-176.3	-105.9	-5	0	0	0	115.1
62	Q	48.7	Very low	52.1	Low	177 Å²	177	133.5 Å²	133.5	83%	0.827	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-8.5	175.8	-70.3	-168.5	18.3	0	0	114.2
63	A	51.8	Low	51.9	Low	89 Å²	89	135 Å²	135	74%	0.736	70%	0.697	S	S	*	*	S	Bend	trans	-87.2	-13.9	173	0	0	0	0	0	113.3
64	T	53.4	Low	52.1	Low	78 Å²	78	136 Å²	136	48%	0.479	70%	0.698	S	S	.	*	S	Bend	trans	-98.1	-8.4	-169.9	-24.4	0	0	0	0	114.1	V60	V60-T64 PolarHBondContact O-OG1 3.47Å
65	V	52.9	Low	52.3	Low	126 Å²	126	136.6 Å²	136.6	76%	0.764	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	43.7	-178.6	-165.4	0	0	0	0	111.7
66	R	50.1	Low	52.5	Low	232 Å²	232	139.5 Å²	139.5	88%	0.875	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.8	39.1	152.3	-73.1	-165.6	176	-171.7	0.3	110.1	R68	R66-R68 PolarHBondContact O-N 3.03Å
67	Q	48.4	Very low	52.3	Low	171 Å²	171	142.4 Å²	142.4	80%	0.799	72%	0.719	S	S	*	*			trans	-59.4	92.9	153	-77.7	-168	-7.8	0	0	106.7	E69	Q67-E69 PolarHBondContact O-N 3.14Å
68	R	49.1	Very low	52.6	Low	226 Å²	226	144.9 Å²	144.9	85%	0.853	73%	0.731	S	S	*	*			trans	-38.5	129.8	156.3	-82.1	176.2	164.6	169.1	-5.4	106.4	R66 P70	R66-R68 PolarHBondContact O-N 3.03Å; R68-P70 VanDerWaalsContact O-N 3.13Å
69	E	52.7	Low	52.5	Low	168 Å²	168	149.6 Å²	149.6	79%	0.785	75%	0.747	S	S	*	*			trans	-40.3	126.2	156.5	-68.6	179	155.4	0	0	106.8	Q67 T71	Q67-E69 PolarHBondContact O-N 3.14Å; E69-T71 PolarHBondContact O-N 3.07Å
70	P	56.1	Low	52.8	Low	128 Å²	128	149.6 Å²	149.6	83%	0.831	75%	0.749	S	S	*	*			trans	-61.5	95.9	170.7	24	-29.5	0	0	0	105.5	R68 K72	R68-P70 VanDerWaalsContact O-N 3.13Å; P70-K72 PolarHBondContact O-N 3.44Å
71	T	54.1	Low	52.5	Low	123 Å²	123	151.8 Å²	151.8	76%	0.755	76%	0.763	S	S	*	*			trans	-54.4	111.9	168.7	-44	0	0	0	0	103.9	E69 M73	E69-T71 PolarHBondContact O-N 3.07Å; T71-M73 VanDerWaalsContact C-N 3.27Å; T71-M73 PolarHBondContact O-N 3.5Å
72	K	53.5	Low	52.4	Low	164 Å²	164	149 Å²	149	71%	0.713	76%	0.764	S	S	*	*			trans	-49.6	97.1	178.3	-176.1	-171.3	176.2	-141.7	0	106.9	P70 E74	P70-K72 PolarHBondContact O-N 3.44Å; K72-E74 HydrophobicContact CG-CG 4.44Å; K72-E74 IonicContact NZ-OE1 2.81Å; K72-E74 PolarHBondContact NZ-OE1 3.41Å; K72-E74 PolarHBondContact O-N 3.25Å; K72-E74 VanDerWaalsContact O-N 3.09Å
73	M	51.2	Low	52.6	Low	162 Å²	162	146.1 Å²	146.1	80%	0.798	76%	0.758	S	S	*	*			trans	-76	101.1	174.9	-162.5	179.8	-63.8	0	0	103.4	T71 V75	T71-M73 VanDerWaalsContact C-N 3.27Å; T71-M73 PolarHBondContact O-N 3.5Å; M73-V75 HydrophobicContact CG-CG2 4.37Å; M73-V75 PolarHBondContact O-N 3.18Å
74	E	56.7	Low	52.4	Low	146 Å²	146	147.9 Å²	147.9	68%	0.682	76%	0.762	S	S	*	*			trans	-66.3	89.6	167.9	-64.4	-169.7	160.2	0	0	105.6	K72 E76	K72-E74 HydrophobicContact CG-CG 4.44Å; K72-E74 IonicContact NZ-OE1 2.81Å; K72-E74 PolarHBondContact NZ-OE1 3.41Å; K72-E74 PolarHBondContact O-N 3.25Å; K72-E74 VanDerWaalsContact O-N 3.09Å; E74-E76 VanDerWaalsContact C-N 3.27Å; E74-E76 PolarHBondContact O-N 3.38Å
