A0A093HPJ6_STRCA Loading...

Ankyrin repeat and SOCS box protein 7

Probable substrate-recognition component of a SCF-like ECS (Elongin-Cullin-SOCS-box protein) E3 ubiquitin-protein ligase complex which mediates the ubiquitination and subsequent proteasomal degradation of target proteins. Plays a role in spindle dynamics and genome integrity by targeting the mitotic progression protein PSRC1 for proteasomal degradation in a cell cycle-dependent manner. Also participates in meiosis by mediating the proper attachment between kinetochores and microtubules.

AlphaFold DB , UniProt , Accession A0A093HPJ6, Species STRCA (Struthio camelus australis), Gene n/a, Length 318 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	38.5	Very low	50.1	Low	240 Å²	240	168.3 Å²	168.3	100%	1.182	81%	0.807	S	S	*	*				0	49.5	0	-74.7	-169.7	-165.3	0	0	112.4
2	L	34.8	Very low	52.6	Low	173 Å²	173	161.9 Å²	161.9	91%	0.906	78%	0.78	S	S	*	*			trans	-151.9	45.9	172.2	-79.5	175.6	0	0	0	111.7
3	H	36.8	Very low	54.9	Low	183 Å²	183	157.8 Å²	157.8	85%	0.847	76%	0.759	S	S	*	*	S	Bend	trans	-137.1	33.4	179.9	-100	-62.1	0	0	0	113.9
4	H	39.7	Very low	57.2	Low	169 Å²	169	153.6 Å²	153.6	78%	0.782	74%	0.738	S	S	*	*	S	Bend	trans	-143.4	15.9	-175.7	-99.9	-49.3	0	0	0	119.5
5	H	38.6	Very low	59.2	Low	193 Å²	193	146.8 Å²	146.8	89%	0.894	71%	0.705	S	S	*	*	S	Bend	trans	-120	12.2	-177.5	-77.4	-54.8	0	0	0	118.7
6	C	37.1	Very low	61	Low	132 Å²	132	144 Å²	144	89%	0.892	69%	0.694	S	S	*	*			trans	-109.5	63.6	161.9	-82.9	0	0	0	0	110.9	R8	C6-R8 PolarHBondContact O-N 3.26Å; C6-R8 VanDerWaalsContact O-N 3.13Å
7	R	48.5	Very low	62.9	Low	235 Å²	235	141.6 Å²	141.6	89%	0.887	68%	0.682	S	S	*	*			trans	-63.3	109	155.2	-86.4	-177.3	172.8	177	-2.1	106.1	N9	R7-N9 PolarHBondContact O-N 3.08Å
8	R	56.6	Low	64.6	Low	206 Å²	206	133.7 Å²	133.7	78%	0.777	64%	0.644	S	S	*	*			trans	-49.7	124.8	166.8	-82.2	177.6	171.5	169.8	-3.1	107.5	C6 P10	C6-R8 PolarHBondContact O-N 3.26Å; C6-R8 VanDerWaalsContact O-N 3.13Å; R8-P10 VanDerWaalsContact O-CD 3.26Å; R8-P10 WeakPolarHBondContact O-CD 3.34Å; R8-P10 VanDerWaalsContact O-N 3.14Å
9	N	68.8	Low	66	Low	90 Å²	90	129.1 Å²	129.1	48%	0.481	62%	0.621	S	S	.	*			trans	-58.6	114.1	-178.7	-168.3	-1.3	0	0	0	108.8	R7 E11 L12 Q13	R7-N9 PolarHBondContact O-N 3.08Å; N9-E11 VanDerWaalsContact C-N 3.26Å; N9-E11 PolarHBondContact O-N 3.32Å; N9-L12 HydrophobicContact CB-CB 3.91Å; N9-L12 WeakPolarHBondContact O-CB 3.38Å; N9-L12 PolarHBondContact O-N 3.07Å; N9-Q13 PolarHBondContact O-N 3.1Å; N9-Q13 VanDerWaalsContact O-N 3.15Å
10	P	75.3	Confident	67.4	Low	86 Å²	86	125.6 Å²	125.6	56%	0.558	61%	0.614	S	S	*	*	H	α-helix	trans	-57.6	-38.2	-173	-25.6	34.5	0	0	0	113.1	R8 L12 Q13 E14	R8-P10 VanDerWaalsContact O-CD 3.26Å; R8-P10 WeakPolarHBondContact O-CD 3.34Å; R8-P10 VanDerWaalsContact O-N 3.14Å; P10-L12 VanDerWaalsContact C-N 3.32Å; P10-L12 PolarHBondContact O-N 3.21Å; P10-Q13 WeakPolarHBondContact O-CB 3.2Å; P10-Q13 PolarHBondContact O-N 3.4Å; P10-Q13 VanDerWaalsContact O-N 3.1Å; P10-E14 PolarHBondContact O-N 3.23Å
11	E	76.3	Confident	68.7	Low	144 Å²	144	120 Å²	120	67%	0.673	59%	0.588	S	S	*	*	H	α-helix	trans	-60.7	-41.3	176.1	-64.4	175.7	174.7	0	0	111.7	N9 Q13 E14 E15	N9-E11 VanDerWaalsContact C-N 3.26Å; N9-E11 PolarHBondContact O-N 3.32Å; E11-Q13 VanDerWaalsContact C-N 3.27Å; E11-Q13 PolarHBondContact O-N 3.27Å; E11-E14 PolarHBondContact O-N 3.39Å; E11-E15 WeakPolarHBondContact O-CB 3.46Å; E11-E15 PolarHBondContact O-N 2.94Å
12	L	80	Confident	71.4	Confident	92 Å²	92	108.6 Å²	108.6	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-66.9	-32.1	177.1	-162.1	108.4	0	0	0	111.4	N9 P10 L16	N9-L12 HydrophobicContact CB-CB 3.91Å; N9-L12 WeakPolarHBondContact O-CB 3.38Å; N9-L12 PolarHBondContact O-N 3.07Å; P10-L12 VanDerWaalsContact C-N 3.32Å; P10-L12 PolarHBondContact O-N 3.21Å; L12-L16 HydrophobicContact CD2-CD1 4.03Å; L12-L16 HydrophobicContact CG-CD1 4.43Å; L12-L16 WeakPolarHBondContact O-CB 3.23Å; L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 3.2Å
13	Q	83.3	Confident	74.1	Confident	108 Å²	108	101.9 Å²	101.9	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-73.4	-39.3	177.6	-168.2	167.7	-26.3	0	0	111.6	N9 P10 E11 Q17	N9-Q13 PolarHBondContact O-N 3.1Å; N9-Q13 VanDerWaalsContact O-N 3.15Å; P10-Q13 WeakPolarHBondContact O-CB 3.2Å; P10-Q13 PolarHBondContact O-N 3.4Å; P10-Q13 VanDerWaalsContact O-N 3.1Å; E11-Q13 VanDerWaalsContact C-N 3.27Å; E11-Q13 PolarHBondContact O-N 3.27Å; Q13-Q17 WeakPolarHBondContact O-CB 3.04Å; Q13-Q17 PolarHBondContact O-N 3.35Å
14	E	86.3	Confident	76.8	Confident	100 Å²	100	97 Å²	97	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-43.2	172.4	-71.5	-178.8	178.4	0	0	111.7	P10 E11 Q17 I18 M33 Y38	P10-E14 PolarHBondContact O-N 3.23Å; E11-E14 PolarHBondContact O-N 3.39Å; E14-Q17 PolarHBondContact O-N 3.4Å; E14-I18 PolarHBondContact O-N 2.97Å; E14-M33 HydrophobicContact CB-CE 4.37Å; E14-M33 WeakPolarHBondContact O-CE 3.39Å; E14-Y38 HydrophobicContact CB-CE2 4.32Å
15	E	87.1	Confident	79.4	Confident	51 Å²	51	90.1 Å²	90.1	24%	0.238	47%	0.468	C	S	.	.	H	α-helix	trans	-59	-49.8	175.4	-174.8	-176.6	178.6	0	0	111.7	E11 Q17 I18 Q19 D44	E11-E15 WeakPolarHBondContact O-CB 3.46Å; E11-E15 PolarHBondContact O-N 2.94Å; E15-Q17 VanDerWaalsContact C-N 3.27Å; E15-Q17 PolarHBondContact O-N 3Å; E15-I18 VanDerWaalsContact O-CG2 3.31Å; E15-I18 WeakPolarHBondContact O-CG2 3.32Å; E15-I18 PolarHBondContact O-N 3.48Å; E15-Q19 HydrophobicContact CG-CG 4.47Å; E15-Q19 WeakPolarHBondContact O-CB 3.19Å; E15-Q19 VanDerWaalsContact O-CG 3.26Å; E15-Q19 WeakPolarHBondContact O-CG 3.4Å; E15-Q19 PolarHBondContact O-N 3.38Å; E15-Q19 PolarHBondContact OE1-NE2 3.23Å; E15-D44 WeakPolarHBondContact OE1-CB 2.86Å
16	L	89.1	Confident	82.1	Confident	102 Å²	102	84 Å²	84	53%	0.534	44%	0.442	S	S	.	.	H	α-helix	trans	-60.6	-38.6	177	-75.3	165.8	0	0	0	111.8	L12 A20	L12-L16 HydrophobicContact CD2-CD1 4.03Å; L12-L16 HydrophobicContact CG-CD1 4.43Å; L12-L16 WeakPolarHBondContact O-CB 3.23Å; L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 3.2Å; L16-A20 VanDerWaalsContact O-CB 3.28Å; L16-A20 WeakPolarHBondContact O-CB 3.38Å; L16-A20 PolarHBondContact O-N 3.31Å
17	Q	93.1	Very high	85	Confident	103 Å²	103	79.2 Å²	79.2	48%	0.481	41%	0.408	S	S	.	.	H	α-helix	trans	-65.8	-48.3	179.2	-177.6	177.4	2.1	0	0	111.8	Q13 E14 E15 A20 A21 M33	Q13-Q17 WeakPolarHBondContact O-CB 3.04Å; Q13-Q17 PolarHBondContact O-N 3.35Å; E14-Q17 PolarHBondContact O-N 3.4Å; E15-Q17 VanDerWaalsContact C-N 3.27Å; E15-Q17 PolarHBondContact O-N 3Å; Q17-A20 PolarHBondContact O-N 3.28Å; Q17-A21 PolarHBondContact O-N 2.9Å; Q17-M33 HydrophobicContact CB-CE 4.27Å; Q17-M33 HydrophobicContact CG-CE 4.3Å; Q17-M33 HydrophobicContact CG-SD 4.06Å
18	I	93.1	Very high	87.2	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-69.1	-37.1	-179.8	-164.1	160.9	0	0	0	111.4	E14 E15 A20 A21 V22 V30 M33 Y38 L50	E14-I18 PolarHBondContact O-N 2.97Å; E15-I18 VanDerWaalsContact O-CG2 3.31Å; E15-I18 WeakPolarHBondContact O-CG2 3.32Å; E15-I18 PolarHBondContact O-N 3.48Å; I18-A20 VanDerWaalsContact C-N 3.33Å; I18-A20 PolarHBondContact O-N 3.05Å; I18-A21 PolarHBondContact O-N 3.05Å; I18-V22 WeakPolarHBondContact O-CG2 3.42Å; I18-V22 PolarHBondContact O-N 3.42Å; I18-V30 HydrophobicContact CG1-CG2 4.49Å; I18-M33 HydrophobicContact CB-CE 3.79Å; I18-M33 HydrophobicContact CB-SD 3.76Å; I18-M33 HydrophobicContact CD1-CB 4.06Å; I18-M33 HydrophobicContact CD1-SD 4.35Å; I18-M33 HydrophobicContact CG1-SD 4.13Å; I18-Y38 HydrophobicContact CD1-CD1 3.58Å; I18-Y38 HydrophobicContact CD1-CE1 3.83Å; I18-Y38 HydrophobicContact CD1-CG 4.05Å; I18-Y38 HydrophobicContact CG2-CE1 3.95Å; I18-Y38 HydrophobicContact CG2-CE2 4.07Å; I18-L50 HydrophobicContact CD1-CD1 3.57Å; I18-L50 HydrophobicContact CG1-CD1 4.01Å; I18-L50 HydrophobicContact CG1-CD2 4.38Å; I18-L50 HydrophobicContact CG2-CD1 4.48Å; I18-L50 HydrophobicContact CG2-CD2 3.99Å
19	Q	91.9	Very high	89.1	Confident	46 Å²	46	66.5 Å²	66.5	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-39.7	174.8	-73.2	179.1	7	0	0	111.5	E15 V22 A23 L50 F53	E15-Q19 HydrophobicContact CG-CG 4.47Å; E15-Q19 WeakPolarHBondContact O-CB 3.19Å; E15-Q19 VanDerWaalsContact O-CG 3.26Å; E15-Q19 WeakPolarHBondContact O-CG 3.4Å; E15-Q19 PolarHBondContact O-N 3.38Å; E15-Q19 PolarHBondContact OE1-NE2 3.23Å; Q19-V22 PolarHBondContact O-N 3.08Å; Q19-A23 VanDerWaalsContact O-CB 3.3Å; Q19-A23 WeakPolarHBondContact O-CB 3.38Å; Q19-A23 PolarHBondContact O-N 3.12Å; Q19-L50 HydrophobicContact CG-CD2 4.47Å; Q19-F53 HydrophobicContact CG-CE2 4.46Å
20	A	93.2	Very high	90.4	Very high	59 Å²	59	62.2 Å²	62.2	49%	0.488	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-40.8	173.5	0	0	0	0	0	112.1	L16 Q17 I18 A23 A24	L16-A20 VanDerWaalsContact O-CB 3.28Å; L16-A20 WeakPolarHBondContact O-CB 3.38Å; L16-A20 PolarHBondContact O-N 3.31Å; Q17-A20 PolarHBondContact O-N 3.28Å; I18-A20 VanDerWaalsContact C-N 3.33Å; I18-A20 PolarHBondContact O-N 3.05Å; A20-A23 WeakPolarHBondContact O-CB 3.29Å; A20-A23 PolarHBondContact O-N 3.35Å; A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 2.92Å
21	A	95.3	Very high	91.4	Very high	8 Å²	8	63 Å²	63	7%	0.066	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-44.4	175	0	0	0	0	0	111.6	Q17 I18 A23 A24 G25 D26 T29 V30	Q17-A21 PolarHBondContact O-N 2.9Å; I18-A21 PolarHBondContact O-N 3.05Å; A21-A23 PolarHBondContact O-N 3.49Å; A21-A24 PolarHBondContact O-N 3.46Å; A21-G25 PolarHBondContact O-N 3.1Å; A21-D26 HydrophobicContact CB-CB 4.32Å; A21-D26 PolarHBondContact O-N 3.47Å; A21-T29 HydrophobicContact CB-CG2 3.85Å; A21-V30 HydrophobicContact CB-CG2 3.93Å
22	V	94.6	Very high	92.4	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-46.8	172.6	171.1	0	0	0	0	110.7	I18 Q19 A24 G25 V30 L50 F53 S54 Q59 F66	I18-V22 WeakPolarHBondContact O-CG2 3.42Å; I18-V22 PolarHBondContact O-N 3.42Å; Q19-V22 PolarHBondContact O-N 3.08Å; V22-A24 VanDerWaalsContact C-N 3.26Å; V22-A24 PolarHBondContact O-N 3.17Å; V22-G25 PolarHBondContact O-N 3.41Å; V22-V30 HydrophobicContact CG2-CG2 3.87Å; V22-L50 HydrophobicContact CG2-CD2 4.36Å; V22-F53 HydrophobicContact CG1-CB 4.31Å; V22-S54 VanDerWaalsContact CG1-OG 3.3Å; V22-S54 WeakPolarHBondContact CG1-OG 3.43Å; V22-Q59 HydrophobicContact CG1-CG 4.43Å; V22-Q59 VanDerWaalsContact O-CG 3.22Å; V22-Q59 WeakPolarHBondContact O-CG 3.37Å; V22-Q59 PolarHBondContact O-NE2 2.58Å; V22-F66 HydrophobicContact CG2-CE2 3.74Å; V22-F66 HydrophobicContact CG2-CZ 3.48Å; V22-F66 VanDerWaalsContact CG2-CZ 3.48Å
23	A	92.1	Very high	93.1	Very high	31 Å²	31	57.6 Å²	57.6	26%	0.256	31%	0.309	S	S	.	.	H	α-helix	trans	-56	-41.1	178.5	0	0	0	0	0	112.6	Q19 A20 A21 G25 Q59	Q19-A23 VanDerWaalsContact O-CB 3.3Å; Q19-A23 WeakPolarHBondContact O-CB 3.38Å; Q19-A23 PolarHBondContact O-N 3.12Å; A20-A23 WeakPolarHBondContact O-CB 3.29Å; A20-A23 PolarHBondContact O-N 3.35Å; A21-A23 PolarHBondContact O-N 3.49Å; A23-G25 VanDerWaalsContact C-N 3.34Å; A23-Q59 PolarHBondContact O-NE2 3.11Å
24	A	93.8	Very high	93.6	Very high	82 Å²	82	53 Å²	53	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-79.5	-12.3	176.9	0	0	0	0	0	114	A20 A21 V22 D26	A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 2.92Å; A21-A24 PolarHBondContact O-N 3.46Å; V22-A24 VanDerWaalsContact C-N 3.26Å; V22-A24 PolarHBondContact O-N 3.17Å; A24-D26 VanDerWaalsContact C-N 3.28Å
25	G	93.4	Very high	94	Very high	24 Å²	24	54.4 Å²	54.4	25%	0.247	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	23.1	-172	0	0	0	0	0	113.3	A21 V22 A23 V27	A21-G25 PolarHBondContact O-N 3.1Å; V22-G25 PolarHBondContact O-N 3.41Å; A23-G25 VanDerWaalsContact C-N 3.34Å; G25-V27 VanDerWaalsContact C-N 3.34Å; G25-V27 PolarHBondContact O-N 2.98Å
26	D	96.1	Very high	94.4	Very high	64 Å²	64	58.7 Å²	58.7	34%	0.342	32%	0.315	S	S	.	.			trans	-76.6	84.2	177.8	-177.5	0.6	0	0	0	110.8	A21 A24 H28 T29 V30	A21-D26 HydrophobicContact CB-CB 4.32Å; A21-D26 PolarHBondContact O-N 3.47Å; A24-D26 VanDerWaalsContact C-N 3.28Å; D26-H28 PolarHBondContact O-N 3.1Å; D26-H28 WeakPolarHBondContact OD1-CB 3.44Å; D26-H28 PolarHBondContact OD1-N 3.29Å; D26-H28 VanDerWaalsContact OD1-N 3.1Å; D26-T29 PolarHBondContact O-N 3.17Å; D26-T29 PolarHBondContact OD1-N 3.38Å; D26-T29 VanDerWaalsContact OD1-N 3.1Å; D26-T29 WeakPolarHBondContact OD2-CB 3.11Å; D26-T29 PolarHBondContact OD2-OG1 2.63Å; D26-V30 WeakPolarHBondContact O-CG2 3.43Å; D26-V30 PolarHBondContact O-N 3.49Å; D26-V30 VanDerWaalsContact O-N 3.1Å
27	V	96.3	Very high	94.5	Very high	32 Å²	32	56.9 Å²	56.9	19%	0.194	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-28.8	179.2	-173.2	0	0	0	0	112	G25 R31 R61 V65	G25-V27 VanDerWaalsContact C-N 3.34Å; G25-V27 PolarHBondContact O-N 2.98Å; V27-R31 VanDerWaalsContact O-CB 3.29Å; V27-R31 WeakPolarHBondContact O-CB 3.33Å; V27-R31 PolarHBondContact O-N 3.48Å; V27-R61 HydrophobicContact CG2-CB 3.5Å; V27-V65 HydrophobicContact CG1-CG2 3.63Å
28	H	96.4	Very high	94.5	Very high	139 Å²	139	54.2 Å²	54.2	64%	0.644	31%	0.307	S	S	*	.	H	α-helix	trans	-69.6	-50.5	-178	179.5	73.7	0	0	0	110.5	D26 V30 R31 K32	D26-H28 PolarHBondContact O-N 3.1Å; D26-H28 WeakPolarHBondContact OD1-CB 3.44Å; D26-H28 PolarHBondContact OD1-N 3.29Å; D26-H28 VanDerWaalsContact OD1-N 3.1Å; H28-V30 VanDerWaalsContact C-N 3.34Å; H28-V30 PolarHBondContact O-N 3.2Å; H28-R31 PolarHBondContact O-N 2.95Å; H28-K32 WeakPolarHBondContact O-CB 3.38Å; H28-K32 PolarHBondContact O-N 3.28Å
29	T	95.8	Very high	94.5	Very high	34 Å²	34	57.3 Å²	57.3	21%	0.209	33%	0.328	C	S	.	.	H	α-helix	trans	-62.2	-43.5	175.8	-62.6	0	0	0	0	111.1	A21 D26 R31 K32 M33	A21-T29 HydrophobicContact CB-CG2 3.85Å; D26-T29 PolarHBondContact O-N 3.17Å; D26-T29 PolarHBondContact OD1-N 3.38Å; D26-T29 VanDerWaalsContact OD1-N 3.1Å; D26-T29 WeakPolarHBondContact OD2-CB 3.11Å; D26-T29 PolarHBondContact OD2-OG1 2.63Å; T29-R31 PolarHBondContact O-N 2.96Å; T29-K32 PolarHBondContact O-N 3.32Å; T29-M33 HydrophobicContact CG2-CG 4.42Å; T29-M33 HydrophobicContact CG2-SD 4.01Å; T29-M33 WeakPolarHBondContact O-CG 3.37Å; T29-M33 PolarHBondContact O-N 3.34Å
30	V	96.3	Very high	94.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-56	-51.5	175.7	166.9	0	0	0	0	111.5	I18 A21 V22 D26 H28 K32 M33 L34 V65 F66	I18-V30 HydrophobicContact CG1-CG2 4.49Å; A21-V30 HydrophobicContact CB-CG2 3.93Å; V22-V30 HydrophobicContact CG2-CG2 3.87Å; D26-V30 WeakPolarHBondContact O-CG2 3.43Å; D26-V30 PolarHBondContact O-N 3.49Å; D26-V30 VanDerWaalsContact O-N 3.1Å; H28-V30 VanDerWaalsContact C-N 3.34Å; H28-V30 PolarHBondContact O-N 3.2Å; V30-K32 PolarHBondContact O-N 3.01Å; V30-M33 PolarHBondContact O-N 2.98Å; V30-L34 HydrophobicContact CG1-CD1 4.13Å; V30-L34 WeakPolarHBondContact O-CG 3.33Å; V30-L34 PolarHBondContact O-N 3.16Å; V30-L34 VanDerWaalsContact O-N 3.15Å; V30-V65 HydrophobicContact CG1-CG1 4.27Å; V30-F66 HydrophobicContact CG1-CD1 4.24Å; V30-F66 HydrophobicContact CG1-CE1 3.32Å; V30-F66 HydrophobicContact CG1-CE2 4.38Å; V30-F66 HydrophobicContact CG1-CZ 3.4Å; V30-F66 VanDerWaalsContact CG1-CZ 3.4Å; V30-F66 HydrophobicContact CG2-CZ 4.26Å
31	R	96.3	Very high	94.5	Very high	102 Å²	102	55.6 Å²	55.6	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-59.5	-48.1	179.8	179.4	-176	-56.4	-73.9	-0.6	111.5	V27 H28 T29 M33 L34 E35 V65	V27-R31 VanDerWaalsContact O-CB 3.29Å; V27-R31 WeakPolarHBondContact O-CB 3.33Å; V27-R31 PolarHBondContact O-N 3.48Å; H28-R31 PolarHBondContact O-N 2.95Å; T29-R31 PolarHBondContact O-N 2.96Å; R31-M33 VanDerWaalsContact C-N 3.29Å; R31-M33 PolarHBondContact O-N 3.26Å; R31-L34 PolarHBondContact O-N 3.15Å; R31-E35 WeakPolarHBondContact CD-OE1 3.34Å; R31-E35 HydrophobicContact CG-CG 4.33Å; R31-E35 WeakPolarHBondContact CG-OE1 3.22Å; R31-E35 WeakPolarHBondContact O-CG 3.48Å; R31-E35 PolarHBondContact O-N 2.85Å; R31-V65 HydrophobicContact CB-CG1 4.39Å
32	K	96.2	Very high	94.3	Very high	109 Å²	109	56.7 Å²	56.7	47%	0.474	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-43	-179.7	-177.7	-179.6	176.6	-178	0	111.6	H28 T29 V30 E35 Q36	H28-K32 WeakPolarHBondContact O-CB 3.38Å; H28-K32 PolarHBondContact O-N 3.28Å; T29-K32 PolarHBondContact O-N 3.32Å; V30-K32 PolarHBondContact O-N 3.01Å; K32-E35 PolarHBondContact O-N 2.63Å; K32-Q36 WeakPolarHBondContact O-CB 3.49Å; K32-Q36 VanDerWaalsContact O-CG 3.23Å; K32-Q36 WeakPolarHBondContact O-CG 3.27Å; K32-Q36 PolarHBondContact O-N 3.46Å
33	M	95.4	Very high	94.3	Very high	14 Å²	14	63.4 Å²	63.4	7%	0.069	35%	0.351	C	S	.	.	H	α-helix	trans	-67	-39.2	179.5	-68.8	-178.3	76.6	0	0	112.3	E14 Q17 I18 T29 V30 R31 Q36 G37 Y38	E14-M33 HydrophobicContact CB-CE 4.37Å; E14-M33 WeakPolarHBondContact O-CE 3.39Å; Q17-M33 HydrophobicContact CB-CE 4.27Å; Q17-M33 HydrophobicContact CG-CE 4.3Å; Q17-M33 HydrophobicContact CG-SD 4.06Å; I18-M33 HydrophobicContact CB-CE 3.79Å; I18-M33 HydrophobicContact CB-SD 3.76Å; I18-M33 HydrophobicContact CD1-CB 4.06Å; I18-M33 HydrophobicContact CD1-SD 4.35Å; I18-M33 HydrophobicContact CG1-SD 4.13Å; T29-M33 HydrophobicContact CG2-CG 4.42Å; T29-M33 HydrophobicContact CG2-SD 4.01Å; T29-M33 WeakPolarHBondContact O-CG 3.37Å; T29-M33 PolarHBondContact O-N 3.34Å; V30-M33 PolarHBondContact O-N 2.98Å; R31-M33 VanDerWaalsContact C-N 3.29Å; R31-M33 PolarHBondContact O-N 3.26Å; M33-Q36 PolarHBondContact O-N 3.12Å; M33-G37 PolarHBondContact O-N 3.17Å; M33-Y38 HydrophobicContact CE-CD2 4.46Å; M33-Y38 WeakPolarHBondContact O-CB 3.48Å; M33-Y38 PolarHBondContact O-N 3.36Å
34	L	94.8	Very high	94.2	Very high	13 Å²	13	63.4 Å²	63.4	7%	0.068	35%	0.346	C	S	.	.	H	α-helix	trans	-65.9	-40.4	175	-63.3	171.6	0	0	0	112	V30 R31 Q36 G37 Y38 P40 V65 F66 H69	V30-L34 HydrophobicContact CG1-CD1 4.13Å; V30-L34 WeakPolarHBondContact O-CG 3.33Å; V30-L34 PolarHBondContact O-N 3.16Å; V30-L34 VanDerWaalsContact O-N 3.15Å; R31-L34 PolarHBondContact O-N 3.15Å; L34-Q36 PolarHBondContact O-N 3.38Å; L34-G37 PolarHBondContact O-N 3.31Å; L34-Y38 HydrophobicContact CD2-CD1 4.38Å; L34-Y38 WeakPolarHBondContact CD2-O 3.37Å; L34-P40 HydrophobicContact CD2-CB 3.87Å; L34-P40 HydrophobicContact CD2-CG 4.39Å; L34-V65 HydrophobicContact CD1-CG1 3.66Å; L34-F66 HydrophobicContact CD1-CD1 3.73Å; L34-F66 HydrophobicContact CD1-CE1 3.89Å; L34-F66 HydrophobicContact CD2-CD1 4.33Å; L34-F66 HydrophobicContact CD2-CE1 4.31Å; L34-F66 HydrophobicContact CG-CE1 4.43Å; L34-H69 HydrophobicContact CD1-CB 4.06Å
35	E	94.6	Very high	94.1	Very high	128 Å²	128	64.2 Å²	64.2	60%	0.598	35%	0.353	S	S	*	.	H	α-helix	trans	-64.4	-28.4	174.1	-71.9	169.2	179.4	0	0	112.3	R31 K32 G37	R31-E35 WeakPolarHBondContact CD-OE1 3.34Å; R31-E35 HydrophobicContact CG-CG 4.33Å; R31-E35 WeakPolarHBondContact CG-OE1 3.22Å; R31-E35 WeakPolarHBondContact O-CG 3.48Å; R31-E35 PolarHBondContact O-N 2.85Å; K32-E35 PolarHBondContact O-N 2.63Å; E35-G37 PolarHBondContact O-N 2.79Å
36	Q	94.2	Very high	94.1	Very high	141 Å²	141	66.7 Å²	66.7	66%	0.659	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	3	173.2	-72.2	174.7	-25.2	0	0	113.6	K32 M33 L34	K32-Q36 WeakPolarHBondContact O-CB 3.49Å; K32-Q36 VanDerWaalsContact O-CG 3.23Å; K32-Q36 WeakPolarHBondContact O-CG 3.27Å; K32-Q36 PolarHBondContact O-N 3.46Å; M33-Q36 PolarHBondContact O-N 3.12Å; L34-Q36 PolarHBondContact O-N 3.38Å
37	G	91.3	Very high	94.1	Very high	64 Å²	64	63.7 Å²	63.7	66%	0.66	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	7.4	174.8	0	0	0	0	0	115.1	M33 L34 E35 S39	M33-G37 PolarHBondContact O-N 3.17Å; L34-G37 PolarHBondContact O-N 3.31Å; E35-G37 PolarHBondContact O-N 2.79Å; G37-S39 PolarHBondContact O-N 3.14Å
38	Y	92.6	Very high	94.1	Very high	48 Å²	48	64.7 Å²	64.7	19%	0.188	35%	0.345	C	S	.	.			trans	-61.8	127.5	172.6	-170.3	-82.3	0	0	0	110	E14 I18 M33 L34 P40 L50	E14-Y38 HydrophobicContact CB-CE2 4.32Å; I18-Y38 HydrophobicContact CD1-CD1 3.58Å; I18-Y38 HydrophobicContact CD1-CE1 3.83Å; I18-Y38 HydrophobicContact CD1-CG 4.05Å; I18-Y38 HydrophobicContact CG2-CE1 3.95Å; I18-Y38 HydrophobicContact CG2-CE2 4.07Å; M33-Y38 HydrophobicContact CE-CD2 4.46Å; M33-Y38 WeakPolarHBondContact O-CB 3.48Å; M33-Y38 PolarHBondContact O-N 3.36Å; L34-Y38 HydrophobicContact CD2-CD1 4.38Å; L34-Y38 WeakPolarHBondContact CD2-O 3.37Å; Y38-P40 WeakPolarHBondContact O-CD 3.18Å; Y38-L50 HydrophobicContact CD1-CD1 4.35Å; Y38-L50 HydrophobicContact CE1-CD1 3.89Å
39	S	93	Very high	94.1	Very high	64 Å²	64	58.1 Å²	58.1	45%	0.448	31%	0.314	S	S	.	.			trans	-74.8	122.2	-179.5	178.5	0	0	0	0	111.3	G37 N41 G42	G37-S39 PolarHBondContact O-N 3.14Å; S39-N41 PolarHBondContact O-N 3.21Å; S39-N41 PolarHBondContact OG-N 2.94Å; S39-G42 PolarHBondContact O-N 3.2Å
40	P	91.8	Very high	94.1	Very high	14 Å²	14	56.8 Å²	56.8	9%	0.091	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-11.7	176.7	29.7	-34.7	0	0	0	113.4	L34 Y38 F66 H69 A71	L34-P40 HydrophobicContact CD2-CB 3.87Å; L34-P40 HydrophobicContact CD2-CG 4.39Å; Y38-P40 WeakPolarHBondContact O-CD 3.18Å; P40-F66 HydrophobicContact CB-CD1 4.3Å; P40-H69 WeakPolarHBondContact CG-O 3.45Å; P40-A71 HydrophobicContact CB-CB 3.88Å; P40-A71 HydrophobicContact CG-CB 4.33Å
41	N	94.1	Very high	94.1	Very high	55 Å²	55	56.9 Å²	56.9	29%	0.294	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	5.1	-178.3	-65.6	-40.8	0	0	0	113.3	S39 G70 A71 D72	S39-N41 PolarHBondContact O-N 3.21Å; S39-N41 PolarHBondContact OG-N 2.94Å; N41-G70 PolarHBondContact ND2-O 3.43Å; N41-A71 WeakPolarHBondContact OD1-CA 3.36Å; N41-D72 PolarHBondContact OD1-N 3.28Å
42	G	91.8	Very high	94.2	Very high	31 Å²	31	52.1 Å²	52.1	32%	0.32	29%	0.289	S	S	.	.			trans	-53.4	142.1	169.8	0	0	0	0	0	111	S39 T49	S39-G42 PolarHBondContact O-N 3.2Å; G42-T49 WeakPolarHBondContact O-CA 3.33Å
43	R	92.9	Very high	94.2	Very high	143 Å²	143	48.3 Å²	48.3	54%	0.54	27%	0.272	S	S	.	.			trans	-119.6	133.8	-178	-62.7	-175.9	-171.5	-172.3	0.9	109.7	W48 T49 V75	R43-W48 WeakPolarHBondContact CA-O 3.46Å; R43-T49 HydrophobicContact CG-CG2 4.02Å; R43-V75 VanDerWaalsContact CZ-CG1 3.41Å
44	D	91.5	Very high	94.3	Very high	31 Å²	31	47.7 Å²	47.7	17%	0.166	27%	0.269	C	S	.	.			trans	-74.5	-177.4	169.7	80.6	-5.1	0	0	0	111.3	E15 N46 G47 W48 F53	E15-D44 WeakPolarHBondContact OE1-CB 2.86Å; D44-N46 PolarHBondContact O-N 3.19Å; D44-N46 VanDerWaalsContact O-N 3.12Å; D44-N46 WeakPolarHBondContact OD1-CA 3.4Å; D44-N46 WeakPolarHBondContact OD1-CB 3.46Å; D44-N46 PolarHBondContact OD1-N 2.65Å; D44-G47 PolarHBondContact O-N 3.41Å; D44-G47 PolarHBondContact OD1-N 2.75Å; D44-G47 VanDerWaalsContact OD1-N 3.07Å; D44-W48 PolarHBondContact N-O 3.03Å; D44-W48 WeakPolarHBondContact OD1-CB 3.36Å; D44-W48 PolarHBondContact OD1-N 3.29Å; D44-F53 WeakPolarHBondContact OD2-CZ 3.38Å
45	A	91.3	Very high	94.4	Very high	98 Å²	98	47 Å²	47	81%	0.81	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.6	179.2	0	0	0	0	0	114.5
46	N	93.8	Very high	94.5	Very high	76 Å²	76	41.7 Å²	41.7	41%	0.406	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	3.1	177	-60.3	-45.8	0	0	0	112.2	D44 W48 L78 I79	D44-N46 PolarHBondContact O-N 3.19Å; D44-N46 VanDerWaalsContact O-N 3.12Å; D44-N46 WeakPolarHBondContact OD1-CA 3.4Å; D44-N46 WeakPolarHBondContact OD1-CB 3.46Å; D44-N46 PolarHBondContact OD1-N 2.65Å; N46-W48 VanDerWaalsContact C-N 3.34Å; N46-L78 PolarHBondContact O-N 3.37Å; N46-I79 HydrophobicContact CB-CD1 3.9Å; N46-I79 HydrophobicContact CB-CG1 4.29Å
47	G	95.3	Very high	94.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.01	24%	0.237	C	C	.	.			trans	80.7	9.5	-175.2	0	0	0	0	0	114.5	D44	D44-G47 PolarHBondContact O-N 3.41Å; D44-G47 PolarHBondContact OD1-N 2.75Å; D44-G47 VanDerWaalsContact OD1-N 3.07Å
48	W	96.2	Very high	94.8	Very high	53 Å²	53	40 Å²	40	20%	0.201	22%	0.219	C	C	.	.			trans	-75.9	132.1	-178.9	-78.3	34.8	0	0	0	111.3	R43 D44 N46 H52 F53 A56 Y87	R43-W48 WeakPolarHBondContact CA-O 3.46Å; D44-W48 PolarHBondContact N-O 3.03Å; D44-W48 WeakPolarHBondContact OD1-CB 3.36Å; D44-W48 PolarHBondContact OD1-N 3.29Å; N46-W48 VanDerWaalsContact C-N 3.34Å; W48-H52 HydrophobicContact CB-CB 4.11Å; W48-H52 HydrophobicContact CD2-CB 3.92Å; W48-H52 HydrophobicContact CE3-CB 3.93Å; W48-H52 HydrophobicContact CG-CB 4.02Å; W48-F53 HydrophobicContact CB-CD2 4.23Å; W48-F53 HydrophobicContact CB-CE2 3.61Å; W48-F53 HydrophobicContact CB-CZ 4Å; W48-F53 HydrophobicContact CD2-CZ 4.41Å; W48-F53 AromaticContact CE3-CD1 3.61Å; W48-F53 HydrophobicContact CE3-CD1 3.61Å; W48-F53 HydrophobicContact CE3-CD2 4.06Å; W48-F53 AromaticContact CE3-CE1 3.57Å; W48-F53 HydrophobicContact CE3-CE1 3.57Å; W48-F53 HydrophobicContact CE3-CE2 4.02Å; W48-F53 AromaticContact CE3-CG 3.86Å; W48-F53 HydrophobicContact CE3-CG 3.86Å; W48-F53 AromaticContact CE3-CZ 3.77Å; W48-F53 HydrophobicContact CE3-CZ 3.77Å; W48-F53 AromaticContact CZ3-CD1 3.84Å; W48-F53 HydrophobicContact CZ3-CD1 3.84Å; W48-F53 HydrophobicContact CZ3-CE1 4Å; W48-F53 HydrophobicContact CZ3-CG 4.34Å; W48-A56 HydrophobicContact CH2-CB 4.44Å; W48-A56 HydrophobicContact CZ3-CB 4.43Å; W48-Y87 AromaticContact CE2-CZ 3.76Å; W48-Y87 HydrophobicContact CH2-CD1 4.35Å; W48-Y87 AromaticContact CH2-CE1 3.91Å; W48-Y87 HydrophobicContact CH2-CE1 3.91Å; W48-Y87 HydrophobicContact CZ2-CD1 4.28Å; W48-Y87 AromaticContact CZ2-CE1 3.44Å; W48-Y87 HydrophobicContact CZ2-CE1 3.44Å; W48-Y87 VanDerWaalsContact CZ2-CE1 3.44Å; W48-Y87 HydrophobicContact CZ2-CE2 4.2Å; W48-Y87 AromaticContact CZ2-CZ 3.38Å; W48-Y87 VanDerWaalsContact CZ2-OH 3.3Å; W48-Y87 WeakPolarHBondContact CZ2-OH 3.22Å; W48-Y87 AromaticContact NE1-CZ 3.89Å; W48-Y87 PolarHBondContact NE1-OH 3.5Å
49	T	96.3	Very high	95	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.22	C	C	.	.			trans	-95.4	169.2	167.8	69.1	0	0	0	0	111.2	G42 R43 L51 H52 F53 V75	G42-T49 WeakPolarHBondContact O-CA 3.33Å; R43-T49 HydrophobicContact CG-CG2 4.02Å; T49-L51 PolarHBondContact O-N 3.21Å; T49-L51 VanDerWaalsContact O-N 3.13Å; T49-L51 PolarHBondContact OG1-N 3.14Å; T49-H52 PolarHBondContact N-ND1 3.28Å; T49-H52 VanDerWaalsContact N-ND1 3.15Å; T49-H52 WeakPolarHBondContact O-CB 3.33Å; T49-H52 PolarHBondContact O-N 3.47Å; T49-H52 PolarHBondContact OG1-ND1 3.21Å; T49-F53 VanDerWaalsContact O-CD2 3.28Å; T49-F53 WeakPolarHBondContact O-CD2 3.06Å; T49-F53 PolarHBondContact O-N 3.46Å; T49-V75 HydrophobicContact CG2-CB 3.98Å; T49-V75 HydrophobicContact CG2-CG1 3.62Å; T49-V75 HydrophobicContact CG2-CG2 4.21Å
50	L	96.1	Very high	95.2	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-26.6	174.9	-61.8	177.7	0	0	0	113.4	I18 Q19 V22 Y38 S54 F66	I18-L50 HydrophobicContact CD1-CD1 3.57Å; I18-L50 HydrophobicContact CG1-CD1 4.01Å; I18-L50 HydrophobicContact CG1-CD2 4.38Å; I18-L50 HydrophobicContact CG2-CD1 4.48Å; I18-L50 HydrophobicContact CG2-CD2 3.99Å; Q19-L50 HydrophobicContact CG-CD2 4.47Å; V22-L50 HydrophobicContact CG2-CD2 4.36Å; Y38-L50 HydrophobicContact CD1-CD1 4.35Å; Y38-L50 HydrophobicContact CE1-CD1 3.89Å; L50-S54 VanDerWaalsContact O-CB 3.28Å; L50-S54 WeakPolarHBondContact O-CB 3.32Å; L50-S54 PolarHBondContact O-N 2.81Å; L50-S54 PolarHBondContact O-OG 3.35Å; L50-F66 HydrophobicContact CB-CD1 4.27Å; L50-F66 HydrophobicContact CB-CD2 4.03Å; L50-F66 HydrophobicContact CB-CE1 3.96Å; L50-F66 HydrophobicContact CB-CE2 3.69Å; L50-F66 HydrophobicContact CB-CG 4.34Å; L50-F66 HydrophobicContact CB-CZ 3.67Å; L50-F66 HydrophobicContact CD1-CD1 4.08Å; L50-F66 HydrophobicContact CD1-CE1 3.37Å; L50-F66 HydrophobicContact CD1-CE2 4.49Å; L50-F66 HydrophobicContact CD1-CZ 3.63Å; L50-F66 HydrophobicContact CG-CE1 4.29Å; L50-F66 HydrophobicContact CG-CZ 4.17Å
