A0A087YJE6_POEFO Loading...

Ankyrin repeat and death domain containing 1B

AlphaFold DB , UniProt , Accession A0A087YJE6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 548 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	38.9	Very low	33.8	Very low	218 Å²	218	154.7 Å²	154.7	100%	1.074	73%	0.73	S	S	*	*				0	-53.7	0	-87.5	155.1	178	0	0	112.2	R3 R4	M1-R3 PolarHBondContact O-N 2.75Å; M1-R4 PolarHBondContact O-N 2.57Å
2	E	28.3	Very low	33.8	Very low	169 Å²	169	152.9 Å²	152.9	79%	0.79	73%	0.726	S	S	*	*	H	α-helix	trans	-62.9	-30.8	-175.6	-66.7	179	154.1	0	0	116.4	R4	E2-R4 VanDerWaalsContact C-N 3.29Å; E2-R4 PolarHBondContact O-N 3.42Å
3	R	29.1	Very low	33.3	Very low	233 Å²	233	155.8 Å²	155.8	88%	0.879	73%	0.734	S	S	*	*	H	α-helix	trans	-70.3	-19.8	178	-75	-174.5	-174.9	177.2	2	114.3	M1	M1-R3 PolarHBondContact O-N 2.75Å
4	R	41.3	Very low	33.2	Very low	210 Å²	210	155.2 Å²	155.2	79%	0.792	74%	0.738	S	S	*	*	H	α-helix	trans	-86.2	-27.7	-179	-74.9	-175	175.5	177	-2.4	112.6	M1 E2 L6 S7 V8	M1-R4 PolarHBondContact O-N 2.57Å; E2-R4 VanDerWaalsContact C-N 3.29Å; E2-R4 PolarHBondContact O-N 3.42Å; R4-L6 PolarHBondContact O-N 2.75Å; R4-S7 PolarHBondContact O-N 2.85Å; R4-V8 PolarHBondContact O-N 2.85Å
5	V	37.9	Very low	32.8	Very low	90 Å²	90	155.8 Å²	155.8	55%	0.545	75%	0.747	S	S	.	*	H	α-helix	trans	-59.4	-30.7	171.2	-176.7	0	0	0	0	111.8
6	L	32	Very low	32.4	Very low	118 Å²	118	152.8 Å²	152.8	62%	0.618	75%	0.746	S	S	*	*	H	α-helix	trans	-80.3	-23	176.2	-86.7	141.9	0	0	0	114.2	R4	R4-L6 PolarHBondContact O-N 2.75Å
7	S	33.2	Very low	32.1	Very low	78 Å²	78	149.4 Å²	149.4	55%	0.545	74%	0.738	S	S	.	*	H	α-helix	trans	-81.6	-24.7	-177.3	-174.6	0	0	0	0	113.1	R4 T10	R4-S7 PolarHBondContact O-N 2.85Å; S7-T10 PolarHBondContact O-OG1 3Å
8	V	36.4	Very low	31.9	Very low	84 Å²	84	152.6 Å²	152.6	51%	0.509	75%	0.747	S	S	.	*	H	α-helix	trans	-83	-32.9	178.2	-177.1	0	0	0	0	110.9	R4 T10 K11	R4-V8 PolarHBondContact O-N 2.85Å; V8-T10 PolarHBondContact O-N 3.44Å; V8-T10 VanDerWaalsContact O-N 3.08Å; V8-K11 PolarHBondContact O-N 2.98Å
9	R	32.7	Very low	32	Very low	201 Å²	201	152.5 Å²	152.5	76%	0.758	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-18.5	176.3	-78.4	-178.6	173.7	-179.6	-0.9	115.2
10	T	28.3	Very low	32.3	Very low	116 Å²	116	151.7 Å²	151.7	71%	0.712	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	0.4	-172.1	40.6	0	0	0	0	115.3	S7 V8	S7-T10 PolarHBondContact O-OG1 3Å; V8-T10 PolarHBondContact O-N 3.44Å; V8-T10 VanDerWaalsContact O-N 3.08Å
11	K	33.7	Very low	32.9	Very low	185 Å²	185	147.9 Å²	147.9	80%	0.804	72%	0.717	S	S	*	*	S	Bend	trans	-124	1.6	-173.2	-90.7	-174.9	175.2	-178.2	0	118.3	V8	V8-K11 PolarHBondContact O-N 2.98Å
12	I	34.6	Very low	33.8	Very low	133 Å²	133	138.4 Å²	138.4	68%	0.682	67%	0.671	S	S	*	*			trans	-133	71	-171.8	-46.8	178.4	0	0	0	110.2
13	K	26.9	Very low	35.3	Very low	191 Å²	191	133.1 Å²	133.1	83%	0.83	65%	0.647	S	S	*	*			trans	-90.4	133.3	144.7	-88.4	179.2	173.3	177.4	0	105.2
14	D	32	Very low	36.8	Very low	147 Å²	147	124.3 Å²	124.3	79%	0.786	62%	0.618	S	S	*	*	S	Bend	trans	89.9	73.2	171.9	-46.2	-29.7	0	0	0	116
15	N	27.4	Very low	37.6	Very low	164 Å²	164	117.5 Å²	117.5	88%	0.877	60%	0.601	S	S	*	*				-172.6	99.5	127	-101.9	-21	0	0	0	110.1
16	C	25.3	Very low	38.9	Very low	108 Å²	108	117 Å²	117	73%	0.73	59%	0.591	S	S	*	*			trans	-113.9	129.1	172.1	-168.3	0	0	0	0	107.4
17	P	27.9	Very low	41.1	Very low	95 Å²	95	111.4 Å²	111.4	62%	0.617	56%	0.562	S	S	*	*			trans	-57.9	140.9	175.3	-11	19.1	0	0	0	110.7	K19	P17-K19 PolarHBondContact O-N 3.25Å
18	K	27.6	Very low	42.6	Very low	206 Å²	206	109.3 Å²	109.3	90%	0.896	54%	0.544	S	S	*	.			trans	-65.7	117.1	-170.5	-70.8	174.1	-179.9	170.2	0	111.4	E20	K18-E20 PolarHBondContact O-N 3.33Å; K18-E20 VanDerWaalsContact O-N 3.12Å
19	K	35.4	Very low	43.5	Very low	152 Å²	152	112.4 Å²	112.4	66%	0.661	55%	0.553	S	S	*	*			trans	-43.8	107.3	165.5	-68.3	172.2	-179.3	174.9	0	111.8	P17 K21	P17-K19 PolarHBondContact O-N 3.25Å; K19-K21 HydrophobicContact CB-CG 4.13Å; K19-K21 HydrophobicContact CD-CD 4.26Å; K19-K21 PolarHBondContact O-N 2.98Å; K19-K21 VanDerWaalsContact O-N 3.15Å
20	E	37.1	Very low	44.3	Very low	136 Å²	136	109.8 Å²	109.8	64%	0.636	54%	0.543	S	S	*	.			trans	-84.1	62.4	156.6	-75.9	-165.2	163.9	0	0	109.2	K18	K18-E20 PolarHBondContact O-N 3.33Å; K18-E20 VanDerWaalsContact O-N 3.12Å
21	K	45.2	Very low	45	Very low	71 Å²	71	109.5 Å²	109.5	31%	0.309	54%	0.537	S	S	.	.	S	Bend	trans	-82.1	149.8	163.6	-68.1	-173.3	-178.3	-151.4	0	108	K19 D23	K19-K21 HydrophobicContact CB-CG 4.13Å; K19-K21 HydrophobicContact CD-CD 4.26Å; K19-K21 PolarHBondContact O-N 2.98Å; K19-K21 VanDerWaalsContact O-N 3.15Å; K21-D23 PolarHBondContact O-N 3.15Å
22	L	57.8	Low	45	Very low	20 Å²	20	107.2 Å²	107.2	11%	0.105	53%	0.533	C	S	.	.			trans	-62	86.4	162	-153.4	97.8	0	0	0	107.5	L24 W27 F33 W132 F133	L22-L24 PolarHBondContact O-N 3.14Å; L22-W27 VanDerWaalsContact CD2-CD1 3.45Å; L22-W27 HydrophobicContact CD2-CG 4.15Å; L22-W27 HydrophobicContact CG-CG 4.35Å; L22-F33 HydrophobicContact CD1-CD1 4.44Å; L22-F33 HydrophobicContact CD1-CE1 3.82Å; L22-F33 HydrophobicContact CG-CE1 4.25Å; L22-W132 HydrophobicContact CB-CD2 4.42Å; L22-W132 VanDerWaalsContact CB-CE2 3.43Å; L22-W132 HydrophobicContact CB-CH2 4.2Å; L22-W132 HydrophobicContact CB-CZ2 3.33Å; L22-W132 HydrophobicContact CD2-CD2 4.41Å; L22-W132 HydrophobicContact CD2-CG 4.49Å; L22-W132 PolarHBondContact O-NE1 2.94Å; L22-F133 HydrophobicContact CD2-CZ 4.21Å
23	D	60.2	Low	45	Very low	57 Å²	57	102.1 Å²	102.1	31%	0.305	51%	0.507	S	S	.	.			trans	-78.1	118	-170.4	-177.9	5.3	0	0	0	108.7	K21 P25 K26 W27	K21-D23 PolarHBondContact O-N 3.15Å; D23-P25 VanDerWaalsContact OD1-CD 3.28Å; D23-P25 WeakPolarHBondContact OD1-CD 3.33Å; D23-K26 HydrophobicContact CB-CB 4.08Å; D23-K26 HydrophobicContact CB-CD 3.92Å; D23-K26 HydrophobicContact CB-CG 4.03Å; D23-K26 CarbonylContact O-C 3.56Å; D23-K26 WeakPolarHBondContact O-CA 3.31Å; D23-K26 PolarHBondContact O-N 3.09Å; D23-K26 WeakPolarHBondContact OD2-CD 3.28Å; D23-K26 WeakPolarHBondContact OD2-CE 3.21Å; D23-K26 WeakPolarHBondContact OD2-CG 3.25Å; D23-K26 IonicContact OD2-NZ 3.11Å; D23-K26 PolarHBondContact OD2-NZ 3.35Å; D23-W27 PolarHBondContact O-N 2.93Å