75	V	57.2	Low	52.3	Low	87 Å²	87	151.7 Å²	151.7	53%	0.527	78%	0.779	S	S	.	*			trans	-69	96.2	168.9	179.9	0	0	0	0	104.7	M73 F77	M73-V75 HydrophobicContact CG-CG2 4.37Å; M73-V75 PolarHBondContact O-N 3.18Å; V75-F77 VanDerWaalsContact C-N 3.31Å; V75-F77 HydrophobicContact CB-CE2 4.35Å; V75-F77 HydrophobicContact CG1-CD2 4.34Å; V75-F77 HydrophobicContact CG1-CE1 4.47Å; V75-F77 HydrophobicContact CG1-CE2 4.24Å; V75-F77 HydrophobicContact CG1-CZ 4.31Å; V75-F77 VanDerWaalsContact O-CD2 3.32Å; V75-F77 WeakPolarHBondContact O-CD2 3.38Å; V75-F77 PolarHBondContact O-N 3.04Å
76	E	54.4	Low	51.9	Low	172 Å²	172	154.9 Å²	154.9	80%	0.804	79%	0.786	S	S	*	*			trans	-58.7	103.6	157.7	-79	-175.7	156.5	0	0	106.3	E74 V78	E74-E76 VanDerWaalsContact C-N 3.27Å; E74-E76 PolarHBondContact O-N 3.38Å; E76-V78 PolarHBondContact O-N 3.02Å
77	F	49	Very low	52.2	Low	188 Å²	188	149.5 Å²	149.5	83%	0.825	78%	0.784	S	S	*	*			trans	-66.8	92.3	166.9	-71.4	-89.8	0	0	0	106.9	V75 E79	V75-F77 VanDerWaalsContact C-N 3.31Å; V75-F77 HydrophobicContact CB-CE2 4.35Å; V75-F77 HydrophobicContact CG1-CD2 4.34Å; V75-F77 HydrophobicContact CG1-CE1 4.47Å; V75-F77 HydrophobicContact CG1-CE2 4.24Å; V75-F77 HydrophobicContact CG1-CZ 4.31Å; V75-F77 VanDerWaalsContact O-CD2 3.32Å; V75-F77 WeakPolarHBondContact O-CD2 3.38Å; V75-F77 PolarHBondContact O-N 3.04Å; F77-E79 PolarHBondContact O-N 3.45Å; F77-E79 VanDerWaalsContact O-N 3.17Å
78	V	58.4	Low	51.9	Low	118 Å²	118	145.3 Å²	145.3	72%	0.715	78%	0.778	S	S	*	*			trans	-69.9	104.8	160	172.9	0	0	0	0	105.8	E76 E80	E76-V78 PolarHBondContact O-N 3.02Å; V78-E80 PolarHBondContact O-N 3.28Å
79	E	51.6	Low	51.6	Low	185 Å²	185	142.6 Å²	142.6	86%	0.864	78%	0.78	S	S	*	*			trans	-69.6	77.6	174.3	-150.1	175.9	-160.5	0	0	108.3	F77 T81	F77-E79 PolarHBondContact O-N 3.45Å; F77-E79 VanDerWaalsContact O-N 3.17Å; E79-T81 PolarHBondContact O-N 2.94Å
80	E	56.1	Low	50.9	Low	175 Å²	175	138 Å²	138	82%	0.818	78%	0.779	S	S	*	*			trans	-79.9	104.1	174.9	-162.8	172.2	-173.3	0	0	109.1	V78 G82	V78-E80 PolarHBondContact O-N 3.28Å; E80-G82 VanDerWaalsContact C-N 3.33Å; E80-G82 PolarHBondContact O-N 3.44Å
81	T	47.7	Very low	50.7	Low	148 Å²	148	139.3 Å²	139.3	91%	0.908	78%	0.778	S	S	*	*			trans	-69.6	85.5	172.9	12.4	0	0	0	0	109.1	E79	E79-T81 PolarHBondContact O-N 2.94Å
82	G	47.7	Very low	50.6	Low	66 Å²	66	141.9 Å²	141.9	68%	0.68	78%	0.781	S	S	*	*			trans	-119	123.5	175.1	0	0	0	0	0	111.7	E80	E80-G82 VanDerWaalsContact C-N 3.33Å; E80-G82 PolarHBondContact O-N 3.44Å
83	T	52.1	Low	50.6	Low	116 Å²	116	141.3 Å²	141.3	71%	0.712	78%	0.784	S	S	*	*			trans	-56.1	151.5	-174.3	45.6	0	0	0	0	115.4	L85	T83-L85 PolarHBondContact O-N 3.36Å; T83-L85 VanDerWaalsContact O-N 3.09Å
84	P	48.3	Very low	50.4	Low	127 Å²	127	138.8 Å²	138.8	83%	0.825	78%	0.778	S	S	*	*			trans	-75.2	103.3	178.2	31.6	-30.1	0	0	0	109.4	E86	P84-E86 PolarHBondContact O-N 2.93Å
85	L	51.9	Low	50.3	Low	158 Å²	158	140.3 Å²	140.3	83%	0.827	79%	0.785	S	S	*	*			trans	-86.9	107.5	168.3	-77.4	169.7	0	0	0	109.1	T83 S87	T83-L85 PolarHBondContact O-N 3.36Å; T83-L85 VanDerWaalsContact O-N 3.09Å; L85-S87 PolarHBondContact O-N 3.48Å