51	L	97.4	Very high	95.4	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-39.8	172.1	-71.5	178.2	0	0	0	112.1	T49 S54 A55 V63 F66 L67 A71 P73 A84	T49-L51 PolarHBondContact O-N 3.21Å; T49-L51 VanDerWaalsContact O-N 3.13Å; T49-L51 PolarHBondContact OG1-N 3.14Å; L51-S54 PolarHBondContact O-N 3.11Å; L51-A55 WeakPolarHBondContact O-CB 3.28Å; L51-A55 PolarHBondContact O-N 2.86Å; L51-V63 HydrophobicContact CD2-CG1 4.1Å; L51-F66 HydrophobicContact CD2-CB 3.73Å; L51-F66 HydrophobicContact CD2-CD2 4.39Å; L51-F66 HydrophobicContact CG-CB 4.36Å; L51-L67 HydrophobicContact CD1-CD2 4.11Å; L51-L67 HydrophobicContact CD2-CD2 4.26Å; L51-L67 HydrophobicContact CD2-CG 4.31Å; L51-A71 HydrophobicContact CD1-CB 3.62Å; L51-A71 HydrophobicContact CD2-CB 4.22Å; L51-A71 HydrophobicContact CG-CB 3.83Å; L51-P73 HydrophobicContact CD1-CB 3.96Å; L51-A84 HydrophobicContact CB-CB 3.8Å
52	H	97.7	Very high	95.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-51.6	175.5	-65.7	82.6	0	0	0	110.8	W48 T49 S54 A55 A56 V75 F82 A84 Y87	W48-H52 HydrophobicContact CB-CB 4.11Å; W48-H52 HydrophobicContact CD2-CB 3.92Å; W48-H52 HydrophobicContact CE3-CB 3.93Å; W48-H52 HydrophobicContact CG-CB 4.02Å; T49-H52 PolarHBondContact N-ND1 3.28Å; T49-H52 VanDerWaalsContact N-ND1 3.15Å; T49-H52 WeakPolarHBondContact O-CB 3.33Å; T49-H52 PolarHBondContact O-N 3.47Å; T49-H52 PolarHBondContact OG1-ND1 3.21Å; H52-S54 VanDerWaalsContact C-N 3.33Å; H52-S54 PolarHBondContact O-N 3.35Å; H52-A55 PolarHBondContact O-N 3.3Å; H52-A56 WeakPolarHBondContact O-CB 3.28Å; H52-A56 PolarHBondContact O-N 3.48Å; H52-V75 PolarHBondContact CE1-O 3.27Å; H52-V75 PolarHBondContact NE2-O 3.43Å; H52-F82 PolarHBondContact NE2-O 2.92Å; H52-A84 PolarHBondContact NE2-N 3.02Å; H52-Y87 AromaticContact CD2-CD2 3.67Å; H52-Y87 AromaticContact CD2-CE2 3.63Å
53	F	95.9	Very high	95.8	Very high	30 Å²	30	43.7 Å²	43.7	13%	0.132	21%	0.211	C	C	.	.	H	α-helix	trans	-56.8	-46.8	177.3	-73.6	-75.8	0	0	0	112	Q19 V22 D44 W48 T49 A56 R57	Q19-F53 HydrophobicContact CG-CE2 4.46Å; V22-F53 HydrophobicContact CG1-CB 4.31Å; D44-F53 WeakPolarHBondContact OD2-CZ 3.38Å; W48-F53 HydrophobicContact CB-CD2 4.23Å; W48-F53 HydrophobicContact CB-CE2 3.61Å; W48-F53 HydrophobicContact CB-CZ 4Å; W48-F53 HydrophobicContact CD2-CZ 4.41Å; W48-F53 AromaticContact CE3-CD1 3.61Å; W48-F53 HydrophobicContact CE3-CD1 3.61Å; W48-F53 HydrophobicContact CE3-CD2 4.06Å; W48-F53 AromaticContact CE3-CE1 3.57Å; W48-F53 HydrophobicContact CE3-CE1 3.57Å; W48-F53 HydrophobicContact CE3-CE2 4.02Å; W48-F53 AromaticContact CE3-CG 3.86Å; W48-F53 HydrophobicContact CE3-CG 3.86Å; W48-F53 AromaticContact CE3-CZ 3.77Å; W48-F53 HydrophobicContact CE3-CZ 3.77Å; W48-F53 AromaticContact CZ3-CD1 3.84Å; W48-F53 HydrophobicContact CZ3-CD1 3.84Å; W48-F53 HydrophobicContact CZ3-CE1 4Å; W48-F53 HydrophobicContact CZ3-CG 4.34Å; T49-F53 VanDerWaalsContact O-CD2 3.28Å; T49-F53 WeakPolarHBondContact O-CD2 3.06Å; T49-F53 PolarHBondContact O-N 3.46Å; F53-A56 PolarHBondContact O-N 3.3Å; F53-R57 WeakPolarHBondContact O-CB 3.2Å; F53-R57 WeakPolarHBondContact O-CG 3.29Å; F53-R57 PolarHBondContact O-N 3.37Å
54	S	96.8	Very high	96	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-40	-178	-57.5	0	0	0	0	112.3	V22 L50 L51 H52 R57 G58 Q59 V63 F66	V22-S54 VanDerWaalsContact CG1-OG 3.3Å; V22-S54 WeakPolarHBondContact CG1-OG 3.43Å; L50-S54 VanDerWaalsContact O-CB 3.28Å; L50-S54 WeakPolarHBondContact O-CB 3.32Å; L50-S54 PolarHBondContact O-N 2.81Å; L50-S54 PolarHBondContact O-OG 3.35Å; L51-S54 PolarHBondContact O-N 3.11Å; H52-S54 VanDerWaalsContact C-N 3.33Å; H52-S54 PolarHBondContact O-N 3.35Å; S54-R57 PolarHBondContact O-N 3.07Å; S54-G58 PolarHBondContact O-N 3.15Å; S54-Q59 PolarHBondContact O-N 3.1Å; S54-V63 VanDerWaalsContact CB-CG2 3.46Å; S54-F66 VanDerWaalsContact OG-CE2 3.28Å; S54-F66 WeakPolarHBondContact OG-CE2 3.31Å
55	A	97.5	Very high	96.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-43.2	176.6	0	0	0	0	0	112.1	L51 H52 A84 A88 R93 I96	L51-A55 WeakPolarHBondContact O-CB 3.28Å; L51-A55 PolarHBondContact O-N 2.86Å; H52-A55 PolarHBondContact O-N 3.3Å; A55-A84 HydrophobicContact CB-CB 4.2Å; A55-A84 VanDerWaalsContact CB-O 3.24Å; A55-A84 WeakPolarHBondContact CB-O 3.09Å; A55-A88 HydrophobicContact CB-CB 4.21Å; A55-R93 VanDerWaalsContact O-CG 3.3Å; A55-R93 WeakPolarHBondContact O-CG 3.17Å; A55-I96 HydrophobicContact CB-CG2 4.15Å
56	A	96.2	Very high	96.5	Very high	15 Å²	15	38 Å²	38	12%	0.124	17%	0.167	C	C	.	.	H	α-helix	trans	-64.3	-45.7	175.9	0	0	0	0	0	111.8	W48 H52 F53 G58 Y87	W48-A56 HydrophobicContact CH2-CB 4.44Å; W48-A56 HydrophobicContact CZ3-CB 4.43Å; H52-A56 WeakPolarHBondContact O-CB 3.28Å; H52-A56 PolarHBondContact O-N 3.48Å; F53-A56 PolarHBondContact O-N 3.3Å; A56-G58 PolarHBondContact O-N 2.97Å; A56-Y87 HydrophobicContact CB-CD1 4.4Å
57	R	95.3	Very high	96.6	Very high	143 Å²	143	36 Å²	36	54%	0.54	16%	0.157	S	C	.	.	H	α-helix	trans	-79.7	-13.3	-176.7	-68	-174.9	175.4	-120.4	4.5	114.6	F53 S54 Q59	F53-R57 WeakPolarHBondContact O-CB 3.2Å; F53-R57 WeakPolarHBondContact O-CG 3.29Å; F53-R57 PolarHBondContact O-N 3.37Å; S54-R57 PolarHBondContact O-N 3.07Å; R57-Q59 HydrophobicContact CB-CG 3.93Å
58	G	96.4	Very high	96.6	Very high	26 Å²	26	40 Å²	40	27%	0.268	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	25.5	-179.3	0	0	0	0	0	114.1	S54 A56 E60 I96	S54-G58 PolarHBondContact O-N 3.15Å; A56-G58 PolarHBondContact O-N 2.97Å; G58-E60 VanDerWaalsContact C-N 3.33Å; G58-E60 PolarHBondContact O-N 3.44Å; G58-I96 VanDerWaalsContact C-CD1 3.5Å
59	Q	97.1	Very high	96.6	Very high	45 Å²	45	40.9 Å²	40.9	21%	0.21	20%	0.195	C	C	.	.			trans	-85.4	71.4	-176	-59.8	-68.8	6.5	0	0	111.7	V22 A23 S54 R57 R61 C62 V63	V22-Q59 HydrophobicContact CG1-CG 4.43Å; V22-Q59 VanDerWaalsContact O-CG 3.22Å; V22-Q59 WeakPolarHBondContact O-CG 3.37Å; V22-Q59 PolarHBondContact O-NE2 2.58Å; A23-Q59 PolarHBondContact O-NE2 3.11Å; S54-Q59 PolarHBondContact O-N 3.1Å; R57-Q59 HydrophobicContact CB-CG 3.93Å; Q59-R61 VanDerWaalsContact C-N 3.34Å; Q59-R61 PolarHBondContact O-N 2.73Å; Q59-C62 HydrophobicContact CB-CB 4.04Å; Q59-C62 PolarHBondContact O-N 2.96Å; Q59-C62 VanDerWaalsContact O-N 3.15Å; Q59-V63 PolarHBondContact O-N 3.25Å
60	E	96.9	Very high	96.5	Very high	52 Å²	52	42.7 Å²	42.7	24%	0.243	22%	0.215	C	C	.	.	H	α-helix	trans	-54.9	-43.9	-173.5	-173.3	-168.7	138.9	0	0	113.6	G58 C62 V63 R64 R95 I96 L99	G58-E60 VanDerWaalsContact C-N 3.33Å; G58-E60 PolarHBondContact O-N 3.44Å; E60-C62 VanDerWaalsContact C-N 3.35Å; E60-C62 PolarHBondContact O-N 3.4Å; E60-V63 PolarHBondContact O-N 3.47Å; E60-R64 PolarHBondContact O-N 2.95Å; E60-R64 VanDerWaalsContact O-N 3.11Å; E60-R64 IonicContact OE1-NH2 3.8Å; E60-R95 HydrophobicContact CG-CB 4.34Å; E60-R95 VanDerWaalsContact OE2-CB 3.29Å; E60-R95 WeakPolarHBondContact OE2-CB 3.34Å; E60-R95 WeakPolarHBondContact OE2-CD 3.38Å; E60-R95 IonicContact OE2-NH1 3.67Å; E60-I96 HydrophobicContact CB-CG1 4.01Å; E60-I96 HydrophobicContact CG-CG1 4.29Å; E60-L99 HydrophobicContact CG-CD1 3.71Å
61	R	97.3	Very high	96.6	Very high	192 Å²	192	42.4 Å²	42.4	73%	0.725	21%	0.213	S	C	*	.	H	α-helix	trans	-67.1	-37.2	-179.1	-64.6	-177.9	179.2	166.6	-1	112	V27 Q59 R64 V65	V27-R61 HydrophobicContact CG2-CB 3.5Å; Q59-R61 VanDerWaalsContact C-N 3.34Å; Q59-R61 PolarHBondContact O-N 2.73Å; R61-R64 PolarHBondContact O-N 3.34Å; R61-V65 PolarHBondContact O-N 3.42Å; R61-V65 VanDerWaalsContact O-N 3.17Å
62	C	97.1	Very high	96.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-44.4	175.5	-60.3	0	0	0	0	110.7	Q59 E60 R64 V65 F66	Q59-C62 HydrophobicContact CB-CB 4.04Å; Q59-C62 PolarHBondContact O-N 2.96Å; Q59-C62 VanDerWaalsContact O-N 3.15Å; E60-C62 VanDerWaalsContact C-N 3.35Å; E60-C62 PolarHBondContact O-N 3.4Å; C62-R64 VanDerWaalsContact C-N 3.27Å; C62-R64 PolarHBondContact O-N 3.23Å; C62-V65 PolarHBondContact O-N 3.13Å; C62-V65 VanDerWaalsContact O-N 3.08Å; C62-F66 HydrophobicContact CB-CD2 4.23Å; C62-F66 HydrophobicContact CB-CE2 3.7Å; C62-F66 HydrophobicContact CB-CZ 4.39Å; C62-F66 WeakPolarHBondContact O-CD2 3.41Å; C62-F66 VanDerWaalsContact O-CG 3.32Å; C62-F66 WeakPolarHBondContact O-CG 3.36Å; C62-F66 PolarHBondContact O-N 2.86Å
63	V	97.3	Very high	96.5	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-53.5	-46	174.2	173.5	0	0	0	0	111.2	L51 S54 Q59 E60 V65 F66 L67 I96 L99	L51-V63 HydrophobicContact CD2-CG1 4.1Å; S54-V63 VanDerWaalsContact CB-CG2 3.46Å; Q59-V63 PolarHBondContact O-N 3.25Å; E60-V63 PolarHBondContact O-N 3.47Å; V63-V65 VanDerWaalsContact C-N 3.33Å; V63-V65 PolarHBondContact O-N 2.86Å; V63-F66 PolarHBondContact O-N 2.95Å; V63-L67 HydrophobicContact CG1-CD1 3.85Å; V63-L67 HydrophobicContact CG1-CG 4.27Å; V63-L67 WeakPolarHBondContact O-CG 3.46Å; V63-L67 PolarHBondContact O-N 3.24Å; V63-I96 HydrophobicContact CG1-CG2 4.38Å; V63-I96 HydrophobicContact CG2-CD1 4.12Å; V63-I96 HydrophobicContact CG2-CG1 4.13Å; V63-I96 HydrophobicContact CG2-CG2 3.99Å; V63-L99 HydrophobicContact CG1-CD1 4.35Å
64	R	96.7	Very high	96.6	Very high	146 Å²	146	45.1 Å²	45.1	55%	0.551	23%	0.231	S	C	*	.	H	α-helix	trans	-60.1	-42.7	178.5	-167.5	-179	-59.1	-159.4	1.5	112.4	E60 R61 C62 A68 L99	E60-R64 PolarHBondContact O-N 2.95Å; E60-R64 VanDerWaalsContact O-N 3.11Å; E60-R64 IonicContact OE1-NH2 3.8Å; R61-R64 PolarHBondContact O-N 3.34Å; C62-R64 VanDerWaalsContact C-N 3.27Å; C62-R64 PolarHBondContact O-N 3.23Å; R64-A68 WeakPolarHBondContact O-CB 3.34Å; R64-A68 PolarHBondContact O-N 3.39Å; R64-A68 VanDerWaalsContact O-N 3.12Å; R64-L99 HydrophobicContact CB-CD1 4.26Å
65	V	97.1	Very high	96.7	Very high	7 Å²	7	45.4 Å²	45.4	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-66.3	-44.5	176.7	174.6	0	0	0	0	110.8	V27 V30 R31 L34 R61 C62 V63 L67 A68 H69	V27-V65 HydrophobicContact CG1-CG2 3.63Å; V30-V65 HydrophobicContact CG1-CG1 4.27Å; R31-V65 HydrophobicContact CB-CG1 4.39Å; L34-V65 HydrophobicContact CD1-CG1 3.66Å; R61-V65 PolarHBondContact O-N 3.42Å; R61-V65 VanDerWaalsContact O-N 3.17Å; C62-V65 PolarHBondContact O-N 3.13Å; C62-V65 VanDerWaalsContact O-N 3.08Å; V63-V65 VanDerWaalsContact C-N 3.33Å; V63-V65 PolarHBondContact O-N 2.86Å; V65-L67 PolarHBondContact O-N 3.36Å; V65-A68 PolarHBondContact O-N 2.92Å; V65-H69 PolarHBondContact O-CD2 3.1Å; V65-H69 VanDerWaalsContact O-CD2 3.23Å; V65-H69 PolarHBondContact O-N 2.99Å; V65-H69 VanDerWaalsContact O-N 3.1Å
66	F	96.8	Very high	96.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-48.8	178.6	-66.2	-44	0	0	0	112.4	V22 V30 L34 P40 L50 L51 S54 C62 V63 A68 H69 G70 A71	V22-F66 HydrophobicContact CG2-CE2 3.74Å; V22-F66 HydrophobicContact CG2-CZ 3.48Å; V22-F66 VanDerWaalsContact CG2-CZ 3.48Å; V30-F66 HydrophobicContact CG1-CD1 4.24Å; V30-F66 HydrophobicContact CG1-CE1 3.32Å; V30-F66 HydrophobicContact CG1-CE2 4.38Å; V30-F66 HydrophobicContact CG1-CZ 3.4Å; V30-F66 VanDerWaalsContact CG1-CZ 3.4Å; V30-F66 HydrophobicContact CG2-CZ 4.26Å; L34-F66 HydrophobicContact CD1-CD1 3.73Å; L34-F66 HydrophobicContact CD1-CE1 3.89Å; L34-F66 HydrophobicContact CD2-CD1 4.33Å; L34-F66 HydrophobicContact CD2-CE1 4.31Å; L34-F66 HydrophobicContact CG-CE1 4.43Å; P40-F66 HydrophobicContact CB-CD1 4.3Å; L50-F66 HydrophobicContact CB-CD1 4.27Å; L50-F66 HydrophobicContact CB-CD2 4.03Å; L50-F66 HydrophobicContact CB-CE1 3.96Å; L50-F66 HydrophobicContact CB-CE2 3.69Å; L50-F66 HydrophobicContact CB-CG 4.34Å; L50-F66 HydrophobicContact CB-CZ 3.67Å; L50-F66 HydrophobicContact CD1-CD1 4.08Å; L50-F66 HydrophobicContact CD1-CE1 3.37Å; L50-F66 HydrophobicContact CD1-CE2 4.49Å; L50-F66 HydrophobicContact CD1-CZ 3.63Å; L50-F66 HydrophobicContact CG-CE1 4.29Å; L50-F66 HydrophobicContact CG-CZ 4.17Å; L51-F66 HydrophobicContact CD2-CB 3.73Å; L51-F66 HydrophobicContact CD2-CD2 4.39Å; L51-F66 HydrophobicContact CG-CB 4.36Å; S54-F66 VanDerWaalsContact OG-CE2 3.28Å; S54-F66 WeakPolarHBondContact OG-CE2 3.31Å; C62-F66 HydrophobicContact CB-CD2 4.23Å; C62-F66 HydrophobicContact CB-CE2 3.7Å; C62-F66 HydrophobicContact CB-CZ 4.39Å; C62-F66 WeakPolarHBondContact O-CD2 3.41Å; C62-F66 VanDerWaalsContact O-CG 3.32Å; C62-F66 WeakPolarHBondContact O-CG 3.36Å; C62-F66 PolarHBondContact O-N 2.86Å; V63-F66 PolarHBondContact O-N 2.95Å; F66-A68 VanDerWaalsContact C-N 3.32Å; F66-A68 PolarHBondContact O-N 3.35Å; F66-H69 CarbonylContact O-C 3.56Å; F66-H69 PolarHBondContact O-N 3.4Å; F66-G70 PolarHBondContact O-N 3.15Å; F66-A71 HydrophobicContact CB-CB 3.69Å; F66-A71 WeakPolarHBondContact O-CB 3.5Å; F66-A71 PolarHBondContact O-N 3.39Å
67	L	96.1	Very high	96.8	Very high	35 Å²	35	49.2 Å²	49.2	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-42.2	177.3	-66.7	173.6	0	0	0	111.6	L51 V63 V65 H69 G70 P73 L99 M100	L51-L67 HydrophobicContact CD1-CD2 4.11Å; L51-L67 HydrophobicContact CD2-CD2 4.26Å; L51-L67 HydrophobicContact CD2-CG 4.31Å; V63-L67 HydrophobicContact CG1-CD1 3.85Å; V63-L67 HydrophobicContact CG1-CG 4.27Å; V63-L67 WeakPolarHBondContact O-CG 3.46Å; V63-L67 PolarHBondContact O-N 3.24Å; V65-L67 PolarHBondContact O-N 3.36Å; L67-H69 PolarHBondContact O-N 3.21Å; L67-G70 PolarHBondContact O-N 3.15Å; L67-G70 VanDerWaalsContact O-N 3.08Å; L67-P73 HydrophobicContact CD2-CG 4.37Å; L67-L99 HydrophobicContact CD1-CB 4.31Å; L67-M100 HydrophobicContact CD1-CG 4.26Å
68	A	95.3	Very high	96.9	Very high	84 Å²	84	48.2 Å²	48.2	69%	0.694	25%	0.251	S	S	*	.	H	α-helix	trans	-64.5	-21.4	176.9	0	0	0	0	0	114	R64 V65 F66	R64-A68 WeakPolarHBondContact O-CB 3.34Å; R64-A68 PolarHBondContact O-N 3.39Å; R64-A68 VanDerWaalsContact O-N 3.12Å; V65-A68 PolarHBondContact O-N 2.92Å; F66-A68 VanDerWaalsContact C-N 3.32Å; F66-A68 PolarHBondContact O-N 3.35Å
69	H	95.9	Very high	96.9	Very high	71 Å²	71	52.4 Å²	52.4	33%	0.329	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	19.2	175.9	-76.5	-101.3	0	0	0	112.7	L34 P40 V65 F66 L67	L34-H69 HydrophobicContact CD1-CB 4.06Å; P40-H69 WeakPolarHBondContact CG-O 3.45Å; V65-H69 PolarHBondContact O-CD2 3.1Å; V65-H69 VanDerWaalsContact O-CD2 3.23Å; V65-H69 PolarHBondContact O-N 2.99Å; V65-H69 VanDerWaalsContact O-N 3.1Å; F66-H69 CarbonylContact O-C 3.56Å; F66-H69 PolarHBondContact O-N 3.4Å; L67-H69 PolarHBondContact O-N 3.21Å
70	G	94.4	Very high	96.9	Very high	40 Å²	40	51 Å²	51	41%	0.412	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	26.4	173.2	0	0	0	0	0	114.8	N41 F66 L67 D72	N41-G70 PolarHBondContact ND2-O 3.43Å; F66-G70 PolarHBondContact O-N 3.15Å; L67-G70 PolarHBondContact O-N 3.15Å; L67-G70 VanDerWaalsContact O-N 3.08Å; G70-D72 PolarHBondContact O-N 3.04Å
71	A	96.4	Very high	96.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.			trans	-66.5	130.6	170.1	0	0	0	0	0	110.8	P40 N41 L51 F66 P73	P40-A71 HydrophobicContact CB-CB 3.88Å; P40-A71 HydrophobicContact CG-CB 4.33Å; N41-A71 WeakPolarHBondContact OD1-CA 3.36Å; L51-A71 HydrophobicContact CD1-CB 3.62Å; L51-A71 HydrophobicContact CD2-CB 4.22Å; L51-A71 HydrophobicContact CG-CB 3.83Å; F66-A71 HydrophobicContact CB-CB 3.69Å; F66-A71 WeakPolarHBondContact O-CB 3.5Å; F66-A71 PolarHBondContact O-N 3.39Å; A71-P73 WeakPolarHBondContact O-CD 3.26Å
72	D	96.9	Very high	97	Very high	43 Å²	43	41.1 Å²	41.1	23%	0.23	23%	0.226	C	C	.	.			trans	-90.8	110.1	-178.4	179.1	0.9	0	0	0	110.5	N41 G70 T74 V75	N41-D72 PolarHBondContact OD1-N 3.28Å; G70-D72 PolarHBondContact O-N 3.04Å; D72-T74 VanDerWaalsContact CG-OG1 3.22Å; D72-T74 PolarHBondContact O-N 3.19Å; D72-T74 WeakPolarHBondContact OD1-CA 3.45Å; D72-T74 WeakPolarHBondContact OD1-CB 3.33Å; D72-T74 VanDerWaalsContact OD1-CG2 3.27Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.48Å; D72-T74 PolarHBondContact OD1-N 3.22Å; D72-T74 PolarHBondContact OD1-OG1 2.84Å; D72-T74 PolarHBondContact OD2-OG1 3.12Å; D72-T74 VanDerWaalsContact OD2-OG1 3.12Å; D72-V75 HydrophobicContact CB-CG2 4.11Å; D72-V75 WeakPolarHBondContact O-CG2 3.43Å
73	P	97.3	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-4.9	178.8	34.7	-36.5	0	0	0	113.4	L51 L67 A71 V75 M100 Y105 I109	L51-P73 HydrophobicContact CD1-CB 3.96Å; L67-P73 HydrophobicContact CD2-CG 4.37Å; A71-P73 WeakPolarHBondContact O-CD 3.26Å; P73-V75 VanDerWaalsContact C-N 3.31Å; P73-M100 HydrophobicContact CB-CG 4.36Å; P73-M100 HydrophobicContact CB-SD 4.02Å; P73-Y105 VanDerWaalsContact CD-CG 3.48Å; P73-Y105 VanDerWaalsContact CG-CB 3.44Å; P73-Y105 HydrophobicContact CG-CD1 4.16Å; P73-Y105 HydrophobicContact CG-CD2 3.49Å; P73-Y105 VanDerWaalsContact CG-CD2 3.49Å; P73-Y105 HydrophobicContact CG-CE2 4.25Å; P73-Y105 HydrophobicContact CG-CG 3.42Å; P73-Y105 VanDerWaalsContact CG-CG 3.42Å; P73-I109 HydrophobicContact CB-CD1 4.45Å; P73-I109 HydrophobicContact CB-CG2 4.29Å; P73-I109 HydrophobicContact CG-CD1 4.47Å; P73-I109 HydrophobicContact CG-CG2 4.24Å
74	T	98.1	Very high	97.1	Very high	47 Å²	47	41.1 Å²	41.1	29%	0.288	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.8	179.4	76.1	0	0	0	0	112.9	D72 K76 Y105 D108 I109	D72-T74 VanDerWaalsContact CG-OG1 3.22Å; D72-T74 PolarHBondContact O-N 3.19Å; D72-T74 WeakPolarHBondContact OD1-CA 3.45Å; D72-T74 WeakPolarHBondContact OD1-CB 3.33Å; D72-T74 VanDerWaalsContact OD1-CG2 3.27Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.48Å; D72-T74 PolarHBondContact OD1-N 3.22Å; D72-T74 PolarHBondContact OD1-OG1 2.84Å; D72-T74 PolarHBondContact OD2-OG1 3.12Å; D72-T74 VanDerWaalsContact OD2-OG1 3.12Å; T74-K76 PolarHBondContact O-N 3.41Å; T74-Y105 HydrophobicContact CG2-CD1 3.71Å; T74-Y105 HydrophobicContact CG2-CE1 4.47Å; T74-Y105 HydrophobicContact CG2-CG 4.39Å; T74-D108 HydrophobicContact CG2-CB 3.59Å; T74-I109 HydrophobicContact CG2-CG2 3.94Å
75	V	98	Very high	97.2	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.036	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-56.8	131.7	178.3	178	0	0	0	0	110.4	R43 T49 H52 D72 P73 T83	R43-V75 VanDerWaalsContact CZ-CG1 3.41Å; T49-V75 HydrophobicContact CG2-CB 3.98Å; T49-V75 HydrophobicContact CG2-CG1 3.62Å; T49-V75 HydrophobicContact CG2-CG2 4.21Å; H52-V75 PolarHBondContact CE1-O 3.27Å; H52-V75 PolarHBondContact NE2-O 3.43Å; D72-V75 HydrophobicContact CB-CG2 4.11Å; D72-V75 WeakPolarHBondContact O-CG2 3.43Å; P73-V75 VanDerWaalsContact C-N 3.31Å; V75-T83 WeakPolarHBondContact O-CA 3.22Å
76	K	98.1	Very high	97.3	Very high	88 Å²	88	33.8 Å²	33.8	38%	0.383	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-102.2	143.7	173.5	-64.9	-179	-177.7	-174.8	0	110.5	T74 G81 F82 T83 K113	T74-K76 PolarHBondContact O-N 3.41Å; K76-G81 WeakPolarHBondContact CD-O 3.26Å; K76-G81 WeakPolarHBondContact CG-O 3.29Å; K76-F82 WeakPolarHBondContact CA-O 3.21Å; K76-T83 HydrophobicContact CG-CG2 3.78Å; K76-K113 WeakPolarHBondContact CE-O 3.34Å; K76-K113 PolarHBondContact NZ-O 2.85Å
77	D	97.9	Very high	97.4	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.037	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-65.8	162.7	167	84.7	-14.1	0	0	0	111.9	G80 G81 F82 Y87	D77-G80 PolarHBondContact OD1-N 3.42Å; D77-G81 WeakPolarHBondContact O-CA 3.18Å; D77-G81 PolarHBondContact O-N 3.22Å; D77-G81 WeakPolarHBondContact OD1-CA 3.34Å; D77-G81 PolarHBondContact OD1-N 2.92Å; D77-F82 PolarHBondContact N-O 2.94Å; D77-F82 PolarHBondContact OD1-N 3.4Å; D77-Y87 PolarHBondContact OD2-OH 3.39Å
78	L	98	Very high	97.5	Very high	122 Å²	122	33.2 Å²	33.2	64%	0.639	19%	0.193	S	C	*	.	S	Bend	trans	-85.7	-15.1	-179.2	-64.1	176.1	0	0	0	112.9	N46	N46-L78 PolarHBondContact O-N 3.37Å
79	I	96.3	Very high	97.7	Very high	115 Å²	115	29.2 Å²	29.2	59%	0.59	16%	0.16	S	C	*	.	S	Bend	trans	-84.1	-64	-175.7	-55.9	176.3	0	0	0	110.1	N46	N46-I79 HydrophobicContact CB-CD1 3.9Å; N46-I79 HydrophobicContact CB-CG1 4.29Å
80	G	96.4	Very high	97.8	Very high	16 Å²	16	27.2 Å²	27.2	17%	0.165	15%	0.151	C	C	.	.	S	Bend	trans	-104.2	-8.7	-174	0	0	0	0	0	114.1	D77 F82 S114 N115	D77-G80 PolarHBondContact OD1-N 3.42Å; G80-F82 VanDerWaalsContact C-N 3.25Å; G80-S114 VanDerWaalsContact O-CB 3.3Å; G80-S114 WeakPolarHBondContact O-CB 3.4Å; G80-N115 WeakPolarHBondContact O-CB 3.47Å; G80-N115 PolarHBondContact O-N 3.09Å
81	G	98.3	Very high	98	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.01	15%	0.148	C	C	.	.			trans	69.9	23.7	-166.9	0	0	0	0	0	112.5	K76 D77 S114 N115	K76-G81 WeakPolarHBondContact CD-O 3.26Å; K76-G81 WeakPolarHBondContact CG-O 3.29Å; D77-G81 WeakPolarHBondContact O-CA 3.18Å; D77-G81 PolarHBondContact O-N 3.22Å; D77-G81 WeakPolarHBondContact OD1-CA 3.34Å; D77-G81 PolarHBondContact OD1-N 2.92Å; G81-S114 WeakPolarHBondContact O-CA 3.47Å; G81-N115 WeakPolarHBondContact CA-OD1 3.02Å; G81-N115 PolarHBondContact N-ND2 3.12Å
82	F	98.6	Very high	98	Very high	34 Å²	34	30.2 Å²	30.2	15%	0.149	16%	0.162	C	C	.	.			trans	-83.4	134.5	-177.6	-75.4	-15	0	0	0	111.5	H52 K76 D77 G80 H86 Y87 M90 V123	H52-F82 PolarHBondContact NE2-O 2.92Å; K76-F82 WeakPolarHBondContact CA-O 3.21Å; D77-F82 PolarHBondContact N-O 2.94Å; D77-F82 PolarHBondContact OD1-N 3.4Å; G80-F82 VanDerWaalsContact C-N 3.25Å; F82-H86 HydrophobicContact CB-CB 3.83Å; F82-H86 HydrophobicContact CD1-CB 4.01Å; F82-H86 AromaticContact CD1-CD2 3.68Å; F82-H86 AromaticContact CD1-CG 3.88Å; F82-H86 HydrophobicContact CD2-CB 4.49Å; F82-H86 HydrophobicContact CG-CB 3.87Å; F82-Y87 HydrophobicContact CB-CD2 4.21Å; F82-Y87 HydrophobicContact CB-CE2 3.6Å; F82-Y87 HydrophobicContact CD2-CE2 4.4Å; F82-M90 HydrophobicContact CD2-CE 4.47Å; F82-M90 HydrophobicContact CE2-CE 3.96Å; F82-V123 HydrophobicContact CE1-CG2 4.43Å; F82-V123 HydrophobicContact CZ-CG2 4.45Å
83	T	98.6	Very high	98.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-84.8	168.8	168.7	68.3	0	0	0	0	111.4	V75 K76 L85 H86 Y87 A112	V75-T83 WeakPolarHBondContact O-CA 3.22Å; K76-T83 HydrophobicContact CG-CG2 3.78Å; T83-L85 PolarHBondContact O-N 2.91Å; T83-L85 VanDerWaalsContact O-N 3.13Å; T83-L85 PolarHBondContact OG1-N 3.28Å; T83-H86 PolarHBondContact N-ND1 2.87Å; T83-H86 WeakPolarHBondContact O-CB 3.47Å; T83-H86 PolarHBondContact O-N 3.29Å; T83-H86 PolarHBondContact OG1-ND1 2.97Å; T83-Y87 WeakPolarHBondContact O-CD2 3.22Å; T83-Y87 PolarHBondContact O-N 3.3Å; T83-A112 HydrophobicContact CG2-CB 4.13Å
84	A	98.3	Very high	98.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-54.6	-32.8	173.1	0	0	0	0	0	113.1	L51 H52 A55 H86 Y87 A88 M100	L51-A84 HydrophobicContact CB-CB 3.8Å; H52-A84 PolarHBondContact NE2-N 3.02Å; A55-A84 HydrophobicContact CB-CB 4.2Å; A55-A84 VanDerWaalsContact CB-O 3.24Å; A55-A84 WeakPolarHBondContact CB-O 3.09Å; A84-H86 VanDerWaalsContact C-N 3.35Å; A84-H86 PolarHBondContact O-N 2.93Å; A84-Y87 PolarHBondContact O-N 3.12Å; A84-A88 PolarHBondContact O-N 3.03Å; A84-M100 HydrophobicContact CB-CE 4.39Å; A84-M100 HydrophobicContact CB-SD 3.86Å
85	L	98.8	Very high	98	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-32.3	176.5	-171.6	63.4	0	0	0	112.7	T83 A88 A89 A97 M100 L101 I109 P120 F132 L136	T83-L85 PolarHBondContact O-N 2.91Å; T83-L85 VanDerWaalsContact O-N 3.13Å; T83-L85 PolarHBondContact OG1-N 3.28Å; L85-A88 PolarHBondContact O-N 3.07Å; L85-A89 WeakPolarHBondContact O-CB 3.47Å; L85-A89 PolarHBondContact O-N 2.98Å; L85-A97 HydrophobicContact CD1-CB 3.54Å; L85-M100 HydrophobicContact CB-CE 4.22Å; L85-M100 HydrophobicContact CD1-CE 3.97Å; L85-L101 HydrophobicContact CD1-CG 4.47Å; L85-L101 HydrophobicContact CD2-CD2 3.88Å; L85-L101 HydrophobicContact CD2-CG 4.41Å; L85-I109 HydrophobicContact CD2-CB 4.2Å; L85-I109 HydrophobicContact CD2-CD1 4.1Å; L85-I109 HydrophobicContact CD2-CG1 3.89Å; L85-P120 HydrophobicContact CB-CG 4.39Å; L85-P120 HydrophobicContact CD2-CB 4.22Å; L85-P120 HydrophobicContact CD2-CG 3.86Å; L85-P120 HydrophobicContact CG-CB 4.08Å; L85-P120 HydrophobicContact CG-CG 3.97Å; L85-F132 HydrophobicContact CD1-CE1 4.42Å; L85-F132 HydrophobicContact CD1-CZ 3.86Å; L85-L136 HydrophobicContact CD2-CD2 4.4Å
86	H	98.8	Very high	98	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-43.4	173	-68.9	80.9	0	0	0	111.4	F82 T83 A84 A89 M90 A112 W118	F82-H86 HydrophobicContact CB-CB 3.83Å; F82-H86 HydrophobicContact CD1-CB 4.01Å; F82-H86 AromaticContact CD1-CD2 3.68Å; F82-H86 AromaticContact CD1-CG 3.88Å; F82-H86 HydrophobicContact CD2-CB 4.49Å; F82-H86 HydrophobicContact CG-CB 3.87Å; T83-H86 PolarHBondContact N-ND1 2.87Å; T83-H86 WeakPolarHBondContact O-CB 3.47Å; T83-H86 PolarHBondContact O-N 3.29Å; T83-H86 PolarHBondContact OG1-ND1 2.97Å; A84-H86 VanDerWaalsContact C-N 3.35Å; A84-H86 PolarHBondContact O-N 2.93Å; H86-A89 WeakPolarHBondContact O-CB 3.37Å; H86-A89 PolarHBondContact O-N 2.88Å; H86-M90 PolarHBondContact O-N 3.33Å; H86-A112 PolarHBondContact CE1-O 3.01Å; H86-A112 PolarHBondContact NE2-O 3.03Å; H86-A112 VanDerWaalsContact NE2-O 3.16Å; H86-W118 PolarHBondContact NE2-O 3.31Å
87	Y	98.6	Very high	98	Very high	22 Å²	22	36.2 Å²	36.2	9%	0.086	18%	0.18	C	C	.	.	H	α-helix	trans	-66.1	-40.1	175.6	-73.2	-78	0	0	0	112.1	W48 H52 A56 D77 F82 T83 A84 A89 M90 H91	W48-Y87 AromaticContact CE2-CZ 3.76Å; W48-Y87 HydrophobicContact CH2-CD1 4.35Å; W48-Y87 AromaticContact CH2-CE1 3.91Å; W48-Y87 HydrophobicContact CH2-CE1 3.91Å; W48-Y87 HydrophobicContact CZ2-CD1 4.28Å; W48-Y87 AromaticContact CZ2-CE1 3.44Å; W48-Y87 HydrophobicContact CZ2-CE1 3.44Å; W48-Y87 VanDerWaalsContact CZ2-CE1 3.44Å; W48-Y87 HydrophobicContact CZ2-CE2 4.2Å; W48-Y87 AromaticContact CZ2-CZ 3.38Å; W48-Y87 VanDerWaalsContact CZ2-OH 3.3Å; W48-Y87 WeakPolarHBondContact CZ2-OH 3.22Å; W48-Y87 AromaticContact NE1-CZ 3.89Å; W48-Y87 PolarHBondContact NE1-OH 3.5Å; H52-Y87 AromaticContact CD2-CD2 3.67Å; H52-Y87 AromaticContact CD2-CE2 3.63Å; A56-Y87 HydrophobicContact CB-CD1 4.4Å; D77-Y87 PolarHBondContact OD2-OH 3.39Å; F82-Y87 HydrophobicContact CB-CD2 4.21Å; F82-Y87 HydrophobicContact CB-CE2 3.6Å; F82-Y87 HydrophobicContact CD2-CE2 4.4Å; T83-Y87 WeakPolarHBondContact O-CD2 3.22Å; T83-Y87 PolarHBondContact O-N 3.3Å; A84-Y87 PolarHBondContact O-N 3.12Å; Y87-A89 VanDerWaalsContact C-N 3.26Å; Y87-A89 PolarHBondContact O-N 3.41Å; Y87-M90 PolarHBondContact O-N 3.49Å; Y87-H91 PolarHBondContact O-CD2 2.86Å; Y87-H91 VanDerWaalsContact O-CD2 3.27Å; Y87-H91 PolarHBondContact O-N 2.95Å; Y87-H91 VanDerWaalsContact O-N 3.11Å
88	A	98.6	Very high	98	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.5	-41.6	171.6	0	0	0	0	0	111.1	A55 A84 L85 H91 G92 R93 I96 A97 M100 F132	A55-A88 HydrophobicContact CB-CB 4.21Å; A84-A88 PolarHBondContact O-N 3.03Å; L85-A88 PolarHBondContact O-N 3.07Å; A88-H91 PolarHBondContact O-N 3.05Å; A88-G92 CarbonylContact O-C 3.59Å; A88-G92 WeakPolarHBondContact O-CA 3.24Å; A88-G92 PolarHBondContact O-N 3.32Å; A88-R93 HydrophobicContact CB-CB 4.2Å; A88-R93 PolarHBondContact O-N 3.44Å; A88-I96 HydrophobicContact CB-CG2 4.12Å; A88-A97 HydrophobicContact CB-CB 4.44Å; A88-M100 HydrophobicContact CB-CE 4.02Å; A88-F132 HydrophobicContact CB-CE2 3.78Å; A88-F132 HydrophobicContact CB-CZ 3.9Å; A88-F132 WeakPolarHBondContact O-CE2 3.29Å