24	L	59.8	Low	45.6	Very low	48 Å²	48	100.8 Å²	100.8	25%	0.251	50%	0.496	S	S	.	.	H	α-helix	trans	-53.4	-50.1	-170.2	-179.2	67.6	0	0	0	112.2	L22 K26 W27 M28 A99 F133	L22-L24 PolarHBondContact O-N 3.14Å; L24-K26 PolarHBondContact O-N 3.05Å; L24-W27 PolarHBondContact O-N 3.43Å; L24-M28 HydrophobicContact CD1-CE 3.56Å; L24-M28 HydrophobicContact CD1-CG 4.03Å; L24-M28 HydrophobicContact CD2-CE 3.96Å; L24-M28 HydrophobicContact CG-CE 3.75Å; L24-M28 HydrophobicContact CG-CG 4.32Å; L24-M28 WeakPolarHBondContact O-CB 2.83Å; L24-M28 VanDerWaalsContact O-CG 3.23Å; L24-M28 WeakPolarHBondContact O-CG 3.16Å; L24-M28 PolarHBondContact O-N 2.85Å; L24-A99 HydrophobicContact CD1-CB 3.99Å; L24-A99 WeakPolarHBondContact CD1-O 3.49Å; L24-F133 HydrophobicContact CB-CD1 4.17Å; L24-F133 HydrophobicContact CB-CE1 3.62Å; L24-F133 HydrophobicContact CB-CZ 4.28Å; L24-F133 HydrophobicContact CD1-CD1 3.89Å; L24-F133 HydrophobicContact CD1-CD2 4.3Å; L24-F133 HydrophobicContact CD1-CE1 3.44Å; L24-F133 VanDerWaalsContact CD1-CE1 3.44Å; L24-F133 HydrophobicContact CD1-CE2 3.86Å; L24-F133 HydrophobicContact CD1-CG 4.32Å; L24-F133 HydrophobicContact CD1-CZ 3.41Å; L24-F133 VanDerWaalsContact CD1-CZ 3.41Å; L24-F133 HydrophobicContact CG-CD1 4.44Å; L24-F133 HydrophobicContact CG-CE1 4.07Å; L24-F133 HydrophobicContact CG-CZ 4.46Å
25	P	58.3	Low	46	Very low	68 Å²	68	94.4 Å²	94.4	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-49.5	-47.1	168.6	-29.8	30	0	0	0	114.6	D23 M28 Q29	D23-P25 VanDerWaalsContact OD1-CD 3.28Å; D23-P25 WeakPolarHBondContact OD1-CD 3.33Å; P25-M28 PolarHBondContact O-N 3.21Å; P25-Q29 WeakPolarHBondContact O-CB 3.29Å; P25-Q29 WeakPolarHBondContact O-CG 3.35Å; P25-Q29 PolarHBondContact O-N 3.05Å
26	K	65.9	Low	46.2	Very low	79 Å²	79	89.8 Å²	89.8	34%	0.343	44%	0.444	S	S	.	.	H	α-helix	trans	-72.2	-40.4	-178.2	-63.1	180	-171.1	156.1	0	112.4	D23 L24 M28 Q29 R30 F33	D23-K26 HydrophobicContact CB-CB 4.08Å; D23-K26 HydrophobicContact CB-CD 3.92Å; D23-K26 HydrophobicContact CB-CG 4.03Å; D23-K26 CarbonylContact O-C 3.56Å; D23-K26 WeakPolarHBondContact O-CA 3.31Å; D23-K26 PolarHBondContact O-N 3.09Å; D23-K26 WeakPolarHBondContact OD2-CD 3.28Å; D23-K26 WeakPolarHBondContact OD2-CE 3.21Å; D23-K26 WeakPolarHBondContact OD2-CG 3.25Å; D23-K26 IonicContact OD2-NZ 3.11Å; D23-K26 PolarHBondContact OD2-NZ 3.35Å; L24-K26 PolarHBondContact O-N 3.05Å; K26-M28 VanDerWaalsContact C-N 3.28Å; K26-M28 PolarHBondContact O-N 3.08Å; K26-Q29 PolarHBondContact O-N 3.05Å; K26-R30 PolarHBondContact O-N 3.05Å; K26-F33 HydrophobicContact CB-CD2 3.69Å; K26-F33 HydrophobicContact CB-CE2 3.56Å; K26-F33 HydrophobicContact CD-CE2 3.95Å; K26-F33 HydrophobicContact CG-CE2 4.41Å
27	W	77.1	Confident	46.7	Very low	1 Å²	1	92.2 Å²	92.2	0%	0.004	44%	0.438	C	S	.	.	H	α-helix	trans	-63.8	-36.6	175.1	-174.2	98.3	0	0	0	111	L22 D23 L24 R91 H95 Y96 A99 L129	L22-W27 VanDerWaalsContact CD2-CD1 3.45Å; L22-W27 HydrophobicContact CD2-CG 4.15Å; L22-W27 HydrophobicContact CG-CG 4.35Å; D23-W27 PolarHBondContact O-N 2.93Å; L24-W27 PolarHBondContact O-N 3.43Å; W27-R91 VanDerWaalsContact CD1-NH2 3.32Å; W27-R91 VanDerWaalsContact CE2-CZ 3.41Å; W27-R91 PolarHBondContact O-NH1 2.94Å; W27-H95 HydrophobicContact CH2-CB 4.03Å; W27-Y96 HydrophobicContact CZ3-CD1 4.06Å; W27-Y96 HydrophobicContact CZ3-CE1 4.29Å; W27-A99 HydrophobicContact CE3-CB 3.78Å; W27-A99 HydrophobicContact CH2-CB 3.74Å; W27-A99 HydrophobicContact CZ3-CB 3.26Å; W27-L129 HydrophobicContact CH2-CD1 3.87Å; W27-L129 HydrophobicContact CZ2-CD1 3.71Å; W27-L129 HydrophobicContact CZ2-CD2 3.95Å
28	M	64.8	Low	46.9	Very low	34 Å²	34	96.7 Å²	96.7	17%	0.167	45%	0.447	C	S	.	.	H	α-helix	trans	-77.5	-26.9	177.2	-79.6	-149.5	-163.5	0	0	115	L24 P25 K26 K67	L24-M28 HydrophobicContact CD1-CE 3.56Å; L24-M28 HydrophobicContact CD1-CG 4.03Å; L24-M28 HydrophobicContact CD2-CE 3.96Å; L24-M28 HydrophobicContact CG-CE 3.75Å; L24-M28 HydrophobicContact CG-CG 4.32Å; L24-M28 WeakPolarHBondContact O-CB 2.83Å; L24-M28 VanDerWaalsContact O-CG 3.23Å; L24-M28 WeakPolarHBondContact O-CG 3.16Å; L24-M28 PolarHBondContact O-N 2.85Å; P25-M28 PolarHBondContact O-N 3.21Å; K26-M28 VanDerWaalsContact C-N 3.28Å; K26-M28 PolarHBondContact O-N 3.08Å; M28-K67 PolarHBondContact O-NZ 3.24Å; M28-K67 HydrophobicContact SD-CD 4.38Å; M28-K67 HydrophobicContact SD-CG 3.94Å
29	Q	54.5	Low	47.3	Very low	148 Å²	148	95.6 Å²	95.6	69%	0.692	45%	0.445	S	S	*	.	H	α-helix	trans	-102.1	-21.2	-170.8	-73.7	176.4	9.3	0	0	115.5	P25 K26	P25-Q29 WeakPolarHBondContact O-CB 3.29Å; P25-Q29 WeakPolarHBondContact O-CG 3.35Å; P25-Q29 PolarHBondContact O-N 3.05Å; K26-Q29 PolarHBondContact O-N 3.05Å
30	R	50.9	Low	47.2	Very low	147 Å²	147	91.9 Å²	91.9	56%	0.555	44%	0.439	S	S	*	.			trans	-113.3	128.7	-168.8	-73.4	-178.1	175.5	-179.4	-3.4	114.1	K26 N32 F33	K26-R30 PolarHBondContact O-N 3.05Å; R30-N32 PolarHBondContact O-N 3.02Å; R30-F33 HydrophobicContact CB-CB 4.27Å
31	D	41.7	Very low	46.8	Very low	109 Å²	109	92 Å²	92	58%	0.583	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	11.6	164.2	-65.5	-41	0	0	0	113.5	H89	D31-H89 VanDerWaalsContact C-CE1 3.46Å; D31-H89 WeakPolarHBondContact CA-NE2 3.36Å; D31-H89 PolarHBondContact O-CE1 3.11Å; D31-H89 PolarHBondContact O-NE2 3.01Å
32	N	34.3	Very low	46.3	Very low	137 Å²	137	100.8 Å²	100.8	73%	0.733	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	23.4	-177.6	-96.2	-16.4	0	0	0	114.6	R30 R34	R30-N32 PolarHBondContact O-N 3.02Å; N32-R34 PolarHBondContact O-N 3.05Å
33	F	35.8	Very low	45	Very low	27 Å²	27	108 Å²	108	12%	0.118	51%	0.508	C	S	.	.			trans	-71.9	115.8	177.9	-169.5	-95.4	0	0	0	111	L22 K26 R30 Y122	L22-F33 HydrophobicContact CD1-CD1 4.44Å; L22-F33 HydrophobicContact CD1-CE1 3.82Å; L22-F33 HydrophobicContact CG-CE1 4.25Å; K26-F33 HydrophobicContact CB-CD2 3.69Å; K26-F33 HydrophobicContact CB-CE2 3.56Å; K26-F33 HydrophobicContact CD-CE2 3.95Å; K26-F33 HydrophobicContact CG-CE2 4.41Å; R30-F33 HydrophobicContact CB-CB 4.27Å; F33-Y122 PolarHBondContact O-OH 3.3Å
34	R	39.4	Very low	43.6	Very low	163 Å²	163	111.8 Å²	111.8	62%	0.615	53%	0.533	S	S	*	.			trans	-74	137.3	169.5	-66.2	-173.4	-172.5	-162.7	2	109.2	N32	N32-R34 PolarHBondContact O-N 3.05Å
35	G	39.1	Very low	42.1	Very low	12 Å²	12	116.4 Å²	116.4	12%	0.124	56%	0.558	C	S	.	*			trans	-62.3	-170.8	169	0	0	0	0	0	112.3	R37	G35-R37 PolarHBondContact O-N 2.89Å; G35-R37 VanDerWaalsContact O-N 3.1Å
36	P	32.8	Very low	40.7	Very low	68 Å²	68	120.3 Å²	120.3	44%	0.442	58%	0.575	S	S	.	*	S	Bend	trans	-46.4	121.3	174.3	-22.2	31.9	0	0	0	109.9	E155	P36-E155 WeakPolarHBondContact CD-OE1 3.27Å
37	R	35.7	Very low	39.4	Very low	159 Å²	159	125.3 Å²	125.3	60%	0.6	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-71.8	137.1	-173.7	-76.9	178.7	171.5	-162.5	-2.7	110.1	G35 H39	G35-R37 PolarHBondContact O-N 2.89Å; G35-R37 VanDerWaalsContact O-N 3.1Å; R37-H39 PolarHBondContact O-N 2.62Å
38	K	32.3	Very low	37.2	Very low	188 Å²	188	129.4 Å²	129.4	82%	0.817	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-59	128.4	160.8	-70.1	-176.2	176.3	-178.9	0	108.9	S40	K38-S40 PolarHBondContact O-N 3.19Å
39	H	34.7	Very low	35.9	Very low	183 Å²	183	137.2 Å²	137.2	85%	0.847	66%	0.662	S	S	*	*	S	Bend	trans	-76.5	70.4	162.4	-89.8	-76.3	0	0	0	109.6	R37	R37-H39 PolarHBondContact O-N 2.62Å
40	S	34.6	Very low	35	Very low	75 Å²	75	135.8 Å²	135.8	52%	0.524	66%	0.659	S	S	.	*			trans	-178.8	149.5	149.9	62.8	0	0	0	0	108.7	K38	K38-S40 PolarHBondContact O-N 3.19Å