86	E	44.8	Very low	49.7	Very low	193 Å²	193	144.7 Å²	144.7	90%	0.902	81%	0.805	S	S	*	*			trans	-41.7	114.9	158.5	-61.4	168.7	142.5	0	0	110.9	P84	P84-E86 PolarHBondContact O-N 2.93Å
87	S	55.1	Low	49.5	Very low	119 Å²	119	141.1 Å²	141.1	83%	0.832	80%	0.795	S	S	*	*			trans	-138.4	75.8	150.5	83.1	0	0	0	0	109.3	L85	L85-S87 PolarHBondContact O-N 3.48Å
88	A	41.9	Very low	49.8	Very low	82 Å²	82	140 Å²	140	68%	0.678	79%	0.792	S	S	*	*			trans	-68.2	153.5	151.5	0	0	0	0	0	109.4
89	N	42.7	Very low	49.1	Very low	169 Å²	169	142.3 Å²	142.3	90%	0.904	80%	0.801	S	S	*	*			trans	77.9	107.1	162.6	-58.8	-16.6	0	0	0	117.7
90	G	39.5	Very low	48.7	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	80%	0.796	S	S	*	*			trans	168.4	46.1	165	0	0	0	0	0	115.4
91	L	51	Low	48.3	Very low	155 Å²	155	135.2 Å²	135.2	81%	0.812	79%	0.79	S	S	*	*			trans	-131	71.6	158.7	-144.9	92.7	0	0	0	109.2	I93	L91-I93 HydrophobicContact CD2-CD1 3.95Å; L91-I93 HydrophobicContact CD2-CG1 4.03Å; L91-I93 HydrophobicContact CG-CG1 4.36Å; L91-I93 PolarHBondContact O-N 3.28Å
92	E	52.9	Low	48.1	Very low	176 Å²	176	135 Å²	135	82%	0.822	78%	0.784	S	S	*	*			trans	-73.1	100.4	162.8	-70.7	178.5	163.6	0	0	107.6	T94	E92-T94 PolarHBondContact O-N 2.95Å
93	I	53.7	Low	48.1	Very low	153 Å²	153	136.5 Å²	136.5	79%	0.785	79%	0.789	S	S	*	*			trans	-87.3	77.8	162.7	-51.8	174.9	0	0	0	106.1	L91	L91-I93 HydrophobicContact CD2-CD1 3.95Å; L91-I93 HydrophobicContact CD2-CG1 4.03Å; L91-I93 HydrophobicContact CG-CG1 4.36Å; L91-I93 PolarHBondContact O-N 3.28Å
94	T	45.5	Very low	48	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	79%	0.789	S	S	*	*			trans	-110.4	104.7	167.5	39.5	0	0	0	0	108.1	E92	E92-T94 PolarHBondContact O-N 2.95Å
95	E	54.6	Low	48.3	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	79%	0.79	S	S	*	*			trans	-177.6	89	135.7	-100.2	171.8	-172.1	0	0	108.8
96	L	45.8	Very low	47.9	Very low	180 Å²	180	139.5 Å²	139.5	94%	0.942	79%	0.789	S	S	*	*			trans	-79.5	103.6	151	-74.8	160.6	0	0	0	106.1
97	T	50.4	Low	47.6	Very low	96 Å²	96	139.1 Å²	139.1	59%	0.589	79%	0.787	S	S	*	*			trans	-143.3	91.3	172	-43.6	0	0	0	0	106.9
98	E	54.9	Low	46.9	Very low	165 Å²	165	142.6 Å²	142.6	77%	0.771	79%	0.79	S	S	*	*				75.8	83.5	108.9	-70.5	179.5	179.3	0	0	113.2
99	D	42.8	Very low	46.6	Very low	167 Å²	167	146.4 Å²	146.4	89%	0.893	80%	0.799	S	S	*	*			trans	-113.7	72.7	145.6	-100.1	-28.8	0	0	0	108	A101	D99-A101 VanDerWaalsContact C-N 3.28Å; D99-A101 PolarHBondContact O-N 3.37Å
100	V	43.4	Very low	46.5	Very low	126 Å²	126	141.9 Å²	141.9	76%	0.764	79%	0.793	S	S	*	*			trans	-84.5	78.2	162.4	-177.6	0	0	0	0	107.2
101	A	47.9	Very low	46.4	Very low	84 Å²	84	147.7 Å²	147.7	69%	0.694	80%	0.8	S	S	*	*			trans	-103.5	85.2	161.8	0	0	0	0	0	108.9	D99 A103	D99-A101 VanDerWaalsContact C-N 3.28Å; D99-A101 PolarHBondContact O-N 3.37Å; A101-A103 PolarHBondContact O-N 2.91Å
102	N	42.4	Very low	46	Very low	145 Å²	145	152 Å²	152	78%	0.775	81%	0.805	S	S	*	*			trans	15.3	95.5	145.9	-69.4	-39.7	0	0	0	117.4
103	A	48.2	Very low	45.7	Very low	97 Å²	97	150 Å²	150	80%	0.802	81%	0.805	S	S	*	*			trans	-145.6	68.1	152.3	0	0	0	0	0	110.9	A101	A101-A103 PolarHBondContact O-N 2.91Å