89	A	98.8	Very high	98	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-43.7	176.6	0	0	0	0	0	112.2	L85 H86 Y87 H91 G92 P120 V123 A124 R129 F132	L85-A89 WeakPolarHBondContact O-CB 3.47Å; L85-A89 PolarHBondContact O-N 2.98Å; H86-A89 WeakPolarHBondContact O-CB 3.37Å; H86-A89 PolarHBondContact O-N 2.88Å; Y87-A89 VanDerWaalsContact C-N 3.26Å; Y87-A89 PolarHBondContact O-N 3.41Å; A89-H91 VanDerWaalsContact C-N 3.31Å; A89-H91 PolarHBondContact O-N 2.96Å; A89-G92 PolarHBondContact O-N 3.49Å; A89-P120 HydrophobicContact CB-CB 4.29Å; A89-P120 WeakPolarHBondContact CB-O 3.42Å; A89-V123 HydrophobicContact CB-CB 4.1Å; A89-V123 HydrophobicContact CB-CG1 4.07Å; A89-A124 HydrophobicContact CB-CB 4.18Å; A89-R129 WeakPolarHBondContact O-CG 3.48Å; A89-F132 VanDerWaalsContact CA-CE1 3.47Å; A89-F132 HydrophobicContact CB-CD1 3.84Å; A89-F132 HydrophobicContact CB-CE1 3.38Å; A89-F132 HydrophobicContact CB-CE2 4.42Å; A89-F132 HydrophobicContact CB-CZ 3.69Å
90	M	98.6	Very high	98.1	Very high	30 Å²	30	30.8 Å²	30.8	15%	0.148	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-42.2	178	-178.3	179.1	-63.7	0	0	112	F82 H86 Y87 V123 Y127 R129	F82-M90 HydrophobicContact CD2-CE 4.47Å; F82-M90 HydrophobicContact CE2-CE 3.96Å; H86-M90 PolarHBondContact O-N 3.33Å; Y87-M90 PolarHBondContact O-N 3.49Å; M90-V123 HydrophobicContact CB-CG1 3.71Å; M90-Y127 HydrophobicContact CB-CD2 4.29Å; M90-Y127 HydrophobicContact CB-CE2 4.29Å; M90-Y127 HydrophobicContact CE-CE2 4Å; M90-Y127 HydrophobicContact CG-CD1 4.45Å; M90-Y127 HydrophobicContact CG-CD2 3.88Å; M90-Y127 HydrophobicContact CG-CE1 4.19Å; M90-Y127 HydrophobicContact CG-CE2 3.62Å; M90-Y127 HydrophobicContact CG-CG 4.31Å; M90-Y127 HydrophobicContact SD-CE2 4.35Å; M90-R129 PolarHBondContact O-NE 3.4Å; M90-R129 PolarHBondContact O-NH2 2.88Å
91	H	98.2	Very high	98.2	Very high	73 Å²	73	30 Å²	30	34%	0.338	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	3.7	-177.2	-63.5	-73	0	0	0	114.1	Y87 A88 A89 R93	Y87-H91 PolarHBondContact O-CD2 2.86Å; Y87-H91 VanDerWaalsContact O-CD2 3.27Å; Y87-H91 PolarHBondContact O-N 2.95Å; Y87-H91 VanDerWaalsContact O-N 3.11Å; A88-H91 PolarHBondContact O-N 3.05Å; A89-H91 VanDerWaalsContact C-N 3.31Å; A89-H91 PolarHBondContact O-N 2.96Å; H91-R93 VanDerWaalsContact C-N 3.34Å; H91-R93 HydrophobicContact CB-CG 3.97Å; H91-R93 PolarHBondContact O-N 3.38Å
92	G	97.9	Very high	98.1	Very high	29 Å²	29	35.7 Å²	35.7	30%	0.299	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	30.6	178.2	0	0	0	0	0	114.3	A88 A89 A94	A88-G92 CarbonylContact O-C 3.59Å; A88-G92 WeakPolarHBondContact O-CA 3.24Å; A88-G92 PolarHBondContact O-N 3.32Å; A89-G92 PolarHBondContact O-N 3.49Å; G92-A94 VanDerWaalsContact C-N 3.26Å; G92-A94 PolarHBondContact O-N 3.49Å
93	R	98.1	Very high	97.9	Very high	98 Å²	98	35 Å²	35	37%	0.37	16%	0.163	S	C	.	.			trans	-80.7	66.9	-177.2	-52	-52.8	-170.7	177.8	0.7	112	A55 A88 H91 R95 I96 A97	A55-R93 VanDerWaalsContact O-CG 3.3Å; A55-R93 WeakPolarHBondContact O-CG 3.17Å; A88-R93 HydrophobicContact CB-CB 4.2Å; A88-R93 PolarHBondContact O-N 3.44Å; H91-R93 VanDerWaalsContact C-N 3.34Å; H91-R93 HydrophobicContact CB-CG 3.97Å; H91-R93 PolarHBondContact O-N 3.38Å; R93-R95 VanDerWaalsContact C-N 3.29Å; R93-R95 PolarHBondContact O-N 3.45Å; R93-I96 HydrophobicContact CB-CB 4.02Å; R93-I96 HydrophobicContact CB-CD1 4.13Å; R93-I96 HydrophobicContact CB-CG1 4.43Å; R93-I96 HydrophobicContact CG-CD1 4.46Å; R93-I96 PolarHBondContact O-N 2.99Å; R93-I96 VanDerWaalsContact O-N 3.12Å; R93-A97 PolarHBondContact O-N 2.96Å
94	A	96.9	Very high	97.8	Very high	28 Å²	28	42 Å²	42	23%	0.231	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-36.4	-173.1	0	0	0	0	0	113.7	G92 A97 R98 F132 L135	G92-A94 VanDerWaalsContact C-N 3.26Å; G92-A94 PolarHBondContact O-N 3.49Å; A94-A97 PolarHBondContact O-N 3.26Å; A94-R98 WeakPolarHBondContact O-CB 3.41Å; A94-R98 PolarHBondContact O-N 2.85Å; A94-F132 HydrophobicContact CB-CD2 4.46Å; A94-L135 HydrophobicContact CB-CD2 4.18Å; A94-L135 WeakPolarHBondContact O-CD2 3.3Å
95	R	96.9	Very high	97.7	Very high	182 Å²	182	44.6 Å²	44.6	69%	0.687	21%	0.206	S	C	*	.	H	α-helix	trans	-66.1	-41	177.4	-64.2	-175	-177.4	176.5	-0.5	112.8	E60 R93 R98 L99	E60-R95 HydrophobicContact CG-CB 4.34Å; E60-R95 VanDerWaalsContact OE2-CB 3.29Å; E60-R95 WeakPolarHBondContact OE2-CB 3.34Å; E60-R95 WeakPolarHBondContact OE2-CD 3.38Å; E60-R95 IonicContact OE2-NH1 3.67Å; R93-R95 VanDerWaalsContact C-N 3.29Å; R93-R95 PolarHBondContact O-N 3.45Å; R95-R98 PolarHBondContact O-N 2.93Å; R95-L99 PolarHBondContact O-N 3.33Å; R95-L99 VanDerWaalsContact O-N 3.14Å
96	I	97.9	Very high	97.6	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-43.3	175.7	-75.9	175.7	0	0	0	110.9	A55 G58 E60 V63 A88 R93 R98 L99 M100	A55-I96 HydrophobicContact CB-CG2 4.15Å; G58-I96 VanDerWaalsContact C-CD1 3.5Å; E60-I96 HydrophobicContact CB-CG1 4.01Å; E60-I96 HydrophobicContact CG-CG1 4.29Å; V63-I96 HydrophobicContact CG1-CG2 4.38Å; V63-I96 HydrophobicContact CG2-CD1 4.12Å; V63-I96 HydrophobicContact CG2-CG1 4.13Å; V63-I96 HydrophobicContact CG2-CG2 3.99Å; A88-I96 HydrophobicContact CB-CG2 4.12Å; R93-I96 HydrophobicContact CB-CB 4.02Å; R93-I96 HydrophobicContact CB-CD1 4.13Å; R93-I96 HydrophobicContact CB-CG1 4.43Å; R93-I96 HydrophobicContact CG-CD1 4.46Å; R93-I96 PolarHBondContact O-N 2.99Å; R93-I96 VanDerWaalsContact O-N 3.12Å; I96-R98 VanDerWaalsContact C-N 3.31Å; I96-R98 PolarHBondContact O-N 3.28Å; I96-L99 PolarHBondContact O-N 3.16Å; I96-M100 HydrophobicContact CG2-CE 3.58Å; I96-M100 PolarHBondContact O-N 3.03Å; I96-M100 VanDerWaalsContact O-N 3.14Å
97	A	98.1	Very high	97.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-40.4	175.6	0	0	0	0	0	112.4	L85 A88 R93 A94 L99 M100 L101 F132 L135	L85-A97 HydrophobicContact CD1-CB 3.54Å; A88-A97 HydrophobicContact CB-CB 4.44Å; R93-A97 PolarHBondContact O-N 2.96Å; A94-A97 PolarHBondContact O-N 3.26Å; A97-L99 PolarHBondContact O-N 3.11Å; A97-M100 PolarHBondContact O-N 2.88Å; A97-L101 WeakPolarHBondContact O-CB 3.3Å; A97-L101 VanDerWaalsContact O-CG 3.22Å; A97-L101 WeakPolarHBondContact O-CG 3.35Å; A97-L101 PolarHBondContact O-N 2.96Å; A97-F132 HydrophobicContact CB-CD2 4.24Å; A97-F132 HydrophobicContact CB-CE1 4.22Å; A97-F132 HydrophobicContact CB-CE2 3.27Å; A97-F132 HydrophobicContact CB-CZ 3.27Å; A97-L135 HydrophobicContact CB-CD2 3.59Å
98	R	98.3	Very high	97.5	Very high	95 Å²	95	56.2 Å²	56.2	36%	0.358	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-46.9	174.8	-175.8	176.5	-62.3	-76.6	0.8	111.5	A94 R95 I96 M100 L101 E102 L135 E138 F139	A94-R98 WeakPolarHBondContact O-CB 3.41Å; A94-R98 PolarHBondContact O-N 2.85Å; R95-R98 PolarHBondContact O-N 2.93Å; I96-R98 VanDerWaalsContact C-N 3.31Å; I96-R98 PolarHBondContact O-N 3.28Å; R98-M100 VanDerWaalsContact C-N 3.31Å; R98-M100 PolarHBondContact O-N 3.2Å; R98-L101 PolarHBondContact O-N 3.43Å; R98-E102 WeakPolarHBondContact CD-OE1 3.28Å; R98-E102 VanDerWaalsContact CG-CD 3.44Å; R98-E102 HydrophobicContact CG-CG 4.2Å; R98-E102 WeakPolarHBondContact CG-OE1 3.34Å; R98-E102 IonicContact NH1-OE1 3.31Å; R98-E102 WeakPolarHBondContact O-CB 3.42Å; R98-E102 VanDerWaalsContact O-CG 3.32Å; R98-E102 WeakPolarHBondContact O-CG 3.39Å; R98-E102 PolarHBondContact O-N 3.13Å; R98-L135 HydrophobicContact CB-CD1 4.38Å; R98-L135 HydrophobicContact CB-CD2 4.45Å; R98-L135 VanDerWaalsContact CZ-CD1 3.5Å; R98-E138 IonicContact NH2-OE2 3.64Å; R98-F139 HydrophobicContact CG-CE2 4.44Å
99	L	97.7	Very high	97.5	Very high	33 Å²	33	56.2 Å²	56.2	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-56.7	-43.6	175.8	-68.1	174	0	0	0	112.4	E60 V63 R64 L67 R95 I96 A97	E60-L99 HydrophobicContact CG-CD1 3.71Å; V63-L99 HydrophobicContact CG1-CD1 4.35Å; R64-L99 HydrophobicContact CB-CD1 4.26Å; L67-L99 HydrophobicContact CD1-CB 4.31Å; R95-L99 PolarHBondContact O-N 3.33Å; R95-L99 VanDerWaalsContact O-N 3.14Å; I96-L99 PolarHBondContact O-N 3.16Å; A97-L99 PolarHBondContact O-N 3.11Å
100	M	97.8	Very high	97.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-70.3	-39.5	177.6	-72.3	-172.6	-79.6	0	0	112.4	L67 P73 A84 L85 A88 I96 A97 R98 E102 S103 I109	L67-M100 HydrophobicContact CD1-CG 4.26Å; P73-M100 HydrophobicContact CB-CG 4.36Å; P73-M100 HydrophobicContact CB-SD 4.02Å; A84-M100 HydrophobicContact CB-CE 4.39Å; A84-M100 HydrophobicContact CB-SD 3.86Å; L85-M100 HydrophobicContact CB-CE 4.22Å; L85-M100 HydrophobicContact CD1-CE 3.97Å; A88-M100 HydrophobicContact CB-CE 4.02Å; I96-M100 HydrophobicContact CG2-CE 3.58Å; I96-M100 PolarHBondContact O-N 3.03Å; I96-M100 VanDerWaalsContact O-N 3.14Å; A97-M100 PolarHBondContact O-N 2.88Å; R98-M100 VanDerWaalsContact C-N 3.31Å; R98-M100 PolarHBondContact O-N 3.2Å; M100-E102 VanDerWaalsContact C-N 3.33Å; M100-E102 PolarHBondContact O-N 3.37Å; M100-S103 WeakPolarHBondContact O-CB 3.46Å; M100-S103 PolarHBondContact O-N 3.36Å; M100-S103 PolarHBondContact O-OG 3.26Å; M100-I109 HydrophobicContact CB-CD1 3.72Å
101	L	98.1	Very high	97.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-76.2	-18.8	-178.2	-69.1	170.2	0	0	0	113.6	L85 A97 R98 S103 R106 I109 I110 L135 L136 F139	L85-L101 HydrophobicContact CD1-CG 4.47Å; L85-L101 HydrophobicContact CD2-CD2 3.88Å; L85-L101 HydrophobicContact CD2-CG 4.41Å; A97-L101 WeakPolarHBondContact O-CB 3.3Å; A97-L101 VanDerWaalsContact O-CG 3.22Å; A97-L101 WeakPolarHBondContact O-CG 3.35Å; A97-L101 PolarHBondContact O-N 2.96Å; R98-L101 PolarHBondContact O-N 3.43Å; L101-S103 VanDerWaalsContact C-N 3.33Å; L101-R106 HydrophobicContact CD2-CG 4.46Å; L101-R106 WeakPolarHBondContact O-CB 3.28Å; L101-R106 WeakPolarHBondContact O-CD 3.44Å; L101-R106 WeakPolarHBondContact O-CG 3.42Å; L101-I109 HydrophobicContact CD2-CD1 4.44Å; L101-I109 HydrophobicContact CD2-CG1 4.32Å; L101-I110 HydrophobicContact CD2-CB 3.91Å; L101-I110 HydrophobicContact CD2-CD1 4.11Å; L101-I110 HydrophobicContact CD2-CG1 4Å; L101-L135 HydrophobicContact CD1-CD2 4.4Å; L101-L135 HydrophobicContact CD1-CG 4.35Å; L101-L136 HydrophobicContact CD1-CD2 4.17Å; L101-F139 HydrophobicContact CB-CD1 4.09Å; L101-F139 HydrophobicContact CB-CD2 4.14Å; L101-F139 HydrophobicContact CB-CE1 4.07Å; L101-F139 HydrophobicContact CB-CE2 4.17Å; L101-F139 HydrophobicContact CB-CG 4.1Å; L101-F139 HydrophobicContact CB-CZ 4.12Å; L101-F139 HydrophobicContact CD1-CB 4.17Å; L101-F139 HydrophobicContact CD1-CD2 3.79Å; L101-F139 HydrophobicContact CD1-CE2 4.38Å; L101-F139 HydrophobicContact CD1-CG 4.03Å
102	E	96.9	Very high	97.5	Very high	120 Å²	120	54.1 Å²	54.1	56%	0.561	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.6	172.2	-71.8	170.6	178.3	0	0	112.7	R98 M100 F139	R98-E102 WeakPolarHBondContact CD-OE1 3.28Å; R98-E102 VanDerWaalsContact CG-CD 3.44Å; R98-E102 HydrophobicContact CG-CG 4.2Å; R98-E102 WeakPolarHBondContact CG-OE1 3.34Å; R98-E102 IonicContact NH1-OE1 3.31Å; R98-E102 WeakPolarHBondContact O-CB 3.42Å; R98-E102 VanDerWaalsContact O-CG 3.32Å; R98-E102 WeakPolarHBondContact O-CG 3.39Å; R98-E102 PolarHBondContact O-N 3.13Å; M100-E102 VanDerWaalsContact C-N 3.33Å; M100-E102 PolarHBondContact O-N 3.37Å; E102-F139 HydrophobicContact CG-CE1 4.27Å; E102-F139 HydrophobicContact CG-CZ 3.8Å
103	S	95.1	Very high	97.5	Very high	21 Å²	21	56.9 Å²	56.9	15%	0.147	27%	0.269	C	S	.	.	S	Bend	trans	-82.2	168.6	174	77.2	0	0	0	0	112.7	M100 L101 Y105 R106	M100-S103 WeakPolarHBondContact O-CB 3.46Å; M100-S103 PolarHBondContact O-N 3.36Å; M100-S103 PolarHBondContact O-OG 3.26Å; L101-S103 VanDerWaalsContact C-N 3.33Å; S103-Y105 PolarHBondContact O-N 3.15Å; S103-Y105 PolarHBondContact OG-N 2.96Å; S103-R106 WeakPolarHBondContact O-CB 3.26Å; S103-R106 PolarHBondContact O-N 3.01Å
104	E	95.1	Very high	97.6	Very high	147 Å²	147	52.7 Å²	52.7	69%	0.687	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-24	174.4	61.9	-87	-158.2	0	0	113.7	R106	E104-R106 PolarHBondContact O-N 2.93Å
105	Y	96.1	Very high	97.6	Very high	54 Å²	54	55.9 Å²	55.9	21%	0.212	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.2	-177.9	-59.5	-78.5	0	0	0	114.5	P73 T74 S103 S107 D108 I109	P73-Y105 VanDerWaalsContact CD-CG 3.48Å; P73-Y105 VanDerWaalsContact CG-CB 3.44Å; P73-Y105 HydrophobicContact CG-CD1 4.16Å; P73-Y105 HydrophobicContact CG-CD2 3.49Å; P73-Y105 VanDerWaalsContact CG-CD2 3.49Å; P73-Y105 HydrophobicContact CG-CE2 4.25Å; P73-Y105 HydrophobicContact CG-CG 3.42Å; P73-Y105 VanDerWaalsContact CG-CG 3.42Å; T74-Y105 HydrophobicContact CG2-CD1 3.71Å; T74-Y105 HydrophobicContact CG2-CE1 4.47Å; T74-Y105 HydrophobicContact CG2-CG 4.39Å; S103-Y105 PolarHBondContact O-N 3.15Å; S103-Y105 PolarHBondContact OG-N 2.96Å; Y105-S107 VanDerWaalsContact C-N 3.3Å; Y105-S107 PolarHBondContact O-N 3.05Å; Y105-D108 WeakPolarHBondContact O-CB 3.36Å; Y105-D108 PolarHBondContact O-N 3.01Å; Y105-I109 WeakPolarHBondContact O-CG1 3.42Å; Y105-I109 PolarHBondContact O-N 3.35Å; Y105-I109 VanDerWaalsContact O-N 3.16Å
106	R	97.5	Very high	97.7	Very high	77 Å²	77	51.5 Å²	51.5	29%	0.291	26%	0.258	S	S	.	.	H	α-helix	trans	-48	-48.2	-173.9	174.5	-178.1	149.3	59.9	1	113.3	L101 S103 E104 D108 I109 I110 F139	L101-R106 HydrophobicContact CD2-CG 4.46Å; L101-R106 WeakPolarHBondContact O-CB 3.28Å; L101-R106 WeakPolarHBondContact O-CD 3.44Å; L101-R106 WeakPolarHBondContact O-CG 3.42Å; S103-R106 WeakPolarHBondContact O-CB 3.26Å; S103-R106 PolarHBondContact O-N 3.01Å; E104-R106 PolarHBondContact O-N 2.93Å; R106-D108 VanDerWaalsContact C-N 3.26Å; R106-D108 PolarHBondContact O-N 2.92Å; R106-I109 PolarHBondContact O-N 2.69Å; R106-I110 WeakPolarHBondContact O-CB 3.36Å; R106-I110 VanDerWaalsContact O-CG2 3.29Å; R106-I110 WeakPolarHBondContact O-CG2 3.45Å; R106-I110 PolarHBondContact O-N 2.89Å; R106-I110 VanDerWaalsContact O-N 3.11Å; R106-F139 PolarHBondContact NH1-O 2.95Å; R106-F139 PolarHBondContact NH2-O 3.16Å
107	S	96.9	Very high	97.7	Very high	95 Å²	95	51.4 Å²	51.4	66%	0.664	26%	0.257	S	S	*	.	H	α-helix	trans	-63.2	-32.6	-178.9	42.3	0	0	0	0	112.7	Y105	Y105-S107 VanDerWaalsContact C-N 3.3Å; Y105-S107 PolarHBondContact O-N 3.05Å
108	D	98.1	Very high	97.8	Very high	94 Å²	94	53.8 Å²	53.8	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-80.4	-29.5	-176.2	-54.5	-57.4	0	0	0	112.1	T74 Y105 R106	T74-D108 HydrophobicContact CG2-CB 3.59Å; Y105-D108 WeakPolarHBondContact O-CB 3.36Å; Y105-D108 PolarHBondContact O-N 3.01Å; R106-D108 VanDerWaalsContact C-N 3.26Å; R106-D108 PolarHBondContact O-N 2.92Å
109	I	98.4	Very high	97.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-102.6	-29.7	-171.4	67.9	178.8	0	0	0	114.6	P73 T74 L85 M100 L101 Y105 R106 N111 A112	P73-I109 HydrophobicContact CB-CD1 4.45Å; P73-I109 HydrophobicContact CB-CG2 4.29Å; P73-I109 HydrophobicContact CG-CD1 4.47Å; P73-I109 HydrophobicContact CG-CG2 4.24Å; T74-I109 HydrophobicContact CG2-CG2 3.94Å; L85-I109 HydrophobicContact CD2-CB 4.2Å; L85-I109 HydrophobicContact CD2-CD1 4.1Å; L85-I109 HydrophobicContact CD2-CG1 3.89Å; M100-I109 HydrophobicContact CB-CD1 3.72Å; L101-I109 HydrophobicContact CD2-CD1 4.44Å; L101-I109 HydrophobicContact CD2-CG1 4.32Å; Y105-I109 WeakPolarHBondContact O-CG1 3.42Å; Y105-I109 PolarHBondContact O-N 3.35Å; Y105-I109 VanDerWaalsContact O-N 3.16Å; R106-I109 PolarHBondContact O-N 2.69Å; I109-N111 VanDerWaalsContact C-N 3.35Å; I109-N111 PolarHBondContact O-N 3.07Å; I109-A112 WeakPolarHBondContact O-CB 3.36Å; I109-A112 PolarHBondContact O-N 2.81Å
110	I	98.7	Very high	97.8	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.046	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-38.6	-167.8	-170.3	167.6	0	0	0	113.5	L101 R106 P120 L136 F139 A141	L101-I110 HydrophobicContact CD2-CB 3.91Å; L101-I110 HydrophobicContact CD2-CD1 4.11Å; L101-I110 HydrophobicContact CD2-CG1 4Å; R106-I110 WeakPolarHBondContact O-CB 3.36Å; R106-I110 VanDerWaalsContact O-CG2 3.29Å; R106-I110 WeakPolarHBondContact O-CG2 3.45Å; R106-I110 PolarHBondContact O-N 2.89Å; R106-I110 VanDerWaalsContact O-N 3.11Å; I110-P120 WeakPolarHBondContact O-CD 3.41Å; I110-L136 HydrophobicContact CG1-CD2 4.33Å; I110-F139 HydrophobicContact CD1-CB 3.85Å; I110-F139 WeakPolarHBondContact CD1-O 3.35Å; I110-A141 HydrophobicContact CD1-CB 3.88Å; I110-A141 HydrophobicContact CG1-CB 3.8Å
111	N	98.7	Very high	97.9	Very high	37 Å²	37	47.6 Å²	47.6	20%	0.198	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	16.6	177.2	-62.9	-26.1	0	0	0	111.6	I109 K113 E142	I109-N111 VanDerWaalsContact C-N 3.35Å; I109-N111 PolarHBondContact O-N 3.07Å; N111-K113 PolarHBondContact O-N 2.82Å; N111-E142 VanDerWaalsContact ND2-CD 3.35Å; N111-E142 WeakPolarHBondContact ND2-CG 3.43Å; N111-E142 PolarHBondContact ND2-OE1 3.45Å; N111-E142 PolarHBondContact OD1-N 3.12Å
112	A	98.6	Very high	97.9	Very high	14 Å²	14	47.6 Å²	47.6	12%	0.116	24%	0.241	C	C	.	.			trans	-54.8	130.2	178	0	0	0	0	0	110.1	T83 H86 I109 T119 P120	T83-A112 HydrophobicContact CG2-CB 4.13Å; H86-A112 PolarHBondContact CE1-O 3.01Å; H86-A112 PolarHBondContact NE2-O 3.03Å; H86-A112 VanDerWaalsContact NE2-O 3.16Å; I109-A112 WeakPolarHBondContact O-CB 3.36Å; I109-A112 PolarHBondContact O-N 2.81Å; A112-T119 WeakPolarHBondContact O-CA 3.42Å; A112-P120 WeakPolarHBondContact O-CD 3.43Å
113	K	98.6	Very high	98	Very high	87 Å²	87	41.9 Å²	41.9	38%	0.378	21%	0.214	S	C	.	.			trans	-94.3	136.3	178.4	-69.7	-167.8	180	-162.8	0	111.8	K76 N111 W118 T119 L146	K76-K113 WeakPolarHBondContact CE-O 3.34Å; K76-K113 PolarHBondContact NZ-O 2.85Å; N111-K113 PolarHBondContact O-N 2.82Å; K113-W118 CarbonylContact C-O 3.58Å; K113-W118 WeakPolarHBondContact CA-O 3.44Å; K113-T119 HydrophobicContact CG-CG2 4.11Å; K113-L146 PolarHBondContact NZ-O 3.44Å
114	S	98.6	Very high	98.2	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.063	21%	0.207	C	C	.	.			trans	-70.2	-179	166.7	84.1	0	0	0	0	112.3	G80 G81 D116 G117 W118	G80-S114 VanDerWaalsContact O-CB 3.3Å; G80-S114 WeakPolarHBondContact O-CB 3.4Å; G81-S114 WeakPolarHBondContact O-CA 3.47Å; S114-D116 PolarHBondContact O-N 3.13Å; S114-D116 PolarHBondContact OG-N 2.93Å; S114-G117 PolarHBondContact O-N 2.74Å; S114-W118 PolarHBondContact N-O 3.04Å; S114-W118 WeakPolarHBondContact OG-CB 3.21Å; S114-W118 PolarHBondContact OG-N 2.86Å; S114-W118 VanDerWaalsContact OG-N 3.14Å
115	N	98.4	Very high	98.4	Very high	95 Å²	95	33.9 Å²	33.9	51%	0.508	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.9	175.3	-67.2	-10.5	0	0	0	113.7	G80 G81	G80-N115 WeakPolarHBondContact O-CB 3.47Å; G80-N115 PolarHBondContact O-N 3.09Å; G81-N115 WeakPolarHBondContact CA-OD1 3.02Å; G81-N115 PolarHBondContact N-ND2 3.12Å
116	D	98.1	Very high	98.5	Very high	91 Å²	91	32.6 Å²	32.6	49%	0.487	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	11.2	173.8	-70.8	-50.6	0	0	0	112	S114 W118 D148	S114-D116 PolarHBondContact O-N 3.13Å; S114-D116 PolarHBondContact OG-N 2.93Å; D116-W118 VanDerWaalsContact C-N 3.28Å; D116-W118 PolarHBondContact O-N 3.42Å; D116-D148 PolarHBondContact O-N 2.86Å; D116-D148 VanDerWaalsContact O-N 3.11Å
117	G	98.5	Very high	98.5	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.01	17%	0.172	C	C	.	.	S	Bend	trans	75.4	9.5	-177.3	0	0	0	0	0	114.7	S114 S147 D148	S114-G117 PolarHBondContact O-N 2.74Å; G117-S147 WeakPolarHBondContact O-CA 3.4Å; G117-D148 WeakPolarHBondContact CA-OD1 3.38Å; G117-D148 PolarHBondContact N-OD2 3.2Å
118	W	98.8	Very high	98.6	Very high	49 Å²	49	29.3 Å²	29.3	19%	0.186	15%	0.15	C	C	.	.			trans	-74.8	132.8	-179.5	-75.3	37.7	0	0	0	110.3	H86 K113 S114 D116 H122 V123 H126 L156	H86-W118 PolarHBondContact NE2-O 3.31Å; K113-W118 CarbonylContact C-O 3.58Å; K113-W118 WeakPolarHBondContact CA-O 3.44Å; S114-W118 PolarHBondContact N-O 3.04Å; S114-W118 WeakPolarHBondContact OG-CB 3.21Å; S114-W118 PolarHBondContact OG-N 2.86Å; S114-W118 VanDerWaalsContact OG-N 3.14Å; D116-W118 VanDerWaalsContact C-N 3.28Å; D116-W118 PolarHBondContact O-N 3.42Å; W118-H122 HydrophobicContact CB-CB 3.98Å; W118-H122 HydrophobicContact CD2-CB 4.02Å; W118-H122 HydrophobicContact CE3-CB 3.98Å; W118-H122 HydrophobicContact CG-CB 4.04Å; W118-V123 HydrophobicContact CE3-CG2 3.89Å; W118-H126 HydrophobicContact CH2-CB 4.07Å; W118-H126 AromaticContact CH2-CE1 3.94Å; W118-H126 AromaticContact CH2-CG 3.73Å; W118-H126 AromaticContact CH2-ND1 3.44Å; W118-H126 WeakPolarHBondContact CH2-ND1 3.39Å; W118-H126 HydrophobicContact CZ3-CB 3.74Å; W118-H126 AromaticContact CZ3-CG 3.79Å; W118-H126 AromaticContact CZ3-ND1 4Å; W118-L156 HydrophobicContact CD2-CD1 4.31Å; W118-L156 HydrophobicContact CE3-CD1 4.3Å; W118-L156 HydrophobicContact CH2-CD1 3.89Å; W118-L156 HydrophobicContact CH2-CD2 4.39Å; W118-L156 HydrophobicContact CZ2-CD1 3.85Å; W118-L156 HydrophobicContact CZ2-CD2 4.17Å; W118-L156 HydrophobicContact CZ3-CD1 4.1Å
119	T	98.9	Very high	98.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.			trans	-90.7	167.7	169.5	67.6	0	0	0	0	110.7	A112 K113 L121 H122 V123 P145	A112-T119 WeakPolarHBondContact O-CA 3.42Å; K113-T119 HydrophobicContact CG-CG2 4.11Å; T119-L121 PolarHBondContact O-N 3.2Å; T119-L121 VanDerWaalsContact O-N 3.11Å; T119-L121 PolarHBondContact OG1-N 3.19Å; T119-H122 PolarHBondContact N-ND1 2.93Å; T119-H122 VanDerWaalsContact N-ND1 3.12Å; T119-H122 WeakPolarHBondContact O-CB 3.49Å; T119-H122 PolarHBondContact O-N 3.32Å; T119-H122 PolarHBondContact OG1-N 2.88Å; T119-H122 PolarHBondContact OG1-ND1 3.28Å; T119-V123 PolarHBondContact O-N 3.13Å; T119-V123 VanDerWaalsContact O-N 3.15Å; T119-P145 HydrophobicContact CG2-CB 3.97Å; T119-P145 HydrophobicContact CG2-CG 4.05Å
120	P	98.8	Very high	98.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-53.6	-31.7	170.6	-28.4	36.2	0	0	0	113.3	L85 A89 I110 A112 V123 A124 L136	L85-P120 HydrophobicContact CB-CG 4.39Å; L85-P120 HydrophobicContact CD2-CB 4.22Å; L85-P120 HydrophobicContact CD2-CG 3.86Å; L85-P120 HydrophobicContact CG-CB 4.08Å; L85-P120 HydrophobicContact CG-CG 3.97Å; A89-P120 HydrophobicContact CB-CB 4.29Å; A89-P120 WeakPolarHBondContact CB-O 3.42Å; I110-P120 WeakPolarHBondContact O-CD 3.41Å; A112-P120 WeakPolarHBondContact O-CD 3.43Å; P120-V123 PolarHBondContact O-N 2.65Å; P120-A124 WeakPolarHBondContact O-CB 3.39Å; P120-A124 PolarHBondContact O-N 3.33Å; P120-L136 HydrophobicContact CB-CD1 4Å; P120-L136 HydrophobicContact CB-CD2 4.19Å
121	L	98.9	Very high	98.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.2	-39.6	176.5	-169.2	61.7	0	0	0	112.2	T119 A124 A125 V133 L136 L137 E142 P153 L169	T119-L121 PolarHBondContact O-N 3.2Å; T119-L121 VanDerWaalsContact O-N 3.11Å; T119-L121 PolarHBondContact OG1-N 3.19Å; L121-A124 PolarHBondContact O-N 3.18Å; L121-A125 VanDerWaalsContact O-CB 3.23Å; L121-A125 WeakPolarHBondContact O-CB 2.86Å; L121-A125 PolarHBondContact O-N 3.14Å; L121-V133 HydrophobicContact CD1-CB 4.38Å; L121-V133 HydrophobicContact CD1-CG1 3.94Å; L121-V133 HydrophobicContact CD1-CG2 4.36Å; L121-L136 HydrophobicContact CB-CD1 3.99Å; L121-L136 HydrophobicContact CD1-CB 4.16Å; L121-L136 HydrophobicContact CD1-CD1 3.92Å; L121-L137 HydrophobicContact CD1-CG 4.43Å; L121-L137 HydrophobicContact CD2-CD2 4.09Å; L121-E142 WeakPolarHBondContact CD2-O 3.49Å; L121-P153 HydrophobicContact CB-CG 4.17Å; L121-P153 HydrophobicContact CD2-CB 4.27Å; L121-P153 HydrophobicContact CD2-CG 3.97Å; L121-P153 HydrophobicContact CG-CB 3.9Å; L121-P153 HydrophobicContact CG-CG 3.86Å; L121-L169 HydrophobicContact CD1-CD2 4.24Å; L121-L169 HydrophobicContact CD2-CD2 4.09Å; L121-L169 HydrophobicContact CG-CD2 4.34Å
122	H	98.9	Very high	98.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-48.1	172.2	-72	89.5	0	0	0	111.4	W118 T119 A125 H126 P145 T151 L156	W118-H122 HydrophobicContact CB-CB 3.98Å; W118-H122 HydrophobicContact CD2-CB 4.02Å; W118-H122 HydrophobicContact CE3-CB 3.98Å; W118-H122 HydrophobicContact CG-CB 4.04Å; T119-H122 PolarHBondContact N-ND1 2.93Å; T119-H122 VanDerWaalsContact N-ND1 3.12Å; T119-H122 WeakPolarHBondContact O-CB 3.49Å; T119-H122 PolarHBondContact O-N 3.32Å; T119-H122 PolarHBondContact OG1-N 2.88Å; T119-H122 PolarHBondContact OG1-ND1 3.28Å; H122-A125 PolarHBondContact O-N 3.48Å; H122-H126 WeakPolarHBondContact O-CB 3.37Å; H122-H126 PolarHBondContact O-N 3.24Å; H122-P145 PolarHBondContact CE1-O 2.84Å; H122-P145 PolarHBondContact NE2-O 3.17Å; H122-P145 VanDerWaalsContact NE2-O 3.16Å; H122-T151 PolarHBondContact NE2-O 3.08Å; H122-L156 HydrophobicContact CB-CD1 3.93Å
123	V	98.8	Very high	98.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-50.3	179.6	179.7	0	0	0	0	110.3	F82 A89 M90 W118 T119 P120 A125 H126 Y127	F82-V123 HydrophobicContact CE1-CG2 4.43Å; F82-V123 HydrophobicContact CZ-CG2 4.45Å; A89-V123 HydrophobicContact CB-CB 4.1Å; A89-V123 HydrophobicContact CB-CG1 4.07Å; M90-V123 HydrophobicContact CB-CG1 3.71Å; W118-V123 HydrophobicContact CE3-CG2 3.89Å; T119-V123 PolarHBondContact O-N 3.13Å; T119-V123 VanDerWaalsContact O-N 3.15Å; P120-V123 PolarHBondContact O-N 2.65Å; V123-A125 VanDerWaalsContact C-N 3.31Å; V123-A125 PolarHBondContact O-N 3.24Å; V123-H126 PolarHBondContact O-N 3.31Å; V123-Y127 HydrophobicContact CG1-CD2 3.83Å; V123-Y127 HydrophobicContact CG1-CE2 4.03Å; V123-Y127 VanDerWaalsContact O-CD2 3.29Å; V123-Y127 WeakPolarHBondContact O-CD2 3.29Å; V123-Y127 PolarHBondContact O-N 3.48Å; V123-Y127 VanDerWaalsContact O-N 3.08Å
124	A	98.8	Very high	98.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.6	-42.8	179.3	0	0	0	0	0	112.1	A89 P120 L121 G128 R129 F132 V133 L136	A89-A124 HydrophobicContact CB-CB 4.18Å; P120-A124 WeakPolarHBondContact O-CB 3.39Å; P120-A124 PolarHBondContact O-N 3.33Å; L121-A124 PolarHBondContact O-N 3.18Å; A124-G128 PolarHBondContact O-N 3.35Å; A124-R129 HydrophobicContact CB-CB 4.31Å; A124-R129 PolarHBondContact O-N 3.19Å; A124-F132 HydrophobicContact CB-CB 4.32Å; A124-F132 HydrophobicContact CB-CD1 3.89Å; A124-F132 HydrophobicContact CB-CG 4.45Å; A124-V133 HydrophobicContact CB-CG2 3.68Å; A124-L136 HydrophobicContact CB-CD1 4.31Å
125	A	98.8	Very high	98.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-43.4	177.8	0	0	0	0	0	112.4	L121 H122 V123 Y127 G128 P153 A157 R162 L169	L121-A125 VanDerWaalsContact O-CB 3.23Å; L121-A125 WeakPolarHBondContact O-CB 2.86Å; L121-A125 PolarHBondContact O-N 3.14Å; H122-A125 PolarHBondContact O-N 3.48Å; V123-A125 VanDerWaalsContact C-N 3.31Å; V123-A125 PolarHBondContact O-N 3.24Å; A125-Y127 PolarHBondContact O-N 2.86Å; A125-G128 PolarHBondContact O-N 3.02Å; A125-P153 HydrophobicContact CB-CB 3.93Å; A125-P153 VanDerWaalsContact CB-O 3.31Å; A125-P153 WeakPolarHBondContact CB-O 3.3Å; A125-A157 HydrophobicContact CB-CB 4.25Å; A125-R162 WeakPolarHBondContact O-CG 3.19Å; A125-L169 HydrophobicContact CB-CD1 4.3Å