41	D	28.8	Very low	34.7	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	67%	0.673	S	S	*	*			trans	95.5	100.2	164.8	-44.6	-37.6	0	0	0	116.9
42	R	34.7	Very low	35	Very low	255 Å²	255	135.9 Å²	135.9	96%	0.962	67%	0.67	S	S	*	*			trans	-73.7	108.8	155.3	-73.2	178.1	177.6	176.9	-0	107.2
43	E	30.3	Very low	36	Very low	173 Å²	173	136.5 Å²	136.5	81%	0.808	67%	0.669	S	S	*	*			trans	-135.1	145.3	164	-74	-168.1	161.5	0	0	111.6
44	T	29.7	Very low	37.5	Very low	135 Å²	135	140.3 Å²	140.3	83%	0.828	69%	0.688	S	S	*	*			trans	-69.5	140.6	-160.9	39.1	0	0	0	0	114.3	D46	T44-D46 PolarHBondContact O-N 3.1Å
45	D	29.7	Very low	39.4	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	66%	0.664	S	S	*	*			trans	-65.4	108.6	171	-64.1	-43	0	0	0	110.2
46	D	28.8	Very low	41.7	Very low	150 Å²	150	138.3 Å²	138.3	80%	0.802	69%	0.686	S	S	*	*			trans	-108.9	81.6	161.1	-161.3	11.2	0	0	0	107.9	T44 S48	T44-D46 PolarHBondContact O-N 3.1Å; D46-S48 PolarHBondContact O-N 3.18Å
47	E	38.5	Very low	44.2	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	69%	0.691	S	S	*	*			trans	-77.7	97.3	168.8	-75.2	-163.2	163	0	0	109.1
48	S	30.2	Very low	46.7	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	68%	0.68	S	S	*	*			trans	-137.6	107.8	168.9	140	0	0	0	0	110.5	D46	D46-S48 PolarHBondContact O-N 3.18Å
49	F	36.5	Very low	49.5	Very low	199 Å²	199	127.4 Å²	127.4	87%	0.873	65%	0.647	S	S	*	*			trans	52.5	105.4	155	-76.5	-94.9	0	0	0	118.5
50	D	35.8	Very low	52.1	Low	118 Å²	118	122.2 Å²	122.2	63%	0.631	62%	0.622	S	S	*	*			trans	-145.3	105.3	158.6	-133.7	2.1	0	0	0	112	K52	D50-K52 PolarHBondContact O-N 3.39Å; D50-K52 VanDerWaalsContact O-N 3.12Å; D50-K52 WeakPolarHBondContact OD2-CE 3.41Å; D50-K52 IonicContact OD2-NZ 2.62Å; D50-K52 PolarHBondContact OD2-NZ 2.93Å
51	T	44.3	Very low	54.8	Low	139 Å²	139	123.8 Å²	123.8	85%	0.853	62%	0.621	S	S	*	*			trans	-61.7	94.9	169	39.7	0	0	0	0	111.1
52	K	49.2	Very low	57.8	Low	118 Å²	118	117.3 Å²	117.3	51%	0.513	59%	0.586	S	S	.	*			trans	-129.1	80	-176.6	-92.3	174.5	173.7	145.7	0	114	D50 M54 V88	D50-K52 PolarHBondContact O-N 3.39Å; D50-K52 VanDerWaalsContact O-N 3.12Å; D50-K52 WeakPolarHBondContact OD2-CE 3.41Å; D50-K52 IonicContact OD2-NZ 2.62Å; D50-K52 PolarHBondContact OD2-NZ 2.93Å; K52-M54 HydrophobicContact CB-CG 4.48Å; K52-M54 HydrophobicContact CD-SD 4.43Å; K52-M54 HydrophobicContact CG-CG 4.21Å; K52-M54 HydrophobicContact CG-SD 4.4Å; K52-V88 HydrophobicContact CB-CG1 4.14Å; K52-V88 HydrophobicContact CD-CG1 4.19Å
53	E	54.9	Low	60.6	Low	150 Å²	150	105.8 Å²	105.8	70%	0.701	54%	0.543	S	S	*	.			trans	-97	83.1	154.8	-141	172.7	-159.9	0	0	108.8	L55 K60	E53-L55 VanDerWaalsContact C-N 3.33Å; E53-K60 IonicContact OE1-NZ 3.88Å; E53-K60 PolarHBondContact OE1-NZ 3.26Å
54	M	66.5	Low	63.5	Low	107 Å²	107	100.4 Å²	100.4	53%	0.527	52%	0.518	S	S	.	.			trans	-82.2	-8.7	-178.8	-68.8	-172.6	73.9	0	0	113.8	K52 V88	K52-M54 HydrophobicContact CB-CG 4.48Å; K52-M54 HydrophobicContact CD-SD 4.43Å; K52-M54 HydrophobicContact CG-CG 4.21Å; K52-M54 HydrophobicContact CG-SD 4.4Å; M54-V88 HydrophobicContact CG-CG1 4.41Å; M54-V88 HydrophobicContact SD-CG1 4.15Å
55	L	79.6	Confident	66.6	Low	20 Å²	20	94.2 Å²	94.2	11%	0.105	48%	0.481	C	S	.	.	S	Bend	trans	-127.5	136.9	-176	-71.9	175.3	0	0	0	110.7	E53 E59 K60 M63 A85 K86 N87	E53-L55 VanDerWaalsContact C-N 3.33Å; L55-E59 WeakPolarHBondContact CA-OE2 3.44Å; L55-E59 HydrophobicContact CB-CB 4.31Å; L55-E59 HydrophobicContact CD2-CB 3.91Å; L55-E59 WeakPolarHBondContact CD2-OE2 3.26Å; L55-K60 HydrophobicContact CB-CG 3.9Å; L55-K60 HydrophobicContact CD1-CG 4.36Å; L55-K60 WeakPolarHBondContact O-CE 3.25Å; L55-M63 HydrophobicContact CD1-CE 3.65Å; L55-M63 HydrophobicContact CD1-SD 3.77Å; L55-M63 HydrophobicContact CD2-CE 3.74Å; L55-M63 HydrophobicContact CG-CE 4.37Å; L55-A85 HydrophobicContact CD2-CB 3.65Å; L55-K86 WeakPolarHBondContact CD2-O 3.39Å; L55-N87 HydrophobicContact CD1-CB 3.63Å
56	L	87.1	Confident	69.7	Low	113 Å²	113	87.3 Å²	87.3	59%	0.592	44%	0.443	S	S	*	.			trans	-64.8	151.7	167.1	-58.6	171.3	0	0	0	109.8	T58 E59 K60	L56-T58 PolarHBondContact O-N 3.47Å; L56-T58 VanDerWaalsContact O-N 3.16Å; L56-E59 HydrophobicContact CB-CB 4.48Å; L56-E59 HydrophobicContact CB-CG 4.04Å; L56-E59 PolarHBondContact N-OE2 3.38Å; L56-E59 WeakPolarHBondContact O-CA 3.38Å; L56-E59 WeakPolarHBondContact O-CB 3.5Å; L56-E59 PolarHBondContact O-N 3.23Å; L56-K60 PolarHBondContact O-N 2.87Å
57	D	86.9	Confident	72.8	Confident	101 Å²	101	82.4 Å²	82.4	54%	0.54	42%	0.415	S	S	.	.	H	α-helix	trans	-58.2	-33.2	178.6	-72.1	-28.2	0	0	0	113	E59 K60 Q61	D57-E59 VanDerWaalsContact C-N 3.33Å; D57-K60 PolarHBondContact O-N 2.85Å; D57-K60 IonicContact OD1-NZ 3.79Å; D57-K60 PolarHBondContact OD1-NZ 3.16Å; D57-Q61 WeakPolarHBondContact O-CB 3.38Å; D57-Q61 VanDerWaalsContact O-CG 3.28Å; D57-Q61 WeakPolarHBondContact O-CG 3.37Å; D57-Q61 PolarHBondContact O-N 2.95Å
58	T	88.5	Confident	75.4	Confident	62 Å²	62	82.3 Å²	82.3	38%	0.38	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-32.9	173.6	49.8	0	0	0	0	112.5	L56 F62 L81	L56-T58 PolarHBondContact O-N 3.47Å; L56-T58 VanDerWaalsContact O-N 3.16Å; T58-F62 WeakPolarHBondContact O-CB 3.48Å; T58-F62 PolarHBondContact O-N 2.71Å; T58-L81 WeakPolarHBondContact OG1-CD1 3.37Å
59	E	90.1	Very high	78.5	Confident	23 Å²	23	80.5 Å²	80.5	11%	0.107	39%	0.39	C	S	.	.	H	α-helix	trans	-73.8	-38.6	175.4	-62.6	173.5	147.1	0	0	111	L55 L56 D57 F62 M63 L81 A85	L55-E59 WeakPolarHBondContact CA-OE2 3.44Å; L55-E59 HydrophobicContact CB-CB 4.31Å; L55-E59 HydrophobicContact CD2-CB 3.91Å; L55-E59 WeakPolarHBondContact CD2-OE2 3.26Å; L56-E59 HydrophobicContact CB-CB 4.48Å; L56-E59 HydrophobicContact CB-CG 4.04Å; L56-E59 PolarHBondContact N-OE2 3.38Å; L56-E59 WeakPolarHBondContact O-CA 3.38Å; L56-E59 WeakPolarHBondContact O-CB 3.5Å; L56-E59 PolarHBondContact O-N 3.23Å; D57-E59 VanDerWaalsContact C-N 3.33Å; E59-F62 PolarHBondContact O-N 3Å; E59-M63 WeakPolarHBondContact O-CG 3.48Å; E59-M63 PolarHBondContact O-N 2.99Å; E59-L81 HydrophobicContact CB-CD1 4.4Å; E59-L81 HydrophobicContact CB-CD2 4.46Å; E59-L81 HydrophobicContact CG-CD1 3.62Å; E59-L81 HydrophobicContact CG-CD2 4.01Å; E59-L81 HydrophobicContact CG-CG 3.84Å; E59-A85 HydrophobicContact CB-CB 4.22Å; E59-A85 HydrophobicContact CG-CB 4.05Å; E59-A85 WeakPolarHBondContact OE1-CB 3.35Å
60	K	89.6	Confident	81.4	Confident	75 Å²	75	73.9 Å²	73.9	33%	0.326	36%	0.364	S	S	.	.	H	α-helix	trans	-60	-47.8	171.5	-61.5	177.1	-164.8	155.9	0	110.9	E53 L55 L56 D57 F62 M63 E64	E53-K60 IonicContact OE1-NZ 3.88Å; E53-K60 PolarHBondContact OE1-NZ 3.26Å; L55-K60 HydrophobicContact CB-CG 3.9Å; L55-K60 HydrophobicContact CD1-CG 4.36Å; L55-K60 WeakPolarHBondContact O-CE 3.25Å; L56-K60 PolarHBondContact O-N 2.87Å; D57-K60 PolarHBondContact O-N 2.85Å; D57-K60 IonicContact OD1-NZ 3.79Å; D57-K60 PolarHBondContact OD1-NZ 3.16Å; K60-F62 VanDerWaalsContact C-N 3.3Å; K60-F62 PolarHBondContact O-N 2.9Å; K60-M63 PolarHBondContact O-N 3.11Å; K60-E64 WeakPolarHBondContact O-CB 3.38Å; K60-E64 PolarHBondContact O-N 2.84Å