104	V	49.8	Very low	45.2	Very low	116 Å²	116	148.3 Å²	148.3	70%	0.703	81%	0.805	S	S	*	*			trans	-21.7	124.2	136.6	177.2	0	0	0	0	109.7
105	R	54.7	Low	45.4	Very low	225 Å²	225	150.9 Å²	150.9	85%	0.849	81%	0.814	S	S	*	*			cis	-172.8	157.1	34.9	-110.7	161.2	-166	179.4	2.9	107
106	P	44.5	Very low	45.1	Very low	123 Å²	123	147.7 Å²	147.7	80%	0.799	81%	0.808	S	S	*	*			trans	-108.2	146.7	149.6	31.9	-20.5	0	0	0	111.6
107	Q	38.4	Very low	45	Very low	184 Å²	184	147.4 Å²	147.4	86%	0.86	81%	0.807	S	S	*	*			trans	90.1	113.8	157.9	-140.4	-175.2	73.9	0	0	118
108	E	40.4	Very low	44.4	Very low	193 Å²	193	151 Å²	151	90%	0.902	82%	0.821	S	S	*	*				-163.8	148.8	122	-109.7	-174.7	163.5	0	0	113.4
109	N	35.2	Very low	43.8	Very low	161 Å²	161	148.5 Å²	148.5	86%	0.861	82%	0.822	S	S	*	*			trans	-64.7	159	-175.1	-74	-46.7	0	0	0	114.9
110	G	41	Very low	43.3	Very low	75 Å²	75	148.7 Å²	148.7	77%	0.773	82%	0.817	S	S	*	*			trans	174.8	86.5	162.1	0	0	0	0	0	116.5
111	Q	36.5	Very low	43.2	Very low	195 Å²	195	149 Å²	149	91%	0.911	82%	0.815	S	S	*	*			trans	-51.6	132.3	160.6	-76	165.1	-45	0	0	112.6
112	R	43.6	Very low	42.9	Very low	244 Å²	244	155.7 Å²	155.7	92%	0.921	82%	0.824	S	S	*	*				177.5	125.8	124.3	-96.9	172.8	-179.6	-170.2	0.9	112.2
113	T	45.3	Very low	42.9	Very low	134 Å²	134	156.7 Å²	156.7	82%	0.822	83%	0.828	S	S	*	*			trans	-46.2	-180	169.8	17.5	0	0	0	0	117.5
114	P	44.9	Very low	42.8	Very low	119 Å²	119	157 Å²	157	77%	0.773	82%	0.822	S	S	*	*			cis	-136.8	175	-28.6	33.8	-13.5	0	0	0	114.6
115	L	48	Very low	42.4	Very low	163 Å²	163	157.4 Å²	157.4	85%	0.853	83%	0.83	S	S	*	*			trans	-60.9	177	165.1	-75.8	167.2	0	0	0	113.2
116	P	49.7	Very low	41.8	Very low	109 Å²	109	154 Å²	154	71%	0.708	83%	0.827	S	S	*	*			cis	-132.1	172.2	-25.6	33.6	-15.9	0	0	0	112.6
117	L	43.1	Very low	41.7	Very low	175 Å²	175	153.6 Å²	153.6	92%	0.916	82%	0.824	S	S	*	*			trans	-143.3	128.6	156.7	-86.3	178.3	0	0	0	113.4
118	L	37.5	Very low	41.9	Very low	170 Å²	170	150.3 Å²	150.3	89%	0.89	82%	0.822	S	S	*	*			trans	-51.7	142.5	163.3	-71.6	137.1	0	0	0	112.1
119	S	41.7	Very low	42.3	Very low	114 Å²	114	151.6 Å²	151.6	80%	0.797	82%	0.819	S	S	*	*				-171.6	104.2	126.9	-164	0	0	0	0	110.1
120	E	33.4	Very low	42.9	Very low	170 Å²	170	149.7 Å²	149.7	79%	0.794	82%	0.815	S	S	*	*			trans	-70	163.7	150.3	-69.9	-174.3	135.5	0	0	109.6
121	N	41.2	Very low	43.3	Very low	132 Å²	132	151.3 Å²	151.3	71%	0.706	81%	0.81	S	S	*	*			trans	86.3	102	173.9	-51.3	-48.7	0	0	0	116
122	Y	41.8	Very low	43.6	Very low	225 Å²	225	150.7 Å²	150.7	88%	0.882	81%	0.807	S	S	*	*				178.6	99	105.5	-91.7	-75.4	0	0	0	109.8
123	L	42.6	Very low	43.9	Very low	167 Å²	167	144.8 Å²	144.8	87%	0.874	80%	0.797	S	S	*	*			trans	22.5	162.3	139.1	-79.5	167.9	0	0	0	122.8
124	P	44.8	Very low	43.8	Very low	103 Å²	103	147 Å²	147	67%	0.669	80%	0.801	S	S	*	*				-106.9	155.5	-128.3	40.4	-32.8	0	0	0	113.8
125	S	41.2	Very low	44	Very low	125 Å²	125	147 Å²	147	87%	0.874	80%	0.803	S	S	*	*			trans	-130.2	124.6	161.1	40.5	0	0	0	0	110.5
126	I	42.7	Very low	44.2	Very low	152 Å²	152	143.9 Å²	143.9	78%	0.779	80%	0.795	S	S	*	*			trans	-93.5	169.1	-174.4	-54.8	160.5	0	0	0	107.4