126	H	98.7	Very high	98.6	Very high	26 Å²	26	28.3 Å²	28.3	12%	0.12	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-45.4	177.2	-177.3	91.1	0	0	0	112.4	W118 H122 V123 G128 L156 R160 R162	W118-H126 HydrophobicContact CH2-CB 4.07Å; W118-H126 AromaticContact CH2-CE1 3.94Å; W118-H126 AromaticContact CH2-CG 3.73Å; W118-H126 AromaticContact CH2-ND1 3.44Å; W118-H126 WeakPolarHBondContact CH2-ND1 3.39Å; W118-H126 HydrophobicContact CZ3-CB 3.74Å; W118-H126 AromaticContact CZ3-CG 3.79Å; W118-H126 AromaticContact CZ3-ND1 4Å; H122-H126 WeakPolarHBondContact O-CB 3.37Å; H122-H126 PolarHBondContact O-N 3.24Å; V123-H126 PolarHBondContact O-N 3.31Å; H126-G128 VanDerWaalsContact C-N 3.33Å; H126-L156 HydrophobicContact CB-CD1 4.44Å; H126-R160 PolarHBondContact CE1-NH1 3.31Å; H126-R160 VanDerWaalsContact CE1-NH1 3.26Å; H126-R160 PolarHBondContact NE2-NH1 2.98Å; H126-R162 PolarHBondContact O-NE 3.3Å
127	Y	98.5	Very high	98.6	Very high	84 Å²	84	24.3 Å²	24.3	33%	0.329	12%	0.117	S	C	.	.	H	α-helix	trans	-85.9	-0.8	-178.8	-71.3	-80.1	0	0	0	114	M90 V123 A125	M90-Y127 HydrophobicContact CB-CD2 4.29Å; M90-Y127 HydrophobicContact CB-CE2 4.29Å; M90-Y127 HydrophobicContact CE-CE2 4Å; M90-Y127 HydrophobicContact CG-CD1 4.45Å; M90-Y127 HydrophobicContact CG-CD2 3.88Å; M90-Y127 HydrophobicContact CG-CE1 4.19Å; M90-Y127 HydrophobicContact CG-CE2 3.62Å; M90-Y127 HydrophobicContact CG-CG 4.31Å; M90-Y127 HydrophobicContact SD-CE2 4.35Å; V123-Y127 HydrophobicContact CG1-CD2 3.83Å; V123-Y127 HydrophobicContact CG1-CE2 4.03Å; V123-Y127 VanDerWaalsContact O-CD2 3.29Å; V123-Y127 WeakPolarHBondContact O-CD2 3.29Å; V123-Y127 PolarHBondContact O-N 3.48Å; V123-Y127 VanDerWaalsContact O-N 3.08Å; A125-Y127 PolarHBondContact O-N 2.86Å
128	G	98.3	Very high	98.6	Very high	20 Å²	20	29.3 Å²	29.3	21%	0.206	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	40.9	177.2	0	0	0	0	0	113.5	A124 A125 H126 D130	A124-G128 PolarHBondContact O-N 3.35Å; A125-G128 PolarHBondContact O-N 3.02Å; H126-G128 VanDerWaalsContact C-N 3.33Å; G128-D130 PolarHBondContact O-N 2.88Å
129	R	98.6	Very high	98.6	Very high	89 Å²	89	28.6 Å²	28.6	34%	0.336	14%	0.138	S	C	.	.			trans	-92.3	72.5	-177.6	-55.4	-46.6	-171.3	-173.4	-2.8	111.5	A89 M90 A124 S131 F132 V133	A89-R129 WeakPolarHBondContact O-CG 3.48Å; M90-R129 PolarHBondContact O-NE 3.4Å; M90-R129 PolarHBondContact O-NH2 2.88Å; A124-R129 HydrophobicContact CB-CB 4.31Å; A124-R129 PolarHBondContact O-N 3.19Å; R129-S131 PolarHBondContact O-N 3.48Å; R129-F132 HydrophobicContact CB-CB 3.73Å; R129-F132 CarbonylContact O-C 3.38Å; R129-F132 WeakPolarHBondContact O-CA 3.47Å; R129-F132 VanDerWaalsContact O-CB 3.29Å; R129-F132 WeakPolarHBondContact O-CB 3.26Å; R129-F132 PolarHBondContact O-N 2.88Å; R129-V133 PolarHBondContact O-N 3.38Å
130	D	98.1	Very high	98.5	Very high	46 Å²	46	36.4 Å²	36.4	25%	0.246	17%	0.172	C	C	.	.	H	α-helix	trans	-47.4	-51.7	-173.9	-59.3	-11.9	0	0	0	114.7	G128 F132 V133 R134 S164 C165 I168	G128-D130 PolarHBondContact O-N 2.88Å; D130-F132 PolarHBondContact O-N 2.84Å; D130-V133 PolarHBondContact O-N 3.43Å; D130-R134 PolarHBondContact O-N 2.92Å; D130-S164 VanDerWaalsContact CG-CB 3.47Å; D130-S164 WeakPolarHBondContact OD1-CB 3.39Å; D130-S164 PolarHBondContact OD1-OG 3.48Å; D130-S164 WeakPolarHBondContact OD2-CB 3.4Å; D130-S164 PolarHBondContact OD2-OG 3.38Å; D130-C165 PolarHBondContact OD1-N 3.31Å; D130-C165 PolarHBondContact OD1-SG 3.48Å; D130-I168 HydrophobicContact CB-CD1 3.76Å
131	S	97.8	Very high	98.5	Very high	83 Å²	83	36.6 Å²	36.6	58%	0.58	17%	0.174	S	C	*	.	H	α-helix	trans	-65.5	-27.5	179.9	-52.4	0	0	0	0	112.6	R129 L135	R129-S131 PolarHBondContact O-N 3.48Å; S131-L135 WeakPolarHBondContact O-CB 3.18Å; S131-L135 PolarHBondContact O-N 3.46Å; S131-L135 VanDerWaalsContact O-N 3.12Å
132	F	98.6	Very high	98.5	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-79.8	-40.1	177.2	-155.7	-74.8	0	0	0	111.4	L85 A88 A89 A94 A97 A124 R129 D130 R134 L135 L136	L85-F132 HydrophobicContact CD1-CE1 4.42Å; L85-F132 HydrophobicContact CD1-CZ 3.86Å; A88-F132 HydrophobicContact CB-CE2 3.78Å; A88-F132 HydrophobicContact CB-CZ 3.9Å; A88-F132 WeakPolarHBondContact O-CE2 3.29Å; A89-F132 VanDerWaalsContact CA-CE1 3.47Å; A89-F132 HydrophobicContact CB-CD1 3.84Å; A89-F132 HydrophobicContact CB-CE1 3.38Å; A89-F132 HydrophobicContact CB-CE2 4.42Å; A89-F132 HydrophobicContact CB-CZ 3.69Å; A94-F132 HydrophobicContact CB-CD2 4.46Å; A97-F132 HydrophobicContact CB-CD2 4.24Å; A97-F132 HydrophobicContact CB-CE1 4.22Å; A97-F132 HydrophobicContact CB-CE2 3.27Å; A97-F132 HydrophobicContact CB-CZ 3.27Å; A124-F132 HydrophobicContact CB-CB 4.32Å; A124-F132 HydrophobicContact CB-CD1 3.89Å; A124-F132 HydrophobicContact CB-CG 4.45Å; R129-F132 HydrophobicContact CB-CB 3.73Å; R129-F132 CarbonylContact O-C 3.38Å; R129-F132 WeakPolarHBondContact O-CA 3.47Å; R129-F132 VanDerWaalsContact O-CB 3.29Å; R129-F132 WeakPolarHBondContact O-CB 3.26Å; R129-F132 PolarHBondContact O-N 2.88Å; D130-F132 PolarHBondContact O-N 2.84Å; F132-R134 VanDerWaalsContact C-N 3.35Å; F132-L135 WeakPolarHBondContact O-CB 3.38Å; F132-L135 PolarHBondContact O-N 2.91Å; F132-L136 HydrophobicContact CD1-CD1 3.68Å; F132-L136 HydrophobicContact CD1-CG 3.81Å; F132-L136 HydrophobicContact CE1-CD1 3.72Å; F132-L136 HydrophobicContact CE1-CD2 3.97Å; F132-L136 HydrophobicContact CE1-CG 3.76Å; F132-L136 WeakPolarHBondContact O-CG 3.42Å; F132-L136 PolarHBondContact O-N 3.42Å
133	V	98.8	Very high	98.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-49.4	171.7	173	0	0	0	0	109.8	L121 A124 R129 D130 L135 L136 L137 I168 L169	L121-V133 HydrophobicContact CD1-CB 4.38Å; L121-V133 HydrophobicContact CD1-CG1 3.94Å; L121-V133 HydrophobicContact CD1-CG2 4.36Å; A124-V133 HydrophobicContact CB-CG2 3.68Å; R129-V133 PolarHBondContact O-N 3.38Å; D130-V133 PolarHBondContact O-N 3.43Å; V133-L135 PolarHBondContact O-N 3.11Å; V133-L136 PolarHBondContact O-N 3.41Å; V133-L137 HydrophobicContact CG1-CD1 3.73Å; V133-L137 WeakPolarHBondContact O-CD1 3.36Å; V133-L137 VanDerWaalsContact O-CG 3.26Å; V133-L137 WeakPolarHBondContact O-CG 3.3Å; V133-L137 PolarHBondContact O-N 3.28Å; V133-L137 VanDerWaalsContact O-N 3.09Å; V133-I168 HydrophobicContact CG1-CB 4.33Å; V133-I168 HydrophobicContact CG1-CG2 3.68Å; V133-L169 HydrophobicContact CG1-CD2 4.06Å; V133-L169 HydrophobicContact CG1-CG 4.13Å
134	R	98.6	Very high	98.4	Very high	102 Å²	102	45.3 Å²	45.3	39%	0.385	22%	0.218	S	C	.	.	H	α-helix	trans	-55.5	-49	174.3	-83.8	-175	-100.8	-98.4	-0.7	112.3	D130 F132 L136 L137 E138 I168	D130-R134 PolarHBondContact O-N 2.92Å; F132-R134 VanDerWaalsContact C-N 3.35Å; R134-L136 PolarHBondContact O-N 2.82Å; R134-L137 PolarHBondContact O-N 3.39Å; R134-E138 WeakPolarHBondContact O-CG 3.23Å; R134-E138 PolarHBondContact O-N 2.95Å; R134-I168 HydrophobicContact CG-CD1 4.18Å; R134-I168 HydrophobicContact CG-CG1 4.33Å; R134-I168 HydrophobicContact CG-CG2 3.76Å; R134-I168 VanDerWaalsContact CZ-CD1 3.43Å; R134-I168 VanDerWaalsContact NH1-CG1 3.34Å
135	L	98.6	Very high	98.3	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-56.6	-48.5	178.8	-179.1	71.6	0	0	0	112.1	A94 A97 R98 L101 S131 F132 V133 L137 E138 F139	A94-L135 HydrophobicContact CB-CD2 4.18Å; A94-L135 WeakPolarHBondContact O-CD2 3.3Å; A97-L135 HydrophobicContact CB-CD2 3.59Å; R98-L135 HydrophobicContact CB-CD1 4.38Å; R98-L135 HydrophobicContact CB-CD2 4.45Å; R98-L135 VanDerWaalsContact CZ-CD1 3.5Å; L101-L135 HydrophobicContact CD1-CD2 4.4Å; L101-L135 HydrophobicContact CD1-CG 4.35Å; S131-L135 WeakPolarHBondContact O-CB 3.18Å; S131-L135 PolarHBondContact O-N 3.46Å; S131-L135 VanDerWaalsContact O-N 3.12Å; F132-L135 WeakPolarHBondContact O-CB 3.38Å; F132-L135 PolarHBondContact O-N 2.91Å; V133-L135 PolarHBondContact O-N 3.11Å; L135-L137 VanDerWaalsContact C-N 3.3Å; L135-L137 PolarHBondContact O-N 3.37Å; L135-E138 WeakPolarHBondContact O-CB 3.28Å; L135-E138 PolarHBondContact O-N 3.17Å; L135-F139 HydrophobicContact CD1-CD2 3.75Å; L135-F139 HydrophobicContact CD1-CE2 3.64Å; L135-F139 HydrophobicContact CG-CD2 4.09Å; L135-F139 HydrophobicContact CG-CE2 4.38Å; L135-F139 WeakPolarHBondContact O-CB 3.4Å; L135-F139 WeakPolarHBondContact O-CD2 3.46Å; L135-F139 PolarHBondContact O-N 3.38Å
136	L	98.8	Very high	98.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-41.6	179.2	-71.9	173.8	0	0	0	111.7	L85 L101 I110 P120 L121 A124 F132 V133 R134 F139 K140 A141	L85-L136 HydrophobicContact CD2-CD2 4.4Å; L101-L136 HydrophobicContact CD1-CD2 4.17Å; I110-L136 HydrophobicContact CG1-CD2 4.33Å; P120-L136 HydrophobicContact CB-CD1 4Å; P120-L136 HydrophobicContact CB-CD2 4.19Å; L121-L136 HydrophobicContact CB-CD1 3.99Å; L121-L136 HydrophobicContact CD1-CB 4.16Å; L121-L136 HydrophobicContact CD1-CD1 3.92Å; A124-L136 HydrophobicContact CB-CD1 4.31Å; F132-L136 HydrophobicContact CD1-CD1 3.68Å; F132-L136 HydrophobicContact CD1-CG 3.81Å; F132-L136 HydrophobicContact CE1-CD1 3.72Å; F132-L136 HydrophobicContact CE1-CD2 3.97Å; F132-L136 HydrophobicContact CE1-CG 3.76Å; F132-L136 WeakPolarHBondContact O-CG 3.42Å; F132-L136 PolarHBondContact O-N 3.42Å; V133-L136 PolarHBondContact O-N 3.41Å; R134-L136 PolarHBondContact O-N 2.82Å; L136-F139 CarbonylContact O-C 3.32Å; L136-F139 WeakPolarHBondContact O-CA 3.4Å; L136-F139 PolarHBondContact O-N 3.27Å; L136-K140 PolarHBondContact O-N 3.5Å; L136-A141 HydrophobicContact CB-CB 3.92Å; L136-A141 VanDerWaalsContact O-CB 3.26Å; L136-A141 WeakPolarHBondContact O-CB 3.5Å; L136-A141 PolarHBondContact O-N 2.85Å
137	L	98.6	Very high	98.2	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-71.6	-36.5	179.6	-63.9	165.9	0	0	0	112.8	L121 V133 R134 L135 F139 K140 V143 I168 L169 H172	L121-L137 HydrophobicContact CD1-CG 4.43Å; L121-L137 HydrophobicContact CD2-CD2 4.09Å; V133-L137 HydrophobicContact CG1-CD1 3.73Å; V133-L137 WeakPolarHBondContact O-CD1 3.36Å; V133-L137 VanDerWaalsContact O-CG 3.26Å; V133-L137 WeakPolarHBondContact O-CG 3.3Å; V133-L137 PolarHBondContact O-N 3.28Å; V133-L137 VanDerWaalsContact O-N 3.09Å; R134-L137 PolarHBondContact O-N 3.39Å; L135-L137 VanDerWaalsContact C-N 3.3Å; L135-L137 PolarHBondContact O-N 3.37Å; L137-F139 PolarHBondContact O-N 3.11Å; L137-K140 PolarHBondContact O-N 2.88Å; L137-V143 HydrophobicContact CD2-CB 4.45Å; L137-V143 HydrophobicContact CD2-CG1 4.36Å; L137-V143 HydrophobicContact CD2-CG2 3.81Å; L137-I168 HydrophobicContact CD1-CG2 3.78Å; L137-L169 HydrophobicContact CD1-CD2 4.25Å; L137-H172 HydrophobicContact CD1-CB 3.83Å; L137-H172 HydrophobicContact CD2-CB 4.17Å; L137-H172 HydrophobicContact CG-CB 4.41Å
138	E	98.1	Very high	98.2	Very high	106 Å²	106	49.7 Å²	49.7	50%	0.495	25%	0.249	S	C	.	.	H	α-helix	trans	-55.9	-44.5	169.1	-76	168	-164.1	0	0	110.3	R98 R134 L135 K140	R98-E138 IonicContact NH2-OE2 3.64Å; R134-E138 WeakPolarHBondContact O-CG 3.23Å; R134-E138 PolarHBondContact O-N 2.95Å; L135-E138 WeakPolarHBondContact O-CB 3.28Å; L135-E138 PolarHBondContact O-N 3.17Å; E138-K140 PolarHBondContact O-N 2.87Å
139	F	98.3	Very high	98.1	Very high	34 Å²	34	56.9 Å²	56.9	15%	0.149	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	20.4	174	-85.6	-70	0	0	0	112.8	R98 L101 E102 R106 I110 L135 L136 L137 A141	R98-F139 HydrophobicContact CG-CE2 4.44Å; L101-F139 HydrophobicContact CB-CD1 4.09Å; L101-F139 HydrophobicContact CB-CD2 4.14Å; L101-F139 HydrophobicContact CB-CE1 4.07Å; L101-F139 HydrophobicContact CB-CE2 4.17Å; L101-F139 HydrophobicContact CB-CG 4.1Å; L101-F139 HydrophobicContact CB-CZ 4.12Å; L101-F139 HydrophobicContact CD1-CB 4.17Å; L101-F139 HydrophobicContact CD1-CD2 3.79Å; L101-F139 HydrophobicContact CD1-CE2 4.38Å; L101-F139 HydrophobicContact CD1-CG 4.03Å; E102-F139 HydrophobicContact CG-CE1 4.27Å; E102-F139 HydrophobicContact CG-CZ 3.8Å; R106-F139 PolarHBondContact NH1-O 2.95Å; R106-F139 PolarHBondContact NH2-O 3.16Å; I110-F139 HydrophobicContact CD1-CB 3.85Å; I110-F139 WeakPolarHBondContact CD1-O 3.35Å; L135-F139 HydrophobicContact CD1-CD2 3.75Å; L135-F139 HydrophobicContact CD1-CE2 3.64Å; L135-F139 HydrophobicContact CG-CD2 4.09Å; L135-F139 HydrophobicContact CG-CE2 4.38Å; L135-F139 WeakPolarHBondContact O-CB 3.4Å; L135-F139 WeakPolarHBondContact O-CD2 3.46Å; L135-F139 PolarHBondContact O-N 3.38Å; L136-F139 CarbonylContact O-C 3.32Å; L136-F139 WeakPolarHBondContact O-CA 3.4Å; L136-F139 PolarHBondContact O-N 3.27Å; L137-F139 PolarHBondContact O-N 3.11Å; F139-A141 VanDerWaalsContact C-N 3.28Å; F139-A141 PolarHBondContact O-N 3.12Å
140	K	97.8	Very high	98	Very high	163 Å²	163	53.4 Å²	53.4	71%	0.709	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	33.2	170.9	-48.4	-58.7	-177.8	-176.1	0	115	L136 L137 E138	L136-K140 PolarHBondContact O-N 3.5Å; L137-K140 PolarHBondContact O-N 2.88Å; E138-K140 PolarHBondContact O-N 2.87Å
141	A	98.5	Very high	97.9	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.041	26%	0.264	C	S	.	.			trans	-56	147.8	165.3	0	0	0	0	0	110.1	I110 L136 F139 V143	I110-A141 HydrophobicContact CD1-CB 3.88Å; I110-A141 HydrophobicContact CG1-CB 3.8Å; L136-A141 HydrophobicContact CB-CB 3.92Å; L136-A141 VanDerWaalsContact O-CB 3.26Å; L136-A141 WeakPolarHBondContact O-CB 3.5Å; L136-A141 PolarHBondContact O-N 2.85Å; F139-A141 VanDerWaalsContact C-N 3.28Å; F139-A141 PolarHBondContact O-N 3.12Å; A141-V143 PolarHBondContact O-N 3.01Å
142	E	98.4	Very high	97.9	Very high	104 Å²	104	48.8 Å²	48.8	49%	0.486	24%	0.236	S	C	.	.			trans	-59.2	133.4	171	-78.2	163.5	-141.8	0	0	109.4	N111 L121 P145	N111-E142 VanDerWaalsContact ND2-CD 3.35Å; N111-E142 WeakPolarHBondContact ND2-CG 3.43Å; N111-E142 PolarHBondContact ND2-OE1 3.45Å; N111-E142 PolarHBondContact OD1-N 3.12Å; L121-E142 WeakPolarHBondContact CD2-O 3.49Å; E142-P145 HydrophobicContact CB-CB 4.28Å; E142-P145 HydrophobicContact CB-CG 4.29Å; E142-P145 VanDerWaalsContact O-CD 3.22Å; E142-P145 WeakPolarHBondContact O-CD 3.36Å
143	V	97.8	Very high	97.9	Very high	33 Å²	33	48.7 Å²	48.7	20%	0.2	24%	0.236	C	C	.	.	S	Bend	trans	-83.4	-41.2	-173.3	-172.9	0	0	0	0	112.1	L137 A141 P145 A174	L137-V143 HydrophobicContact CD2-CB 4.45Å; L137-V143 HydrophobicContact CD2-CG1 4.36Å; L137-V143 HydrophobicContact CD2-CG2 3.81Å; A141-V143 PolarHBondContact O-N 3.01Å; V143-P145 VanDerWaalsContact O-CD 3.28Å; V143-P145 WeakPolarHBondContact O-CD 3.3Å; V143-A174 HydrophobicContact CG1-CB 3.58Å
144	D	97.5	Very high	97.9	Very high	46 Å²	46	48.7 Å²	48.7	25%	0.246	24%	0.236	C	C	.	.	S	Bend	trans	-114.9	44.4	-179.1	-63.1	-48	0	0	0	113.9	L146 T152 N175 I178	D144-L146 PolarHBondContact O-N 3.15Å; D144-T152 HydrophobicContact CB-CG2 4.47Å; D144-N175 PolarHBondContact OD1-N 3.34Å; D144-N175 WeakPolarHBondContact OD2-CB 3.49Å; D144-N175 PolarHBondContact OD2-N 2.94Å; D144-I178 HydrophobicContact CB-CD1 4.02Å
145	P	97.6	Very high	97.9	Very high	6 Å²	6	44 Å²	44	4%	0.039	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-63.7	142.8	173.9	28.4	-32	0	0	0	108.9	T119 H122 E142 V143 P153	T119-P145 HydrophobicContact CG2-CB 3.97Å; T119-P145 HydrophobicContact CG2-CG 4.05Å; H122-P145 PolarHBondContact CE1-O 2.84Å; H122-P145 PolarHBondContact NE2-O 3.17Å; H122-P145 VanDerWaalsContact NE2-O 3.16Å; E142-P145 HydrophobicContact CB-CB 4.28Å; E142-P145 HydrophobicContact CB-CG 4.29Å; E142-P145 VanDerWaalsContact O-CD 3.22Å; E142-P145 WeakPolarHBondContact O-CD 3.36Å; V143-P145 VanDerWaalsContact O-CD 3.28Å; V143-P145 WeakPolarHBondContact O-CD 3.3Å; P145-P153 HydrophobicContact CG-CG 3.97Å; P145-P153 WeakPolarHBondContact O-CD 3.37Å
146	L	97.4	Very high	97.8	Very high	78 Å²	78	44.7 Å²	44.7	41%	0.408	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-94.8	130.1	174.6	-62.2	176	0	0	0	110.1	K113 D144 T152	K113-L146 PolarHBondContact NZ-O 3.44Å; D144-L146 PolarHBondContact O-N 3.15Å; L146-T152 HydrophobicContact CD2-CG2 3.69Å
147	S	98.1	Very high	97.8	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.042	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-66.6	173	161.3	73.5	0	0	0	0	111.2	G117 K149 G150 T151	G117-S147 WeakPolarHBondContact O-CA 3.4Å; S147-K149 PolarHBondContact O-N 2.82Å; S147-K149 PolarHBondContact OG-N 3.36Å; S147-G150 WeakPolarHBondContact O-CA 3.5Å; S147-G150 PolarHBondContact O-N 3.14Å; S147-T151 PolarHBondContact N-O 3.01Å; S147-T151 WeakPolarHBondContact OG-CB 3.45Å; S147-T151 PolarHBondContact OG-N 2.83Å; S147-T151 PolarHBondContact OG-O 2.81Å
148	D	97.9	Very high	97.7	Very high	111 Å²	111	44.5 Å²	44.5	59%	0.594	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-20.1	-179.5	-62.7	-16.3	0	0	0	112.3	D116 G117 G150	D116-D148 PolarHBondContact O-N 2.86Å; D116-D148 VanDerWaalsContact O-N 3.11Å; G117-D148 WeakPolarHBondContact CA-OD1 3.38Å; G117-D148 PolarHBondContact N-OD2 3.2Å; D148-G150 VanDerWaalsContact C-N 3.26Å
149	K	95.8	Very high	97.6	Very high	171 Å²	171	42.8 Å²	42.8	74%	0.743	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	10.6	171.4	-60.9	-178.6	-176.9	173.2	0	112.8	S147 T151	S147-K149 PolarHBondContact O-N 2.82Å; S147-K149 PolarHBondContact OG-N 3.36Å; K149-T151 VanDerWaalsContact C-N 3.26Å; K149-T151 PolarHBondContact O-N 2.85Å
150	G	96	Very high	97.5	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	23%	0.227	C	C	.	.	S	Bend	trans	65.9	23.4	-177.2	0	0	0	0	0	113.7	S147 D148 Q179	S147-G150 WeakPolarHBondContact O-CA 3.5Å; S147-G150 PolarHBondContact O-N 3.14Å; D148-G150 VanDerWaalsContact C-N 3.26Å; G150-Q179 PolarHBondContact O-NE2 3.12Å
151	T	96.9	Very high	97.4	Very high	31 Å²	31	45.8 Å²	45.8	19%	0.19	23%	0.227	C	C	.	.			trans	-93.7	138.1	-179.7	-46.4	0	0	0	0	110.3	H122 S147 K149 Q155 L156	H122-T151 PolarHBondContact NE2-O 3.08Å; S147-T151 PolarHBondContact N-O 3.01Å; S147-T151 WeakPolarHBondContact OG-CB 3.45Å; S147-T151 PolarHBondContact OG-N 2.83Å; S147-T151 PolarHBondContact OG-O 2.81Å; K149-T151 VanDerWaalsContact C-N 3.26Å; K149-T151 PolarHBondContact O-N 2.85Å; T151-Q155 VanDerWaalsContact CA-OE1 3.27Å; T151-Q155 HydrophobicContact CG2-CB 3.7Å; T151-L156 HydrophobicContact CG2-CD2 3.83Å; T151-L156 HydrophobicContact CG2-CG 3.83Å
152	T	98.3	Very high	97.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.241	C	C	.	.			trans	-91	163.6	172.8	67.9	0	0	0	0	112.7	D144 L146 L154 Q155 L156 I178	D144-T152 HydrophobicContact CB-CG2 4.47Å; L146-T152 HydrophobicContact CD2-CG2 3.69Å; T152-L154 VanDerWaalsContact C-N 3.26Å; T152-L154 PolarHBondContact O-N 3.18Å; T152-L154 PolarHBondContact OG1-N 3.02Å; T152-Q155 PolarHBondContact O-N 3.13Å; T152-Q155 WeakPolarHBondContact OG1-CG 3.48Å; T152-Q155 PolarHBondContact OG1-N 2.95Å; T152-Q155 VanDerWaalsContact OG1-N 3.15Å; T152-L156 PolarHBondContact O-N 3.24Å; T152-L156 VanDerWaalsContact O-N 3.12Å; T152-I178 HydrophobicContact CG2-CD1 3.52Å; T152-I178 HydrophobicContact CG2-CG1 4.12Å; T152-I178 HydrophobicContact CG2-CG2 4.45Å
153	P	98.6	Very high	97.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-38.6	170.5	-25.5	35.4	0	0	0	113	L121 A125 P145 L156 A157 L169	L121-P153 HydrophobicContact CB-CG 4.17Å; L121-P153 HydrophobicContact CD2-CB 4.27Å; L121-P153 HydrophobicContact CD2-CG 3.97Å; L121-P153 HydrophobicContact CG-CB 3.9Å; L121-P153 HydrophobicContact CG-CG 3.86Å; A125-P153 HydrophobicContact CB-CB 3.93Å; A125-P153 VanDerWaalsContact CB-O 3.31Å; A125-P153 WeakPolarHBondContact CB-O 3.3Å; P145-P153 HydrophobicContact CG-CG 3.97Å; P145-P153 WeakPolarHBondContact O-CD 3.37Å; P153-L156 PolarHBondContact O-N 2.94Å; P153-A157 PolarHBondContact O-N 2.73Å; P153-L169 HydrophobicContact CB-CD1 4.28Å; P153-L169 HydrophobicContact CB-CD2 4.45Å
154	L	98.3	Very high	97.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-44.3	178.2	177.9	57.2	0	0	0	111.7	T152 L156 A157 I158 V166 L169 L170 A174 L183	T152-L154 VanDerWaalsContact C-N 3.26Å; T152-L154 PolarHBondContact O-N 3.18Å; T152-L154 PolarHBondContact OG1-N 3.02Å; L154-L156 VanDerWaalsContact C-N 3.35Å; L154-L156 PolarHBondContact O-N 3.28Å; L154-A157 PolarHBondContact O-N 3.33Å; L154-I158 HydrophobicContact CD1-CD1 3.99Å; L154-I158 HydrophobicContact CD1-CG1 4.36Å; L154-I158 HydrophobicContact CG-CD1 3.99Å; L154-I158 WeakPolarHBondContact O-CD1 3.28Å; L154-I158 VanDerWaalsContact O-CG1 3.29Å; L154-I158 WeakPolarHBondContact O-CG1 3.43Å; L154-I158 PolarHBondContact O-N 3.21Å; L154-V166 HydrophobicContact CD1-CB 4.32Å; L154-V166 HydrophobicContact CD1-CG1 3.83Å; L154-V166 HydrophobicContact CD1-CG2 4.42Å; L154-L169 HydrophobicContact CB-CD1 4.14Å; L154-L169 HydrophobicContact CD1-CB 4.13Å; L154-L169 HydrophobicContact CD1-CD1 4.33Å; L154-L170 HydrophobicContact CD1-CD2 4.47Å; L154-L170 HydrophobicContact CD1-CG 4.25Å; L154-L170 HydrophobicContact CD2-CD2 3.68Å; L154-L170 HydrophobicContact CD2-CG 4.32Å; L154-A174 HydrophobicContact CB-CB 4.38Å; L154-A174 HydrophobicContact CD2-CB 3.7Å; L154-L183 HydrophobicContact CD2-CD1 3.36Å; L154-L183 HydrophobicContact CG-CD1 3.78Å
155	Q	97.9	Very high	97.3	Very high	4 Å²	4	46 Å²	46	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-44	174.6	-76.3	172	-37.3	0	0	111.9	T151 T152 I158 I159 F182 L183	T151-Q155 VanDerWaalsContact CA-OE1 3.27Å; T151-Q155 HydrophobicContact CG2-CB 3.7Å; T152-Q155 PolarHBondContact O-N 3.13Å; T152-Q155 WeakPolarHBondContact OG1-CG 3.48Å; T152-Q155 PolarHBondContact OG1-N 2.95Å; T152-Q155 VanDerWaalsContact OG1-N 3.15Å; Q155-I158 PolarHBondContact O-N 3.44Å; Q155-I159 WeakPolarHBondContact O-CB 3.41Å; Q155-I159 WeakPolarHBondContact O-CD1 3.2Å; Q155-I159 VanDerWaalsContact O-CG1 3.26Å; Q155-I159 WeakPolarHBondContact O-CG1 3.41Å; Q155-I159 PolarHBondContact O-N 2.74Å; Q155-F182 HydrophobicContact CG-CD1 3.97Å; Q155-F182 HydrophobicContact CG-CE1 4.18Å; Q155-F182 VanDerWaalsContact NE2-CD1 3.33Å; Q155-L183 HydrophobicContact CB-CD2 4.44Å; Q155-L183 HydrophobicContact CG-CD2 3.43Å; Q155-L183 VanDerWaalsContact CG-CD2 3.43Å
156	L	97.9	Very high	97.3	Very high	17 Å²	17	45.7 Å²	45.7	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-42.7	176.3	-69.8	178.5	0	0	0	112.1	W118 H122 H126 T151 T152 P153 L154 I158 I159 R160	W118-L156 HydrophobicContact CD2-CD1 4.31Å; W118-L156 HydrophobicContact CE3-CD1 4.3Å; W118-L156 HydrophobicContact CH2-CD1 3.89Å; W118-L156 HydrophobicContact CH2-CD2 4.39Å; W118-L156 HydrophobicContact CZ2-CD1 3.85Å; W118-L156 HydrophobicContact CZ2-CD2 4.17Å; W118-L156 HydrophobicContact CZ3-CD1 4.1Å; H122-L156 HydrophobicContact CB-CD1 3.93Å; H126-L156 HydrophobicContact CB-CD1 4.44Å; T151-L156 HydrophobicContact CG2-CD2 3.83Å; T151-L156 HydrophobicContact CG2-CG 3.83Å; T152-L156 PolarHBondContact O-N 3.24Å; T152-L156 VanDerWaalsContact O-N 3.12Å; P153-L156 PolarHBondContact O-N 2.94Å; L154-L156 VanDerWaalsContact C-N 3.35Å; L154-L156 PolarHBondContact O-N 3.28Å; L156-I158 VanDerWaalsContact C-N 3.29Å; L156-I158 PolarHBondContact O-N 3.25Å; L156-I159 PolarHBondContact O-N 2.59Å; L156-R160 VanDerWaalsContact O-CB 3.3Å; L156-R160 WeakPolarHBondContact O-CB 3.28Å; L156-R160 VanDerWaalsContact O-CG 3.28Å; L156-R160 WeakPolarHBondContact O-CG 3.44Å; L156-R160 PolarHBondContact O-N 3.01Å
157	A	98.2	Very high	97.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-39.8	175.9	0	0	0	0	0	111.7	A125 P153 L154 R160 E161 R162 C165 V166 L169	A125-A157 HydrophobicContact CB-CB 4.25Å; P153-A157 PolarHBondContact O-N 2.73Å; L154-A157 PolarHBondContact O-N 3.33Å; A157-R160 CarbonylContact O-C 3.46Å; A157-E161 PolarHBondContact O-N 3.44Å; A157-E161 VanDerWaalsContact O-N 3.11Å; A157-R162 HydrophobicContact CB-CB 4.19Å; A157-R162 PolarHBondContact O-N 2.84Å; A157-C165 HydrophobicContact CB-CB 3.99Å; A157-V166 HydrophobicContact CB-CG2 3.71Å; A157-L169 HydrophobicContact CB-CD1 4.25Å
158	I	96.9	Very high	97.3	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	23%	0.231	C	C	.	.	H	α-helix	trans	-67.2	-51.4	177.6	-68.3	163.3	0	0	0	110.9	L154 Q155 L156 R160 E161 V166 L183 Y186 Y195 F199	L154-I158 HydrophobicContact CD1-CD1 3.99Å; L154-I158 HydrophobicContact CD1-CG1 4.36Å; L154-I158 HydrophobicContact CG-CD1 3.99Å; L154-I158 WeakPolarHBondContact O-CD1 3.28Å; L154-I158 VanDerWaalsContact O-CG1 3.29Å; L154-I158 WeakPolarHBondContact O-CG1 3.43Å; L154-I158 PolarHBondContact O-N 3.21Å; Q155-I158 PolarHBondContact O-N 3.44Å; L156-I158 VanDerWaalsContact C-N 3.29Å; L156-I158 PolarHBondContact O-N 3.25Å; I158-R160 PolarHBondContact O-N 2.73Å; I158-E161 PolarHBondContact O-N 3.49Å; I158-V166 HydrophobicContact CG1-CG1 4.19Å; I158-V166 HydrophobicContact CG1-CG2 3.68Å; I158-L183 HydrophobicContact CD1-CB 4.09Å; I158-L183 HydrophobicContact CD1-CD1 3.84Å; I158-L183 HydrophobicContact CD1-CD2 3.48Å; I158-L183 VanDerWaalsContact CD1-CD2 3.48Å; I158-L183 HydrophobicContact CD1-CG 3.99Å; I158-Y186 HydrophobicContact CG2-CD1 3.81Å; I158-Y186 HydrophobicContact CG2-CE1 4.05Å; I158-Y195 HydrophobicContact CB-CE2 4.43Å; I158-Y195 HydrophobicContact CG2-CD2 4.01Å; I158-Y195 HydrophobicContact CG2-CE2 3.92Å; I158-F199 HydrophobicContact CD1-CE1 4.01Å; I158-F199 HydrophobicContact CD1-CE2 4.17Å; I158-F199 HydrophobicContact CD1-CZ 3.38Å; I158-F199 HydrophobicContact CG1-CZ 3.83Å
159	I	95.7	Very high	97.3	Very high	69 Å²	69	41.9 Å²	41.9	35%	0.354	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-31.9	-179.5	-67.9	164.2	0	0	0	111.4	Q155 L156 Y186	Q155-I159 WeakPolarHBondContact O-CB 3.41Å; Q155-I159 WeakPolarHBondContact O-CD1 3.2Å; Q155-I159 VanDerWaalsContact O-CG1 3.26Å; Q155-I159 WeakPolarHBondContact O-CG1 3.41Å; Q155-I159 PolarHBondContact O-N 2.74Å; L156-I159 PolarHBondContact O-N 2.59Å; I159-Y186 HydrophobicContact CG1-CE1 4.36Å; I159-Y186 HydrophobicContact CG1-CE2 4.25Å
160	R	96.8	Very high	97.2	Very high	112 Å²	112	34.6 Å²	34.6	42%	0.423	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	10.4	177.8	-59.4	-56.2	-61.9	-127.5	-4.5	113.7	H126 L156 A157 I158 R162	H126-R160 PolarHBondContact CE1-NH1 3.31Å; H126-R160 VanDerWaalsContact CE1-NH1 3.26Å; H126-R160 PolarHBondContact NE2-NH1 2.98Å; L156-R160 VanDerWaalsContact O-CB 3.3Å; L156-R160 WeakPolarHBondContact O-CB 3.28Å; L156-R160 VanDerWaalsContact O-CG 3.28Å; L156-R160 WeakPolarHBondContact O-CG 3.44Å; L156-R160 PolarHBondContact O-N 3.01Å; A157-R160 CarbonylContact O-C 3.46Å; I158-R160 PolarHBondContact O-N 2.73Å; R160-R162 HydrophobicContact CB-CG 3.94Å; R160-R162 VanDerWaalsContact O-CD 3.26Å; R160-R162 WeakPolarHBondContact O-CD 3.35Å; R160-R162 PolarHBondContact O-N 3.48Å; R160-R162 PolarHBondContact O-NE 3.01Å
161	E	95.8	Very high	97.1	Very high	149 Å²	149	38.3 Å²	38.3	70%	0.696	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	32.6	176.7	-60.2	179.4	-175	0	0	114.3	A157 I158 S163	A157-E161 PolarHBondContact O-N 3.44Å; A157-E161 VanDerWaalsContact O-N 3.11Å; I158-E161 PolarHBondContact O-N 3.49Å; E161-S163 VanDerWaalsContact C-N 3.28Å; E161-S163 PolarHBondContact O-N 3.32Å