61	Q	90.7	Very high	84.2	Confident	107 Å²	107	69.6 Å²	69.6	50%	0.5	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-37.7	176.2	-72.3	174.6	26.6	0	0	112.2	D57 E64 A65 L77	D57-Q61 WeakPolarHBondContact O-CB 3.38Å; D57-Q61 VanDerWaalsContact O-CG 3.28Å; D57-Q61 WeakPolarHBondContact O-CG 3.37Å; D57-Q61 PolarHBondContact O-N 2.95Å; Q61-E64 PolarHBondContact O-N 3.46Å; Q61-A65 WeakPolarHBondContact O-CB 3.48Å; Q61-A65 PolarHBondContact O-N 2.75Å; Q61-L77 HydrophobicContact CB-CD1 3.71Å
62	F	92.8	Very high	86.6	Confident	3 Å²	3	71.6 Å²	71.6	1%	0.013	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-44	175.9	-173.9	-99	0	0	0	112.1	T58 E59 K60 A65 A66 L74 L77 L81 V83 A93 F108 L109	T58-F62 WeakPolarHBondContact O-CB 3.48Å; T58-F62 PolarHBondContact O-N 2.71Å; E59-F62 PolarHBondContact O-N 3Å; K60-F62 VanDerWaalsContact C-N 3.3Å; K60-F62 PolarHBondContact O-N 2.9Å; F62-A65 PolarHBondContact O-N 3.13Å; F62-A66 PolarHBondContact O-N 3.11Å; F62-L74 HydrophobicContact CD1-CD2 4.23Å; F62-L74 HydrophobicContact CD2-CD2 3.57Å; F62-L74 HydrophobicContact CE1-CD2 4.1Å; F62-L74 HydrophobicContact CE2-CB 4.21Å; F62-L74 HydrophobicContact CE2-CD2 3.42Å; F62-L74 VanDerWaalsContact CE2-CD2 3.42Å; F62-L74 HydrophobicContact CE2-CG 4.45Å; F62-L74 HydrophobicContact CG-CD2 3.98Å; F62-L74 HydrophobicContact CZ-CD2 3.7Å; F62-L74 VanDerWaalsContact O-CD2 3.26Å; F62-L74 WeakPolarHBondContact O-CD2 3.2Å; F62-L77 HydrophobicContact CB-CD1 4.42Å; F62-L77 HydrophobicContact CD2-CB 4.04Å; F62-L81 HydrophobicContact CB-CD2 3.62Å; F62-L81 HydrophobicContact CD1-CD2 3.78Å; F62-L81 HydrophobicContact CD2-CD2 4.06Å; F62-L81 HydrophobicContact CE1-CD2 4.45Å; F62-L81 HydrophobicContact CG-CD2 3.55Å; F62-V83 HydrophobicContact CE1-CB 4.15Å; F62-V83 HydrophobicContact CE1-CG1 4.09Å; F62-V83 HydrophobicContact CE2-CG1 4.42Å; F62-V83 HydrophobicContact CZ-CB 4.21Å; F62-V83 HydrophobicContact CZ-CG1 3.7Å; F62-A93 HydrophobicContact CD1-CB 3.7Å; F62-A93 HydrophobicContact CE1-CB 3.58Å; F62-F108 HydrophobicContact CE2-CE1 4.49Å; F62-L109 HydrophobicContact CE1-CD2 3.67Å; F62-L109 HydrophobicContact CZ-CD2 3.54Å
63	M	92.3	Very high	88.7	Confident	12 Å²	12	68.3 Å²	68.3	6%	0.059	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-41.5	174.4	-68.7	-170.5	-170.5	0	0	112.1	L55 E59 K60 A65 A66 K67 A85 N87 A93 Y96	L55-M63 HydrophobicContact CD1-CE 3.65Å; L55-M63 HydrophobicContact CD1-SD 3.77Å; L55-M63 HydrophobicContact CD2-CE 3.74Å; L55-M63 HydrophobicContact CG-CE 4.37Å; E59-M63 WeakPolarHBondContact O-CG 3.48Å; E59-M63 PolarHBondContact O-N 2.99Å; K60-M63 PolarHBondContact O-N 3.11Å; M63-A65 VanDerWaalsContact C-N 3.33Å; M63-A65 PolarHBondContact O-N 3.25Å; M63-A66 WeakPolarHBondContact O-CB 3.35Å; M63-A66 PolarHBondContact O-N 3.2Å; M63-K67 WeakPolarHBondContact O-CB 3.34Å; M63-K67 PolarHBondContact O-N 3.12Å; M63-A85 HydrophobicContact CE-CB 4.21Å; M63-A85 WeakPolarHBondContact CE-O 3.42Å; M63-N87 HydrophobicContact SD-CB 4.36Å; M63-A93 HydrophobicContact CG-CB 4.26Å; M63-Y96 HydrophobicContact CB-CD2 4.28Å; M63-Y96 HydrophobicContact SD-CD2 4.41Å; M63-Y96 HydrophobicContact SD-CE2 4.04Å
64	E	91.6	Very high	90.5	Very high	61 Å²	61	61.1 Å²	61.1	29%	0.285	30%	0.295	S	S	.	.	H	α-helix	trans	-65.7	-37.5	177.4	-172	62.2	-165.3	0	0	111.7	K60 Q61 A66 K67 R68	K60-E64 WeakPolarHBondContact O-CB 3.38Å; K60-E64 PolarHBondContact O-N 2.84Å; Q61-E64 PolarHBondContact O-N 3.46Å; E64-A66 VanDerWaalsContact C-N 3.34Å; E64-A66 PolarHBondContact O-N 2.91Å; E64-K67 WeakPolarHBondContact O-CB 3.36Å; E64-K67 PolarHBondContact O-N 2.96Å; E64-K67 WeakPolarHBondContact OE2-CD 3.4Å; E64-K67 IonicContact OE2-NZ 3.89Å; E64-R68 WeakPolarHBondContact O-CG 3.39Å; E64-R68 PolarHBondContact O-N 3.25Å; E64-R68 IonicContact OE1-CZ 3.89Å; E64-R68 IonicContact OE1-NE 3.13Å; E64-R68 PolarHBondContact OE1-NE 3.41Å; E64-R68 IonicContact OE1-NH2 2.82Å; E64-R68 PolarHBondContact OE1-NH2 2.96Å
65	A	94.6	Very high	91.7	Very high	5 Å²	5	61.6 Å²	61.6	4%	0.041	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-40.9	172.6	0	0	0	0	0	111.7	Q61 F62 M63 R68 N69 D70 T73 L74	Q61-A65 WeakPolarHBondContact O-CB 3.48Å; Q61-A65 PolarHBondContact O-N 2.75Å; F62-A65 PolarHBondContact O-N 3.13Å; M63-A65 VanDerWaalsContact C-N 3.33Å; M63-A65 PolarHBondContact O-N 3.25Å; A65-R68 PolarHBondContact O-N 2.84Å; A65-N69 PolarHBondContact O-N 3.09Å; A65-N69 VanDerWaalsContact O-N 3.16Å; A65-D70 HydrophobicContact CB-CB 4.27Å; A65-D70 PolarHBondContact O-N 2.95Å; A65-T73 HydrophobicContact CB-CG2 3.78Å; A65-L74 HydrophobicContact CB-CD2 3.88Å; A65-L74 HydrophobicContact CB-CG 3.87Å
66	A	95.1	Very high	92.2	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-40.4	173.6	0	0	0	0	0	112.6	F62 M63 E64 R68 N69 L74 A93 A97 N102 L109	F62-A66 PolarHBondContact O-N 3.11Å; M63-A66 WeakPolarHBondContact O-CB 3.35Å; M63-A66 PolarHBondContact O-N 3.2Å; E64-A66 VanDerWaalsContact C-N 3.34Å; E64-A66 PolarHBondContact O-N 2.91Å; A66-R68 VanDerWaalsContact C-N 3.34Å; A66-R68 PolarHBondContact O-N 3.18Å; A66-N69 PolarHBondContact O-N 3.16Å; A66-L74 HydrophobicContact CB-CD1 4.38Å; A66-L74 HydrophobicContact CB-CD2 4.06Å; A66-A93 HydrophobicContact CB-CB 3.85Å; A66-A93 WeakPolarHBondContact CB-O 3.29Å; A66-A97 HydrophobicContact CB-CB 4.25Å; A66-N102 PolarHBondContact O-ND2 3.12Å; A66-L109 HydrophobicContact CB-CD1 4.24Å
67	K	93.2	Very high	92.1	Very high	48 Å²	48	63.7 Å²	63.7	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-34.2	176.3	-173.5	-179.1	169.5	-178.6	0	113.1	M28 M63 E64 Y96 N102	M28-K67 PolarHBondContact O-NZ 3.24Å; M28-K67 HydrophobicContact SD-CD 4.38Å; M28-K67 HydrophobicContact SD-CG 3.94Å; M63-K67 WeakPolarHBondContact O-CB 3.34Å; M63-K67 PolarHBondContact O-N 3.12Å; E64-K67 WeakPolarHBondContact O-CB 3.36Å; E64-K67 PolarHBondContact O-N 2.96Å; E64-K67 WeakPolarHBondContact OE2-CD 3.4Å; E64-K67 IonicContact OE2-NZ 3.89Å; K67-Y96 HydrophobicContact CB-CD1 4.47Å; K67-Y96 HydrophobicContact CD-CD1 4.2Å; K67-Y96 HydrophobicContact CG-CD1 4.34Å; K67-N102 VanDerWaalsContact C-ND2 3.28Å; K67-N102 PolarHBondContact O-ND2 2.98Å
68	R	93.9	Very high	91.6	Very high	180 Å²	180	59 Å²	59	68%	0.679	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	2.9	179.9	-65.5	-178.6	-172.4	-174.7	5.1	114.8	E64 A65 A66 D70	E64-R68 WeakPolarHBondContact O-CG 3.39Å; E64-R68 PolarHBondContact O-N 3.25Å; E64-R68 IonicContact OE1-CZ 3.89Å; E64-R68 IonicContact OE1-NE 3.13Å; E64-R68 PolarHBondContact OE1-NE 3.41Å; E64-R68 IonicContact OE1-NH2 2.82Å; E64-R68 PolarHBondContact OE1-NH2 2.96Å; A65-R68 PolarHBondContact O-N 2.84Å; A66-R68 VanDerWaalsContact C-N 3.34Å; A66-R68 PolarHBondContact O-N 3.18Å; R68-D70 PolarHBondContact O-N 3.41Å