127	P	42.9	Very low	43.9	Very low	115 Å²	115	149.7 Å²	149.7	75%	0.747	81%	0.805	S	S	*	*			cis	-124.9	158.1	-45.5	35.1	-20.1	0	0	0	112.1
128	S	42.7	Very low	44.3	Very low	115 Å²	115	147.6 Å²	147.6	80%	0.804	80%	0.799	S	S	*	*			trans	-154.9	110	153.4	57.8	0	0	0	0	112.8
129	R	47.8	Very low	45.1	Very low	221 Å²	221	143.7 Å²	143.7	83%	0.834	79%	0.791	S	S	*	*			trans	49.7	116.6	156.5	-85.8	179.8	166	-177.7	-3.6	118.7	V131	R129-V131 PolarHBondContact O-N 3.37Å
130	P	49.4	Very low	45.5	Very low	120 Å²	120	141 Å²	141	78%	0.779	78%	0.782	S	S	*	*			trans	-78.6	108	140.5	30.3	-24.9	0	0	0	108.3	Q132	P130-Q132 VanDerWaalsContact C-N 3.32Å; P130-Q132 PolarHBondContact O-N 3.48Å
131	V	47.5	Very low	46.7	Very low	110 Å²	110	138.6 Å²	138.6	67%	0.667	78%	0.78	S	S	*	*			trans	-65	101.2	155.9	176.8	0	0	0	0	105.4	R129 V133	R129-V131 PolarHBondContact O-N 3.37Å; V131-V133 VanDerWaalsContact C-N 3.27Å; V131-V133 HydrophobicContact CG1-CG2 3.75Å; V131-V133 PolarHBondContact O-N 3.47Å
132	Q	43.4	Very low	47.6	Very low	182 Å²	182	138 Å²	138	85%	0.85	78%	0.784	S	S	*	*			trans	-67.9	94	165.8	-80.5	-175	-6.2	0	0	107.3	P130 M134	P130-Q132 VanDerWaalsContact C-N 3.32Å; P130-Q132 PolarHBondContact O-N 3.48Å; Q132-M134 PolarHBondContact O-N 3.47Å
133	V	49.9	Very low	48.3	Very low	120 Å²	120	132.7 Å²	132.7	73%	0.727	78%	0.78	S	S	*	*			trans	-76	117.3	164.4	-175.6	0	0	0	0	106.2	V131 S135	V131-V133 VanDerWaalsContact C-N 3.27Å; V131-V133 HydrophobicContact CG1-CG2 3.75Å; V131-V133 PolarHBondContact O-N 3.47Å; V133-S135 PolarHBondContact O-N 3.45Å; V133-S135 VanDerWaalsContact O-N 3.08Å
134	M	43.1	Very low	48.9	Very low	180 Å²	180	130.4 Å²	130.4	89%	0.887	77%	0.773	S	S	*	*			trans	-49.7	113.7	169.5	-85.8	154	55.2	0	0	109.4	Q132 S136	Q132-M134 PolarHBondContact O-N 3.47Å; M134-S136 PolarHBondContact O-N 3.3Å
135	S	50.3	Low	49.3	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	78%	0.777	S	S	*	*			trans	-72	109.2	165.1	-155	0	0	0	0	106.8	V133 Y137	V133-S135 PolarHBondContact O-N 3.45Å; V133-S135 VanDerWaalsContact O-N 3.08Å; S135-Y137 PolarHBondContact O-N 3.17Å
136	S	51.9	Low	49.7	Very low	97 Å²	97	135.8 Å²	135.8	68%	0.678	78%	0.777	S	S	*	*			trans	-52	129	176.9	47.1	0	0	0	0	110.9	M134 V138	M134-S136 PolarHBondContact O-N 3.3Å; S136-V138 PolarHBondContact O-N 3.25Å
137	Y	42.1	Very low	50.2	Low	232 Å²	232	132.5 Å²	132.5	91%	0.91	77%	0.767	S	S	*	*			trans	-53.3	106.1	165.1	-99.2	-106.3	0	0	0	109.3	S135 A139	S135-Y137 PolarHBondContact O-N 3.17Å; Y137-A139 PolarHBondContact O-N 3.41Å
138	V	52.9	Low	50.6	Low	130 Å²	130	136.7 Å²	136.7	79%	0.788	78%	0.777	S	S	*	*			trans	-77.9	105.3	157.8	178.1	0	0	0	0	105.3	S136 G140	S136-V138 PolarHBondContact O-N 3.25Å; V138-G140 PolarHBondContact O-N 3.42Å
139	A	52.7	Low	50.6	Low	89 Å²	89	139.6 Å²	139.6	74%	0.736	78%	0.778	S	S	*	*			trans	-56.5	107.7	169.3	0	0	0	0	0	108.1	Y137	Y137-A139 PolarHBondContact O-N 3.41Å
140	G	51.3	Low	50.5	Low	58 Å²	58	132.2 Å²	132.2	60%	0.598	77%	0.771	S	S	*	*			trans	-60.5	141.3	166.8	0	0	0	0	0	108.9	V138	V138-G140 PolarHBondContact O-N 3.42Å