162	R	97.6	Very high	97.1	Very high	90 Å²	90	40.4 Å²	40.4	34%	0.34	20%	0.195	S	C	.	.			trans	-84.9	65.5	179.6	-51.3	-50.6	-171.3	-169.2	1.1	111.2	A125 H126 A157 R160 S164 C165 V166	A125-R162 WeakPolarHBondContact O-CG 3.19Å; H126-R162 PolarHBondContact O-NE 3.3Å; A157-R162 HydrophobicContact CB-CB 4.19Å; A157-R162 PolarHBondContact O-N 2.84Å; R160-R162 HydrophobicContact CB-CG 3.94Å; R160-R162 VanDerWaalsContact O-CD 3.26Å; R160-R162 WeakPolarHBondContact O-CD 3.35Å; R160-R162 PolarHBondContact O-N 3.48Å; R160-R162 PolarHBondContact O-NE 3.01Å; R162-S164 PolarHBondContact O-N 3.24Å; R162-C165 HydrophobicContact CB-CB 3.94Å; R162-C165 WeakPolarHBondContact O-CB 3.37Å; R162-C165 PolarHBondContact O-N 3.06Å; R162-V166 WeakPolarHBondContact O-CG2 3.29Å; R162-V166 PolarHBondContact O-N 3.43Å
163	S	96	Very high	96.7	Very high	57 Å²	57	46.3 Å²	46.3	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-50.9	-36.2	-173.2	-71.6	0	0	0	0	114.7	E161 V166 K167 Y195	E161-S163 VanDerWaalsContact C-N 3.28Å; E161-S163 PolarHBondContact O-N 3.32Å; S163-V166 PolarHBondContact O-N 3.11Å; S163-K167 WeakPolarHBondContact O-CG 3.44Å; S163-K167 PolarHBondContact O-N 3.31Å; S163-K167 VanDerWaalsContact O-N 3.11Å; S163-Y195 PolarHBondContact N-OH 3.46Å; S163-Y195 WeakPolarHBondContact OG-CE1 3.49Å; S163-Y195 PolarHBondContact OG-OH 3.49Å
164	S	97.5	Very high	96.6	Very high	45 Å²	45	46.4 Å²	46.4	32%	0.315	23%	0.227	S	C	.	.	H	α-helix	trans	-69	-46.8	177.5	-175.8	0	0	0	0	112	D130 R162 V166 K167 I168	D130-S164 VanDerWaalsContact CG-CB 3.47Å; D130-S164 WeakPolarHBondContact OD1-CB 3.39Å; D130-S164 PolarHBondContact OD1-OG 3.48Å; D130-S164 WeakPolarHBondContact OD2-CB 3.4Å; D130-S164 PolarHBondContact OD2-OG 3.38Å; R162-S164 PolarHBondContact O-N 3.24Å; S164-V166 VanDerWaalsContact C-N 3.3Å; S164-V166 PolarHBondContact O-N 2.6Å; S164-K167 PolarHBondContact O-N 2.92Å; S164-I168 WeakPolarHBondContact O-CD1 3.04Å; S164-I168 VanDerWaalsContact O-CG1 3.25Å; S164-I168 WeakPolarHBondContact O-CG1 3.25Å; S164-I168 PolarHBondContact O-N 2.94Å
165	C	98.3	Very high	96.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-40.2	170.9	-73.3	0	0	0	0	112.5	D130 A157 R162 K167 I168 L169	D130-C165 PolarHBondContact OD1-N 3.31Å; D130-C165 PolarHBondContact OD1-SG 3.48Å; A157-C165 HydrophobicContact CB-CB 3.99Å; R162-C165 HydrophobicContact CB-CB 3.94Å; R162-C165 WeakPolarHBondContact O-CB 3.37Å; R162-C165 PolarHBondContact O-N 3.06Å; C165-K167 PolarHBondContact O-N 3.37Å; C165-I168 PolarHBondContact O-N 3.09Å; C165-L169 WeakPolarHBondContact O-CB 3.44Å; C165-L169 WeakPolarHBondContact O-CG 3.49Å; C165-L169 PolarHBondContact O-N 3.42Å
166	V	97.6	Very high	96.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-48.4	176.5	177.1	0	0	0	0	110.8	L154 A157 I158 R162 S163 S164 I168 L169 L170 M198 F199	L154-V166 HydrophobicContact CD1-CB 4.32Å; L154-V166 HydrophobicContact CD1-CG1 3.83Å; L154-V166 HydrophobicContact CD1-CG2 4.42Å; A157-V166 HydrophobicContact CB-CG2 3.71Å; I158-V166 HydrophobicContact CG1-CG1 4.19Å; I158-V166 HydrophobicContact CG1-CG2 3.68Å; R162-V166 WeakPolarHBondContact O-CG2 3.29Å; R162-V166 PolarHBondContact O-N 3.43Å; S163-V166 PolarHBondContact O-N 3.11Å; S164-V166 VanDerWaalsContact C-N 3.3Å; S164-V166 PolarHBondContact O-N 2.6Å; V166-I168 PolarHBondContact O-N 3.17Å; V166-L169 PolarHBondContact O-N 2.91Å; V166-L170 HydrophobicContact CG1-CD1 3.91Å; V166-L170 WeakPolarHBondContact O-CB 3.48Å; V166-L170 VanDerWaalsContact O-CG 3.29Å; V166-L170 WeakPolarHBondContact O-CG 3.05Å; V166-L170 PolarHBondContact O-N 3.01Å; V166-M198 HydrophobicContact CB-CE 4.18Å; V166-M198 HydrophobicContact CG1-CE 3.29Å; V166-F199 HydrophobicContact CG1-CE1 3.95Å
167	K	96.4	Very high	96.1	Very high	110 Å²	110	49.9 Å²	49.9	48%	0.478	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-47.8	176.6	-70.5	173.7	-176.9	-179.9	0	111.5	S163 S164 C165 L169 L170 D171 M198	S163-K167 WeakPolarHBondContact O-CG 3.44Å; S163-K167 PolarHBondContact O-N 3.31Å; S163-K167 VanDerWaalsContact O-N 3.11Å; S164-K167 PolarHBondContact O-N 2.92Å; C165-K167 PolarHBondContact O-N 3.37Å; K167-L169 PolarHBondContact O-N 3.04Å; K167-L170 PolarHBondContact O-N 3.29Å; K167-D171 WeakPolarHBondContact O-CB 3.29Å; K167-D171 PolarHBondContact O-N 3.28Å; K167-M198 HydrophobicContact CG-SD 3.82Å
168	I	97.9	Very high	95.8	Very high	4 Å²	4	51 Å²	51	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-48.5	179.9	-65	160.9	0	0	0	111.1	D130 V133 R134 L137 S164 C165 V166 L170 D171 H172	D130-I168 HydrophobicContact CB-CD1 3.76Å; V133-I168 HydrophobicContact CG1-CB 4.33Å; V133-I168 HydrophobicContact CG1-CG2 3.68Å; R134-I168 HydrophobicContact CG-CD1 4.18Å; R134-I168 HydrophobicContact CG-CG1 4.33Å; R134-I168 HydrophobicContact CG-CG2 3.76Å; R134-I168 VanDerWaalsContact CZ-CD1 3.43Å; R134-I168 VanDerWaalsContact NH1-CG1 3.34Å; L137-I168 HydrophobicContact CD1-CG2 3.78Å; S164-I168 WeakPolarHBondContact O-CD1 3.04Å; S164-I168 VanDerWaalsContact O-CG1 3.25Å; S164-I168 WeakPolarHBondContact O-CG1 3.25Å; S164-I168 PolarHBondContact O-N 2.94Å; C165-I168 PolarHBondContact O-N 3.09Å; V166-I168 PolarHBondContact O-N 3.17Å; I168-L170 PolarHBondContact O-N 3.43Å; I168-D171 PolarHBondContact O-N 3.05Å; I168-H172 PolarHBondContact O-CD2 3.41Å; I168-H172 VanDerWaalsContact O-CD2 3.28Å; I168-H172 PolarHBondContact O-N 2.86Å; I168-H172 VanDerWaalsContact O-N 3.08Å
169	L	98.1	Very high	95.5	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-43.7	-179.3	-72.9	165.3	0	0	0	111.4	L121 A125 V133 L137 P153 L154 A157 C165 V166 K167 D171 H172 N173 A174	L121-L169 HydrophobicContact CD1-CD2 4.24Å; L121-L169 HydrophobicContact CD2-CD2 4.09Å; L121-L169 HydrophobicContact CG-CD2 4.34Å; A125-L169 HydrophobicContact CB-CD1 4.3Å; V133-L169 HydrophobicContact CG1-CD2 4.06Å; V133-L169 HydrophobicContact CG1-CG 4.13Å; L137-L169 HydrophobicContact CD1-CD2 4.25Å; P153-L169 HydrophobicContact CB-CD1 4.28Å; P153-L169 HydrophobicContact CB-CD2 4.45Å; L154-L169 HydrophobicContact CB-CD1 4.14Å; L154-L169 HydrophobicContact CD1-CB 4.13Å; L154-L169 HydrophobicContact CD1-CD1 4.33Å; A157-L169 HydrophobicContact CB-CD1 4.25Å; C165-L169 WeakPolarHBondContact O-CB 3.44Å; C165-L169 WeakPolarHBondContact O-CG 3.49Å; C165-L169 PolarHBondContact O-N 3.42Å; V166-L169 PolarHBondContact O-N 2.91Å; K167-L169 PolarHBondContact O-N 3.04Å; L169-D171 VanDerWaalsContact C-N 3.35Å; L169-D171 PolarHBondContact O-N 2.88Å; L169-H172 CarbonylContact O-C 3.58Å; L169-H172 VanDerWaalsContact O-C 3.32Å; L169-H172 PolarHBondContact O-N 2.93Å; L169-H172 VanDerWaalsContact O-N 3.13Å; L169-N173 PolarHBondContact O-N 3.41Å; L169-A174 HydrophobicContact CB-CB 4.01Å; L169-A174 WeakPolarHBondContact O-CB 3.43Å; L169-A174 PolarHBondContact O-N 3.4Å
170	L	94.9	Very high	95.3	Very high	18 Å²	18	54.2 Å²	54.2	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-35.9	175.9	-67.8	172.4	0	0	0	112.5	L154 V166 K167 I168 H172 N173 I176 M198 F199 R202	L154-L170 HydrophobicContact CD1-CD2 4.47Å; L154-L170 HydrophobicContact CD1-CG 4.25Å; L154-L170 HydrophobicContact CD2-CD2 3.68Å; L154-L170 HydrophobicContact CD2-CG 4.32Å; V166-L170 HydrophobicContact CG1-CD1 3.91Å; V166-L170 WeakPolarHBondContact O-CB 3.48Å; V166-L170 VanDerWaalsContact O-CG 3.29Å; V166-L170 WeakPolarHBondContact O-CG 3.05Å; V166-L170 PolarHBondContact O-N 3.01Å; K167-L170 PolarHBondContact O-N 3.29Å; I168-L170 PolarHBondContact O-N 3.43Å; L170-H172 PolarHBondContact O-N 3.01Å; L170-N173 PolarHBondContact O-N 3.11Å; L170-I176 HydrophobicContact CD2-CB 4.11Å; L170-I176 HydrophobicContact CD2-CD1 4.01Å; L170-I176 HydrophobicContact CD2-CG1 4Å; L170-M198 HydrophobicContact CD1-CE 4.45Å; L170-F199 HydrophobicContact CD1-CD1 4.2Å; L170-F199 HydrophobicContact CD1-CE1 4.21Å; L170-R202 HydrophobicContact CD1-CG 4.34Å
171	D	94	Very high	95.1	Very high	96 Å²	96	49 Å²	49	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-23.5	174.6	-65.5	-13.8	0	0	0	111.9	K167 I168 L169 R202	K167-D171 WeakPolarHBondContact O-CB 3.29Å; K167-D171 PolarHBondContact O-N 3.28Å; I168-D171 PolarHBondContact O-N 3.05Å; L169-D171 VanDerWaalsContact C-N 3.35Å; L169-D171 PolarHBondContact O-N 2.88Å; D171-R202 IonicContact OD1-CZ 2.65Å; D171-R202 IonicContact OD1-NH1 3.12Å; D171-R202 PolarHBondContact OD1-NH1 3.15Å; D171-R202 IonicContact OD1-NH2 2.59Å; D171-R202 PolarHBondContact OD1-NH2 3.27Å
172	H	95.3	Very high	95	Very high	75 Å²	75	45 Å²	45	35%	0.347	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	29.8	174.5	-77.3	-95	0	0	0	113.1	L137 I168 L169 L170 A174	L137-H172 HydrophobicContact CD1-CB 3.83Å; L137-H172 HydrophobicContact CD2-CB 4.17Å; L137-H172 HydrophobicContact CG-CB 4.41Å; I168-H172 PolarHBondContact O-CD2 3.41Å; I168-H172 VanDerWaalsContact O-CD2 3.28Å; I168-H172 PolarHBondContact O-N 2.86Å; I168-H172 VanDerWaalsContact O-N 3.08Å; L169-H172 CarbonylContact O-C 3.58Å; L169-H172 VanDerWaalsContact O-C 3.32Å; L169-H172 PolarHBondContact O-N 2.93Å; L169-H172 VanDerWaalsContact O-N 3.13Å; L170-H172 PolarHBondContact O-N 3.01Å; H172-A174 VanDerWaalsContact C-N 3.34Å; H172-A174 PolarHBondContact O-N 3.5Å
173	N	91.9	Very high	94.9	Very high	123 Å²	123	40.7 Å²	40.7	66%	0.658	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	26.6	171	-57.9	102.8	0	0	0	115.7	L169 L170 N175	L169-N173 PolarHBondContact O-N 3.41Å; L170-N173 PolarHBondContact O-N 3.11Å; N173-N175 PolarHBondContact O-N 3.3Å
174	A	95.8	Very high	94.9	Very high	2 Å²	2	38 Å²	38	2%	0.017	19%	0.194	C	C	.	.			trans	-57.4	132.7	167.4	0	0	0	0	0	110.4	V143 L154 L169 H172 I176	V143-A174 HydrophobicContact CG1-CB 3.58Å; L154-A174 HydrophobicContact CB-CB 4.38Å; L154-A174 HydrophobicContact CD2-CB 3.7Å; L169-A174 HydrophobicContact CB-CB 4.01Å; L169-A174 WeakPolarHBondContact O-CB 3.43Å; L169-A174 PolarHBondContact O-N 3.4Å; H172-A174 VanDerWaalsContact C-N 3.34Å; H172-A174 PolarHBondContact O-N 3.5Å; A174-I176 PolarHBondContact O-N 3.26Å; A174-I176 VanDerWaalsContact O-N 3.11Å
175	N	94.8	Very high	94.9	Very high	65 Å²	65	36.7 Å²	36.7	35%	0.348	18%	0.182	S	C	.	.			trans	-69.7	109.4	-175.8	-177.3	-0.4	0	0	0	111	D144 N173 D177 I178	D144-N175 PolarHBondContact OD1-N 3.34Å; D144-N175 WeakPolarHBondContact OD2-CB 3.49Å; D144-N175 PolarHBondContact OD2-N 2.94Å; N173-N175 PolarHBondContact O-N 3.3Å; N175-D177 VanDerWaalsContact C-N 3.28Å; N175-D177 PolarHBondContact O-N 2.9Å; N175-D177 PolarHBondContact OD1-N 3.35Å; N175-I178 HydrophobicContact CB-CB 4.26Å; N175-I178 HydrophobicContact CB-CD1 4.49Å; N175-I178 WeakPolarHBondContact O-CB 3.34Å; N175-I178 VanDerWaalsContact O-CG2 3.31Å; N175-I178 WeakPolarHBondContact O-CG2 3.47Å; N175-I178 PolarHBondContact O-N 3.44Å; N175-I178 PolarHBondContact OD1-N 3.08Å
176	I	94.1	Very high	94.7	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-24.9	-177.7	-156.7	168.6	0	0	0	113.4	L170 A174 L183 F199 R202 A204	L170-I176 HydrophobicContact CD2-CB 4.11Å; L170-I176 HydrophobicContact CD2-CD1 4.01Å; L170-I176 HydrophobicContact CD2-CG1 4Å; A174-I176 PolarHBondContact O-N 3.26Å; A174-I176 VanDerWaalsContact O-N 3.11Å; I176-L183 HydrophobicContact CG1-CD1 4.1Å; I176-L183 WeakPolarHBondContact O-CD1 3.31Å; I176-L183 WeakPolarHBondContact O-CG 3.16Å; I176-F199 HydrophobicContact CD1-CB 3.78Å; I176-F199 HydrophobicContact CD1-CD1 3.92Å; I176-F199 HydrophobicContact CD1-CG 4.15Å; I176-F199 WeakPolarHBondContact CD1-O 3.27Å; I176-F199 HydrophobicContact CG1-CB 4.36Å; I176-F199 HydrophobicContact CG1-CD1 4.26Å; I176-F199 HydrophobicContact CG1-CG 4.44Å; I176-R202 HydrophobicContact CD1-CB 3.67Å; I176-A204 HydrophobicContact CD1-CB 4.02Å; I176-A204 HydrophobicContact CG1-CB 4.18Å; I176-A204 HydrophobicContact CG2-CB 4.27Å
177	D	94.7	Very high	94.7	Very high	29 Å²	29	39.1 Å²	39.1	16%	0.155	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	13.9	-178	-64.6	-43.3	0	0	0	112	N175 N180 G181 A204 D205 L208 Q293	N175-D177 VanDerWaalsContact C-N 3.28Å; N175-D177 PolarHBondContact O-N 2.9Å; N175-D177 PolarHBondContact OD1-N 3.35Å; D177-N180 PolarHBondContact O-N 3.39Å; D177-G181 PolarHBondContact O-N 2.92Å; D177-A204 WeakPolarHBondContact OD1-CA 3.4Å; D177-D205 PolarHBondContact OD1-N 3.41Å; D177-L208 HydrophobicContact CB-CD1 3.74Å; D177-Q293 PolarHBondContact OD2-NE2 3.18Å
178	I	91.3	Very high	94.7	Very high	23 Å²	23	33.9 Å²	33.9	12%	0.118	17%	0.169	C	C	.	.	H	α-helix	trans	-54.1	143.4	176.9	-165.3	137.3	0	0	0	111.3	D144 T152 N175 N180 G181 F182 L183	D144-I178 HydrophobicContact CB-CD1 4.02Å; T152-I178 HydrophobicContact CG2-CD1 3.52Å; T152-I178 HydrophobicContact CG2-CG1 4.12Å; T152-I178 HydrophobicContact CG2-CG2 4.45Å; N175-I178 HydrophobicContact CB-CB 4.26Å; N175-I178 HydrophobicContact CB-CD1 4.49Å; N175-I178 WeakPolarHBondContact O-CB 3.34Å; N175-I178 VanDerWaalsContact O-CG2 3.31Å; N175-I178 WeakPolarHBondContact O-CG2 3.47Å; N175-I178 PolarHBondContact O-N 3.44Å; N175-I178 PolarHBondContact OD1-N 3.08Å; I178-N180 VanDerWaalsContact C-N 3.27Å; I178-N180 PolarHBondContact O-N 2.65Å; I178-G181 PolarHBondContact O-N 3.46Å; I178-F182 PolarHBondContact O-N 3.17Å; I178-L183 HydrophobicContact CG2-CG 4.49Å
179	Q	90.4	Very high	94.6	Very high	87 Å²	87	36.9 Å²	36.9	41%	0.407	18%	0.184	S	C	.	.	H	α-helix	trans	52.6	48.6	-175.3	-63.6	-178.1	-26.7	0	0	112.2	G150 G181 F182 R185	G150-Q179 PolarHBondContact O-NE2 3.12Å; Q179-G181 VanDerWaalsContact C-N 3.34Å; Q179-G181 PolarHBondContact O-N 3.11Å; Q179-F182 HydrophobicContact CB-CB 4.19Å; Q179-R185 PolarHBondContact O-NH2 3.25Å
180	N	92.2	Very high	94.5	Very high	52 Å²	52	42.7 Å²	42.7	28%	0.278	21%	0.209	S	C	.	.	H	α-helix	trans	57.6	44.9	176	-167.5	19.2	0	0	0	111.3	D177 I178 R185 L208 G209 L211	D177-N180 PolarHBondContact O-N 3.39Å; I178-N180 VanDerWaalsContact C-N 3.27Å; I178-N180 PolarHBondContact O-N 2.65Å; N180-R185 PolarHBondContact O-NH1 3.33Å; N180-R185 PolarHBondContact O-NH2 3.32Å; N180-L208 WeakPolarHBondContact O-CB 3.14Å; N180-L208 WeakPolarHBondContact OD1-CD2 3.43Å; N180-G209 PolarHBondContact ND2-O 3.04Å; N180-L211 HydrophobicContact CB-CD2 4.49Å; N180-L211 HydrophobicContact CB-CG 4.49Å; N180-L211 WeakPolarHBondContact ND2-CD2 3.42Å
181	G	91.8	Very high	94.5	Very high	2 Å²	2	43.9 Å²	43.9	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	79.8	31.1	176.5	0	0	0	0	0	115.6	D177 I178 Q179 L183 R185	D177-G181 PolarHBondContact O-N 2.92Å; I178-G181 PolarHBondContact O-N 3.46Å; Q179-G181 VanDerWaalsContact C-N 3.34Å; Q179-G181 PolarHBondContact O-N 3.11Å; G181-L183 VanDerWaalsContact C-N 3.25Å; G181-L183 PolarHBondContact O-N 3.35Å; G181-R185 PolarHBondContact O-N 3.28Å
182	F	93.6	Very high	94.5	Very high	66 Å²	66	41.4 Å²	41.4	29%	0.289	21%	0.205	S	C	.	.	H	α-helix	trans	-54.1	-41.3	179.3	174.5	-87.2	0	0	0	112.6	Q155 I178 Q179 R185 Y186	Q155-F182 HydrophobicContact CG-CD1 3.97Å; Q155-F182 HydrophobicContact CG-CE1 4.18Å; Q155-F182 VanDerWaalsContact NE2-CD1 3.33Å; I178-F182 PolarHBondContact O-N 3.17Å; Q179-F182 HydrophobicContact CB-CB 4.19Å; F182-R185 PolarHBondContact O-N 2.93Å; F182-Y186 HydrophobicContact CE1-CD2 4.03Å; F182-Y186 HydrophobicContact CE1-CG 4.09Å; F182-Y186 AromaticContact CZ-CD2 3.71Å; F182-Y186 HydrophobicContact CZ-CD2 3.71Å; F182-Y186 HydrophobicContact CZ-CE2 4.47Å; F182-Y186 HydrophobicContact CZ-CG 4.23Å; F182-Y186 VanDerWaalsContact O-CB 3.3Å; F182-Y186 WeakPolarHBondContact O-CB 3.31Å; F182-Y186 PolarHBondContact O-N 2.87Å
183	L	95.6	Very high	94.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-49.8	-171.2	-52.5	-173.2	0	0	0	112.7	L154 Q155 I158 I176 I178 G181 Y186 A187 F199	L154-L183 HydrophobicContact CD2-CD1 3.36Å; L154-L183 HydrophobicContact CG-CD1 3.78Å; Q155-L183 HydrophobicContact CB-CD2 4.44Å; Q155-L183 HydrophobicContact CG-CD2 3.43Å; Q155-L183 VanDerWaalsContact CG-CD2 3.43Å; I158-L183 HydrophobicContact CD1-CB 4.09Å; I158-L183 HydrophobicContact CD1-CD1 3.84Å; I158-L183 HydrophobicContact CD1-CD2 3.48Å; I158-L183 VanDerWaalsContact CD1-CD2 3.48Å; I158-L183 HydrophobicContact CD1-CG 3.99Å; I176-L183 HydrophobicContact CG1-CD1 4.1Å; I176-L183 WeakPolarHBondContact O-CD1 3.31Å; I176-L183 WeakPolarHBondContact O-CG 3.16Å; I178-L183 HydrophobicContact CG2-CG 4.49Å; G181-L183 VanDerWaalsContact C-N 3.25Å; G181-L183 PolarHBondContact O-N 3.35Å; L183-Y186 PolarHBondContact O-N 2.85Å; L183-A187 PolarHBondContact O-N 3.29Å; L183-F199 HydrophobicContact CB-CD2 4.23Å; L183-F199 HydrophobicContact CB-CE2 3.96Å; L183-F199 HydrophobicContact CB-CZ 4.34Å; L183-F199 WeakPolarHBondContact O-CE2 3.39Å
184	L	97.1	Very high	94.6	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-45	179.7	180	59	0	0	0	111	Y186 A187 V188 F199 L200 A204 T206 P217 L233	L184-Y186 PolarHBondContact O-N 2.86Å; L184-A187 PolarHBondContact O-N 3.3Å; L184-V188 WeakPolarHBondContact O-CG2 3.39Å; L184-V188 PolarHBondContact O-N 2.96Å; L184-F199 HydrophobicContact CD1-CB 4.4Å; L184-L200 HydrophobicContact CD1-CD2 4.04Å; L184-L200 HydrophobicContact CD1-CG 4.07Å; L184-L200 HydrophobicContact CD2-CD2 3.81Å; L184-A204 HydrophobicContact CB-CB 4.18Å; L184-A204 HydrophobicContact CD2-CB 4Å; L184-T206 HydrophobicContact CD2-CG2 4.39Å; L184-P217 HydrophobicContact CD2-CB 4.24Å; L184-P217 HydrophobicContact CD2-CG 3.82Å; L184-P217 HydrophobicContact CG-CB 4.24Å; L184-P217 HydrophobicContact CG-CG 3.99Å; L184-L233 HydrophobicContact CD1-CD2 4.19Å; L184-L233 HydrophobicContact CD2-CD2 3.95Å; L184-L233 HydrophobicContact CG-CD2 4.28Å
185	R	96.3	Very high	94.6	Very high	16 Å²	16	39.3 Å²	39.3	6%	0.06	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-42	176.3	-68.6	-170	-62.5	-113.4	-1.1	112.6	Q179 N180 G181 F182 A187 V188 I189 L208 G209 R210 P217 L220	Q179-R185 PolarHBondContact O-NH2 3.25Å; N180-R185 PolarHBondContact O-NH1 3.33Å; N180-R185 PolarHBondContact O-NH2 3.32Å; G181-R185 PolarHBondContact O-N 3.28Å; F182-R185 PolarHBondContact O-N 2.93Å; R185-A187 VanDerWaalsContact C-N 3.33Å; R185-A187 PolarHBondContact O-N 3.04Å; R185-V188 PolarHBondContact O-N 3.18Å; R185-I189 VanDerWaalsContact O-CG1 3.29Å; R185-I189 WeakPolarHBondContact O-CG1 3.44Å; R185-I189 PolarHBondContact O-N 2.9Å; R185-L208 PolarHBondContact NH1-O 3.43Å; R185-G209 PolarHBondContact NH1-O 3.46Å; R185-R210 VanDerWaalsContact CD-CG 3.4Å; R185-P217 HydrophobicContact CG-CG 3.8Å; R185-L220 HydrophobicContact CB-CD1 3.76Å; R185-L220 HydrophobicContact CG-CD1 3.82Å
186	Y	95.8	Very high	94.7	Very high	52 Å²	52	36.2 Å²	36.2	20%	0.204	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-43.8	177.1	-176.7	-89.4	0	0	0	111.3	I158 I159 F182 L183 L184 V188 I189 K190	I158-Y186 HydrophobicContact CG2-CD1 3.81Å; I158-Y186 HydrophobicContact CG2-CE1 4.05Å; I159-Y186 HydrophobicContact CG1-CE1 4.36Å; I159-Y186 HydrophobicContact CG1-CE2 4.25Å; F182-Y186 HydrophobicContact CE1-CD2 4.03Å; F182-Y186 HydrophobicContact CE1-CG 4.09Å; F182-Y186 AromaticContact CZ-CD2 3.71Å; F182-Y186 HydrophobicContact CZ-CD2 3.71Å; F182-Y186 HydrophobicContact CZ-CE2 4.47Å; F182-Y186 HydrophobicContact CZ-CG 4.23Å; F182-Y186 VanDerWaalsContact O-CB 3.3Å; F182-Y186 WeakPolarHBondContact O-CB 3.31Å; F182-Y186 PolarHBondContact O-N 2.87Å; L183-Y186 PolarHBondContact O-N 2.85Å; L184-Y186 PolarHBondContact O-N 2.86Å; Y186-V188 VanDerWaalsContact C-N 3.34Å; Y186-V188 PolarHBondContact O-N 2.88Å; Y186-I189 PolarHBondContact O-N 3.45Å; Y186-K190 HydrophobicContact CD1-CG 4.1Å; Y186-K190 HydrophobicContact CE1-CG 3.67Å; Y186-K190 HydrophobicContact CE2-CG 4.4Å; Y186-K190 WeakPolarHBondContact O-CB 3.29Å; Y186-K190 WeakPolarHBondContact O-CG 3.36Å; Y186-K190 PolarHBondContact O-N 3.03Å; Y186-K190 WeakPolarHBondContact OH-CE 3.46Å
187	A	96.6	Very high	94.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-41.9	176	0	0	0	0	0	112.2	L183 L184 R185 K190 S191 N192 C196 F199	L183-A187 PolarHBondContact O-N 3.29Å; L184-A187 PolarHBondContact O-N 3.3Å; R185-A187 VanDerWaalsContact C-N 3.33Å; R185-A187 PolarHBondContact O-N 3.04Å; A187-K190 CarbonylContact O-C 3.18Å; A187-K190 PolarHBondContact O-N 3.25Å; A187-S191 PolarHBondContact O-N 3.26Å; A187-N192 PolarHBondContact O-N 2.96Å; A187-C196 VanDerWaalsContact CB-SG 3.57Å; A187-F199 HydrophobicContact CB-CD2 4.18Å; A187-F199 HydrophobicContact CB-CE2 3.95Å
188	V	97	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-45.7	175.2	175	0	0	0	0	111.6	L184 R185 Y186 K190 S191 P217 L220 L233	L184-V188 WeakPolarHBondContact O-CG2 3.39Å; L184-V188 PolarHBondContact O-N 2.96Å; R185-V188 PolarHBondContact O-N 3.18Å; Y186-V188 VanDerWaalsContact C-N 3.34Å; Y186-V188 PolarHBondContact O-N 2.88Å; V188-K190 PolarHBondContact O-N 3.48Å; V188-S191 PolarHBondContact O-N 3.37Å; V188-P217 HydrophobicContact CG2-CB 4.36Å; V188-L220 HydrophobicContact CG1-CB 3.87Å; V188-L233 HydrophobicContact CG2-CD1 4.12Å
189	I	95.6	Very high	94.8	Very high	66 Å²	66	38 Å²	38	34%	0.338	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-34.9	178	-70.6	164.7	0	0	0	111.4	R185 Y186 S191 L220 R224	R185-I189 VanDerWaalsContact O-CG1 3.29Å; R185-I189 WeakPolarHBondContact O-CG1 3.44Å; R185-I189 PolarHBondContact O-N 2.9Å; Y186-I189 PolarHBondContact O-N 3.45Å; I189-S191 VanDerWaalsContact C-N 3.32Å; I189-L220 HydrophobicContact CD1-CD1 4.06Å; I189-L220 HydrophobicContact CG1-CD1 4.06Å; I189-R224 PolarHBondContact O-NE 2.89Å; I189-R224 PolarHBondContact O-NH1 3.42Å; I189-R224 PolarHBondContact O-NH2 3.47Å
190	K	95.6	Very high	95	Very high	123 Å²	123	33.9 Å²	33.9	54%	0.535	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-2	176.1	-64.1	-57.3	-174.8	-178.7	0	113.7	Y186 A187 V188 N192	Y186-K190 HydrophobicContact CD1-CG 4.1Å; Y186-K190 HydrophobicContact CE1-CG 3.67Å; Y186-K190 HydrophobicContact CE2-CG 4.4Å; Y186-K190 WeakPolarHBondContact O-CB 3.29Å; Y186-K190 WeakPolarHBondContact O-CG 3.36Å; Y186-K190 PolarHBondContact O-N 3.03Å; Y186-K190 WeakPolarHBondContact OH-CE 3.46Å; A187-K190 CarbonylContact O-C 3.18Å; A187-K190 PolarHBondContact O-N 3.25Å; V188-K190 PolarHBondContact O-N 3.48Å; K190-N192 HydrophobicContact CB-CB 4.48Å; K190-N192 PolarHBondContact O-N 3.46Å
191	S	94.8	Very high	94.9	Very high	42 Å²	42	35.5 Å²	35.5	29%	0.294	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	36.5	-172.9	-64	0	0	0	0	112.4	A187 V188 I189 H193 D226	A187-S191 PolarHBondContact O-N 3.26Å; V188-S191 PolarHBondContact O-N 3.37Å; I189-S191 VanDerWaalsContact C-N 3.32Å; S191-H193 PolarHBondContact O-N 3.46Å; S191-D226 WeakPolarHBondContact CB-OD2 3.3Å; S191-D226 PolarHBondContact OG-OD2 3.07Å; S191-D226 VanDerWaalsContact OG-OD2 3.06Å
192	N	95.1	Very high	94.8	Very high	44 Å²	44	39.4 Å²	39.4	24%	0.235	19%	0.19	C	C	.	.			trans	-89.8	84.8	177.5	-172.6	-29.6	0	0	0	109.3	A187 K190 S194 Y195 C196	A187-N192 PolarHBondContact O-N 2.96Å; K190-N192 HydrophobicContact CB-CB 4.48Å; K190-N192 PolarHBondContact O-N 3.46Å; N192-S194 PolarHBondContact O-N 3.24Å; N192-S194 PolarHBondContact OD1-N 3.36Å; N192-Y195 HydrophobicContact CB-CD2 4.47Å; N192-Y195 VanDerWaalsContact ND2-CD2 3.29Å; N192-Y195 WeakPolarHBondContact ND2-CD2 3.47Å; N192-Y195 PolarHBondContact O-N 3.14Å; N192-Y195 VanDerWaalsContact O-N 3.13Å; N192-Y195 PolarHBondContact OD1-N 3.06Å; N192-C196 PolarHBondContact O-N 3.45Å; N192-C196 PolarHBondContact O-SG 3.5Å; N192-C196 VanDerWaalsContact O-SG 3.41Å
193	H	94.8	Very high	94.7	Very high	60 Å²	60	36.3 Å²	36.3	28%	0.278	18%	0.176	S	C	.	.	H	α-helix	trans	-57.9	-34.8	-177.5	-57.4	137.2	0	0	0	113.1	S191 Y195 C196 R197 D226 C229 M232	S191-H193 PolarHBondContact O-N 3.46Å; H193-Y195 PolarHBondContact O-N 2.95Å; H193-C196 PolarHBondContact O-N 3.16Å; H193-R197 WeakPolarHBondContact O-CB 3.49Å; H193-R197 PolarHBondContact O-N 3.05Å; H193-D226 IonicContact CD2-OD1 3.86Å; H193-D226 IonicContact CD2-OD2 3.3Å; H193-D226 IonicContact CE1-OD1 3.08Å; H193-D226 IonicContact NE2-OD1 3.83Å; H193-D226 PolarHBondContact NE2-OD1 3.32Å; H193-D226 IonicContact NE2-OD2 2.67Å; H193-D226 PolarHBondContact NE2-OD2 3.33Å; H193-D226 VanDerWaalsContact NE2-OD2 3.08Å; H193-C229 PolarHBondContact CD2-SG 3.43Å; H193-M232 HydrophobicContact CB-CE 3.91Å
194	S	94.3	Very high	94.7	Very high	88 Å²	88	36.6 Å²	36.6	62%	0.615	18%	0.179	S	C	*	.	H	α-helix	trans	-62.4	-43.2	177.1	-60.5	0	0	0	0	112.2	N192 M198	N192-S194 PolarHBondContact O-N 3.24Å; N192-S194 PolarHBondContact OD1-N 3.36Å; S194-M198 VanDerWaalsContact O-CB 3.29Å; S194-M198 WeakPolarHBondContact O-CB 3.45Å; S194-M198 PolarHBondContact O-N 2.97Å
195	Y	95.4	Very high	94.6	Very high	8 Å²	8	38.9 Å²	38.9	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-72.4	-40.1	174.7	-77.7	-11.3	0	0	0	112.4	I158 S163 N192 H193 R197 M198 F199	I158-Y195 HydrophobicContact CB-CE2 4.43Å; I158-Y195 HydrophobicContact CG2-CD2 4.01Å; I158-Y195 HydrophobicContact CG2-CE2 3.92Å; S163-Y195 PolarHBondContact N-OH 3.46Å; S163-Y195 WeakPolarHBondContact OG-CE1 3.49Å; S163-Y195 PolarHBondContact OG-OH 3.49Å; N192-Y195 HydrophobicContact CB-CD2 4.47Å; N192-Y195 VanDerWaalsContact ND2-CD2 3.29Å; N192-Y195 WeakPolarHBondContact ND2-CD2 3.47Å; N192-Y195 PolarHBondContact O-N 3.14Å; N192-Y195 VanDerWaalsContact O-N 3.13Å; N192-Y195 PolarHBondContact OD1-N 3.06Å; H193-Y195 PolarHBondContact O-N 2.95Å; Y195-R197 PolarHBondContact O-N 3.03Å; Y195-M198 HydrophobicContact CD1-CE 3.54Å; Y195-M198 HydrophobicContact CE1-CE 3.8Å; Y195-M198 PolarHBondContact O-N 3.5Å; Y195-F199 HydrophobicContact CD2-CZ 4.49Å; Y195-F199 HydrophobicContact CG-CE2 4.44Å; Y195-F199 HydrophobicContact CG-CZ 4.15Å; Y195-F199 WeakPolarHBondContact O-CB 3.47Å; Y195-F199 WeakPolarHBondContact O-CD2 3.16Å; Y195-F199 WeakPolarHBondContact O-CG 3.36Å; Y195-F199 PolarHBondContact O-N 2.77Å
196	C	96.1	Very high	94.6	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-53.6	-55	172.4	-67.8	0	0	0	0	110.6	A187 N192 H193 M198 F199 L200 M232	A187-C196 VanDerWaalsContact CB-SG 3.57Å; N192-C196 PolarHBondContact O-N 3.45Å; N192-C196 PolarHBondContact O-SG 3.5Å; N192-C196 VanDerWaalsContact O-SG 3.41Å; H193-C196 PolarHBondContact O-N 3.16Å; C196-M198 PolarHBondContact O-N 3.02Å; C196-F199 PolarHBondContact O-N 2.9Å; C196-L200 WeakPolarHBondContact O-CB 3.29Å; C196-L200 WeakPolarHBondContact O-CG 3.48Å; C196-L200 PolarHBondContact O-N 3.21Å; C196-M232 HydrophobicContact CB-CE 3.84Å; C196-M232 HydrophobicContact CB-SD 4.45Å
197	R	94.4	Very high	94.6	Very high	65 Å²	65	38 Å²	38	25%	0.245	19%	0.191	C	C	.	.	H	α-helix	trans	-57.1	-49.8	178.4	-175.3	-168.9	-62.2	-103	16.2	112.1	H193 Y195 F199 L200 Q201 M232 D316 D317 I318	H193-R197 WeakPolarHBondContact O-CB 3.49Å; H193-R197 PolarHBondContact O-N 3.05Å; Y195-R197 PolarHBondContact O-N 3.03Å; R197-F199 VanDerWaalsContact C-N 3.31Å; R197-F199 PolarHBondContact O-N 3.06Å; R197-L200 PolarHBondContact O-N 3.45Å; R197-Q201 HydrophobicContact CG-CG 4.43Å; R197-Q201 WeakPolarHBondContact O-CB 3.41Å; R197-Q201 VanDerWaalsContact O-CG 3.29Å; R197-Q201 WeakPolarHBondContact O-CG 3.46Å; R197-Q201 PolarHBondContact O-N 3.37Å; R197-M232 HydrophobicContact CB-SD 3.99Å; R197-D316 PolarHBondContact NH1-O 2.54Å; R197-D317 VanDerWaalsContact NH1-C 3.26Å; R197-D317 PolarHBondContact NH1-O 3.36Å; R197-D317 PolarHBondContact NH2-O 3.45Å; R197-I318 PolarHBondContact NH1-O 3.36Å; R197-I318 PolarHBondContact NH2-O 2.88Å; R197-I318 PolarHBondContact NH2-OXT 3.03Å