69	N	95.8	Very high	91.1	Very high	49 Å²	49	64.2 Å²	64.2	26%	0.262	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	26.5	-170.6	-152.6	20.5	0	0	0	114.2	A65 A66 V71 N102 E104 A105	A65-N69 PolarHBondContact O-N 3.09Å; A65-N69 VanDerWaalsContact O-N 3.16Å; A66-N69 PolarHBondContact O-N 3.16Å; N69-V71 PolarHBondContact O-N 3.5Å; N69-N102 HydrophobicContact CB-CB 3.81Å; N69-N102 PolarHBondContact N-ND2 2.87Å; N69-N102 WeakPolarHBondContact OD1-CB 3.41Å; N69-E104 PolarHBondContact ND2-OE2 3.47Å; N69-A105 WeakPolarHBondContact OD1-CB 3.41Å; N69-A105 PolarHBondContact OD1-N 2.9Å
70	D	96.3	Very high	90.4	Very high	61 Å²	61	69 Å²	69	33%	0.326	33%	0.33	S	S	.	.			trans	-83.2	80.4	179.3	-175.4	-1.2	0	0	0	111.2	A65 R68 K72 T73 L74	A65-D70 HydrophobicContact CB-CB 4.27Å; A65-D70 PolarHBondContact O-N 2.95Å; R68-D70 PolarHBondContact O-N 3.41Å; D70-K72 PolarHBondContact O-N 3.19Å; D70-K72 WeakPolarHBondContact OD1-CB 3.36Å; D70-K72 PolarHBondContact OD1-N 3.46Å; D70-K72 VanDerWaalsContact OD1-N 3.15Å; D70-T73 VanDerWaalsContact CG-OG1 3.26Å; D70-T73 PolarHBondContact O-N 2.92Å; D70-T73 PolarHBondContact OD1-N 2.89Å; D70-T73 VanDerWaalsContact OD1-N 3.09Å; D70-T73 WeakPolarHBondContact OD2-CB 3.29Å; D70-T73 PolarHBondContact OD2-OG1 3.1Å; D70-L74 WeakPolarHBondContact O-CG 3.34Å; D70-L74 PolarHBondContact O-N 3.05Å
71	V	95.3	Very high	90.2	Very high	27 Å²	27	66.7 Å²	66.7	16%	0.164	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-25.9	179.6	-177.5	0	0	0	0	112.5	N69 K75 E104 A105 F108	N69-V71 PolarHBondContact O-N 3.5Å; V71-K75 HydrophobicContact CG1-CD 4.05Å; V71-K75 HydrophobicContact CG1-CG 4.31Å; V71-K75 WeakPolarHBondContact O-CB 3.22Å; V71-K75 VanDerWaalsContact O-CG 3.27Å; V71-K75 WeakPolarHBondContact O-CG 3.34Å; V71-K75 PolarHBondContact O-N 3.43Å; V71-E104 HydrophobicContact CG2-CB 3.67Å; V71-A105 HydrophobicContact CG2-CB 4.47Å; V71-F108 HydrophobicContact CG1-CB 4.27Å; V71-F108 HydrophobicContact CG1-CG 4.39Å
72	K	94.5	Very high	89.9	Confident	181 Å²	181	65.9 Å²	65.9	79%	0.787	32%	0.321	S	S	*	.	H	α-helix	trans	-67.5	-48.3	178.3	-66.4	-179.7	-178.6	175.9	0	110	D70 K75 H76	D70-K72 PolarHBondContact O-N 3.19Å; D70-K72 WeakPolarHBondContact OD1-CB 3.36Å; D70-K72 PolarHBondContact OD1-N 3.46Å; D70-K72 VanDerWaalsContact OD1-N 3.15Å; K72-K75 PolarHBondContact O-N 3.36Å; K72-H76 PolarHBondContact O-N 3.03Å
73	T	92.6	Very high	89.7	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.301	33%	0.325	S	S	.	.	H	α-helix	trans	-66.2	-40.1	176.8	-62	0	0	0	0	111.5	A65 D70 K75 H76 L77	A65-T73 HydrophobicContact CB-CG2 3.78Å; D70-T73 VanDerWaalsContact CG-OG1 3.26Å; D70-T73 PolarHBondContact O-N 2.92Å; D70-T73 PolarHBondContact OD1-N 2.89Å; D70-T73 VanDerWaalsContact OD1-N 3.09Å; D70-T73 WeakPolarHBondContact OD2-CB 3.29Å; D70-T73 PolarHBondContact OD2-OG1 3.1Å; T73-K75 VanDerWaalsContact C-N 3.34Å; T73-K75 PolarHBondContact O-N 3.18Å; T73-H76 PolarHBondContact O-N 3.19Å; T73-L77 HydrophobicContact CG2-CD1 3.59Å; T73-L77 HydrophobicContact CG2-CG 4.07Å; T73-L77 WeakPolarHBondContact O-CB 3.38Å; T73-L77 WeakPolarHBondContact O-CG 3.33Å; T73-L77 PolarHBondContact O-N 3.07Å
74	L	93.1	Very high	89.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57.9	-43.2	172.7	-72.8	175.9	0	0	0	112.8	F62 A65 A66 D70 H76 G78 A105 F108	F62-L74 HydrophobicContact CD1-CD2 4.23Å; F62-L74 HydrophobicContact CD2-CD2 3.57Å; F62-L74 HydrophobicContact CE1-CD2 4.1Å; F62-L74 HydrophobicContact CE2-CB 4.21Å; F62-L74 HydrophobicContact CE2-CD2 3.42Å; F62-L74 VanDerWaalsContact CE2-CD2 3.42Å; F62-L74 HydrophobicContact CE2-CG 4.45Å; F62-L74 HydrophobicContact CG-CD2 3.98Å; F62-L74 HydrophobicContact CZ-CD2 3.7Å; F62-L74 VanDerWaalsContact O-CD2 3.26Å; F62-L74 WeakPolarHBondContact O-CD2 3.2Å; A65-L74 HydrophobicContact CB-CD2 3.88Å; A65-L74 HydrophobicContact CB-CG 3.87Å; A66-L74 HydrophobicContact CB-CD1 4.38Å; A66-L74 HydrophobicContact CB-CD2 4.06Å; D70-L74 WeakPolarHBondContact O-CG 3.34Å; D70-L74 PolarHBondContact O-N 3.05Å; L74-H76 VanDerWaalsContact C-N 3.34Å; L74-G78 WeakPolarHBondContact O-CA 3.42Å; L74-G78 PolarHBondContact O-N 3.09Å; L74-A105 HydrophobicContact CD1-CB 3.69Å; L74-F108 HydrophobicContact CB-CD1 3.79Å; L74-F108 HydrophobicContact CB-CE1 3.66Å; L74-F108 HydrophobicContact CB-CZ 4.49Å; L74-F108 HydrophobicContact CD1-CD1 4.12Å
75	K	91.9	Very high	89.6	Confident	116 Å²	116	65 Å²	65	50%	0.504	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-36.9	177.1	-79.4	172.3	178.3	178.1	0	112.5	V71 K72 T73 F108	V71-K75 HydrophobicContact CG1-CD 4.05Å; V71-K75 HydrophobicContact CG1-CG 4.31Å; V71-K75 WeakPolarHBondContact O-CB 3.22Å; V71-K75 VanDerWaalsContact O-CG 3.27Å; V71-K75 WeakPolarHBondContact O-CG 3.34Å; V71-K75 PolarHBondContact O-N 3.43Å; K72-K75 PolarHBondContact O-N 3.36Å; T73-K75 VanDerWaalsContact C-N 3.34Å; T73-K75 PolarHBondContact O-N 3.18Å; K75-F108 HydrophobicContact CB-CE2 4.34Å; K75-F108 HydrophobicContact CB-CZ 4.42Å; K75-F108 HydrophobicContact CD-CE2 4.43Å; K75-F108 HydrophobicContact CG-CD2 3.84Å; K75-F108 HydrophobicContact CG-CE2 3.35Å; K75-F108 HydrophobicContact CG-CZ 3.84Å
76	H	90.2	Very high	89.5	Confident	151 Å²	151	68.3 Å²	68.3	70%	0.699	33%	0.333	S	S	*	.	H	α-helix	trans	-71.1	-51.9	180	-172.8	72.8	0	0	0	111.7	K72 T73 L74	K72-H76 PolarHBondContact O-N 3.03Å; T73-H76 PolarHBondContact O-N 3.19Å; L74-H76 VanDerWaalsContact C-N 3.34Å
77	L	86.3	Confident	89.3	Confident	26 Å²	26	68.9 Å²	68.9	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-74.7	-33.2	-177.2	-64.7	178.6	0	0	0	113	Q61 F62 T73 K79	Q61-L77 HydrophobicContact CB-CD1 3.71Å; F62-L77 HydrophobicContact CB-CD1 4.42Å; F62-L77 HydrophobicContact CD2-CB 4.04Å; T73-L77 HydrophobicContact CG2-CD1 3.59Å; T73-L77 HydrophobicContact CG2-CG 4.07Å; T73-L77 WeakPolarHBondContact O-CB 3.38Å; T73-L77 WeakPolarHBondContact O-CG 3.33Å; T73-L77 PolarHBondContact O-N 3.07Å; L77-K79 PolarHBondContact O-N 3.35Å
78	G	74.9	Confident	89	Confident	4 Å²	4	69.4 Å²	69.4	4%	0.041	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	7.9	-171.6	0	0	0	0	0	116.7	L74	L74-G78 WeakPolarHBondContact O-CA 3.42Å; L74-G78 PolarHBondContact O-N 3.09Å
79	K	78.3	Confident	88.7	Confident	171 Å²	171	61.3 Å²	61.3	74%	0.743	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-31.2	180	-74.1	-175.7	179.9	-179.9	0	113.8	L77	L77-K79 PolarHBondContact O-N 3.35Å
80	S	75.1	Confident	88.5	Confident	122 Å²	122	62.2 Å²	62.2	85%	0.853	32%	0.318	S	S	*	.	S	Bend	trans	-126.1	7.1	-175.4	51.8	0	0	0	0	113.3