141	P	58.6	Low	50.3	Low	118 Å²	118	132.6 Å²	132.6	77%	0.766	77%	0.771	S	S	*	*			trans	-57	146.4	176.7	24.3	-32.6	0	0	0	109.7	S143	P141-S143 PolarHBondContact O-N 3.39Å
142	P	59.5	Low	50.3	Low	119 Å²	119	132.3 Å²	132.3	77%	0.773	78%	0.781	S	S	*	*			trans	-57.9	113.5	179.2	23.6	-32.2	0	0	0	109	V144	P142-V144 PolarHBondContact O-N 3.02Å
143	S	56.6	Low	50.4	Low	115 Å²	115	128.8 Å²	128.8	80%	0.804	77%	0.771	S	S	*	*			trans	-60.2	102.8	168.4	48.4	0	0	0	0	107.7	P141	P141-S143 PolarHBondContact O-N 3.39Å
144	V	55.6	Low	50.4	Low	119 Å²	119	134.8 Å²	134.8	72%	0.721	78%	0.781	S	S	*	*			trans	-55.6	125.2	171.7	-176.6	0	0	0	0	107.6	P142 Y146	P142-V144 PolarHBondContact O-N 3.02Å; V144-Y146 PolarHBondContact O-N 2.91Å
145	P	52.6	Low	50.9	Low	117 Å²	117	132 Å²	132	76%	0.76	77%	0.774	S	S	*	*			trans	-69.5	108.3	170.5	28.1	-29	0	0	0	106.6	S147	P145-S147 PolarHBondContact O-N 2.73Å
146	Y	50.3	Low	50.8	Low	224 Å²	224	129.1 Å²	129.1	88%	0.878	76%	0.763	S	S	*	*			trans	-58.1	110.8	170.1	-116.5	-92.8	0	0	0	107.9	V144 Q148	V144-Y146 PolarHBondContact O-N 2.91Å; Y146-Q148 PolarHBondContact O-N 3.41Å
147	S	52.6	Low	50.4	Low	82 Å²	82	135.2 Å²	135.2	57%	0.573	77%	0.772	S	S	*	*			trans	-56.6	116.7	175.2	51.2	0	0	0	0	109.9	P145 Q149	P145-S147 PolarHBondContact O-N 2.73Å; S147-Q149 PolarHBondContact O-N 2.84Å
148	Q	52	Low	50.7	Low	203 Å²	203	127.8 Å²	127.8	95%	0.949	77%	0.766	S	S	*	*			trans	-70.6	83.3	158.7	-73.6	-164.1	2.6	0	0	108.3	Y146	Y146-Q148 PolarHBondContact O-N 3.41Å
149	Q	43.1	Very low	50.6	Low	176 Å²	176	132.7 Å²	132.7	82%	0.822	77%	0.771	S	S	*	*			trans	-135.4	100.1	178.1	-138.8	164.1	2.5	0	0	108	S147	S147-Q149 PolarHBondContact O-N 2.84Å
150	G	45	Very low	50.8	Low	67 Å²	67	140 Å²	140	69%	0.691	78%	0.779	S	S	*	*			trans	174.2	60.2	-176.6	0	0	0	0	0	113.8
151	T	46.4	Very low	51.1	Low	127 Å²	127	147.9 Å²	147.9	78%	0.779	79%	0.791	S	S	*	*			trans	7.5	118.3	146	25.5	0	0	0	0	116.9	V153	T151-V153 VanDerWaalsContact C-N 3.31Å; T151-V153 PolarHBondContact O-N 2.96Å
152	A	46	Very low	51.2	Low	105 Å²	105	152.1 Å²	152.1	87%	0.868	80%	0.797	S	S	*	*			trans	-56.4	91.1	162.1	0	0	0	0	0	110.5	R154	A152-R154 VanDerWaalsContact C-N 3.35Å; A152-R154 PolarHBondContact O-N 2.96Å
153	V	47.1	Very low	51	Low	108 Å²	108	155 Å²	155	66%	0.655	79%	0.793	S	S	*	*			trans	-76.4	93.5	168.9	177.6	0	0	0	0	107.1	T151 T155	T151-V153 VanDerWaalsContact C-N 3.31Å; T151-V153 PolarHBondContact O-N 2.96Å; V153-T155 HydrophobicContact CG1-CG2 3.68Å; V153-T155 PolarHBondContact O-N 3.48Å
154	R	49.9	Very low	51.4	Low	246 Å²	246	151.8 Å²	151.8	93%	0.928	77%	0.77	S	S	*	*			trans	-65.5	80.5	162.8	-108	-175.3	171	-153.2	0.9	108.4	A152 G156	A152-R154 VanDerWaalsContact C-N 3.35Å; A152-R154 PolarHBondContact O-N 2.96Å; R154-G156 PolarHBondContact O-N 3.34Å
155	T	53.2	Low	51.8	Low	122 Å²	122	151.3 Å²	151.3	75%	0.748	77%	0.77	S	S	*	*			trans	-78.1	79.6	162.6	37.4	0	0	0	0	108.6	V153 Y157	V153-T155 HydrophobicContact CG1-CG2 3.68Å; V153-T155 PolarHBondContact O-N 3.48Å; T155-Y157 PolarHBondContact O-N 3.47Å