198	M	93.4	Very high	94.6	Very high	24 Å²	24	39.8 Å²	39.8	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-44	180	-177.6	171.2	66	0	0	111.3	V166 K167 L170 S194 Y195 C196 R202	V166-M198 HydrophobicContact CB-CE 4.18Å; V166-M198 HydrophobicContact CG1-CE 3.29Å; K167-M198 HydrophobicContact CG-SD 3.82Å; L170-M198 HydrophobicContact CD1-CE 4.45Å; S194-M198 VanDerWaalsContact O-CB 3.29Å; S194-M198 WeakPolarHBondContact O-CB 3.45Å; S194-M198 PolarHBondContact O-N 2.97Å; Y195-M198 HydrophobicContact CD1-CE 3.54Å; Y195-M198 HydrophobicContact CE1-CE 3.8Å; Y195-M198 PolarHBondContact O-N 3.5Å; C196-M198 PolarHBondContact O-N 3.02Å; M198-R202 WeakPolarHBondContact O-CB 3.26Å; M198-R202 WeakPolarHBondContact O-CG 3.48Å; M198-R202 PolarHBondContact O-N 2.86Å
199	F	95.1	Very high	94.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-41.5	-179.3	-60.1	-27.5	0	0	0	112.4	I158 V166 L170 I176 L183 L184 A187 Y195 C196 R197 Q201 R202 G203 A204	I158-F199 HydrophobicContact CD1-CE1 4.01Å; I158-F199 HydrophobicContact CD1-CE2 4.17Å; I158-F199 HydrophobicContact CD1-CZ 3.38Å; I158-F199 HydrophobicContact CG1-CZ 3.83Å; V166-F199 HydrophobicContact CG1-CE1 3.95Å; L170-F199 HydrophobicContact CD1-CD1 4.2Å; L170-F199 HydrophobicContact CD1-CE1 4.21Å; I176-F199 HydrophobicContact CD1-CB 3.78Å; I176-F199 HydrophobicContact CD1-CD1 3.92Å; I176-F199 HydrophobicContact CD1-CG 4.15Å; I176-F199 WeakPolarHBondContact CD1-O 3.27Å; I176-F199 HydrophobicContact CG1-CB 4.36Å; I176-F199 HydrophobicContact CG1-CD1 4.26Å; I176-F199 HydrophobicContact CG1-CG 4.44Å; L183-F199 HydrophobicContact CB-CD2 4.23Å; L183-F199 HydrophobicContact CB-CE2 3.96Å; L183-F199 HydrophobicContact CB-CZ 4.34Å; L183-F199 WeakPolarHBondContact O-CE2 3.39Å; L184-F199 HydrophobicContact CD1-CB 4.4Å; A187-F199 HydrophobicContact CB-CD2 4.18Å; A187-F199 HydrophobicContact CB-CE2 3.95Å; Y195-F199 HydrophobicContact CD2-CZ 4.49Å; Y195-F199 HydrophobicContact CG-CE2 4.44Å; Y195-F199 HydrophobicContact CG-CZ 4.15Å; Y195-F199 WeakPolarHBondContact O-CB 3.47Å; Y195-F199 WeakPolarHBondContact O-CD2 3.16Å; Y195-F199 WeakPolarHBondContact O-CG 3.36Å; Y195-F199 PolarHBondContact O-N 2.77Å; C196-F199 PolarHBondContact O-N 2.9Å; R197-F199 VanDerWaalsContact C-N 3.31Å; R197-F199 PolarHBondContact O-N 3.06Å; F199-Q201 PolarHBondContact O-N 3.26Å; F199-R202 CarbonylContact O-C 3.53Å; F199-R202 WeakPolarHBondContact O-CA 3.33Å; F199-R202 PolarHBondContact O-N 3.31Å; F199-R202 VanDerWaalsContact O-N 3.14Å; F199-G203 PolarHBondContact O-N 3.45Å; F199-A204 HydrophobicContact CB-CB 3.9Å; F199-A204 WeakPolarHBondContact O-CB 3.5Å; F199-A204 PolarHBondContact O-N 3Å
200	L	94.1	Very high	94.4	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-42.5	176.3	-68.5	174.2	0	0	0	112.3	L184 C196 R197 R202 G203 T206 M232 L233 Y236 R287	L184-L200 HydrophobicContact CD1-CD2 4.04Å; L184-L200 HydrophobicContact CD1-CG 4.07Å; L184-L200 HydrophobicContact CD2-CD2 3.81Å; C196-L200 WeakPolarHBondContact O-CB 3.29Å; C196-L200 WeakPolarHBondContact O-CG 3.48Å; C196-L200 PolarHBondContact O-N 3.21Å; R197-L200 PolarHBondContact O-N 3.45Å; L200-R202 VanDerWaalsContact C-N 3.26Å; L200-R202 PolarHBondContact O-N 2.91Å; L200-G203 PolarHBondContact O-N 3.36Å; L200-T206 HydrophobicContact CD2-CG2 3.37Å; L200-M232 HydrophobicContact CD1-CB 3.88Å; L200-L233 HydrophobicContact CD1-CD2 4.33Å; L200-L233 HydrophobicContact CD2-CD2 4.14Å; L200-Y236 HydrophobicContact CB-CD1 3.6Å; L200-Y236 HydrophobicContact CB-CD2 3.88Å; L200-Y236 HydrophobicContact CB-CE1 3.77Å; L200-Y236 HydrophobicContact CB-CE2 4.05Å; L200-Y236 HydrophobicContact CB-CG 3.64Å; L200-Y236 HydrophobicContact CD1-CD2 3.9Å; L200-Y236 HydrophobicContact CD1-CE2 4.41Å; L200-Y236 HydrophobicContact CD1-CG 4.16Å; L200-Y236 HydrophobicContact CD2-CG 4.21Å; L200-Y236 HydrophobicContact CG-CD2 4.39Å; L200-Y236 HydrophobicContact CG-CG 4.21Å; L200-Y236 WeakPolarHBondContact O-CD1 3.43Å; L200-Y236 WeakPolarHBondContact O-CE1 3.4Å; L200-R287 PolarHBondContact O-NH2 3.06Å
201	Q	90.8	Very high	94.3	Very high	87 Å²	87	40.6 Å²	40.6	41%	0.407	21%	0.209	S	C	.	.	H	α-helix	trans	-60.7	-36.6	173.3	-75.3	177.4	-17.1	0	0	112.2	R197 F199 G203 Y236	R197-Q201 HydrophobicContact CG-CG 4.43Å; R197-Q201 WeakPolarHBondContact O-CB 3.41Å; R197-Q201 VanDerWaalsContact O-CG 3.29Å; R197-Q201 WeakPolarHBondContact O-CG 3.46Å; R197-Q201 PolarHBondContact O-N 3.37Å; F199-Q201 PolarHBondContact O-N 3.26Å; Q201-G203 PolarHBondContact O-N 3.03Å; Q201-Y236 HydrophobicContact CG-CE1 4.42Å; Q201-Y236 WeakPolarHBondContact CG-OH 3.24Å
202	R	90.2	Very high	94.2	Very high	84 Å²	84	45.2 Å²	45.2	32%	0.317	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3	176.2	-64.2	-69.6	-177.8	104.1	-5.1	113.8	L170 D171 I176 M198 F199 L200	L170-R202 HydrophobicContact CD1-CG 4.34Å; D171-R202 IonicContact OD1-CZ 2.65Å; D171-R202 IonicContact OD1-NH1 3.12Å; D171-R202 PolarHBondContact OD1-NH1 3.15Å; D171-R202 IonicContact OD1-NH2 2.59Å; D171-R202 PolarHBondContact OD1-NH2 3.27Å; I176-R202 HydrophobicContact CD1-CB 3.67Å; M198-R202 WeakPolarHBondContact O-CB 3.26Å; M198-R202 WeakPolarHBondContact O-CG 3.48Å; M198-R202 PolarHBondContact O-N 2.86Å; F199-R202 CarbonylContact O-C 3.53Å; F199-R202 WeakPolarHBondContact O-CA 3.33Å; F199-R202 PolarHBondContact O-N 3.31Å; F199-R202 VanDerWaalsContact O-N 3.14Å; L200-R202 VanDerWaalsContact C-N 3.26Å; L200-R202 PolarHBondContact O-N 2.91Å
203	G	91.7	Very high	94.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.01	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	36.8	174.3	0	0	0	0	0	114.6	F199 L200 Q201 L292 Q293	F199-G203 PolarHBondContact O-N 3.45Å; L200-G203 PolarHBondContact O-N 3.36Å; Q201-G203 PolarHBondContact O-N 3.03Å; G203-L292 WeakPolarHBondContact CA-O 3.4Å; G203-L292 WeakPolarHBondContact O-CB 3.27Å; G203-Q293 PolarHBondContact O-NE2 3.4Å
204	A	94.9	Very high	94.3	Very high	6 Å²	6	42.3 Å²	42.3	5%	0.05	21%	0.214	C	C	.	.			trans	-62.1	135.7	163	0	0	0	0	0	110.6	I176 D177 L184 F199 T206	I176-A204 HydrophobicContact CD1-CB 4.02Å; I176-A204 HydrophobicContact CG1-CB 4.18Å; I176-A204 HydrophobicContact CG2-CB 4.27Å; D177-A204 WeakPolarHBondContact OD1-CA 3.4Å; L184-A204 HydrophobicContact CB-CB 4.18Å; L184-A204 HydrophobicContact CD2-CB 4Å; F199-A204 HydrophobicContact CB-CB 3.9Å; F199-A204 WeakPolarHBondContact O-CB 3.5Å; F199-A204 PolarHBondContact O-N 3Å; A204-T206 PolarHBondContact O-N 3.27Å
205	D	95.3	Very high	94.4	Very high	49 Å²	49	38.7 Å²	38.7	26%	0.262	19%	0.187	S	C	.	.			trans	-74.7	118.3	175.9	-174.3	-14.9	0	0	0	110.1	D177 N207 L208 L292	D177-D205 PolarHBondContact OD1-N 3.41Å; D205-N207 PolarHBondContact O-N 3.26Å; D205-N207 PolarHBondContact OD1-N 3.11Å; D205-L208 HydrophobicContact CB-CD1 3.85Å; D205-L208 HydrophobicContact CB-CD2 4.47Å; D205-L208 HydrophobicContact CB-CG 3.78Å; D205-L292 HydrophobicContact CB-CD1 3.97Å
206	T	96.1	Very high	94.5	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.031	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-14.4	-178	48.6	0	0	0	0	114.2	L184 L200 A204 P217 L233 G237 A238	L184-T206 HydrophobicContact CD2-CG2 4.39Å; L200-T206 HydrophobicContact CD2-CG2 3.37Å; A204-T206 PolarHBondContact O-N 3.27Å; T206-P217 WeakPolarHBondContact O-CD 3.39Å; T206-L233 HydrophobicContact CG2-CD2 4.1Å; T206-G237 VanDerWaalsContact OG1-C 3.26Å; T206-G237 PolarHBondContact OG1-O 3.45Å; T206-A238 HydrophobicContact CG2-CB 4.47Å; T206-A238 WeakPolarHBondContact OG1-CA 3.32Å; T206-A238 PolarHBondContact OG1-N 3.25Å
207	N	96.1	Very high	94.6	Very high	45 Å²	45	38.4 Å²	38.4	24%	0.241	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	2.4	-169.4	-61.5	-56.5	0	0	0	113.7	D205 G209 G237 A238 D239	D205-N207 PolarHBondContact O-N 3.26Å; D205-N207 PolarHBondContact OD1-N 3.11Å; N207-G209 PolarHBondContact O-N 3.39Å; N207-G209 VanDerWaalsContact O-N 3.11Å; N207-G237 PolarHBondContact ND2-O 3.34Å; N207-A238 WeakPolarHBondContact OD1-CA 3.37Å; N207-D239 PolarHBondContact OD1-N 2.96Å
208	L	95.9	Very high	94.8	Very high	37 Å²	37	35.3 Å²	35.3	19%	0.194	18%	0.175	C	C	.	.			trans	-71.9	106.6	177.4	-61.1	179.9	0	0	0	111.1	D177 N180 R185 D205 P217	D177-L208 HydrophobicContact CB-CD1 3.74Å; N180-L208 WeakPolarHBondContact O-CB 3.14Å; N180-L208 WeakPolarHBondContact OD1-CD2 3.43Å; R185-L208 PolarHBondContact NH1-O 3.43Å; D205-L208 HydrophobicContact CB-CD1 3.85Å; D205-L208 HydrophobicContact CB-CD2 4.47Å; D205-L208 HydrophobicContact CB-CG 3.78Å; L208-P217 WeakPolarHBondContact O-CD 3.42Å
209	G	94.4	Very high	95	Very high	15 Å²	15	34.1 Å²	34.1	16%	0.155	17%	0.169	C	C	.	.			trans	-75.9	149.3	176.9	0	0	0	0	0	112.8	N180 R185 N207 Q215	N180-G209 PolarHBondContact ND2-O 3.04Å; R185-G209 PolarHBondContact NH1-O 3.46Å; N207-G209 PolarHBondContact O-N 3.39Å; N207-G209 VanDerWaalsContact O-N 3.11Å; G209-Q215 WeakPolarHBondContact CA-O 3.33Å
210	R	94	Very high	95.1	Very high	72 Å²	72	34.6 Å²	34.6	27%	0.272	17%	0.171	S	C	.	.			trans	-59.6	145.9	172.7	-74	-159.5	-54.4	155.3	-17.3	111.5	R185 E212 D213 G214 Q215	R185-R210 VanDerWaalsContact CD-CG 3.4Å; R210-E212 WeakPolarHBondContact CB-OE2 3.42Å; R210-E212 IonicContact NH1-OE2 3.69Å; R210-E212 PolarHBondContact O-N 2.6Å; R210-D213 WeakPolarHBondContact CB-OD1 3.46Å; R210-D213 IonicContact CZ-OD1 3.88Å; R210-D213 VanDerWaalsContact CZ-OD1 3.3Å; R210-D213 IonicContact CZ-OD2 2.83Å; R210-D213 IonicContact NE-OD1 3.77Å; R210-D213 PolarHBondContact NE-OD1 3.25Å; R210-D213 IonicContact NE-OD2 3.46Å; R210-D213 IonicContact NH2-OD1 2.87Å; R210-D213 PolarHBondContact NH2-OD1 3.24Å; R210-D213 IonicContact NH2-OD2 3.67Å; R210-D213 PolarHBondContact NH2-OD2 3.38Å; R210-G214 VanDerWaalsContact O-CA 3.22Å; R210-G214 WeakPolarHBondContact O-CA 3.45Å; R210-G214 PolarHBondContact O-N 2.81Å; R210-Q215 PolarHBondContact N-O 3.36Å
211	L	92.6	Very high	95.2	Very high	118 Å²	118	34.5 Å²	34.5	62%	0.618	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.9	179.7	-67.5	177.3	0	0	0	112.2	N180 Y245	N180-L211 HydrophobicContact CB-CD2 4.49Å; N180-L211 HydrophobicContact CB-CG 4.49Å; N180-L211 WeakPolarHBondContact ND2-CD2 3.42Å; L211-Y245 WeakPolarHBondContact O-CE2 3.25Å; L211-Y245 PolarHBondContact O-OH 2.67Å
212	E	94.3	Very high	95.5	Very high	139 Å²	139	30.4 Å²	30.4	65%	0.65	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-37.2	-175	-55.9	80.2	-171	0	0	113	R210	R210-E212 WeakPolarHBondContact CB-OE2 3.42Å; R210-E212 IonicContact NH1-OE2 3.69Å; R210-E212 PolarHBondContact O-N 2.6Å
213	D	94.8	Very high	95.7	Very high	36 Å²	36	30 Å²	30	19%	0.193	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.3	1.9	-171.8	67.1	-6.5	0	0	0	115	R210 Q215 N244 Y245	R210-D213 WeakPolarHBondContact CB-OD1 3.46Å; R210-D213 IonicContact CZ-OD1 3.88Å; R210-D213 VanDerWaalsContact CZ-OD1 3.3Å; R210-D213 IonicContact CZ-OD2 2.83Å; R210-D213 IonicContact NE-OD1 3.77Å; R210-D213 PolarHBondContact NE-OD1 3.25Å; R210-D213 IonicContact NE-OD2 3.46Å; R210-D213 IonicContact NH2-OD1 2.87Å; R210-D213 PolarHBondContact NH2-OD1 3.24Å; R210-D213 IonicContact NH2-OD2 3.67Å; R210-D213 PolarHBondContact NH2-OD2 3.38Å; D213-Q215 HydrophobicContact CB-CG 4.33Å; D213-Q215 PolarHBondContact O-N 3.3Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.11Å; D213-Q215 VanDerWaalsContact OD1-CG 3.24Å; D213-Q215 WeakPolarHBondContact OD1-CG 3.42Å; D213-Q215 PolarHBondContact OD1-N 3.26Å; D213-Q215 VanDerWaalsContact OD1-N 3.15Å; D213-Q215 WeakPolarHBondContact OD2-CG 3.45Å; D213-N244 WeakPolarHBondContact O-CB 3.41Å; D213-Y245 PolarHBondContact O-N 2.76Å
214	G	96.2	Very high	95.7	Very high	7 Å²	7	36.3 Å²	36.3	7%	0.072	18%	0.179	C	C	.	.			trans	73.5	4.3	179.4	0	0	0	0	0	114.7	R210 T216	R210-G214 VanDerWaalsContact O-CA 3.22Å; R210-G214 WeakPolarHBondContact O-CA 3.45Å; R210-G214 PolarHBondContact O-N 2.81Å; G214-T216 PolarHBondContact O-N 2.72Å; G214-T216 VanDerWaalsContact O-N 3.17Å
215	Q	96.9	Very high	95.7	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.056	19%	0.189	C	C	.	.			trans	-66	118.3	-179.2	-61	-78.3	33.7	0	0	110.3	G209 R210 D213 H219 L220 N244	G209-Q215 WeakPolarHBondContact CA-O 3.33Å; R210-Q215 PolarHBondContact N-O 3.36Å; D213-Q215 HydrophobicContact CB-CG 4.33Å; D213-Q215 PolarHBondContact O-N 3.3Å; D213-Q215 WeakPolarHBondContact OD1-CB 3.11Å; D213-Q215 VanDerWaalsContact OD1-CG 3.24Å; D213-Q215 WeakPolarHBondContact OD1-CG 3.42Å; D213-Q215 PolarHBondContact OD1-N 3.26Å; D213-Q215 VanDerWaalsContact OD1-N 3.15Å; D213-Q215 WeakPolarHBondContact OD2-CG 3.45Å; Q215-H219 HydrophobicContact CB-CB 4.01Å; Q215-H219 HydrophobicContact CG-CB 4.47Å; Q215-H219 PolarHBondContact OE1-CD2 2.82Å; Q215-L220 HydrophobicContact CB-CD2 4.04Å; Q215-L220 HydrophobicContact CB-CG 4.37Å; Q215-N244 VanDerWaalsContact CD-ND2 3.28Å; Q215-N244 HydrophobicContact CG-CB 4.47Å; Q215-N244 PolarHBondContact NE2-ND2 3.19Å; Q215-N244 PolarHBondContact OE1-ND2 3.42Å
216	T	97.9	Very high	95.6	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.181	C	C	.	.			trans	-75.7	165.2	172.1	70.2	0	0	0	0	110.8	G214 L218 H219 L220 T242	G214-T216 PolarHBondContact O-N 2.72Å; G214-T216 VanDerWaalsContact O-N 3.17Å; T216-L218 PolarHBondContact O-N 3.01Å; T216-L218 VanDerWaalsContact O-N 3.1Å; T216-L218 PolarHBondContact OG1-N 3.24Å; T216-H219 PolarHBondContact N-ND1 3.27Å; T216-H219 WeakPolarHBondContact O-CB 3.26Å; T216-H219 PolarHBondContact O-N 2.7Å; T216-H219 PolarHBondContact OG1-ND1 3.33Å; T216-L220 PolarHBondContact O-N 3.22Å; T216-L220 VanDerWaalsContact O-N 3.14Å; T216-T242 HydrophobicContact CG2-CG2 3.62Å
217	P	98.1	Very high	95.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.013	19%	0.189	C	C	.	.	H	α-helix	trans	-45.3	-38.9	169.4	-30.8	33	0	0	0	114.2	L184 R185 V188 T206 L208 L220 S221 L233	L184-P217 HydrophobicContact CD2-CB 4.24Å; L184-P217 HydrophobicContact CD2-CG 3.82Å; L184-P217 HydrophobicContact CG-CB 4.24Å; L184-P217 HydrophobicContact CG-CG 3.99Å; R185-P217 HydrophobicContact CG-CG 3.8Å; V188-P217 HydrophobicContact CG2-CB 4.36Å; T206-P217 WeakPolarHBondContact O-CD 3.39Å; L208-P217 WeakPolarHBondContact O-CD 3.42Å; P217-L220 PolarHBondContact O-N 3.19Å; P217-S221 PolarHBondContact O-N 3.23Å; P217-L233 VanDerWaalsContact C-CD1 3.46Å; P217-L233 HydrophobicContact CB-CD1 3.77Å; P217-L233 HydrophobicContact CB-CD2 3.62Å; P217-L233 HydrophobicContact CB-CG 4.36Å; P217-L233 WeakPolarHBondContact O-CD1 3.42Å
218	L	98.1	Very high	95.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.5	-33.2	-178.8	-170.8	62.5	0	0	0	112.8	T216 L220 S221 A222 A230 L233 A238 T240 P250 L268	T216-L218 PolarHBondContact O-N 3.01Å; T216-L218 VanDerWaalsContact O-N 3.1Å; T216-L218 PolarHBondContact OG1-N 3.24Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-S221 WeakPolarHBondContact CA-OG 3.37Å; L218-S221 PolarHBondContact O-OG 3.13Å; L218-A222 WeakPolarHBondContact O-CB 3.49Å; L218-A222 PolarHBondContact O-N 3.1Å; L218-A222 VanDerWaalsContact O-N 3.07Å; L218-A230 HydrophobicContact CD1-CB 4.01Å; L218-L233 HydrophobicContact CB-CD1 4.42Å; L218-L233 HydrophobicContact CD1-CB 4.19Å; L218-L233 HydrophobicContact CD1-CD1 4.4Å; L218-A238 HydrophobicContact CB-CB 4.14Å; L218-A238 HydrophobicContact CD2-CB 3.92Å; L218-A238 HydrophobicContact CG-CB 4.46Å; L218-T240 HydrophobicContact CD2-CG2 3.97Å; L218-P250 HydrophobicContact CB-CB 4.44Å; L218-P250 HydrophobicContact CB-CG 4.15Å; L218-P250 HydrophobicContact CD2-CB 4.15Å; L218-P250 HydrophobicContact CD2-CG 3.92Å; L218-P250 HydrophobicContact CG-CB 3.85Å; L218-P250 HydrophobicContact CG-CG 3.91Å; L218-L268 HydrophobicContact CD1-CD2 4.19Å; L218-L268 HydrophobicContact CD2-CD2 4.26Å; L218-L268 HydrophobicContact CG-CD2 4.33Å
219	H	97.8	Very high	95.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-40.1	170	-67.4	88.4	0	0	0	111.4	Q215 T216 A222 L223 T242 Q248 P250	Q215-H219 HydrophobicContact CB-CB 4.01Å; Q215-H219 HydrophobicContact CG-CB 4.47Å; Q215-H219 PolarHBondContact OE1-CD2 2.82Å; T216-H219 PolarHBondContact N-ND1 3.27Å; T216-H219 WeakPolarHBondContact O-CB 3.26Å; T216-H219 PolarHBondContact O-N 2.7Å; T216-H219 PolarHBondContact OG1-ND1 3.33Å; H219-A222 WeakPolarHBondContact O-CB 3.29Å; H219-A222 PolarHBondContact O-N 2.94Å; H219-L223 PolarHBondContact O-N 3.35Å; H219-T242 PolarHBondContact CE1-O 2.85Å; H219-T242 PolarHBondContact NE2-O 2.87Å; H219-Q248 PolarHBondContact NE2-O 2.86Å; H219-P250 VanDerWaalsContact NE2-CD 3.35Å; H219-P250 WeakPolarHBondContact NE2-CD 3.32Å
220	L	96.9	Very high	95.7	Very high	9 Å²	9	37.4 Å²	37.4	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-68.8	-37.7	-179.8	-61	174.9	0	0	0	112	R185 V188 I189 Q215 T216 P217 L218 A222 L223 R224	R185-L220 HydrophobicContact CB-CD1 3.76Å; R185-L220 HydrophobicContact CG-CD1 3.82Å; V188-L220 HydrophobicContact CG1-CB 3.87Å; I189-L220 HydrophobicContact CD1-CD1 4.06Å; I189-L220 HydrophobicContact CG1-CD1 4.06Å; Q215-L220 HydrophobicContact CB-CD2 4.04Å; Q215-L220 HydrophobicContact CB-CG 4.37Å; T216-L220 PolarHBondContact O-N 3.22Å; T216-L220 VanDerWaalsContact O-N 3.14Å; P217-L220 PolarHBondContact O-N 3.19Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L220-A222 VanDerWaalsContact C-N 3.33Å; L220-L223 HydrophobicContact CD2-CD1 4.34Å; L220-R224 WeakPolarHBondContact O-CG 3.49Å; L220-R224 PolarHBondContact O-N 3.14Å
221	S	96.8	Very high	95.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-38.6	172.6	60.2	0	0	0	0	111.4	P217 L218 R224 D225 D226	P217-S221 PolarHBondContact O-N 3.23Å; L218-S221 WeakPolarHBondContact CA-OG 3.37Å; L218-S221 PolarHBondContact O-OG 3.13Å; S221-R224 PolarHBondContact O-N 3.1Å; S221-D225 PolarHBondContact O-N 2.83Å; S221-D225 VanDerWaalsContact O-N 3.1Å; S221-D226 PolarHBondContact O-N 3.11Å
222	A	95.9	Very high	95.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-49.4	174.6	0	0	0	0	0	112.1	L218 H219 L220 R224 D225 P250 I257 L268	L218-A222 WeakPolarHBondContact O-CB 3.49Å; L218-A222 PolarHBondContact O-N 3.1Å; L218-A222 VanDerWaalsContact O-N 3.07Å; H219-A222 WeakPolarHBondContact O-CB 3.29Å; H219-A222 PolarHBondContact O-N 2.94Å; L220-A222 VanDerWaalsContact C-N 3.33Å; A222-R224 PolarHBondContact O-N 3.18Å; A222-R224 VanDerWaalsContact O-N 3.13Å; A222-D225 PolarHBondContact O-N 3.11Å; A222-D225 VanDerWaalsContact O-N 3.08Å; A222-P250 HydrophobicContact CB-CB 4.48Å; A222-P250 WeakPolarHBondContact CB-O 3.28Å; A222-I257 WeakPolarHBondContact O-CD1 3.18Å; A222-L268 HydrophobicContact CB-CD1 3.82Å
223	L	94.1	Very high	96.1	Very high	77 Å²	77	24.8 Å²	24.8	40%	0.403	12%	0.122	S	C	.	.	H	α-helix	trans	-55.2	-29.6	176.3	-79.8	172	0	0	0	113.9	H219 L220 V253	H219-L223 PolarHBondContact O-N 3.35Å; L220-L223 HydrophobicContact CD2-CD1 4.34Å; L223-V253 HydrophobicContact CB-CG1 4.43Å; L223-V253 HydrophobicContact CD1-CG1 4.3Å; L223-V253 HydrophobicContact CD2-CG1 3.26Å; L223-V253 HydrophobicContact CG-CG1 3.36Å
224	R	92.5	Very high	96.1	Very high	132 Å²	132	24.2 Å²	24.2	50%	0.498	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-0.6	-176.2	-63.6	-176.4	68.3	75.1	5	113.3	I189 L220 S221 A222 D226	I189-R224 PolarHBondContact O-NE 2.89Å; I189-R224 PolarHBondContact O-NH1 3.42Å; I189-R224 PolarHBondContact O-NH2 3.47Å; L220-R224 WeakPolarHBondContact O-CG 3.49Å; L220-R224 PolarHBondContact O-N 3.14Å; S221-R224 PolarHBondContact O-N 3.1Å; A222-R224 PolarHBondContact O-N 3.18Å; A222-R224 VanDerWaalsContact O-N 3.13Å; R224-D226 HydrophobicContact CB-CB 4.36Å; R224-D226 PolarHBondContact O-N 3.41Å
225	D	94.6	Very high	96	Very high	50 Å²	50	25.9 Å²	25.9	27%	0.267	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	32.9	-171.3	-161.2	33.8	0	0	0	113.1	S221 A222 V227 P263 C264	S221-D225 PolarHBondContact O-N 2.83Å; S221-D225 VanDerWaalsContact O-N 3.1Å; A222-D225 PolarHBondContact O-N 3.11Å; A222-D225 VanDerWaalsContact O-N 3.08Å; D225-V227 PolarHBondContact O-N 3.03Å; D225-V227 VanDerWaalsContact O-N 3.15Å; D225-P263 WeakPolarHBondContact OD1-CD 3.29Å; D225-P263 WeakPolarHBondContact OD2-CD 3.47Å; D225-C264 WeakPolarHBondContact OD1-CB 3.41Å; D225-C264 PolarHBondContact OD1-N 2.9Å
226	D	94.6	Very high	95.9	Very high	16 Å²	16	26.4 Å²	26.4	9%	0.086	13%	0.126	C	C	.	.			trans	-88	80.9	-179.4	-170	-20.3	0	0	0	109.8	S191 H193 S221 R224 L228 C229 A230	S191-D226 WeakPolarHBondContact CB-OD2 3.3Å; S191-D226 PolarHBondContact OG-OD2 3.07Å; S191-D226 VanDerWaalsContact OG-OD2 3.06Å; H193-D226 IonicContact CD2-OD1 3.86Å; H193-D226 IonicContact CD2-OD2 3.3Å; H193-D226 IonicContact CE1-OD1 3.08Å; H193-D226 IonicContact NE2-OD1 3.83Å; H193-D226 PolarHBondContact NE2-OD1 3.32Å; H193-D226 IonicContact NE2-OD2 2.67Å; H193-D226 PolarHBondContact NE2-OD2 3.33Å; H193-D226 VanDerWaalsContact NE2-OD2 3.08Å; S221-D226 PolarHBondContact O-N 3.11Å; R224-D226 HydrophobicContact CB-CB 4.36Å; R224-D226 PolarHBondContact O-N 3.41Å; D226-L228 VanDerWaalsContact C-N 3.26Å; D226-L228 PolarHBondContact O-N 3.34Å; D226-C229 HydrophobicContact CB-CB 4.1Å; D226-C229 PolarHBondContact O-N 3.38Å; D226-C229 PolarHBondContact OD1-N 2.99Å; D226-C229 PolarHBondContact OD2-SG 3.28Å; D226-A230 PolarHBondContact O-N 2.93Å
227	V	95.2	Very high	95.7	Very high	33 Å²	33	26.8 Å²	26.8	20%	0.2	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-32.8	-176.6	68.4	0	0	0	0	112.9	D225 A230 Q231 P263 C264 F267	D225-V227 PolarHBondContact O-N 3.03Å; D225-V227 VanDerWaalsContact O-N 3.15Å; V227-A230 PolarHBondContact O-N 3.17Å; V227-Q231 HydrophobicContact CG2-CG 4.32Å; V227-Q231 WeakPolarHBondContact O-CB 3.43Å; V227-Q231 VanDerWaalsContact O-CG 3.27Å; V227-Q231 WeakPolarHBondContact O-CG 3.49Å; V227-Q231 PolarHBondContact O-N 3.22Å; V227-P263 HydrophobicContact CB-CB 3.92Å; V227-P263 HydrophobicContact CG1-CB 3.91Å; V227-P263 HydrophobicContact CG2-CB 4.17Å; V227-C264 HydrophobicContact CB-CB 4.41Å; V227-F267 HydrophobicContact CG2-CB 3.92Å; V227-F267 HydrophobicContact CG2-CG 4.31Å
228	L	95.7	Very high	95.6	Very high	81 Å²	81	26.7 Å²	26.7	42%	0.424	13%	0.13	S	C	.	.	H	α-helix	trans	-66.4	-46.1	177.8	-65.9	177.3	0	0	0	110.6	D226 A230 Q231 M232	D226-L228 VanDerWaalsContact C-N 3.26Å; D226-L228 PolarHBondContact O-N 3.34Å; L228-A230 VanDerWaalsContact C-N 3.34Å; L228-A230 PolarHBondContact O-N 3.39Å; L228-Q231 PolarHBondContact O-N 3.38Å; L228-M232 WeakPolarHBondContact O-CG 3.26Å; L228-M232 PolarHBondContact O-N 3.24Å
229	C	96.1	Very high	95.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-45.7	170.5	-84.3	0	0	0	0	111.8	H193 D226 Q231 M232 L233	H193-C229 PolarHBondContact CD2-SG 3.43Å; D226-C229 HydrophobicContact CB-CB 4.1Å; D226-C229 PolarHBondContact O-N 3.38Å; D226-C229 PolarHBondContact OD1-N 2.99Å; D226-C229 PolarHBondContact OD2-SG 3.28Å; C229-Q231 VanDerWaalsContact C-N 3.34Å; C229-Q231 PolarHBondContact O-N 3.33Å; C229-M232 PolarHBondContact O-N 2.94Å; C229-L233 WeakPolarHBondContact O-CB 3.48Å; C229-L233 WeakPolarHBondContact O-CG 3.49Å; C229-L233 PolarHBondContact O-N 3.24Å
230	A	96.7	Very high	95.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-42.3	-178.4	0	0	0	0	0	112.1	L218 D226 V227 L228 L233 Y234 C264 F267	L218-A230 HydrophobicContact CD1-CB 4.01Å; D226-A230 PolarHBondContact O-N 2.93Å; V227-A230 PolarHBondContact O-N 3.17Å; L228-A230 VanDerWaalsContact C-N 3.34Å; L228-A230 PolarHBondContact O-N 3.39Å; A230-L233 PolarHBondContact O-N 2.87Å; A230-Y234 VanDerWaalsContact O-CB 3.3Å; A230-Y234 WeakPolarHBondContact O-CB 3.34Å; A230-Y234 PolarHBondContact O-N 3.46Å; A230-C264 VanDerWaalsContact CB-SG 3.56Å; A230-F267 HydrophobicContact CB-CD1 3.89Å; A230-F267 HydrophobicContact CB-CE1 3.91Å
231	Q	95.8	Very high	95.3	Very high	63 Å²	63	34.8 Å²	34.8	29%	0.294	17%	0.174	S	C	.	.	H	α-helix	trans	-63.3	-47.1	175	-75	173.4	-6.1	0	0	111.7	V227 L228 C229 Y234 N235 F267 I318	V227-Q231 HydrophobicContact CG2-CG 4.32Å; V227-Q231 WeakPolarHBondContact O-CB 3.43Å; V227-Q231 VanDerWaalsContact O-CG 3.27Å; V227-Q231 WeakPolarHBondContact O-CG 3.49Å; V227-Q231 PolarHBondContact O-N 3.22Å; L228-Q231 PolarHBondContact O-N 3.38Å; C229-Q231 VanDerWaalsContact C-N 3.34Å; C229-Q231 PolarHBondContact O-N 3.33Å; Q231-Y234 PolarHBondContact O-N 2.9Å; Q231-N235 WeakPolarHBondContact O-CB 3.26Å; Q231-N235 PolarHBondContact O-N 3.13Å; Q231-N235 PolarHBondContact O-ND2 3.43Å; Q231-F267 HydrophobicContact CB-CZ 4.36Å; Q231-F267 HydrophobicContact CG-CD1 4.41Å; Q231-F267 HydrophobicContact CG-CD2 3.9Å; Q231-F267 HydrophobicContact CG-CE1 4.21Å; Q231-F267 HydrophobicContact CG-CE2 3.67Å; Q231-F267 HydrophobicContact CG-CG 4.27Å; Q231-F267 HydrophobicContact CG-CZ 3.83Å; Q231-I318 HydrophobicContact CB-CG2 4.37Å
232	M	96.1	Very high	95.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-57.7	-52.8	174.1	-74.5	-172.3	-70.6	0	0	111	H193 C196 R197 L200 L228 C229 Y234 N235 Y236 I318	H193-M232 HydrophobicContact CB-CE 3.91Å; C196-M232 HydrophobicContact CB-CE 3.84Å; C196-M232 HydrophobicContact CB-SD 4.45Å; R197-M232 HydrophobicContact CB-SD 3.99Å; L200-M232 HydrophobicContact CD1-CB 3.88Å; L228-M232 WeakPolarHBondContact O-CG 3.26Å; L228-M232 PolarHBondContact O-N 3.24Å; C229-M232 PolarHBondContact O-N 2.94Å; M232-Y234 VanDerWaalsContact C-N 3.31Å; M232-Y234 PolarHBondContact O-N 2.98Å; M232-N235 PolarHBondContact O-N 3.05Å; M232-N235 VanDerWaalsContact O-N 3.14Å; M232-Y236 VanDerWaalsContact O-CD2 3.25Å; M232-Y236 WeakPolarHBondContact O-CD2 3.41Å; M232-Y236 PolarHBondContact O-N 3.43Å; M232-Y236 VanDerWaalsContact O-N 3.07Å; M232-I318 HydrophobicContact CG-CG2 3.98Å
233	L	97.1	Very high	95.4	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-57.9	-44.4	-179.8	-71.3	169.7	0	0	0	111.8	L184 V188 L200 T206 P217 L218 C229 A230 Y236 G237 A238	L184-L233 HydrophobicContact CD1-CD2 4.19Å; L184-L233 HydrophobicContact CD2-CD2 3.95Å; L184-L233 HydrophobicContact CG-CD2 4.28Å; V188-L233 HydrophobicContact CG2-CD1 4.12Å; L200-L233 HydrophobicContact CD1-CD2 4.33Å; L200-L233 HydrophobicContact CD2-CD2 4.14Å; T206-L233 HydrophobicContact CG2-CD2 4.1Å; P217-L233 VanDerWaalsContact C-CD1 3.46Å; P217-L233 HydrophobicContact CB-CD1 3.77Å; P217-L233 HydrophobicContact CB-CD2 3.62Å; P217-L233 HydrophobicContact CB-CG 4.36Å; P217-L233 WeakPolarHBondContact O-CD1 3.42Å; L218-L233 HydrophobicContact CB-CD1 4.42Å; L218-L233 HydrophobicContact CD1-CB 4.19Å; L218-L233 HydrophobicContact CD1-CD1 4.4Å; C229-L233 WeakPolarHBondContact O-CB 3.48Å; C229-L233 WeakPolarHBondContact O-CG 3.49Å; C229-L233 PolarHBondContact O-N 3.24Å; A230-L233 PolarHBondContact O-N 2.87Å; L233-Y236 PolarHBondContact O-N 3.28Å; L233-G237 PolarHBondContact O-N 3.48Å; L233-A238 HydrophobicContact CB-CB 3.96Å; L233-A238 WeakPolarHBondContact O-CB 3.35Å; L233-A238 PolarHBondContact O-N 2.92Å