81	L	85.4	Confident	88.4	Confident	28 Å²	28	59.3 Å²	59.3	15%	0.147	30%	0.303	C	S	.	.	S	Bend	trans	-102.9	148.6	-171.6	-163.3	106.3	0	0	0	112	T58 E59 F62 V83	T58-L81 WeakPolarHBondContact OG1-CD1 3.37Å; E59-L81 HydrophobicContact CB-CD1 4.4Å; E59-L81 HydrophobicContact CB-CD2 4.46Å; E59-L81 HydrophobicContact CG-CD1 3.62Å; E59-L81 HydrophobicContact CG-CD2 4.01Å; E59-L81 HydrophobicContact CG-CG 3.84Å; F62-L81 HydrophobicContact CB-CD2 3.62Å; F62-L81 HydrophobicContact CD1-CD2 3.78Å; F62-L81 HydrophobicContact CD2-CD2 4.06Å; F62-L81 HydrophobicContact CE1-CD2 4.45Å; F62-L81 HydrophobicContact CG-CD2 3.55Å; L81-V83 PolarHBondContact O-N 2.91Å
82	N	85.6	Confident	88.4	Confident	90 Å²	90	58.1 Å²	58.1	48%	0.481	30%	0.296	S	S	.	.			trans	-69.8	95.8	164.3	-179.1	8.8	0	0	0	110.4	N84 A85	N82-N84 PolarHBondContact O-N 3.04Å; N82-N84 WeakPolarHBondContact OD1-CB 3.23Å; N82-N84 PolarHBondContact OD1-N 2.89Å; N82-A85 WeakPolarHBondContact O-CB 3.22Å; N82-A85 PolarHBondContact O-N 3.47Å
83	V	88	Confident	88.4	Confident	19 Å²	19	49.6 Å²	49.6	12%	0.115	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-12.2	178.1	-63.3	0	0	0	0	114.2	F62 L81 V114	F62-V83 HydrophobicContact CE1-CB 4.15Å; F62-V83 HydrophobicContact CE1-CG1 4.09Å; F62-V83 HydrophobicContact CE2-CG1 4.42Å; F62-V83 HydrophobicContact CZ-CB 4.21Å; F62-V83 HydrophobicContact CZ-CG1 3.7Å; L81-V83 PolarHBondContact O-N 2.91Å; V83-V114 HydrophobicContact CB-CG1 3.96Å; V83-V114 HydrophobicContact CG2-CG1 3.67Å
84	N	91.3	Very high	88.7	Confident	31 Å²	31	47.4 Å²	47.4	17%	0.166	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	12.8	177.7	-66.9	-58.4	0	0	0	112.9	N82 V114 K115 Q118	N82-N84 PolarHBondContact O-N 3.04Å; N82-N84 WeakPolarHBondContact OD1-CB 3.23Å; N82-N84 PolarHBondContact OD1-N 2.89Å; N84-V114 WeakPolarHBondContact OD1-CA 3.41Å; N84-V114 WeakPolarHBondContact OD1-CB 3.35Å; N84-K115 PolarHBondContact OD1-N 3.31Å; N84-Q118 PolarHBondContact OD1-NE2 3.17Å
85	A	91.4	Very high	88.8	Confident	8 Å²	8	47.4 Å²	47.4	7%	0.066	25%	0.245	C	C	.	.			trans	-54.6	144.1	175.8	0	0	0	0	0	110.9	L55 E59 M63 N82	L55-A85 HydrophobicContact CD2-CB 3.65Å; E59-A85 HydrophobicContact CB-CB 4.22Å; E59-A85 HydrophobicContact CG-CB 4.05Å; E59-A85 WeakPolarHBondContact OE1-CB 3.35Å; M63-A85 HydrophobicContact CE-CB 4.21Å; M63-A85 WeakPolarHBondContact CE-O 3.42Å; N82-A85 WeakPolarHBondContact O-CB 3.22Å; N82-A85 PolarHBondContact O-N 3.47Å
86	K	92.2	Very high	89	Confident	73 Å²	73	43 Å²	43	32%	0.317	23%	0.226	S	C	.	.			trans	-116.8	135.1	-177.2	-73.6	-173.4	179.1	-163.7	0	109.7	L55 N90 R91 T92	L55-K86 WeakPolarHBondContact CD2-O 3.39Å; K86-N90 HydrophobicContact CD-CB 4.12Å; K86-R91 WeakPolarHBondContact CA-O 3.27Å; K86-T92 HydrophobicContact CG-CG2 3.96Å
87	N	89.5	Confident	89.3	Confident	12 Å²	12	35.8 Å²	35.8	6%	0.064	19%	0.192	C	C	.	.			trans	-78.6	-175.2	169	72.9	-1.2	0	0	0	111.5	L55 M63 H89 N90 R91 Y96	L55-N87 HydrophobicContact CD1-CB 3.63Å; M63-N87 HydrophobicContact SD-CB 4.36Å; N87-H89 PolarHBondContact O-N 2.97Å; N87-H89 WeakPolarHBondContact OD1-CA 3.41Å; N87-H89 WeakPolarHBondContact OD1-CB 3.44Å; N87-H89 PolarHBondContact OD1-N 2.87Å; N87-N90 PolarHBondContact O-N 3.38Å; N87-N90 PolarHBondContact OD1-N 3.15Å; N87-R91 PolarHBondContact N-O 3.15Å; N87-R91 WeakPolarHBondContact OD1-CB 3.49Å; N87-R91 PolarHBondContact OD1-N 2.91Å; N87-R91 PolarHBondContact OD1-O 2.97Å; N87-Y96 PolarHBondContact ND2-OH 3.35Å
88	V	87.7	Confident	89.9	Confident	60 Å²	60	34.6 Å²	34.6	36%	0.364	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.9	176.7	-61.4	0	0	0	0	114.8	K52 M54	K52-V88 HydrophobicContact CB-CG1 4.14Å; K52-V88 HydrophobicContact CD-CG1 4.19Å; M54-V88 HydrophobicContact CG-CG1 4.41Å; M54-V88 HydrophobicContact SD-CG1 4.15Å
89	H	87.6	Confident	90.8	Very high	9 Å²	9	34.4 Å²	34.4	4%	0.042	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	15.4	177.5	-64.6	-21.6	0	0	0	112.8	D31 N87 R91 D120 K121	D31-H89 VanDerWaalsContact C-CE1 3.46Å; D31-H89 WeakPolarHBondContact CA-NE2 3.36Å; D31-H89 PolarHBondContact O-CE1 3.11Å; D31-H89 PolarHBondContact O-NE2 3.01Å; N87-H89 PolarHBondContact O-N 2.97Å; N87-H89 WeakPolarHBondContact OD1-CA 3.41Å; N87-H89 WeakPolarHBondContact OD1-CB 3.44Å; N87-H89 PolarHBondContact OD1-N 2.87Å; H89-R91 HydrophobicContact CB-CG 4.08Å; H89-R91 PolarHBondContact O-N 3.41Å; H89-R91 VanDerWaalsContact O-N 3.12Å; H89-D120 WeakPolarHBondContact O-CB 3.3Å; H89-K121 HydrophobicContact CB-CD 4.14Å; H89-K121 HydrophobicContact CB-CG 4.09Å; H89-K121 PolarHBondContact CE1-NZ 3.25Å; H89-K121 VanDerWaalsContact CE1-NZ 3.27Å; H89-K121 VanDerWaalsContact CG-CE 3.45Å; H89-K121 VanDerWaalsContact ND1-CE 3.27Å; H89-K121 WeakPolarHBondContact ND1-CE 3.37Å; H89-K121 PolarHBondContact ND1-NZ 3.43Å; H89-K121 PolarHBondContact O-N 2.95Å
90	N	92.3	Very high	91.6	Very high	68 Å²	68	27 Å²	27	36%	0.364	16%	0.157	S	C	.	.	S	Bend	trans	59.9	15.7	-174.4	-63.9	-29.4	0	0	0	114.4	K86 N87	K86-N90 HydrophobicContact CD-CB 4.12Å; N87-N90 PolarHBondContact O-N 3.38Å; N87-N90 PolarHBondContact OD1-N 3.15Å
91	R	93.3	Very high	92.6	Very high	1 Å²	1	26 Å²	26	0%	0.004	14%	0.137	C	C	.	.			trans	-85.6	142.9	179.7	-62.4	175.8	-178.6	168.2	0.2	110.6	W27 K86 N87 H89 H95 Y96 D120	W27-R91 VanDerWaalsContact CD1-NH2 3.32Å; W27-R91 VanDerWaalsContact CE2-CZ 3.41Å; W27-R91 PolarHBondContact O-NH1 2.94Å; K86-R91 WeakPolarHBondContact CA-O 3.27Å; N87-R91 PolarHBondContact N-O 3.15Å; N87-R91 WeakPolarHBondContact OD1-CB 3.49Å; N87-R91 PolarHBondContact OD1-N 2.91Å; N87-R91 PolarHBondContact OD1-O 2.97Å; H89-R91 HydrophobicContact CB-CG 4.08Å; H89-R91 PolarHBondContact O-N 3.41Å; H89-R91 VanDerWaalsContact O-N 3.12Å; R91-H95 HydrophobicContact CB-CB 4.23Å; R91-Y96 HydrophobicContact CB-CE2 4.01Å; R91-D120 HydrophobicContact CG-CB 3.63Å; R91-D120 IonicContact NE-OD2 2.94Å; R91-D120 PolarHBondContact NE-OD2 3.18Å; R91-D120 IonicContact NH2-OD2 3.87Å
92	T	95.3	Very high	93.1	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.012	14%	0.135	C	C	.	.			trans	-111.3	170	178.5	68.7	0	0	0	0	110.7	K86 L94 H95 Y96 Q118	K86-T92 HydrophobicContact CG-CG2 3.96Å; T92-L94 PolarHBondContact O-N 3.37Å; T92-L94 VanDerWaalsContact O-N 3.15Å; T92-L94 PolarHBondContact OG1-N 3.37Å; T92-H95 PolarHBondContact N-ND1 3.36Å; T92-H95 VanDerWaalsContact N-ND1 3.11Å; T92-H95 WeakPolarHBondContact O-CB 3.47Å; T92-H95 PolarHBondContact O-N 2.97Å; T92-H95 PolarHBondContact OG1-ND1 2.94Å; T92-Y96 WeakPolarHBondContact O-CD2 3.21Å; T92-Y96 PolarHBondContact O-N 2.91Å; T92-Q118 HydrophobicContact CG2-CB 4.33Å
93	A	95.5	Very high	93.6	Very high	2 Å²	2	24.6 Å²	24.6	2%	0.017	13%	0.126	C	C	.	.	H	α-helix	trans	-52.8	-34.3	172.2	0	0	0	0	0	112.8	F62 M63 A66 Y96 A97 L109	F62-A93 HydrophobicContact CD1-CB 3.7Å; F62-A93 HydrophobicContact CE1-CB 3.58Å; M63-A93 HydrophobicContact CG-CB 4.26Å; A66-A93 HydrophobicContact CB-CB 3.85Å; A66-A93 WeakPolarHBondContact CB-O 3.29Å; A93-Y96 PolarHBondContact O-N 3.12Å; A93-A97 PolarHBondContact O-N 2.94Å; A93-L109 HydrophobicContact CB-CD1 4.14Å; A93-L109 HydrophobicContact CB-CD2 4.18Å