156	G	47	Very low	52.5	Low	57 Å²	57	149.3 Å²	149.3	59%	0.588	76%	0.755	S	S	*	*			trans	-70.5	75.9	169.2	0	0	0	0	0	111.4	R154	R154-G156 PolarHBondContact O-N 3.34Å
157	Y	44.2	Very low	53.1	Low	225 Å²	225	145.9 Å²	145.9	88%	0.882	75%	0.745	S	S	*	*			trans	-149.9	76.9	152.6	-70	-73.3	0	0	0	107.7	T155 R159	T155-Y157 PolarHBondContact O-N 3.47Å; Y157-R159 VanDerWaalsContact C-N 3.27Å; Y157-R159 PolarHBondContact O-N 3.22Å
158	G	48.1	Very low	53.7	Low	76 Å²	76	146.4 Å²	146.4	78%	0.784	74%	0.741	S	S	*	*			trans	-57.8	95.5	166.6	0	0	0	0	0	108.6	R160	G158-R160 PolarHBondContact O-N 3.07Å
159	R	51.6	Low	54.6	Low	233 Å²	233	139.6 Å²	139.6	88%	0.879	72%	0.72	S	S	*	*			trans	-50.4	105.4	173.1	-150.6	-179.4	-167.6	-155.9	4.7	105.7	Y157 R161	Y157-R159 VanDerWaalsContact C-N 3.27Å; Y157-R159 PolarHBondContact O-N 3.22Å; R159-R161 PolarHBondContact O-N 2.92Å
160	R	55.5	Low	55.7	Low	243 Å²	243	135.8 Å²	135.8	92%	0.917	70%	0.704	S	S	*	*			trans	-55.6	91.1	175.2	-106.4	-175.2	173.3	-164.1	0.8	106.7	G158 K162	G158-R160 PolarHBondContact O-N 3.07Å; R160-K162 PolarHBondContact O-N 3.15Å
161	R	58.2	Low	57	Low	223 Å²	223	139.7 Å²	139.7	84%	0.842	70%	0.698	S	S	*	*			trans	-58.7	115.9	175.5	-70.2	-171.3	178.5	-164.8	0.5	105.3	R159 R163	R159-R161 PolarHBondContact O-N 2.92Å; R161-R163 PolarHBondContact O-N 3.01Å
162	K	60.9	Low	58.3	Low	208 Å²	208	141.4 Å²	141.4	90%	0.904	70%	0.695	S	S	*	*			trans	-58	104.8	172.8	-73.8	-162.8	178	-175.3	0	106.2	R160 S164	R160-K162 PolarHBondContact O-N 3.15Å; K162-S164 PolarHBondContact O-N 3.2Å
163	R	56	Low	59.6	Low	180 Å²	180	140.7 Å²	140.7	68%	0.679	68%	0.683	S	S	*	*			trans	-56.2	129.3	174.5	-69.1	-176.4	178.2	-166.7	-1.7	106.5	R161 L168	R161-R163 PolarHBondContact O-N 3.01Å; R163-L168 HydrophobicContact CB-CD1 4.48Å
164	S	64	Low	60.8	Low	46 Å²	46	142.4 Å²	142.4	32%	0.322	69%	0.688	S	S	.	*			trans	-55.6	140.8	-179.1	73.7	0	0	0	0	109.2	K162 T166 F167 L168	K162-S164 PolarHBondContact O-N 3.2Å; S164-T166 PolarHBondContact O-N 3.43Å; S164-F167 PolarHBondContact O-N 3.22Å; S164-F167 VanDerWaalsContact OG-CD2 3.24Å; S164-F167 WeakPolarHBondContact OG-CD2 3.34Å; S164-F167 PolarHBondContact OG-N 3.09Å; S164-L168 PolarHBondContact O-N 2.89Å
165	P	63.7	Low	62	Low	110 Å²	110	138.6 Å²	138.6	71%	0.714	68%	0.678	S	S	*	*	H	α-helix	trans	-54.9	-27.2	179.1	18.8	-29.7	0	0	0	111.8	L168 A169	P165-L168 PolarHBondContact O-N 3.33Å; P165-A169 PolarHBondContact O-N 3.45Å
166	T	67.1	Low	62	Low	74 Å²	74	138.7 Å²	138.7	45%	0.454	70%	0.704	S	S	.	*	H	α-helix	trans	-62.5	-43.3	175.8	-33.7	0	0	0	0	113.4	S164 L168 A169 L170	S164-T166 PolarHBondContact O-N 3.43Å; T166-L168 VanDerWaalsContact C-N 3.34Å; T166-L168 PolarHBondContact O-N 3.25Å; T166-A169 PolarHBondContact O-N 3.1Å; T166-L170 PolarHBondContact O-N 2.77Å; T166-L170 VanDerWaalsContact O-N 3.07Å
167	F	63	Low	62.7	Low	153 Å²	153	142.8 Å²	142.8	67%	0.671	71%	0.709	S	S	*	*	H	α-helix	trans	-71.3	-30.4	178.3	-87.2	-71.4	0	0	0	112.7	S164 R171	S164-F167 PolarHBondContact O-N 3.22Å; S164-F167 VanDerWaalsContact OG-CD2 3.24Å; S164-F167 WeakPolarHBondContact OG-CD2 3.34Å; S164-F167 PolarHBondContact OG-N 3.09Å; F167-R171 WeakPolarHBondContact O-CB 3.48Å; F167-R171 PolarHBondContact O-N 3.42Å; F167-R171 VanDerWaalsContact O-N 3.14Å