234	Y	95.8	Very high	95.5	Very high	23 Å²	23	41.7 Å²	41.7	9%	0.09	20%	0.199	C	C	.	.	H	α-helix	trans	-58.6	-53.1	173.9	-178.6	-98	0	0	0	110.5	A230 Q231 M232 Y236 G237 T240 F267 V271 R276	A230-Y234 VanDerWaalsContact O-CB 3.3Å; A230-Y234 WeakPolarHBondContact O-CB 3.34Å; A230-Y234 PolarHBondContact O-N 3.46Å; Q231-Y234 PolarHBondContact O-N 2.9Å; M232-Y234 VanDerWaalsContact C-N 3.31Å; M232-Y234 PolarHBondContact O-N 2.98Å; Y234-Y236 PolarHBondContact O-N 3.03Å; Y234-G237 PolarHBondContact O-N 3.07Å; Y234-T240 HydrophobicContact CD2-CG2 3.76Å; Y234-T240 HydrophobicContact CE2-CG2 3.93Å; Y234-F267 HydrophobicContact CD1-CZ 4.17Å; Y234-F267 AromaticContact CG-CZ 3.91Å; Y234-F267 HydrophobicContact CG-CZ 3.91Å; Y234-V271 HydrophobicContact CD1-CG1 4.36Å; Y234-V271 HydrophobicContact CD2-CB 4.13Å; Y234-V271 HydrophobicContact CD2-CG1 4.38Å; Y234-V271 HydrophobicContact CD2-CG2 4.03Å; Y234-V271 HydrophobicContact CE1-CB 4.44Å; Y234-V271 HydrophobicContact CE1-CG1 4.01Å; Y234-V271 HydrophobicContact CE2-CB 3.58Å; Y234-V271 HydrophobicContact CE2-CG1 4.02Å; Y234-V271 HydrophobicContact CE2-CG2 3.91Å; Y234-R276 HydrophobicContact CE1-CG 4.35Å; Y234-R276 HydrophobicContact CE2-CG 4.19Å; Y234-R276 PolarHBondContact O-NH1 3.14Å; Y234-R276 PolarHBondContact O-NH2 3.17Å; Y234-R276 WeakPolarHBondContact OH-CG 3.18Å
235	N	93.3	Very high	95.8	Very high	42 Å²	42	42.7 Å²	42.7	23%	0.225	20%	0.204	C	C	.	.	H	α-helix	trans	-55.5	-32.2	-178.8	-69.2	-18.7	0	0	0	113.2	Q231 M232 H313 I318	Q231-N235 WeakPolarHBondContact O-CB 3.26Å; Q231-N235 PolarHBondContact O-N 3.13Å; Q231-N235 PolarHBondContact O-ND2 3.43Å; M232-N235 PolarHBondContact O-N 3.05Å; M232-N235 VanDerWaalsContact O-N 3.14Å; N235-H313 PolarHBondContact O-CE1 2.79Å; N235-I318 WeakPolarHBondContact ND2-CD1 3.35Å
236	Y	94.4	Very high	95.8	Very high	23 Å²	23	47.2 Å²	47.2	9%	0.09	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	5.7	179	-77.2	-98.2	0	0	0	115.3	L200 Q201 M232 L233 Y234 H313	L200-Y236 HydrophobicContact CB-CD1 3.6Å; L200-Y236 HydrophobicContact CB-CD2 3.88Å; L200-Y236 HydrophobicContact CB-CE1 3.77Å; L200-Y236 HydrophobicContact CB-CE2 4.05Å; L200-Y236 HydrophobicContact CB-CG 3.64Å; L200-Y236 HydrophobicContact CD1-CD2 3.9Å; L200-Y236 HydrophobicContact CD1-CE2 4.41Å; L200-Y236 HydrophobicContact CD1-CG 4.16Å; L200-Y236 HydrophobicContact CD2-CG 4.21Å; L200-Y236 HydrophobicContact CG-CD2 4.39Å; L200-Y236 HydrophobicContact CG-CG 4.21Å; L200-Y236 WeakPolarHBondContact O-CD1 3.43Å; L200-Y236 WeakPolarHBondContact O-CE1 3.4Å; Q201-Y236 HydrophobicContact CG-CE1 4.42Å; Q201-Y236 WeakPolarHBondContact CG-OH 3.24Å; M232-Y236 VanDerWaalsContact O-CD2 3.25Å; M232-Y236 WeakPolarHBondContact O-CD2 3.41Å; M232-Y236 PolarHBondContact O-N 3.43Å; M232-Y236 VanDerWaalsContact O-N 3.07Å; L233-Y236 PolarHBondContact O-N 3.28Å; Y234-Y236 PolarHBondContact O-N 3.03Å; Y236-H313 AromaticContact CD1-CD2 3.93Å; Y236-H313 AromaticContact CD1-CE1 3.71Å; Y236-H313 AromaticContact CD1-NE2 3.55Å; Y236-H313 AromaticContact CD2-CE1 3.85Å; Y236-H313 HydrophobicContact CE1-CB 4.23Å; Y236-H313 AromaticContact CE1-CD2 3.41Å; Y236-H313 VanDerWaalsContact CE1-CD2 3.41Å; Y236-H313 WeakPolarHBondContact CE1-CD2 3.19Å; Y236-H313 AromaticContact CE1-CE1 3.72Å; Y236-H313 AromaticContact CE1-CG 3.59Å; Y236-H313 AromaticContact CE1-ND1 3.77Å; Y236-H313 AromaticContact CE1-NE2 3.55Å; Y236-H313 AromaticContact CE2-CE1 3.88Å; Y236-H313 AromaticContact CE2-ND1 3.6Å; Y236-H313 AromaticContact CG-CE1 3.8Å; Y236-H313 AromaticContact CZ-CD2 3.81Å; Y236-H313 AromaticContact CZ-CE1 3.81Å; Y236-H313 AromaticContact CZ-CG 3.45Å; Y236-H313 VanDerWaalsContact CZ-CG 3.45Å; Y236-H313 AromaticContact CZ-ND1 3.46Å; Y236-H313 VanDerWaalsContact OH-CB 3.24Å; Y236-H313 WeakPolarHBondContact OH-CB 3.46Å
237	G	94.6	Very high	95.9	Very high	9 Å²	9	48.2 Å²	48.2	9%	0.093	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	19.7	169.1	0	0	0	0	0	115.9	T206 N207 L233 Y234 D239	T206-G237 VanDerWaalsContact OG1-C 3.26Å; T206-G237 PolarHBondContact OG1-O 3.45Å; N207-G237 PolarHBondContact ND2-O 3.34Å; L233-G237 PolarHBondContact O-N 3.48Å; Y234-G237 PolarHBondContact O-N 3.07Å; G237-D239 PolarHBondContact O-N 3Å
238	A	96.6	Very high	96	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	24%	0.24	C	C	.	.			trans	-59.8	131.5	170.4	0	0	0	0	0	111	T206 N207 L218 L233 R276	T206-A238 HydrophobicContact CG2-CB 4.47Å; T206-A238 WeakPolarHBondContact OG1-CA 3.32Å; T206-A238 PolarHBondContact OG1-N 3.25Å; N207-A238 WeakPolarHBondContact OD1-CA 3.37Å; L218-A238 HydrophobicContact CB-CB 4.14Å; L218-A238 HydrophobicContact CD2-CB 3.92Å; L218-A238 HydrophobicContact CG-CB 4.46Å; L233-A238 HydrophobicContact CB-CB 3.96Å; L233-A238 WeakPolarHBondContact O-CB 3.35Å; L233-A238 PolarHBondContact O-N 2.92Å; A238-R276 PolarHBondContact O-NH2 2.94Å
239	D	95.8	Very high	96.1	Very high	67 Å²	67	46.9 Å²	46.9	36%	0.358	23%	0.229	S	C	.	.			trans	-80.2	119.5	174.4	174.5	20.8	0	0	0	110	N207 G237 N241 T242	N207-D239 PolarHBondContact OD1-N 2.96Å; G237-D239 PolarHBondContact O-N 3Å; D239-N241 PolarHBondContact O-N 2.81Å; D239-N241 PolarHBondContact OD1-N 3.11Å; D239-T242 WeakPolarHBondContact CB-OG1 3.46Å; D239-T242 PolarHBondContact OD2-N 2.99Å; D239-T242 PolarHBondContact OD2-OG1 3.38Å
240	T	95.7	Very high	96.1	Very high	13 Å²	13	46.9 Å²	46.9	8%	0.08	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.1	-179.6	55.6	0	0	0	0	113	L218 Y234 P250 V271	L218-T240 HydrophobicContact CD2-CG2 3.97Å; Y234-T240 HydrophobicContact CD2-CG2 3.76Å; Y234-T240 HydrophobicContact CE2-CG2 3.93Å; T240-P250 WeakPolarHBondContact O-CD 3.48Å; T240-V271 HydrophobicContact CG2-CG2 3.85Å
241	N	95	Very high	96.1	Very high	99 Å²	99	48.4 Å²	48.4	53%	0.529	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-2.1	-176.4	-62.8	-51.1	0	0	0	113.6	D239 R243	D239-N241 PolarHBondContact O-N 2.81Å; D239-N241 PolarHBondContact OD1-N 3.11Å; N241-R243 PolarHBondContact O-N 2.85Å
242	T	96.6	Very high	96.1	Very high	34 Å²	34	47.3 Å²	47.3	21%	0.209	24%	0.239	C	C	.	.			trans	-56.9	134.6	174.5	-65	0	0	0	0	109.4	T216 H219 D239 T249 P250	T216-T242 HydrophobicContact CG2-CG2 3.62Å; H219-T242 PolarHBondContact CE1-O 2.85Å; H219-T242 PolarHBondContact NE2-O 2.87Å; D239-T242 WeakPolarHBondContact CB-OG1 3.46Å; D239-T242 PolarHBondContact OD2-N 2.99Å; D239-T242 PolarHBondContact OD2-OG1 3.38Å; T242-T249 WeakPolarHBondContact O-CA 3.27Å; T242-P250 WeakPolarHBondContact O-CD 3.23Å
243	R	97.2	Very high	96.1	Very high	181 Å²	181	47.3 Å²	47.3	68%	0.683	24%	0.239	S	C	*	.			trans	-101.7	133.7	178	-65.6	-176.3	178.9	-161.9	-1.5	110.7	N241 Q248 T249	N241-R243 PolarHBondContact O-N 2.85Å; R243-Q248 VanDerWaalsContact CA-O 3.31Å; R243-Q248 WeakPolarHBondContact CA-O 3.3Å; R243-T249 HydrophobicContact CG-CG2 4.1Å
244	N	96.8	Very high	95.8	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	24%	0.239	C	C	.	.			trans	-71.3	-179.1	167.4	75	7.9	0	0	0	111	D213 Q215 E246 G247 Q248	D213-N244 WeakPolarHBondContact O-CB 3.41Å; Q215-N244 VanDerWaalsContact CD-ND2 3.28Å; Q215-N244 HydrophobicContact CG-CB 4.47Å; Q215-N244 PolarHBondContact NE2-ND2 3.19Å; Q215-N244 PolarHBondContact OE1-ND2 3.42Å; N244-E246 PolarHBondContact O-N 3.16Å; N244-E246 WeakPolarHBondContact OD1-CA 3.16Å; N244-E246 WeakPolarHBondContact OD1-CB 3.29Å; N244-E246 PolarHBondContact OD1-N 3.25Å; N244-G247 PolarHBondContact O-N 3.49Å; N244-G247 PolarHBondContact OD1-N 3.18Å; N244-G247 VanDerWaalsContact OD1-N 3.11Å; N244-Q248 PolarHBondContact N-O 2.93Å; N244-Q248 PolarHBondContact ND2-OE1 3.27Å; N244-Q248 VanDerWaalsContact ND2-OE1 3.12Å; N244-Q248 PolarHBondContact OD1-N 2.62Å; N244-Q248 PolarHBondContact OD1-O 3.19Å
245	Y	97.3	Very high	95.6	Very high	153 Å²	153	50.7 Å²	50.7	60%	0.6	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.3	-178.3	-61.4	-16.2	0	0	0	113.9	L211 D213	L211-Y245 WeakPolarHBondContact O-CE2 3.25Å; L211-Y245 PolarHBondContact O-OH 2.67Å; D213-Y245 PolarHBondContact O-N 2.76Å
246	E	96	Very high	95.2	Very high	145 Å²	145	52.6 Å²	52.6	68%	0.678	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	2.1	170.5	-58.1	-173.2	168.2	0	0	112.4	N244 Q248	N244-E246 PolarHBondContact O-N 3.16Å; N244-E246 WeakPolarHBondContact OD1-CA 3.16Å; N244-E246 WeakPolarHBondContact OD1-CB 3.29Å; N244-E246 PolarHBondContact OD1-N 3.25Å; E246-Q248 VanDerWaalsContact C-N 3.26Å; E246-Q248 HydrophobicContact CB-CG 4.13Å; E246-Q248 PolarHBondContact O-N 2.62Å; E246-Q248 PolarHBondContact OE2-NE2 2.84Å; E246-Q248 PolarHBondContact OE2-OE1 2.87Å
247	G	96.8	Very high	94.7	Very high	36 Å²	36	53.7 Å²	53.7	37%	0.371	28%	0.281	S	S	.	.	S	Bend	trans	76.8	8.2	-179.1	0	0	0	0	0	114.4	N244	N244-G247 PolarHBondContact O-N 3.49Å; N244-G247 PolarHBondContact OD1-N 3.18Å; N244-G247 VanDerWaalsContact OD1-N 3.11Å
248	Q	97.1	Very high	93.7	Very high	56 Å²	56	58.8 Å²	58.8	26%	0.262	32%	0.316	S	S	.	.			trans	-85.3	140.2	-179.1	-55.7	168.8	-30.8	0	0	110.4	H219 R243 N244 E246 A252 V253	H219-Q248 PolarHBondContact NE2-O 2.86Å; R243-Q248 VanDerWaalsContact CA-O 3.31Å; R243-Q248 WeakPolarHBondContact CA-O 3.3Å; N244-Q248 PolarHBondContact N-O 2.93Å; N244-Q248 PolarHBondContact ND2-OE1 3.27Å; N244-Q248 VanDerWaalsContact ND2-OE1 3.12Å; N244-Q248 PolarHBondContact OD1-N 2.62Å; N244-Q248 PolarHBondContact OD1-O 3.19Å; E246-Q248 VanDerWaalsContact C-N 3.26Å; E246-Q248 HydrophobicContact CB-CG 4.13Å; E246-Q248 PolarHBondContact O-N 2.62Å; E246-Q248 PolarHBondContact OE2-NE2 2.84Å; E246-Q248 PolarHBondContact OE2-OE1 2.87Å; Q248-A252 HydrophobicContact CB-CB 4.15Å; Q248-V253 HydrophobicContact CB-CG2 3.71Å
249	T	97.4	Very high	92.7	Very high	30 Å²	30	61.1 Å²	61.1	18%	0.184	34%	0.34	C	S	.	.			trans	-85.6	167.1	166.8	64.1	0	0	0	0	110.6	T242 R243 L251 A252 V253	T242-T249 WeakPolarHBondContact O-CA 3.27Å; R243-T249 HydrophobicContact CG-CG2 4.1Å; T249-L251 PolarHBondContact O-N 3.39Å; T249-A252 PolarHBondContact O-N 3.14Å; T249-A252 PolarHBondContact OG1-N 3.25Å; T249-V253 WeakPolarHBondContact O-CG2 3.29Å; T249-V253 PolarHBondContact O-N 3.4Å
250	P	96.9	Very high	91.5	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-53.8	-38.5	172.7	-27.3	34.7	0	0	0	113	L218 H219 A222 T240 T242 S254 L268	L218-P250 HydrophobicContact CB-CB 4.44Å; L218-P250 HydrophobicContact CB-CG 4.15Å; L218-P250 HydrophobicContact CD2-CB 4.15Å; L218-P250 HydrophobicContact CD2-CG 3.92Å; L218-P250 HydrophobicContact CG-CB 3.85Å; L218-P250 HydrophobicContact CG-CG 3.91Å; H219-P250 VanDerWaalsContact NE2-CD 3.35Å; H219-P250 WeakPolarHBondContact NE2-CD 3.32Å; A222-P250 HydrophobicContact CB-CB 4.48Å; A222-P250 WeakPolarHBondContact CB-O 3.28Å; T240-P250 WeakPolarHBondContact O-CD 3.48Å; T242-P250 WeakPolarHBondContact O-CD 3.23Å; P250-S254 PolarHBondContact O-N 3.34Å; P250-L268 HydrophobicContact CB-CD1 4.2Å; P250-L268 HydrophobicContact CB-CD2 4.45Å
251	L	96.5	Very high	90.7	Very high	32 Å²	32	68.1 Å²	68.1	17%	0.168	39%	0.394	C	S	.	.	H	α-helix	trans	-64	-47.2	174.8	175.6	61.4	0	0	0	111.6	T249 V253 S254 I255 L265 L268 Q269 T272	T249-L251 PolarHBondContact O-N 3.39Å; L251-V253 VanDerWaalsContact C-N 3.3Å; L251-V253 PolarHBondContact O-N 2.86Å; L251-S254 WeakPolarHBondContact O-CB 3.16Å; L251-S254 PolarHBondContact O-N 3.35Å; L251-S254 VanDerWaalsContact O-N 3.13Å; L251-S254 PolarHBondContact O-OG 3.49Å; L251-I255 HydrophobicContact CD1-CD1 4.41Å; L251-I255 HydrophobicContact CG-CD1 4.28Å; L251-I255 WeakPolarHBondContact O-CG1 3.39Å; L251-I255 PolarHBondContact O-N 2.69Å; L251-I255 VanDerWaalsContact O-N 3.09Å; L251-L265 HydrophobicContact CD1-CD1 3.66Å; L251-L268 HydrophobicContact CB-CB 4.31Å; L251-L268 HydrophobicContact CD1-CB 3.91Å; L251-Q269 HydrophobicContact CD1-CB 4.47Å; L251-Q269 HydrophobicContact CD1-CG 3.58Å; L251-T272 HydrophobicContact CB-CG2 4.4Å; L251-T272 HydrophobicContact CD2-CG2 4.19Å
252	A	95.7	Very high	90.3	Very high	41 Å²	41	66 Å²	66	34%	0.339	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-41.6	179.1	0	0	0	0	0	111.8	Q248 T249 I255 S256	Q248-A252 HydrophobicContact CB-CB 4.15Å; T249-A252 PolarHBondContact O-N 3.14Å; T249-A252 PolarHBondContact OG1-N 3.25Å; A252-I255 PolarHBondContact O-N 3.46Å; A252-S256 PolarHBondContact O-N 2.79Å
253	V	94.4	Very high	90.2	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.006	38%	0.384	C	S	.	.	H	α-helix	trans	-59.9	-47.6	173.1	172.8	0	0	0	0	110.6	L223 Q248 T249 L251 I255 S256	L223-V253 HydrophobicContact CB-CG1 4.43Å; L223-V253 HydrophobicContact CD1-CG1 4.3Å; L223-V253 HydrophobicContact CD2-CG1 3.26Å; L223-V253 HydrophobicContact CG-CG1 3.36Å; Q248-V253 HydrophobicContact CB-CG2 3.71Å; T249-V253 WeakPolarHBondContact O-CG2 3.29Å; T249-V253 PolarHBondContact O-N 3.4Å; L251-V253 VanDerWaalsContact C-N 3.3Å; L251-V253 PolarHBondContact O-N 2.86Å; V253-I255 PolarHBondContact O-N 2.84Å; V253-S256 PolarHBondContact O-N 2.68Å; V253-S256 VanDerWaalsContact O-N 3.13Å; V253-S256 PolarHBondContact O-OG 3Å
254	S	92	Very high	90	Very high	2 Å²	2	58 Å²	58	1%	0.014	35%	0.351	C	S	.	.	H	α-helix	trans	-56.3	-37.1	178.8	76.8	0	0	0	0	112.1	P250 L251 I257 R262 L265	P250-S254 PolarHBondContact O-N 3.34Å; L251-S254 WeakPolarHBondContact O-CB 3.16Å; L251-S254 PolarHBondContact O-N 3.35Å; L251-S254 VanDerWaalsContact O-N 3.13Å; L251-S254 PolarHBondContact O-OG 3.49Å; S254-I257 PolarHBondContact O-N 2.86Å; S254-R262 PolarHBondContact O-NH2 3.41Å; S254-L265 WeakPolarHBondContact OG-CD1 3.37Å
255	I	91.2	Very high	90	Very high	92 Å²	92	58.4 Å²	58.4	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-66.9	-32.1	-179.7	-67.4	166.9	0	0	0	113.1	L251 A252 V253 I257 R262 L265	L251-I255 HydrophobicContact CD1-CD1 4.41Å; L251-I255 HydrophobicContact CG-CD1 4.28Å; L251-I255 WeakPolarHBondContact O-CG1 3.39Å; L251-I255 PolarHBondContact O-N 2.69Å; L251-I255 VanDerWaalsContact O-N 3.09Å; A252-I255 PolarHBondContact O-N 3.46Å; V253-I255 PolarHBondContact O-N 2.84Å; I255-I257 PolarHBondContact O-N 3.3Å; I255-R262 PolarHBondContact O-NH2 3.25Å; I255-L265 HydrophobicContact CD1-CD1 4.44Å; I255-L265 HydrophobicContact CG1-CD1 3.49Å; I255-L265 VanDerWaalsContact CG1-CD1 3.49Å
256	S	84.2	Confident	89.8	Confident	83 Å²	83	55.6 Å²	55.6	58%	0.58	35%	0.349	S	S	*	.	H	α-helix	trans	-69.8	-13.6	179.9	68.6	0	0	0	0	114.5	A252 V253	A252-S256 PolarHBondContact O-N 2.79Å; V253-S256 PolarHBondContact O-N 2.68Å; V253-S256 VanDerWaalsContact O-N 3.13Å; V253-S256 PolarHBondContact O-OG 3Å
257	I	84.5	Confident	89.8	Confident	45 Å²	45	49.9 Å²	49.9	23%	0.231	32%	0.321	C	S	.	.	S	Bend	trans	-77.8	140.8	-178.2	-54.7	166.4	0	0	0	110.8	A222 S254 I255 R262	A222-I257 WeakPolarHBondContact O-CD1 3.18Å; S254-I257 PolarHBondContact O-N 2.86Å; I255-I257 PolarHBondContact O-N 3.3Å; I257-R262 PolarHBondContact O-NH1 3.44Å; I257-R262 PolarHBondContact O-NH2 3.21Å
258	S	73.6	Confident	89.8	Confident	117 Å²	117	48.2 Å²	48.2	82%	0.818	30%	0.304	S	S	*	.			trans	-93.9	132.7	172.8	51.1	0	0	0	0	110.9
259	G	75.4	Confident	89.7	Confident	50 Å²	50	48.3 Å²	48.3	52%	0.515	30%	0.304	S	S	.	.			trans	168.3	151	179	0	0	0	0	0	113.2
260	S	71.6	Confident	89.6	Confident	141 Å²	141	52.1 Å²	52.1	99%	0.986	32%	0.32	S	S	*	.	S	Bend	trans	-81.1	-27	-176.3	-48.4	0	0	0	0	113.9
261	S	78.6	Confident	89.4	Confident	86 Å²	86	52.9 Å²	52.9	60%	0.601	33%	0.325	S	S	*	.			trans	-120.2	131.2	173.3	-177.9	0	0	0	0	107.7
262	R	87.4	Confident	89.3	Confident	54 Å²	54	53.5 Å²	53.5	20%	0.204	33%	0.33	C	S	.	.			trans	-139.6	63.8	-174.9	-56.5	173.1	73.9	167.5	12.8	110.8	S254 I255 I257 C264 L265 D266	S254-R262 PolarHBondContact O-NH2 3.41Å; I255-R262 PolarHBondContact O-NH2 3.25Å; I257-R262 PolarHBondContact O-NH1 3.44Å; I257-R262 PolarHBondContact O-NH2 3.21Å; R262-C264 PolarHBondContact O-N 2.88Å; R262-C264 VanDerWaalsContact O-N 3.15Å; R262-L265 HydrophobicContact CB-CB 3.72Å; R262-L265 HydrophobicContact CB-CD2 4.24Å; R262-L265 WeakPolarHBondContact O-CB 3.37Å; R262-L265 PolarHBondContact O-N 3.38Å; R262-D266 PolarHBondContact O-N 3.43Å; R262-D266 VanDerWaalsContact O-N 3.1Å
263	P	93.6	Very high	89.1	Confident	48 Å²	48	60.8 Å²	60.8	31%	0.312	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-30.9	-174	-23.3	36.5	0	0	0	112.9	D225 V227 F267	D225-P263 WeakPolarHBondContact OD1-CD 3.29Å; D225-P263 WeakPolarHBondContact OD2-CD 3.47Å; V227-P263 HydrophobicContact CB-CB 3.92Å; V227-P263 HydrophobicContact CG1-CB 3.91Å; V227-P263 HydrophobicContact CG2-CB 4.17Å; P263-F267 VanDerWaalsContact O-CB 3.3Å; P263-F267 WeakPolarHBondContact O-CB 3.3Å; P263-F267 PolarHBondContact O-N 2.97Å
264	C	93.7	Very high	88.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-72.3	-33.5	176.7	-165.4	0	0	0	0	112.1	D225 V227 A230 R262 L268	D225-C264 WeakPolarHBondContact OD1-CB 3.41Å; D225-C264 PolarHBondContact OD1-N 2.9Å; V227-C264 HydrophobicContact CB-CB 4.41Å; A230-C264 VanDerWaalsContact CB-SG 3.56Å; R262-C264 PolarHBondContact O-N 2.88Å; R262-C264 VanDerWaalsContact O-N 3.15Å; C264-L268 VanDerWaalsContact O-CB 3.3Å; C264-L268 WeakPolarHBondContact O-CB 3.39Å; C264-L268 WeakPolarHBondContact O-CG 3.22Å; C264-L268 PolarHBondContact O-N 2.88Å
265	L	95.1	Very high	88.5	Confident	15 Å²	15	72.3 Å²	72.3	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-63.5	-50.5	172.9	171.8	64.5	0	0	0	110.1	L251 S254 I255 R262 F267 L268 Q269	L251-L265 HydrophobicContact CD1-CD1 3.66Å; S254-L265 WeakPolarHBondContact OG-CD1 3.37Å; I255-L265 HydrophobicContact CD1-CD1 4.44Å; I255-L265 HydrophobicContact CG1-CD1 3.49Å; I255-L265 VanDerWaalsContact CG1-CD1 3.49Å; R262-L265 HydrophobicContact CB-CB 3.72Å; R262-L265 HydrophobicContact CB-CD2 4.24Å; R262-L265 WeakPolarHBondContact O-CB 3.37Å; R262-L265 PolarHBondContact O-N 3.38Å; L265-F267 VanDerWaalsContact C-N 3.34Å; L265-F267 PolarHBondContact O-N 3.22Å; L265-L268 PolarHBondContact O-N 3.45Å; L265-Q269 HydrophobicContact CD1-CG 4.03Å; L265-Q269 HydrophobicContact CG-CG 4.41Å; L265-Q269 WeakPolarHBondContact O-CB 3.45Å; L265-Q269 VanDerWaalsContact O-CG 3.31Å; L265-Q269 WeakPolarHBondContact O-CG 3.39Å; L265-Q269 PolarHBondContact O-N 3.03Å
266	D	94.5	Very high	88.6	Confident	94 Å²	94	69.7 Å²	69.7	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-59.2	-47.1	-178.7	-63.8	-27	0	0	0	110.7	R262 L268 Q269 E270	R262-D266 PolarHBondContact O-N 3.43Å; R262-D266 VanDerWaalsContact O-N 3.1Å; D266-L268 PolarHBondContact O-N 3.26Å; D266-Q269 PolarHBondContact O-N 3.1Å; D266-E270 PolarHBondContact O-N 2.98Å
267	F	95.8	Very high	89	Confident	24 Å²	24	69.5 Å²	69.5	11%	0.105	39%	0.389	C	S	.	.	H	α-helix	trans	-57.6	-50.4	174.7	171.4	-109.8	0	0	0	112.3	V227 A230 Q231 Y234 P263 L265 Q269 E270 V271	V227-F267 HydrophobicContact CG2-CB 3.92Å; V227-F267 HydrophobicContact CG2-CG 4.31Å; A230-F267 HydrophobicContact CB-CD1 3.89Å; A230-F267 HydrophobicContact CB-CE1 3.91Å; Q231-F267 HydrophobicContact CB-CZ 4.36Å; Q231-F267 HydrophobicContact CG-CD1 4.41Å; Q231-F267 HydrophobicContact CG-CD2 3.9Å; Q231-F267 HydrophobicContact CG-CE1 4.21Å; Q231-F267 HydrophobicContact CG-CE2 3.67Å; Q231-F267 HydrophobicContact CG-CG 4.27Å; Q231-F267 HydrophobicContact CG-CZ 3.83Å; Y234-F267 HydrophobicContact CD1-CZ 4.17Å; Y234-F267 AromaticContact CG-CZ 3.91Å; Y234-F267 HydrophobicContact CG-CZ 3.91Å; P263-F267 VanDerWaalsContact O-CB 3.3Å; P263-F267 WeakPolarHBondContact O-CB 3.3Å; P263-F267 PolarHBondContact O-N 2.97Å; L265-F267 VanDerWaalsContact C-N 3.34Å; L265-F267 PolarHBondContact O-N 3.22Å; F267-Q269 VanDerWaalsContact C-N 3.32Å; F267-Q269 PolarHBondContact O-N 3.31Å; F267-E270 WeakPolarHBondContact O-CB 3.45Å; F267-E270 PolarHBondContact O-N 3.27Å; F267-E270 VanDerWaalsContact O-N 3.16Å; F267-V271 HydrophobicContact CD2-CG1 4Å; F267-V271 HydrophobicContact CE1-CG2 4.28Å; F267-V271 HydrophobicContact CE2-CG1 3.43Å; F267-V271 VanDerWaalsContact CE2-CG1 3.43Å; F267-V271 HydrophobicContact CZ-CG1 3.73Å; F267-V271 HydrophobicContact CZ-CG2 4.24Å; F267-V271 WeakPolarHBondContact O-CG2 3.35Å; F267-V271 PolarHBondContact O-N 3.21Å
268	L	95.9	Very high	89.5	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-65.4	-34.6	-179	-72.6	171.5	0	0	0	112.2	L218 A222 P250 L251 C264 L265 D266 E270 V271 T272	L218-L268 HydrophobicContact CD1-CD2 4.19Å; L218-L268 HydrophobicContact CD2-CD2 4.26Å; L218-L268 HydrophobicContact CG-CD2 4.33Å; A222-L268 HydrophobicContact CB-CD1 3.82Å; P250-L268 HydrophobicContact CB-CD1 4.2Å; P250-L268 HydrophobicContact CB-CD2 4.45Å; L251-L268 HydrophobicContact CB-CB 4.31Å; L251-L268 HydrophobicContact CD1-CB 3.91Å; C264-L268 VanDerWaalsContact O-CB 3.3Å; C264-L268 WeakPolarHBondContact O-CB 3.39Å; C264-L268 WeakPolarHBondContact O-CG 3.22Å; C264-L268 PolarHBondContact O-N 2.88Å; L265-L268 PolarHBondContact O-N 3.45Å; D266-L268 PolarHBondContact O-N 3.26Å; L268-E270 VanDerWaalsContact C-N 3.34Å; L268-V271 HydrophobicContact CD2-CG2 4.36Å; L268-T272 VanDerWaalsContact O-CB 3.28Å; L268-T272 WeakPolarHBondContact O-CB 3.44Å; L268-T272 WeakPolarHBondContact O-CG2 3.44Å; L268-T272 PolarHBondContact O-N 3.37Å; L268-T272 PolarHBondContact O-OG1 3.27Å
269	Q	95.1	Very high	90.4	Very high	58 Å²	58	73.7 Å²	73.7	27%	0.271	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-39.5	173.2	-74.4	-178.1	0	0	0	111.8	L251 L265 D266 F267 T272 R273	L251-Q269 HydrophobicContact CD1-CB 4.47Å; L251-Q269 HydrophobicContact CD1-CG 3.58Å; L265-Q269 HydrophobicContact CD1-CG 4.03Å; L265-Q269 HydrophobicContact CG-CG 4.41Å; L265-Q269 WeakPolarHBondContact O-CB 3.45Å; L265-Q269 VanDerWaalsContact O-CG 3.31Å; L265-Q269 WeakPolarHBondContact O-CG 3.39Å; L265-Q269 PolarHBondContact O-N 3.03Å; D266-Q269 PolarHBondContact O-N 3.1Å; F267-Q269 VanDerWaalsContact C-N 3.32Å; F267-Q269 PolarHBondContact O-N 3.31Å; Q269-T272 PolarHBondContact O-OG1 3.35Å; Q269-R273 WeakPolarHBondContact O-CD 3.33Å; Q269-R273 VanDerWaalsContact O-CG 3.23Å; Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 2.84Å
270	E	95	Very high	91.3	Very high	110 Å²	110	73 Å²	73	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-65	-55.3	177.1	-175.4	179.8	179.4	0	0	111.1	D266 F267 L268 T272 R273 Q274	D266-E270 PolarHBondContact O-N 2.98Å; F267-E270 WeakPolarHBondContact O-CB 3.45Å; F267-E270 PolarHBondContact O-N 3.27Å; F267-E270 VanDerWaalsContact O-N 3.16Å; L268-E270 VanDerWaalsContact C-N 3.34Å; E270-T272 VanDerWaalsContact C-N 3.28Å; E270-T272 PolarHBondContact O-N 3.18Å; E270-R273 PolarHBondContact O-N 3.22Å; E270-R273 VanDerWaalsContact O-N 3.17Å; E270-Q274 PolarHBondContact O-N 3.02Å; E270-Q274 VanDerWaalsContact O-N 3.12Å
271	V	94.3	Very high	92.3	Very high	16 Å²	16	70.5 Å²	70.5	10%	0.097	36%	0.358	C	S	.	.	H	α-helix	trans	-73.5	-16.3	-174.4	-59.9	0	0	0	0	114.5	Y234 T240 F267 L268	Y234-V271 HydrophobicContact CD1-CG1 4.36Å; Y234-V271 HydrophobicContact CD2-CB 4.13Å; Y234-V271 HydrophobicContact CD2-CG1 4.38Å; Y234-V271 HydrophobicContact CD2-CG2 4.03Å; Y234-V271 HydrophobicContact CE1-CB 4.44Å; Y234-V271 HydrophobicContact CE1-CG1 4.01Å; Y234-V271 HydrophobicContact CE2-CB 3.58Å; Y234-V271 HydrophobicContact CE2-CG1 4.02Å; Y234-V271 HydrophobicContact CE2-CG2 3.91Å; T240-V271 HydrophobicContact CG2-CG2 3.85Å; F267-V271 HydrophobicContact CD2-CG1 4Å; F267-V271 HydrophobicContact CE1-CG2 4.28Å; F267-V271 HydrophobicContact CE2-CG1 3.43Å; F267-V271 VanDerWaalsContact CE2-CG1 3.43Å; F267-V271 HydrophobicContact CZ-CG1 3.73Å; F267-V271 HydrophobicContact CZ-CG2 4.24Å; F267-V271 WeakPolarHBondContact O-CG2 3.35Å; F267-V271 PolarHBondContact O-N 3.21Å; L268-V271 HydrophobicContact CD2-CG2 4.36Å
272	T	92.9	Very high	93.1	Very high	45 Å²	45	69.1 Å²	69.1	28%	0.276	35%	0.348	S	S	.	.	H	α-helix	trans	-83	-26.8	172.1	50.6	0	0	0	0	112.5	L251 L268 Q269 E270	L251-T272 HydrophobicContact CB-CG2 4.4Å; L251-T272 HydrophobicContact CD2-CG2 4.19Å; L268-T272 VanDerWaalsContact O-CB 3.28Å; L268-T272 WeakPolarHBondContact O-CB 3.44Å; L268-T272 WeakPolarHBondContact O-CG2 3.44Å; L268-T272 PolarHBondContact O-N 3.37Å; L268-T272 PolarHBondContact O-OG1 3.27Å; Q269-T272 PolarHBondContact O-OG1 3.35Å; E270-T272 VanDerWaalsContact C-N 3.28Å; E270-T272 PolarHBondContact O-N 3.18Å
273	R	92.9	Very high	93.5	Very high	194 Å²	194	67.2 Å²	67.2	73%	0.732	34%	0.341	S	S	*	.	H	α-helix	trans	-81.2	-30.2	175.6	-71.8	173.3	-176.7	167.5	5	112.4	Q269 E270	Q269-R273 WeakPolarHBondContact O-CD 3.33Å; Q269-R273 VanDerWaalsContact O-CG 3.23Å; Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 2.84Å; E270-R273 PolarHBondContact O-N 3.22Å; E270-R273 VanDerWaalsContact O-N 3.17Å
274	Q	90.1	Very high	93.5	Very high	126 Å²	126	66 Å²	66	59%	0.589	33%	0.332	S	S	*	.	S	Bend	trans	-108.2	123	-178.4	-61.5	-169.5	10.4	0	0	111.1	E270	E270-Q274 PolarHBondContact O-N 3.02Å; E270-Q274 VanDerWaalsContact O-N 3.12Å
275	P	83.1	Confident	93.5	Very high	120 Å²	120	72.1 Å²	72.1	78%	0.779	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-64.7	147.5	173.2	28.3	-33.4	0	0	0	110.4
276	R	92.8	Very high	93.5	Very high	37 Å²	37	74.4 Å²	74.4	14%	0.14	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-52.4	142.3	169.7	-71.2	171.9	-174.9	-101.3	5.5	109.8	Y234 A238 D280 L281	Y234-R276 HydrophobicContact CE1-CG 4.35Å; Y234-R276 HydrophobicContact CE2-CG 4.19Å; Y234-R276 PolarHBondContact O-NH1 3.14Å; Y234-R276 PolarHBondContact O-NH2 3.17Å; Y234-R276 WeakPolarHBondContact OH-CG 3.18Å; A238-R276 PolarHBondContact O-NH2 2.94Å; R276-D280 HydrophobicContact CB-CB 4.41Å; R276-L281 HydrophobicContact CB-CD2 3.94Å; R276-L281 HydrophobicContact CB-CG 3.88Å
277	N	93.6	Very high	93.4	Very high	79 Å²	79	70.4 Å²	70.4	42%	0.422	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-64.5	160.4	173.3	67.8	58.1	0	0	0	110.7	Q279 D280 L281	N277-Q279 PolarHBondContact O-N 2.94Å; N277-Q279 WeakPolarHBondContact OD1-CA 3.3Å; N277-Q279 VanDerWaalsContact OD1-CB 3.26Å; N277-Q279 WeakPolarHBondContact OD1-CB 3.17Å; N277-Q279 PolarHBondContact OD1-N 2.57Å; N277-D280 PolarHBondContact ND2-OD2 3.04Å; N277-D280 PolarHBondContact O-N 2.94Å; N277-D280 VanDerWaalsContact OD1-CG 3.3Å; N277-D280 PolarHBondContact OD1-N 2.94Å; N277-D280 PolarHBondContact OD1-OD2 3.26Å; N277-L281 WeakPolarHBondContact O-CG 3.47Å; N277-L281 PolarHBondContact O-N 3.3Å; N277-L281 VanDerWaalsContact O-N 3.11Å
278	L	94.6	Very high	93.2	Very high	134 Å²	134	73.7 Å²	73.7	70%	0.702	36%	0.363	S	S	*	.	H	α-helix	trans	-58	-36	-178.7	179.5	61.3	0	0	0	112.2	L281 C282	L278-L281 PolarHBondContact O-N 3.15Å; L278-C282 WeakPolarHBondContact O-CB 3.42Å; L278-C282 PolarHBondContact O-N 3.31Å; L278-C282 PolarHBondContact O-SG 3.45Å
279	Q	93.4	Very high	92.9	Very high	115 Å²	115	78.3 Å²	78.3	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-44.9	-178	-153.7	-174	-21.1	0	0	111.2	N277 C282 R283 Y310	N277-Q279 PolarHBondContact O-N 2.94Å; N277-Q279 WeakPolarHBondContact OD1-CA 3.3Å; N277-Q279 VanDerWaalsContact OD1-CB 3.26Å; N277-Q279 WeakPolarHBondContact OD1-CB 3.17Å; N277-Q279 PolarHBondContact OD1-N 2.57Å; Q279-C282 WeakPolarHBondContact O-CB 3.38Å; Q279-C282 PolarHBondContact O-N 3.27Å; Q279-R283 PolarHBondContact O-N 2.96Å; Q279-Y310 VanDerWaalsContact CD-CE2 3.5Å; Q279-Y310 HydrophobicContact CG-CE1 3.71Å; Q279-Y310 HydrophobicContact CG-CE2 3.94Å; Q279-Y310 VanDerWaalsContact CG-CZ 3.41Å; Q279-Y310 WeakPolarHBondContact CG-OH 3.5Å; Q279-Y310 VanDerWaalsContact NE2-CD2 3.27Å; Q279-Y310 PolarHBondContact O-OH 3.09Å; Q279-Y310 VanDerWaalsContact O-OH 3.1Å