94	L	97.4	Very high	94.1	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-65.2	-40.4	177	-176.2	62.9	0	0	0	112.1	T92 Y96 A97 V98 T106 L109 L110 V114 V116 P126 L142	T92-L94 PolarHBondContact O-N 3.37Å; T92-L94 VanDerWaalsContact O-N 3.15Å; T92-L94 PolarHBondContact OG1-N 3.37Å; L94-Y96 VanDerWaalsContact C-N 3.3Å; L94-Y96 PolarHBondContact O-N 2.91Å; L94-A97 PolarHBondContact O-N 3.49Å; L94-V98 HydrophobicContact CD1-CG2 3.89Å; L94-V98 HydrophobicContact CG-CG2 4.2Å; L94-V98 WeakPolarHBondContact O-CB 3.48Å; L94-V98 VanDerWaalsContact O-CG2 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.01Å; L94-T106 HydrophobicContact CD1-CG2 4.01Å; L94-L109 HydrophobicContact CB-CD1 4.32Å; L94-L109 HydrophobicContact CD1-CB 4.28Å; L94-L109 HydrophobicContact CD1-CD1 4.32Å; L94-L110 HydrophobicContact CD1-CD2 4.34Å; L94-L110 HydrophobicContact CD2-CD2 4.35Å; L94-V114 HydrophobicContact CD2-CG2 3.82Å; L94-V116 HydrophobicContact CD2-CB 4.5Å; L94-V116 HydrophobicContact CD2-CG1 4.38Å; L94-P126 HydrophobicContact CD2-CB 4.03Å; L94-P126 HydrophobicContact CD2-CG 3.74Å; L94-P126 HydrophobicContact CG-CB 4.08Å; L94-P126 HydrophobicContact CG-CG 3.94Å; L94-L142 HydrophobicContact CD1-CD2 4.41Å; L94-L142 HydrophobicContact CD2-CD2 4.21Å
95	H	96.4	Very high	94.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.8	-44.6	176.2	-67.8	80	0	0	0	111.2	W27 R91 T92 A99 Q118 D120 M124 L129	W27-H95 HydrophobicContact CH2-CB 4.03Å; R91-H95 HydrophobicContact CB-CB 4.23Å; T92-H95 PolarHBondContact N-ND1 3.36Å; T92-H95 VanDerWaalsContact N-ND1 3.11Å; T92-H95 WeakPolarHBondContact O-CB 3.47Å; T92-H95 PolarHBondContact O-N 2.97Å; T92-H95 PolarHBondContact OG1-ND1 2.94Å; H95-A99 VanDerWaalsContact O-CB 3.22Å; H95-A99 WeakPolarHBondContact O-CB 3.48Å; H95-A99 PolarHBondContact O-N 2.93Å; H95-Q118 PolarHBondContact CE1-O 2.86Å; H95-Q118 PolarHBondContact NE2-O 2.77Å; H95-D120 PolarHBondContact NE2-N 3.04Å; H95-M124 PolarHBondContact NE2-O 3.42Å; H95-L129 HydrophobicContact CB-CD1 3.93Å
96	Y	95.6	Very high	94.7	Very high	24 Å²	24	26.5 Å²	26.5	9%	0.094	13%	0.132	C	C	.	.	H	α-helix	trans	-68.1	-42.2	178.9	-72.3	-73.4	0	0	0	112.9	W27 M63 K67 N87 R91 T92 A93 L94 G100	W27-Y96 HydrophobicContact CZ3-CD1 4.06Å; W27-Y96 HydrophobicContact CZ3-CE1 4.29Å; M63-Y96 HydrophobicContact CB-CD2 4.28Å; M63-Y96 HydrophobicContact SD-CD2 4.41Å; M63-Y96 HydrophobicContact SD-CE2 4.04Å; K67-Y96 HydrophobicContact CB-CD1 4.47Å; K67-Y96 HydrophobicContact CD-CD1 4.2Å; K67-Y96 HydrophobicContact CG-CD1 4.34Å; N87-Y96 PolarHBondContact ND2-OH 3.35Å; R91-Y96 HydrophobicContact CB-CE2 4.01Å; T92-Y96 WeakPolarHBondContact O-CD2 3.21Å; T92-Y96 PolarHBondContact O-N 2.91Å; A93-Y96 PolarHBondContact O-N 3.12Å; L94-Y96 VanDerWaalsContact C-N 3.3Å; L94-Y96 PolarHBondContact O-N 2.91Å; Y96-G100 PolarHBondContact O-N 2.94Å
97	A	97.3	Very high	94.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-46.2	176	0	0	0	0	0	111.5	A66 A93 L94 G100 K101 N102 A105 L109	A66-A97 HydrophobicContact CB-CB 4.25Å; A93-A97 PolarHBondContact O-N 2.94Å; L94-A97 PolarHBondContact O-N 3.49Å; A97-G100 PolarHBondContact O-N 3.27Å; A97-K101 PolarHBondContact O-N 2.92Å; A97-N102 HydrophobicContact CB-CB 4.45Å; A97-N102 WeakPolarHBondContact O-CB 3.23Å; A97-N102 PolarHBondContact O-N 3.04Å; A97-A105 HydrophobicContact CB-CB 3.99Å; A97-L109 HydrophobicContact CB-CD1 3.88Å
98	V	97.3	Very high	95.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.7	-47.1	-179.4	173.1	0	0	0	0	111.4	L94 G100 K101 T106 P126 L129 A130 I138 L142	L94-V98 HydrophobicContact CD1-CG2 3.89Å; L94-V98 HydrophobicContact CG-CG2 4.2Å; L94-V98 WeakPolarHBondContact O-CB 3.48Å; L94-V98 VanDerWaalsContact O-CG2 3.25Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.01Å; V98-G100 VanDerWaalsContact C-N 3.25Å; V98-G100 PolarHBondContact O-N 2.69Å; V98-K101 PolarHBondContact O-N 2.9Å; V98-T106 HydrophobicContact CG2-CG2 4.04Å; V98-P126 WeakPolarHBondContact CG1-O 3.32Å; V98-P126 HydrophobicContact CG2-CB 4.2Å; V98-L129 HydrophobicContact CG1-CB 3.89Å; V98-A130 HydrophobicContact CG1-CB 3.76Å; V98-I138 HydrophobicContact CB-CG2 4.2Å; V98-I138 HydrophobicContact CG1-CG2 3.77Å; V98-I138 HydrophobicContact CG2-CG2 3.75Å; V98-L142 HydrophobicContact CG1-CD1 4.38Å; V98-L142 HydrophobicContact CG2-CD1 4.17Å; V98-L142 HydrophobicContact CG2-CD2 4.46Å
99	A	94.7	Very high	95.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.7	-38.5	177.5	0	0	0	0	0	112	L24 W27 H95 K101 F133	L24-A99 HydrophobicContact CD1-CB 3.99Å; L24-A99 WeakPolarHBondContact CD1-O 3.49Å; W27-A99 HydrophobicContact CE3-CB 3.78Å; W27-A99 HydrophobicContact CH2-CB 3.74Å; W27-A99 HydrophobicContact CZ3-CB 3.26Å; H95-A99 VanDerWaalsContact O-CB 3.22Å; H95-A99 WeakPolarHBondContact O-CB 3.48Å; H95-A99 PolarHBondContact O-N 2.93Å; A99-K101 PolarHBondContact O-N 3.19Å; A99-F133 HydrophobicContact CB-CD2 3.99Å; A99-F133 HydrophobicContact CB-CE2 3.56Å; A99-F133 HydrophobicContact CB-CZ 4.37Å
100	G	94.1	Very high	96	Very high	17 Å²	17	25 Å²	25	18%	0.175	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-0	175.6	0	0	0	0	0	115.7	Y96 A97 V98 N102	Y96-G100 PolarHBondContact O-N 2.94Å; A97-G100 PolarHBondContact O-N 3.27Å; V98-G100 VanDerWaalsContact C-N 3.25Å; V98-G100 PolarHBondContact O-N 2.69Å; G100-N102 PolarHBondContact O-N 3.39Å; G100-N102 PolarHBondContact O-OD1 3.16Å
101	K	96	Very high	96.1	Very high	100 Å²	100	28.2 Å²	28.2	44%	0.435	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	29	-171.7	-51.5	-173.9	178.8	-161.5	0	112.8	A97 V98 A99 K103 F133 I138	A97-K101 PolarHBondContact O-N 2.92Å; V98-K101 PolarHBondContact O-N 2.9Å; A99-K101 PolarHBondContact O-N 3.19Å; K101-K103 PolarHBondContact O-N 3.39Å; K101-K103 VanDerWaalsContact O-N 3.08Å; K101-F133 WeakPolarHBondContact CE-O 3.39Å; K101-F133 PolarHBondContact NZ-O 3.43Å; K101-I138 VanDerWaalsContact C-CD1 3.49Å
102	N	97	Very high	95.9	Very high	21 Å²	21	33.1 Å²	33.1	11%	0.112	15%	0.153	C	C	.	.			trans	-83.9	85.2	-175.9	-65.2	-26.9	0	0	0	109.9	A66 K67 N69 A97 G100 E104 A105 T106	A66-N102 PolarHBondContact O-ND2 3.12Å; K67-N102 VanDerWaalsContact C-ND2 3.28Å; K67-N102 PolarHBondContact O-ND2 2.98Å; N69-N102 HydrophobicContact CB-CB 3.81Å; N69-N102 PolarHBondContact N-ND2 2.87Å; N69-N102 WeakPolarHBondContact OD1-CB 3.41Å; A97-N102 HydrophobicContact CB-CB 4.45Å; A97-N102 WeakPolarHBondContact O-CB 3.23Å; A97-N102 PolarHBondContact O-N 3.04Å; G100-N102 PolarHBondContact O-N 3.39Å; G100-N102 PolarHBondContact O-OD1 3.16Å; N102-E104 PolarHBondContact O-N 3.29Å; N102-A105 HydrophobicContact CB-CB 4.02Å; N102-T106 WeakPolarHBondContact O-CB 3.41Å; N102-T106 PolarHBondContact O-N 3.34Å; N102-T106 PolarHBondContact O-OG1 3.24Å