168	L	65.2	Low	63.7	Low	93 Å²	93	138.5 Å²	138.5	49%	0.487	70%	0.7	S	S	.	*	H	α-helix	trans	-72.1	-37	176.3	-118.2	146.5	0	0	0	111.6	R163 S164 P165 T166 K172	R163-L168 HydrophobicContact CB-CD1 4.48Å; S164-L168 PolarHBondContact O-N 2.89Å; P165-L168 PolarHBondContact O-N 3.33Å; T166-L168 VanDerWaalsContact C-N 3.34Å; T166-L168 PolarHBondContact O-N 3.25Å; L168-K172 WeakPolarHBondContact O-CG 3.37Å; L168-K172 PolarHBondContact O-N 3.41Å
169	A	71.1	Confident	64.6	Low	60 Å²	60	141.9 Å²	141.9	50%	0.496	70%	0.696	S	S	.	*	H	α-helix	trans	-67.1	-45.4	173.7	0	0	0	0	0	112.2	P165 T166 R171 K172 S173	P165-A169 PolarHBondContact O-N 3.45Å; T166-A169 PolarHBondContact O-N 3.1Å; A169-R171 PolarHBondContact O-N 3.21Å; A169-K172 PolarHBondContact O-N 3.37Å; A169-S173 PolarHBondContact O-N 3.32Å
170	L	66.9	Low	65.3	Low	95 Å²	95	136.6 Å²	136.6	50%	0.497	69%	0.685	S	S	.	*	H	α-helix	trans	-59.3	-42.8	176.2	-91.3	155.6	0	0	0	112.5	T166 K172 S173 L174	T166-L170 PolarHBondContact O-N 2.77Å; T166-L170 VanDerWaalsContact O-N 3.07Å; L170-K172 VanDerWaalsContact C-N 3.31Å; L170-K172 PolarHBondContact O-N 3.17Å; L170-S173 PolarHBondContact O-N 3.5Å; L170-L174 PolarHBondContact O-N 3.36Å
171	R	71.6	Confident	66	Low	150 Å²	150	129.9 Å²	129.9	57%	0.566	67%	0.67	S	S	*	*	H	α-helix	trans	-67.2	-31.1	178.1	-166.3	-179	-173.3	-159	3.9	113.1	F167 A169	F167-R171 WeakPolarHBondContact O-CB 3.48Å; F167-R171 PolarHBondContact O-N 3.42Å; F167-R171 VanDerWaalsContact O-N 3.14Å; A169-R171 PolarHBondContact O-N 3.21Å
172	K	73.7	Confident	66.5	Low	162 Å²	162	123.7 Å²	123.7	70%	0.704	66%	0.659	S	S	*	*	H	α-helix	trans	-70.8	-38.9	173.6	-77.2	-176.2	176.3	-173	0	111.4	L168 A169 L170 L174 K175	L168-K172 WeakPolarHBondContact O-CG 3.37Å; L168-K172 PolarHBondContact O-N 3.41Å; A169-K172 PolarHBondContact O-N 3.37Å; L170-K172 VanDerWaalsContact C-N 3.31Å; L170-K172 PolarHBondContact O-N 3.17Å; K172-L174 VanDerWaalsContact C-N 3.29Å; K172-L174 PolarHBondContact O-N 3.08Å; K172-K175 PolarHBondContact O-N 3.46Å
173	S	74.5	Confident	66.9	Low	90 Å²	90	117.7 Å²	117.7	63%	0.629	64%	0.641	S	S	*	*	H	α-helix	trans	-67.3	-24	177.2	-179.4	0	0	0	0	114.4	A169 L170	A169-S173 PolarHBondContact O-N 3.32Å; L170-S173 PolarHBondContact O-N 3.5Å
174	L	71.5	Confident	67.7	Low	145 Å²	145	112.9 Å²	112.9	76%	0.759	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-4.7	-179.1	-90.1	150.6	0	0	0	113.8	L170 K172	L170-L174 PolarHBondContact O-N 3.36Å; K172-L174 VanDerWaalsContact C-N 3.29Å; K172-L174 PolarHBondContact O-N 3.08Å
175	K	74.5	Confident	68	Low	166 Å²	166	118.5 Å²	118.5	72%	0.722	67%	0.665	S	S	*	*			trans	-110.6	1	-178.1	-88.4	-168.4	170.7	-159.7	0	113.8	K172	K172-K175 PolarHBondContact O-N 3.46Å
176	G	53.5	Low	68.4	Low	124 Å²	124	119.3 Å²	119.3	100%	1.278	66%	0.66	S	S	*	*			trans	-118.6	0	170	0	0	0	0	0	109.3

Retrieved 176 of 176 residues in 202.4 ms (Link to these results)

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