280	D	92.8	Very high	92.7	Very high	37 Å²	37	77 Å²	77	20%	0.198	39%	0.389	C	S	.	.	H	α-helix	trans	-68.2	-41.2	178.8	-65	-22.5	0	0	0	111	R276 N277 C282 R283 I284 Y310	R276-D280 HydrophobicContact CB-CB 4.41Å; N277-D280 PolarHBondContact ND2-OD2 3.04Å; N277-D280 PolarHBondContact O-N 2.94Å; N277-D280 VanDerWaalsContact OD1-CG 3.3Å; N277-D280 PolarHBondContact OD1-N 2.94Å; N277-D280 PolarHBondContact OD1-OD2 3.26Å; D280-C282 VanDerWaalsContact C-N 3.34Å; D280-C282 PolarHBondContact O-N 3.06Å; D280-R283 VanDerWaalsContact O-CB 3.3Å; D280-R283 WeakPolarHBondContact O-CB 3.36Å; D280-R283 PolarHBondContact O-N 2.85Å; D280-R283 VanDerWaalsContact O-N 3.16Å; D280-I284 VanDerWaalsContact O-CD1 3.27Å; D280-I284 WeakPolarHBondContact O-CD1 3.38Å; D280-I284 VanDerWaalsContact O-CG1 3.23Å; D280-I284 WeakPolarHBondContact O-CG1 3.19Å; D280-I284 PolarHBondContact O-N 3.26Å; D280-Y310 WeakPolarHBondContact CA-OH 2.95Å; D280-Y310 PolarHBondContact N-OH 2.64Å; D280-Y310 VanDerWaalsContact N-OH 3.13Å; D280-Y310 PolarHBondContact OD1-OH 3.13Å
281	L	94.3	Very high	92.1	Very high	87 Å²	87	73 Å²	73	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-59.3	-45.3	173.5	-70	172.7	0	0	0	111.4	R276 N277 L278 I284 K285	R276-L281 HydrophobicContact CB-CD2 3.94Å; R276-L281 HydrophobicContact CB-CG 3.88Å; N277-L281 WeakPolarHBondContact O-CG 3.47Å; N277-L281 PolarHBondContact O-N 3.3Å; N277-L281 VanDerWaalsContact O-N 3.11Å; L278-L281 PolarHBondContact O-N 3.15Å; L281-I284 PolarHBondContact O-N 3.05Å; L281-K285 WeakPolarHBondContact O-CB 3.5Å; L281-K285 PolarHBondContact O-N 3.37Å
282	C	95	Very high	91.3	Very high	57 Å²	57	74 Å²	74	39%	0.385	38%	0.382	S	S	.	.	H	α-helix	trans	-61.2	-43.4	173.6	-72.5	0	0	0	0	111.4	L278 Q279 D280 I284 K285 I286	L278-C282 WeakPolarHBondContact O-CB 3.42Å; L278-C282 PolarHBondContact O-N 3.31Å; L278-C282 PolarHBondContact O-SG 3.45Å; Q279-C282 WeakPolarHBondContact O-CB 3.38Å; Q279-C282 PolarHBondContact O-N 3.27Å; D280-C282 VanDerWaalsContact C-N 3.34Å; D280-C282 PolarHBondContact O-N 3.06Å; C282-I284 PolarHBondContact O-N 3.33Å; C282-K285 PolarHBondContact O-N 3.22Å; C282-I286 HydrophobicContact CB-CD1 4.48Å; C282-I286 WeakPolarHBondContact O-CB 3.4Å; C282-I286 WeakPolarHBondContact O-CD1 3.43Å; C282-I286 WeakPolarHBondContact O-CG1 3.49Å; C282-I286 PolarHBondContact O-N 3.08Å
283	R	94.9	Very high	90.5	Very high	15 Å²	15	75.9 Å²	75.9	6%	0.057	39%	0.387	C	S	.	.	H	α-helix	trans	-54.2	-54.1	177.1	-162.9	-169.4	-78.3	-169.5	-6.5	111.2	Q279 D280 I286 R287 Y310 L311 H313 D316	Q279-R283 PolarHBondContact O-N 2.96Å; D280-R283 VanDerWaalsContact O-CB 3.3Å; D280-R283 WeakPolarHBondContact O-CB 3.36Å; D280-R283 PolarHBondContact O-N 2.85Å; D280-R283 VanDerWaalsContact O-N 3.16Å; R283-I286 PolarHBondContact O-N 3.07Å; R283-R287 WeakPolarHBondContact O-CB 3.29Å; R283-R287 VanDerWaalsContact O-CG 3.26Å; R283-R287 WeakPolarHBondContact O-CG 3.31Å; R283-R287 PolarHBondContact O-N 3.1Å; R283-Y310 HydrophobicContact CB-CD1 4.5Å; R283-Y310 HydrophobicContact CB-CE1 3.66Å; R283-Y310 HydrophobicContact CG-CD1 4.24Å; R283-Y310 HydrophobicContact CG-CE1 3.81Å; R283-Y310 VanDerWaalsContact CZ-O 3.29Å; R283-Y310 PolarHBondContact NE-O 3.08Å; R283-Y310 VanDerWaalsContact NE-O 3.14Å; R283-Y310 PolarHBondContact NE-OH 3.19Å; R283-Y310 VanDerWaalsContact NH2-CZ 3.32Å; R283-L311 HydrophobicContact CB-CD2 4.36Å; R283-L311 HydrophobicContact CG-CD2 4.01Å; R283-H313 PolarHBondContact NH1-CE1 3.26Å; R283-H313 PolarHBondContact NH1-ND1 3.48Å; R283-D316 IonicContact CZ-OD2 2.73Å; R283-D316 IonicContact NH1-OD1 3.93Å; R283-D316 IonicContact NH1-OD2 2.96Å; R283-D316 PolarHBondContact NH1-OD2 2.96Å; R283-D316 IonicContact NH2-OD1 2.86Å
284	I	93.4	Very high	90.1	Very high	23 Å²	23	70.1 Å²	70.1	12%	0.118	37%	0.371	C	S	.	.	H	α-helix	trans	-61.7	-48.5	-177.6	-64.5	155.4	0	0	0	109.7	D280 L281 C282 I286 R287 Q288	D280-I284 VanDerWaalsContact O-CD1 3.27Å; D280-I284 WeakPolarHBondContact O-CD1 3.38Å; D280-I284 VanDerWaalsContact O-CG1 3.23Å; D280-I284 WeakPolarHBondContact O-CG1 3.19Å; D280-I284 PolarHBondContact O-N 3.26Å; L281-I284 PolarHBondContact O-N 3.05Å; C282-I284 PolarHBondContact O-N 3.33Å; I284-I286 PolarHBondContact O-N 2.92Å; I284-R287 PolarHBondContact O-N 3.26Å; I284-Q288 HydrophobicContact CG2-CG 4.47Å; I284-Q288 WeakPolarHBondContact O-CB 3.41Å; I284-Q288 WeakPolarHBondContact O-CG 2.99Å; I284-Q288 PolarHBondContact O-N 2.95Å
285	K	94.4	Very high	90	Very high	128 Å²	128	65.1 Å²	65.1	56%	0.557	35%	0.348	S	S	*	.	H	α-helix	trans	-63.4	-43.3	-177.4	-169.5	63.9	176.2	-179.6	0	112.1	L281 C282 Q288 C289	L281-K285 WeakPolarHBondContact O-CB 3.5Å; L281-K285 PolarHBondContact O-N 3.37Å; C282-K285 PolarHBondContact O-N 3.22Å; K285-Q288 PolarHBondContact O-N 2.87Å; K285-C289 WeakPolarHBondContact O-CB 3.24Å; K285-C289 PolarHBondContact O-N 3.2Å; K285-C289 PolarHBondContact O-SG 3.03Å
286	I	94.2	Very high	90.2	Very high	63 Å²	63	66.3 Å²	66.3	32%	0.323	34%	0.341	S	S	.	.	H	α-helix	trans	-63.3	-46.1	178	-69.1	164	0	0	0	110.6	C282 R283 I284 Q288 C289 I290 L298 L301 L311	C282-I286 HydrophobicContact CB-CD1 4.48Å; C282-I286 WeakPolarHBondContact O-CB 3.4Å; C282-I286 WeakPolarHBondContact O-CD1 3.43Å; C282-I286 WeakPolarHBondContact O-CG1 3.49Å; C282-I286 PolarHBondContact O-N 3.08Å; R283-I286 PolarHBondContact O-N 3.07Å; I284-I286 PolarHBondContact O-N 2.92Å; I286-Q288 VanDerWaalsContact C-N 3.33Å; I286-Q288 PolarHBondContact O-N 3.3Å; I286-C289 PolarHBondContact O-N 2.99Å; I286-I290 HydrophobicContact CG2-CD1 3.92Å; I286-I290 WeakPolarHBondContact O-CG1 3.42Å; I286-I290 PolarHBondContact O-N 2.93Å; I286-L298 HydrophobicContact CG2-CD2 4.23Å; I286-L301 HydrophobicContact CG2-CD1 4.11Å; I286-L311 HydrophobicContact CB-CD2 4.07Å; I286-L311 HydrophobicContact CD1-CD1 4.49Å; I286-L311 HydrophobicContact CD1-CD2 3.93Å; I286-L311 HydrophobicContact CG2-CD1 3.87Å; I286-L311 HydrophobicContact CG2-CD2 4.06Å
287	R	93.8	Very high	90.1	Very high	9 Å²	9	67.3 Å²	67.3	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-59.9	-42.7	177.2	-71.2	171.5	65.3	79.4	1.2	111.8	L200 R283 I284 G291 L292 L295 L311	L200-R287 PolarHBondContact O-NH2 3.06Å; R283-R287 WeakPolarHBondContact O-CB 3.29Å; R283-R287 VanDerWaalsContact O-CG 3.26Å; R283-R287 WeakPolarHBondContact O-CG 3.31Å; R283-R287 PolarHBondContact O-N 3.1Å; I284-R287 PolarHBondContact O-N 3.26Å; R287-G291 PolarHBondContact O-N 2.93Å; R287-L292 HydrophobicContact CB-CD2 4.19Å; R287-L295 HydrophobicContact CB-CD2 4.08Å; R287-L295 HydrophobicContact CG-CD2 4.09Å; R287-L295 VanDerWaalsContact NH2-CD1 3.31Å; R287-L311 WeakPolarHBondContact CD-O 3.13Å; R287-L311 PolarHBondContact NH1-O 3.26Å
288	Q	90.5	Very high	90.1	Very high	93 Å²	93	63.6 Å²	63.6	44%	0.435	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-45.1	175	-74	174.6	-12.1	0	0	112.2	I284 K285 I286 I290 G291	I284-Q288 HydrophobicContact CG2-CG 4.47Å; I284-Q288 WeakPolarHBondContact O-CB 3.41Å; I284-Q288 WeakPolarHBondContact O-CG 2.99Å; I284-Q288 PolarHBondContact O-N 2.95Å; K285-Q288 PolarHBondContact O-N 2.87Å; I286-Q288 VanDerWaalsContact C-N 3.33Å; I286-Q288 PolarHBondContact O-N 3.3Å; Q288-I290 VanDerWaalsContact C-N 3.34Å; Q288-I290 PolarHBondContact O-N 3Å; Q288-G291 PolarHBondContact O-N 3.33Å
289	C	90.6	Very high	90	Very high	99 Å²	99	61.4 Å²	61.4	67%	0.669	32%	0.318	S	S	*	.	H	α-helix	trans	-66.2	-32.6	-179.5	-74.4	0	0	0	0	113.5	K285 I286 G291	K285-C289 WeakPolarHBondContact O-CB 3.24Å; K285-C289 PolarHBondContact O-N 3.2Å; K285-C289 PolarHBondContact O-SG 3.03Å; I286-C289 PolarHBondContact O-N 2.99Å; C289-G291 PolarHBondContact O-N 3.2Å
290	I	89.3	Confident	90	Very high	31 Å²	31	63 Å²	63	16%	0.159	33%	0.325	C	S	.	.	H	α-helix	trans	-69.9	-25.6	172.6	-74.3	168.9	0	0	0	111.6	I286 Q288 N294 L297 L298 L301	I286-I290 HydrophobicContact CG2-CD1 3.92Å; I286-I290 WeakPolarHBondContact O-CG1 3.42Å; I286-I290 PolarHBondContact O-N 2.93Å; Q288-I290 VanDerWaalsContact C-N 3.34Å; Q288-I290 PolarHBondContact O-N 3Å; I290-N294 HydrophobicContact CG2-CB 4.24Å; I290-N294 VanDerWaalsContact CG2-O 3.29Å; I290-N294 WeakPolarHBondContact CG2-O 3.17Å; I290-N294 WeakPolarHBondContact O-CB 3.42Å; I290-L297 HydrophobicContact CG2-CB 4.03Å; I290-L298 HydrophobicContact CD1-CD2 3.24Å; I290-L298 HydrophobicContact CD1-CG 3.8Å; I290-L301 HydrophobicContact CD1-CD1 4.05Å; I290-L301 HydrophobicContact CD1-CD2 4.42Å; I290-L301 HydrophobicContact CD1-CG 4.42Å
291	G	84.3	Confident	90.1	Very high	24 Å²	24	63.4 Å²	63.4	25%	0.247	33%	0.327	C	S	.	.			trans	88.5	125.4	-168.5	0	0	0	0	0	109.9	R287 Q288 C289 Q293 N294	R287-G291 PolarHBondContact O-N 2.93Å; Q288-G291 PolarHBondContact O-N 3.33Å; C289-G291 PolarHBondContact O-N 3.2Å; G291-Q293 PolarHBondContact O-N 3.41Å; G291-Q293 VanDerWaalsContact O-N 3.09Å; G291-N294 PolarHBondContact O-N 3.47Å
292	L	77.1	Confident	90.1	Very high	39 Å²	39	65.7 Å²	65.7	20%	0.204	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-63.5	-21.4	-173.9	-57.6	175.9	0	0	0	113.1	G203 D205 R287 L295	G203-L292 WeakPolarHBondContact CA-O 3.4Å; G203-L292 WeakPolarHBondContact O-CB 3.27Å; D205-L292 HydrophobicContact CB-CD1 3.97Å; R287-L292 HydrophobicContact CB-CD2 4.19Å; L292-L295 WeakPolarHBondContact O-CD1 3.28Å; L292-L295 VanDerWaalsContact O-CG 3.29Å; L292-L295 WeakPolarHBondContact O-CG 3.13Å
293	Q	75.7	Confident	90.2	Very high	84 Å²	84	65.9 Å²	65.9	39%	0.393	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-83.8	-8	173.8	-54.8	-51.8	-39.6	0	0	114	D177 G203 G291	D177-Q293 PolarHBondContact OD2-NE2 3.18Å; G203-Q293 PolarHBondContact O-NE2 3.4Å; G291-Q293 PolarHBondContact O-N 3.41Å; G291-Q293 VanDerWaalsContact O-N 3.09Å
294	N	84.3	Confident	90.2	Very high	72 Å²	72	67.7 Å²	67.7	39%	0.385	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-118	24.1	-173.9	-68.3	-40	0	0	0	112.8	I290 G291 K296 L297	I290-N294 HydrophobicContact CG2-CB 4.24Å; I290-N294 VanDerWaalsContact CG2-O 3.29Å; I290-N294 WeakPolarHBondContact CG2-O 3.17Å; I290-N294 WeakPolarHBondContact O-CB 3.42Å; G291-N294 PolarHBondContact O-N 3.47Å; N294-K296 PolarHBondContact O-N 3.4Å; N294-L297 HydrophobicContact CB-CD1 3.93Å; N294-L297 HydrophobicContact CB-CG 4.33Å; N294-L297 WeakPolarHBondContact O-CB 3.39Å; N294-L297 WeakPolarHBondContact O-CG 3.42Å; N294-L297 PolarHBondContact O-N 2.92Å
295	L	87.1	Confident	90.2	Very high	21 Å²	21	73.9 Å²	73.9	11%	0.11	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-60.5	-13.6	-175.1	-65.3	171	0	0	0	114.6	R287 L292 L297 L298	R287-L295 HydrophobicContact CB-CD2 4.08Å; R287-L295 HydrophobicContact CG-CD2 4.09Å; R287-L295 VanDerWaalsContact NH2-CD1 3.31Å; L292-L295 WeakPolarHBondContact O-CD1 3.28Å; L292-L295 VanDerWaalsContact O-CG 3.29Å; L292-L295 WeakPolarHBondContact O-CG 3.13Å; L295-L297 PolarHBondContact O-N 3.12Å; L295-L298 HydrophobicContact CB-CD1 4.15Å; L295-L298 HydrophobicContact CD2-CD1 3.93Å; L295-L298 WeakPolarHBondContact O-CB 3.44Å; L295-L298 WeakPolarHBondContact O-CD1 3.45Å; L295-L298 VanDerWaalsContact O-CG 3.28Å; L295-L298 WeakPolarHBondContact O-CG 3.35Å; L295-L298 PolarHBondContact O-N 2.97Å; L295-L298 VanDerWaalsContact O-N 3.14Å
296	K	88.4	Confident	90.2	Very high	145 Å²	145	72.4 Å²	72.4	63%	0.63	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-57.9	-30.6	167.4	60.5	-179.5	179.3	-178.9	0	113	N294 L298 D299	N294-K296 PolarHBondContact O-N 3.4Å; K296-L298 PolarHBondContact O-N 3.25Å; K296-D299 PolarHBondContact O-N 3.11Å
297	L	91.3	Very high	90.2	Very high	59 Å²	59	74.4 Å²	74.4	31%	0.309	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-69.1	-11.2	178.2	-57.9	178.9	0	0	0	112.9	I290 N294 L295 D299 E300	I290-L297 HydrophobicContact CG2-CB 4.03Å; N294-L297 HydrophobicContact CB-CD1 3.93Å; N294-L297 HydrophobicContact CB-CG 4.33Å; N294-L297 WeakPolarHBondContact O-CB 3.39Å; N294-L297 WeakPolarHBondContact O-CG 3.42Å; N294-L297 PolarHBondContact O-N 2.92Å; L295-L297 PolarHBondContact O-N 3.12Å; L297-D299 PolarHBondContact O-N 3.29Å; L297-E300 WeakPolarHBondContact CD2-OE1 3.33Å; L297-E300 WeakPolarHBondContact O-CB 3.36Å; L297-E300 PolarHBondContact O-N 3.12Å
298	L	92.2	Very high	90.2	Very high	1 Å²	1	76.1 Å²	76.1	1%	0.005	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-57.3	-28.8	169.8	-73.2	170.3	0	0	0	112.3	I286 I290 L295 K296 E300 L301 L311 K312	I286-L298 HydrophobicContact CG2-CD2 4.23Å; I290-L298 HydrophobicContact CD1-CD2 3.24Å; I290-L298 HydrophobicContact CD1-CG 3.8Å; L295-L298 HydrophobicContact CB-CD1 4.15Å; L295-L298 HydrophobicContact CD2-CD1 3.93Å; L295-L298 WeakPolarHBondContact O-CB 3.44Å; L295-L298 WeakPolarHBondContact O-CD1 3.45Å; L295-L298 VanDerWaalsContact O-CG 3.28Å; L295-L298 WeakPolarHBondContact O-CG 3.35Å; L295-L298 PolarHBondContact O-N 2.97Å; L295-L298 VanDerWaalsContact O-N 3.14Å; K296-L298 PolarHBondContact O-N 3.25Å; L298-E300 PolarHBondContact O-N 3.17Å; L298-L301 HydrophobicContact CD2-CD1 3.94Å; L298-L311 HydrophobicContact CD1-CB 4.27Å; L298-L311 HydrophobicContact CD2-CB 3.78Å; L298-L311 HydrophobicContact CD2-CD1 3.69Å; L298-L311 HydrophobicContact CD2-CG 4.31Å; L298-K312 HydrophobicContact CB-CG 4.46Å; L298-K312 HydrophobicContact CD1-CG 3.81Å
299	D	92.3	Very high	90.3	Very high	87 Å²	87	72.7 Å²	72.7	47%	0.465	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-68.9	-23.7	177.2	-74.2	-47.1	0	0	0	113.4	K296 L297 K308 K312	K296-D299 PolarHBondContact O-N 3.11Å; L297-D299 PolarHBondContact O-N 3.29Å; D299-K308 PolarHBondContact O-NZ 3.01Å; D299-K312 WeakPolarHBondContact OD1-CE 3.4Å; D299-K312 IonicContact OD1-NZ 3.98Å; D299-K312 PolarHBondContact OD1-NZ 3.13Å; D299-K312 IonicContact OD2-NZ 2.94Å; D299-K312 PolarHBondContact OD2-NZ 3.41Å
300	E	94.6	Very high	90.4	Very high	149 Å²	149	69.8 Å²	69.8	70%	0.696	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-86.6	-12.4	-176.3	-60.3	177.3	-171.9	0	0	112.5	L297 L298	L297-E300 WeakPolarHBondContact CD2-OE1 3.33Å; L297-E300 WeakPolarHBondContact O-CB 3.36Å; L297-E300 PolarHBondContact O-N 3.12Å; L298-E300 PolarHBondContact O-N 3.17Å
301	L	94.2	Very high	90.5	Very high	46 Å²	46	68.6 Å²	68.6	24%	0.241	36%	0.361	C	S	.	.	S	Bend	trans	-60.7	136.7	-180	-66.2	-179.8	0	0	0	111.6	I286 I290 L298 I303 K308 L311	I286-L301 HydrophobicContact CG2-CD1 4.11Å; I290-L301 HydrophobicContact CD1-CD1 4.05Å; I290-L301 HydrophobicContact CD1-CD2 4.42Å; I290-L301 HydrophobicContact CD1-CG 4.42Å; L298-L301 HydrophobicContact CD2-CD1 3.94Å; L301-I303 HydrophobicContact CB-CD1 3.97Å; L301-I303 HydrophobicContact CB-CG1 3.87Å; L301-I303 HydrophobicContact CD1-CD1 3.84Å; L301-I303 PolarHBondContact O-N 3.38Å; L301-K308 WeakPolarHBondContact O-CE 3.42Å; L301-K308 PolarHBondContact O-NZ 3.33Å; L301-L311 HydrophobicContact CD1-CD1 3.68Å
302	P	95.5	Very high	90.8	Very high	135 Å²	135	70.6 Å²	70.6	88%	0.877	36%	0.363	S	S	*	.	S	Bend	trans	-80.3	56	179	34.7	-36.9	0	0	0	111.6
303	I	95.6	Very high	91.3	Very high	60 Å²	60	68.9 Å²	68.9	31%	0.308	35%	0.354	S	S	.	.	S	Bend	trans	-128.9	164.1	-178.2	65.2	-178.5	0	0	0	111.2	L301 M307 K308 L311	L301-I303 HydrophobicContact CB-CD1 3.97Å; L301-I303 HydrophobicContact CB-CG1 3.87Å; L301-I303 HydrophobicContact CD1-CD1 3.84Å; L301-I303 PolarHBondContact O-N 3.38Å; I303-M307 HydrophobicContact CB-CB 4.38Å; I303-M307 HydrophobicContact CB-SD 4.15Å; I303-M307 HydrophobicContact CD1-CB 3.79Å; I303-M307 HydrophobicContact CG1-CB 4.14Å; I303-K308 HydrophobicContact CD1-CG 4.1Å; I303-K308 HydrophobicContact CG1-CG 3.74Å; I303-K308 VanDerWaalsContact O-CE 3.28Å; I303-K308 WeakPolarHBondContact O-CE 3.37Å; I303-L311 HydrophobicContact CD1-CD1 3.63Å
304	A	96	Very high	91.5	Very high	54 Å²	54	70.4 Å²	70.4	45%	0.446	36%	0.359	S	S	.	.			trans	-60.1	148.3	179.3	0	0	0	0	0	112.4	V306 M307 K308	A304-V306 HydrophobicContact CB-CG1 4.21Å; A304-V306 PolarHBondContact O-N 2.99Å; A304-M307 HydrophobicContact CB-CG 4.44Å; A304-M307 WeakPolarHBondContact O-CB 3.39Å; A304-M307 PolarHBondContact O-N 3.16Å; A304-K308 PolarHBondContact O-N 3.03Å; A304-K308 VanDerWaalsContact O-N 3.13Å
305	K	93.8	Very high	90.9	Very high	153 Å²	153	73.1 Å²	73.1	67%	0.665	37%	0.367	S	S	*	.	H	α-helix	trans	-53.7	-40.3	179	-177.3	179.1	178.4	-178.9	0	112.9	M307 K308 D309	K305-M307 VanDerWaalsContact C-N 3.27Å; K305-M307 PolarHBondContact O-N 3.19Å; K305-K308 WeakPolarHBondContact O-CB 3.23Å; K305-K308 PolarHBondContact O-N 3.5Å; K305-K308 VanDerWaalsContact O-N 3.17Å; K305-D309 WeakPolarHBondContact O-CB 3.44Å; K305-D309 PolarHBondContact O-N 3.23Å
306	V	93.3	Very high	90.2	Very high	96 Å²	96	73.5 Å²	73.5	58%	0.582	37%	0.37	S	S	*	.	H	α-helix	trans	-60.8	-36.5	177.8	70.7	0	0	0	0	112.1	A304 Y310	A304-V306 HydrophobicContact CB-CG1 4.21Å; A304-V306 PolarHBondContact O-N 2.99Å; V306-Y310 WeakPolarHBondContact O-CB 3.3Å; V306-Y310 PolarHBondContact O-N 3.15Å
307	M	93.8	Very high	88.5	Confident	106 Å²	106	74 Å²	74	52%	0.522	38%	0.379	S	S	.	.	H	α-helix	trans	-71	-40.6	176.2	-63.3	177.9	173.5	0	0	110.8	I303 A304 K305 Y310 L311	I303-M307 HydrophobicContact CB-CB 4.38Å; I303-M307 HydrophobicContact CB-SD 4.15Å; I303-M307 HydrophobicContact CD1-CB 3.79Å; I303-M307 HydrophobicContact CG1-CB 4.14Å; A304-M307 HydrophobicContact CB-CG 4.44Å; A304-M307 WeakPolarHBondContact O-CB 3.39Å; A304-M307 PolarHBondContact O-N 3.16Å; K305-M307 VanDerWaalsContact C-N 3.27Å; K305-M307 PolarHBondContact O-N 3.19Å; M307-Y310 WeakPolarHBondContact O-CB 3.19Å; M307-Y310 PolarHBondContact O-N 2.94Å; M307-L311 VanDerWaalsContact O-CG 3.27Å; M307-L311 WeakPolarHBondContact O-CG 3.3Å; M307-L311 PolarHBondContact O-N 2.96Å
308	K	94.2	Very high	86.5	Confident	44 Å²	44	74.9 Å²	74.9	19%	0.191	38%	0.383	C	S	.	.	H	α-helix	trans	-60.4	-45.6	173.4	-60.6	-177.6	-179.6	-176	0	111.6	D299 L301 I303 A304 K305 Y310 L311 K312	D299-K308 PolarHBondContact O-NZ 3.01Å; L301-K308 WeakPolarHBondContact O-CE 3.42Å; L301-K308 PolarHBondContact O-NZ 3.33Å; I303-K308 HydrophobicContact CD1-CG 4.1Å; I303-K308 HydrophobicContact CG1-CG 3.74Å; I303-K308 VanDerWaalsContact O-CE 3.28Å; I303-K308 WeakPolarHBondContact O-CE 3.37Å; A304-K308 PolarHBondContact O-N 3.03Å; A304-K308 VanDerWaalsContact O-N 3.13Å; K305-K308 WeakPolarHBondContact O-CB 3.23Å; K305-K308 PolarHBondContact O-N 3.5Å; K305-K308 VanDerWaalsContact O-N 3.17Å; K308-Y310 VanDerWaalsContact C-N 3.31Å; K308-Y310 PolarHBondContact O-N 3.2Å; K308-L311 PolarHBondContact O-N 3.41Å; K308-K312 WeakPolarHBondContact O-CB 3.31Å; K308-K312 VanDerWaalsContact O-CG 3.29Å; K308-K312 WeakPolarHBondContact O-CG 3.48Å; K308-K312 PolarHBondContact O-N 3.44Å
309	D	92.2	Very high	86.2	Confident	22 Å²	22	78.6 Å²	78.6	12%	0.118	40%	0.402	C	S	.	.	H	α-helix	trans	-62.3	-39.8	177.8	-75.8	-14.6	0	0	0	110.9	K305 K312 H313 K314 F315	K305-D309 WeakPolarHBondContact O-CB 3.44Å; K305-D309 PolarHBondContact O-N 3.23Å; D309-K312 PolarHBondContact O-N 3.15Å; D309-H313 PolarHBondContact O-N 2.65Å; D309-K314 HydrophobicContact CB-CB 4.12Å; D309-K314 HydrophobicContact CB-CD 3.78Å; D309-K314 WeakPolarHBondContact O-CB 3.15Å; D309-K314 PolarHBondContact O-N 2.86Å; D309-K314 WeakPolarHBondContact OD1-CD 3.4Å; D309-K314 IonicContact OD1-NZ 2.74Å; D309-K314 PolarHBondContact OD1-NZ 3.13Å; D309-K314 IonicContact OD2-NZ 3.38Å; D309-K314 PolarHBondContact OD2-NZ 2.96Å; D309-F315 HydrophobicContact CB-CD2 4.41Å; D309-F315 HydrophobicContact CB-CE2 3.54Å; D309-F315 HydrophobicContact CB-CZ 3.98Å
310	Y	92.6	Very high	85.9	Confident	37 Å²	37	78.2 Å²	78.2	15%	0.145	40%	0.399	C	S	.	.	H	α-helix	trans	-62.8	-46.8	172.2	174.2	-90.9	0	0	0	112.2	Q279 D280 R283 V306 M307 K308 K312 H313	Q279-Y310 VanDerWaalsContact CD-CE2 3.5Å; Q279-Y310 HydrophobicContact CG-CE1 3.71Å; Q279-Y310 HydrophobicContact CG-CE2 3.94Å; Q279-Y310 VanDerWaalsContact CG-CZ 3.41Å; Q279-Y310 WeakPolarHBondContact CG-OH 3.5Å; Q279-Y310 VanDerWaalsContact NE2-CD2 3.27Å; Q279-Y310 PolarHBondContact O-OH 3.09Å; Q279-Y310 VanDerWaalsContact O-OH 3.1Å; D280-Y310 WeakPolarHBondContact CA-OH 2.95Å; D280-Y310 PolarHBondContact N-OH 2.64Å; D280-Y310 VanDerWaalsContact N-OH 3.13Å; D280-Y310 PolarHBondContact OD1-OH 3.13Å; R283-Y310 HydrophobicContact CB-CD1 4.5Å; R283-Y310 HydrophobicContact CB-CE1 3.66Å; R283-Y310 HydrophobicContact CG-CD1 4.24Å; R283-Y310 HydrophobicContact CG-CE1 3.81Å; R283-Y310 VanDerWaalsContact CZ-O 3.29Å; R283-Y310 PolarHBondContact NE-O 3.08Å; R283-Y310 VanDerWaalsContact NE-O 3.14Å; R283-Y310 PolarHBondContact NE-OH 3.19Å; R283-Y310 VanDerWaalsContact NH2-CZ 3.32Å; V306-Y310 WeakPolarHBondContact O-CB 3.3Å; V306-Y310 PolarHBondContact O-N 3.15Å; M307-Y310 WeakPolarHBondContact O-CB 3.19Å; M307-Y310 PolarHBondContact O-N 2.94Å; K308-Y310 VanDerWaalsContact C-N 3.31Å; K308-Y310 PolarHBondContact O-N 3.2Å; Y310-K312 PolarHBondContact O-N 2.91Å; Y310-H313 PolarHBondContact O-N 3.4Å; Y310-H313 VanDerWaalsContact O-N 3.1Å
311	L	92.4	Very high	85.4	Confident	6 Å²	6	74.2 Å²	74.2	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-24.1	176.8	-66.5	174.7	0	0	0	113.3	R283 I286 R287 L298 L301 I303 M307 K308	R283-L311 HydrophobicContact CB-CD2 4.36Å; R283-L311 HydrophobicContact CG-CD2 4.01Å; I286-L311 HydrophobicContact CB-CD2 4.07Å; I286-L311 HydrophobicContact CD1-CD1 4.49Å; I286-L311 HydrophobicContact CD1-CD2 3.93Å; I286-L311 HydrophobicContact CG2-CD1 3.87Å; I286-L311 HydrophobicContact CG2-CD2 4.06Å; R287-L311 WeakPolarHBondContact CD-O 3.13Å; R287-L311 PolarHBondContact NH1-O 3.26Å; L298-L311 HydrophobicContact CD1-CB 4.27Å; L298-L311 HydrophobicContact CD2-CB 3.78Å; L298-L311 HydrophobicContact CD2-CD1 3.69Å; L298-L311 HydrophobicContact CD2-CG 4.31Å; L301-L311 HydrophobicContact CD1-CD1 3.68Å; I303-L311 HydrophobicContact CD1-CD1 3.63Å; M307-L311 VanDerWaalsContact O-CG 3.27Å; M307-L311 WeakPolarHBondContact O-CG 3.3Å; M307-L311 PolarHBondContact O-N 2.96Å; K308-L311 PolarHBondContact O-N 3.41Å
312	K	89.8	Confident	84.9	Confident	67 Å²	67	75.9 Å²	75.9	29%	0.291	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.9	178.8	-72.6	177.8	168.1	-165.3	0	114.3	L298 D299 K308 D309 Y310 K314	L298-K312 HydrophobicContact CB-CG 4.46Å; L298-K312 HydrophobicContact CD1-CG 3.81Å; D299-K312 WeakPolarHBondContact OD1-CE 3.4Å; D299-K312 IonicContact OD1-NZ 3.98Å; D299-K312 PolarHBondContact OD1-NZ 3.13Å; D299-K312 IonicContact OD2-NZ 2.94Å; D299-K312 PolarHBondContact OD2-NZ 3.41Å; K308-K312 WeakPolarHBondContact O-CB 3.31Å; K308-K312 VanDerWaalsContact O-CG 3.29Å; K308-K312 WeakPolarHBondContact O-CG 3.48Å; K308-K312 PolarHBondContact O-N 3.44Å; D309-K312 PolarHBondContact O-N 3.15Å; Y310-K312 PolarHBondContact O-N 2.91Å; K312-K314 PolarHBondContact O-N 2.69Å
313	H	87.9	Confident	84.2	Confident	3 Å²	3	72.2 Å²	72.2	1%	0.014	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	31.1	-175.5	-62.9	-105	0	0	0	112.9	N235 Y236 R283 D309 Y310 F315 D316	N235-H313 PolarHBondContact O-CE1 2.79Å; Y236-H313 AromaticContact CD1-CD2 3.93Å; Y236-H313 AromaticContact CD1-CE1 3.71Å; Y236-H313 AromaticContact CD1-NE2 3.55Å; Y236-H313 AromaticContact CD2-CE1 3.85Å; Y236-H313 HydrophobicContact CE1-CB 4.23Å; Y236-H313 AromaticContact CE1-CD2 3.41Å; Y236-H313 VanDerWaalsContact CE1-CD2 3.41Å; Y236-H313 WeakPolarHBondContact CE1-CD2 3.19Å; Y236-H313 AromaticContact CE1-CE1 3.72Å; Y236-H313 AromaticContact CE1-CG 3.59Å; Y236-H313 AromaticContact CE1-ND1 3.77Å; Y236-H313 AromaticContact CE1-NE2 3.55Å; Y236-H313 AromaticContact CE2-CE1 3.88Å; Y236-H313 AromaticContact CE2-ND1 3.6Å; Y236-H313 AromaticContact CG-CE1 3.8Å; Y236-H313 AromaticContact CZ-CD2 3.81Å; Y236-H313 AromaticContact CZ-CE1 3.81Å; Y236-H313 AromaticContact CZ-CG 3.45Å; Y236-H313 VanDerWaalsContact CZ-CG 3.45Å; Y236-H313 AromaticContact CZ-ND1 3.46Å; Y236-H313 VanDerWaalsContact OH-CB 3.24Å; Y236-H313 WeakPolarHBondContact OH-CB 3.46Å; R283-H313 PolarHBondContact NH1-CE1 3.26Å; R283-H313 PolarHBondContact NH1-ND1 3.48Å; D309-H313 PolarHBondContact O-N 2.65Å; Y310-H313 PolarHBondContact O-N 3.4Å; Y310-H313 VanDerWaalsContact O-N 3.1Å; H313-F315 PolarHBondContact O-N 3.1Å; H313-D316 HydrophobicContact CB-CB 4.1Å; H313-D316 IonicContact CE1-OD2 2.57Å; H313-D316 IonicContact CG-OD2 3.71Å; H313-D316 IonicContact ND1-OD2 3.71Å; H313-D316 PolarHBondContact ND1-OD2 2.72Å; H313-D316 PolarHBondContact O-N 3.4Å
314	K	79.4	Confident	83.5	Confident	116 Å²	116	73 Å²	73	50%	0.504	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23	-173.1	-171.3	-177.5	178.2	-176.6	0	113.8	D309 K312	D309-K314 HydrophobicContact CB-CB 4.12Å; D309-K314 HydrophobicContact CB-CD 3.78Å; D309-K314 WeakPolarHBondContact O-CB 3.15Å; D309-K314 PolarHBondContact O-N 2.86Å; D309-K314 WeakPolarHBondContact OD1-CD 3.4Å; D309-K314 IonicContact OD1-NZ 2.74Å; D309-K314 PolarHBondContact OD1-NZ 3.13Å; D309-K314 IonicContact OD2-NZ 3.38Å; D309-K314 PolarHBondContact OD2-NZ 2.96Å; K312-K314 PolarHBondContact O-N 2.69Å
315	F	72	Confident	82.6	Confident	128 Å²	128	74.4 Å²	74.4	56%	0.561	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	3.9	-179.3	-53.4	-66.9	0	0	0	112.8	D309 H313 D317	D309-F315 HydrophobicContact CB-CD2 4.41Å; D309-F315 HydrophobicContact CB-CE2 3.54Å; D309-F315 HydrophobicContact CB-CZ 3.98Å; H313-F315 PolarHBondContact O-N 3.1Å; F315-D317 PolarHBondContact O-N 2.71Å
316	D	72	Confident	81.7	Confident	30 Å²	30	68.3 Å²	68.3	16%	0.16	34%	0.335	C	S	.	.			trans	-86.2	92.2	-179.8	-64	13.6	0	0	0	107.6	R197 R283 H313 I318	R197-D316 PolarHBondContact NH1-O 2.54Å; R283-D316 IonicContact CZ-OD2 2.73Å; R283-D316 IonicContact NH1-OD1 3.93Å; R283-D316 IonicContact NH1-OD2 2.96Å; R283-D316 PolarHBondContact NH1-OD2 2.96Å; R283-D316 IonicContact NH2-OD1 2.86Å; H313-D316 HydrophobicContact CB-CB 4.1Å; H313-D316 IonicContact CE1-OD2 2.57Å; H313-D316 IonicContact CG-OD2 3.71Å; H313-D316 IonicContact ND1-OD2 3.71Å; H313-D316 PolarHBondContact ND1-OD2 2.72Å; H313-D316 PolarHBondContact O-N 3.4Å; D316-I318 PolarHBondContact O-N 3.25Å; D316-I318 VanDerWaalsContact O-N 3.16Å
317	D	52.8	Low	80.7	Confident	154 Å²	154	66 Å²	66	82%	0.824	31%	0.314	S	S	*	.			trans	-71.5	1.1	176.2	-76.7	-32.3	0	0	0	113.2	R197 F315	R197-D317 VanDerWaalsContact NH1-C 3.26Å; R197-D317 PolarHBondContact NH1-O 3.36Å; R197-D317 PolarHBondContact NH2-O 3.45Å; F315-D317 PolarHBondContact O-N 2.71Å
318	I	49.9	Very low	79.6	Confident	79 Å²	79	62.4 Å²	62.4	41%	0.405	30%	0.295	S	S	.	.			trans	-78.3	0	-174.8	-51.8	162.7	0	0	0	114	R197 Q231 M232 N235 D316	R197-I318 PolarHBondContact NH1-O 3.36Å; R197-I318 PolarHBondContact NH2-O 2.88Å; R197-I318 PolarHBondContact NH2-OXT 3.03Å; Q231-I318 HydrophobicContact CB-CG2 4.37Å; M232-I318 HydrophobicContact CG-CG2 3.98Å; N235-I318 WeakPolarHBondContact ND2-CD1 3.35Å; D316-I318 PolarHBondContact O-N 3.25Å; D316-I318 VanDerWaalsContact O-N 3.16Å

Retrieved 318 of 318 residues in 61 ms (Link to these results)

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