103	K	96.8	Very high	95.6	Very high	68 Å²	68	43.9 Å²	43.9	30%	0.296	19%	0.194	S	C	.	.	H	α-helix	trans	-58.1	-46.3	-174.9	-176.6	-176	-173.6	167.9	0	112.5	K101 T106 Q107 E137 L141	K101-K103 PolarHBondContact O-N 3.39Å; K101-K103 VanDerWaalsContact O-N 3.08Å; K103-T106 WeakPolarHBondContact O-CB 3.35Å; K103-T106 PolarHBondContact O-N 2.66Å; K103-Q107 WeakPolarHBondContact O-CB 3.37Å; K103-Q107 PolarHBondContact O-N 3.07Å; K103-E137 VanDerWaalsContact CD-OE2 3.3Å; K103-E137 WeakPolarHBondContact CD-OE2 3.36Å; K103-E137 VanDerWaalsContact CE-OE2 3.29Å; K103-E137 WeakPolarHBondContact CE-OE2 3.34Å; K103-E137 VanDerWaalsContact NZ-CD 3.29Å; K103-E137 IonicContact NZ-OE1 2.64Å; K103-E137 PolarHBondContact NZ-OE1 2.89Å; K103-E137 IonicContact NZ-OE2 3.96Å; K103-E137 PolarHBondContact NZ-OE2 2.9Å; K103-L141 HydrophobicContact CG-CD1 4.06Å
104	E	97.4	Very high	95.4	Very high	98 Å²	98	44.2 Å²	44.2	46%	0.458	20%	0.195	S	C	.	.	H	α-helix	trans	-69.7	-42.7	-174.8	-61.1	69.3	-152.4	0	0	111.4	N69 V71 N102 Q107 F108	N69-E104 PolarHBondContact ND2-OE2 3.47Å; V71-E104 HydrophobicContact CG2-CB 3.67Å; N102-E104 PolarHBondContact O-N 3.29Å; E104-Q107 PolarHBondContact O-N 2.84Å; E104-F108 WeakPolarHBondContact O-CB 3.02Å; E104-F108 PolarHBondContact O-N 2.96Å
105	A	97	Very high	95.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.8	171.9	0	0	0	0	0	111.6	N69 V71 L74 A97 N102 F108 L109	N69-A105 WeakPolarHBondContact OD1-CB 3.41Å; N69-A105 PolarHBondContact OD1-N 2.9Å; V71-A105 HydrophobicContact CG2-CB 4.47Å; L74-A105 HydrophobicContact CD1-CB 3.69Å; A97-A105 HydrophobicContact CB-CB 3.99Å; N102-A105 HydrophobicContact CB-CB 4.02Å; A105-F108 PolarHBondContact O-N 3.13Å; A105-L109 WeakPolarHBondContact O-CB 3.43Å; A105-L109 VanDerWaalsContact O-CG 3.23Å; A105-L109 WeakPolarHBondContact O-CG 3.42Å; A105-L109 PolarHBondContact O-N 3.19Å
106	T	98	Very high	95.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-51	176.1	-58.9	0	0	0	0	110.6	L94 V98 N102 K103 F108 L109 L110 I138	L94-T106 HydrophobicContact CD1-CG2 4.01Å; V98-T106 HydrophobicContact CG2-CG2 4.04Å; N102-T106 WeakPolarHBondContact O-CB 3.41Å; N102-T106 PolarHBondContact O-N 3.34Å; N102-T106 PolarHBondContact O-OG1 3.24Å; K103-T106 WeakPolarHBondContact O-CB 3.35Å; K103-T106 PolarHBondContact O-N 2.66Å; T106-F108 VanDerWaalsContact C-N 3.33Å; T106-F108 PolarHBondContact O-N 3.47Å; T106-L109 PolarHBondContact O-N 2.84Å; T106-L109 VanDerWaalsContact O-N 3.15Å; T106-L110 HydrophobicContact CG2-CD1 3.99Å; T106-L110 HydrophobicContact CG2-CG 4.35Å; T106-L110 VanDerWaalsContact O-CG 3.29Å; T106-L110 WeakPolarHBondContact O-CG 3.39Å; T106-L110 PolarHBondContact O-N 2.93Å; T106-I138 HydrophobicContact CG2-CG2 4.03Å
107	Q	97.4	Very high	95.3	Very high	85 Å²	85	53.1 Å²	53.1	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-41.7	179.8	-167.2	177.4	11.5	0	0	111.9	K103 E104 L110 Q111 L141	K103-Q107 WeakPolarHBondContact O-CB 3.37Å; K103-Q107 PolarHBondContact O-N 3.07Å; E104-Q107 PolarHBondContact O-N 2.84Å; Q107-L110 PolarHBondContact O-N 2.89Å; Q107-Q111 VanDerWaalsContact O-CG 3.29Å; Q107-Q111 WeakPolarHBondContact O-CG 3.43Å; Q107-Q111 PolarHBondContact O-N 2.79Å; Q107-L141 HydrophobicContact CB-CD1 4.42Å
108	F	95.8	Very high	95.3	Very high	12 Å²	12	54.3 Å²	54.3	5%	0.053	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-44.8	174.7	172.8	-99.2	0	0	0	112.2	F62 V71 L74 K75 E104 A105 T106 Q111 R112	F62-F108 HydrophobicContact CE2-CE1 4.49Å; V71-F108 HydrophobicContact CG1-CB 4.27Å; V71-F108 HydrophobicContact CG1-CG 4.39Å; L74-F108 HydrophobicContact CB-CD1 3.79Å; L74-F108 HydrophobicContact CB-CE1 3.66Å; L74-F108 HydrophobicContact CB-CZ 4.49Å; L74-F108 HydrophobicContact CD1-CD1 4.12Å; K75-F108 HydrophobicContact CB-CE2 4.34Å; K75-F108 HydrophobicContact CB-CZ 4.42Å; K75-F108 HydrophobicContact CD-CE2 4.43Å; K75-F108 HydrophobicContact CG-CD2 3.84Å; K75-F108 HydrophobicContact CG-CE2 3.35Å; K75-F108 HydrophobicContact CG-CZ 3.84Å; E104-F108 WeakPolarHBondContact O-CB 3.02Å; E104-F108 PolarHBondContact O-N 2.96Å; A105-F108 PolarHBondContact O-N 3.13Å; T106-F108 VanDerWaalsContact C-N 3.33Å; T106-F108 PolarHBondContact O-N 3.47Å; F108-Q111 PolarHBondContact O-N 2.98Å; F108-R112 HydrophobicContact CE1-CG 4.25Å; F108-R112 HydrophobicContact CE2-CG 4.39Å; F108-R112 HydrophobicContact CZ-CG 4.07Å; F108-R112 WeakPolarHBondContact O-CG 3.27Å; F108-R112 PolarHBondContact O-N 3.5Å
109	L	95.9	Very high	95.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-41.9	178.3	-69.9	169.2	0	0	0	111.2	F62 A66 A93 L94 A97 A105 T106 R112 V114	F62-L109 HydrophobicContact CE1-CD2 3.67Å; F62-L109 HydrophobicContact CZ-CD2 3.54Å; A66-L109 HydrophobicContact CB-CD1 4.24Å; A93-L109 HydrophobicContact CB-CD1 4.14Å; A93-L109 HydrophobicContact CB-CD2 4.18Å; L94-L109 HydrophobicContact CB-CD1 4.32Å; L94-L109 HydrophobicContact CD1-CB 4.28Å; L94-L109 HydrophobicContact CD1-CD1 4.32Å; A97-L109 HydrophobicContact CB-CD1 3.88Å; A105-L109 WeakPolarHBondContact O-CB 3.43Å; A105-L109 VanDerWaalsContact O-CG 3.23Å; A105-L109 WeakPolarHBondContact O-CG 3.42Å; A105-L109 PolarHBondContact O-N 3.19Å; T106-L109 PolarHBondContact O-N 2.84Å; T106-L109 VanDerWaalsContact O-N 3.15Å; L109-R112 WeakPolarHBondContact O-CA 3.45Å; L109-R112 WeakPolarHBondContact O-CB 3.34Å; L109-R112 PolarHBondContact O-N 2.9Å; L109-R112 VanDerWaalsContact O-N 3.08Å; L109-V114 HydrophobicContact CB-CG1 4.22Å; L109-V114 HydrophobicContact CB-CG2 4.21Å; L109-V114 HydrophobicContact CD2-CG1 4.31Å; L109-V114 WeakPolarHBondContact O-CG1 3.4Å; L109-V114 WeakPolarHBondContact O-CG2 3.33Å
110	L	95.8	Very high	95.1	Very high	25 Å²	25	58.5 Å²	58.5	13%	0.131	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-39	176.5	-63.9	177.4	0	0	0	112.5	L94 T106 Q107 R112 R113 V114 V116 L141 L142 A145	L94-L110 HydrophobicContact CD1-CD2 4.34Å; L94-L110 HydrophobicContact CD2-CD2 4.35Å; T106-L110 HydrophobicContact CG2-CD1 3.99Å; T106-L110 HydrophobicContact CG2-CG 4.35Å; T106-L110 VanDerWaalsContact O-CG 3.29Å; T106-L110 WeakPolarHBondContact O-CG 3.39Å; T106-L110 PolarHBondContact O-N 2.93Å; Q107-L110 PolarHBondContact O-N 2.89Å; L110-R112 PolarHBondContact O-N 3.37Å; L110-R113 PolarHBondContact O-N 3.27Å; L110-V114 HydrophobicContact CD2-CG2 4.2Å; L110-V116 HydrophobicContact CD2-CG1 3.42Å; L110-V116 VanDerWaalsContact CD2-CG1 3.42Å; L110-L141 HydrophobicContact CD1-CB 3.89Å; L110-L142 HydrophobicContact CD1-CD2 4.4Å; L110-L142 HydrophobicContact CD2-CD2 4.09Å; L110-A145 HydrophobicContact CB-CB 4.35Å; L110-A145 HydrophobicContact CD1-CB 4.01Å; L110-A145 HydrophobicContact CD2-CB 3.78Å; L110-A145 HydrophobicContact CG-CB 4.25Å
111	Q	93.8	Very high	95	Very high	135 Å²	135	60.3 Å²	60.3	63%	0.631	27%	0.265	S	S	*	.	H	α-helix	trans	-59.5	-27.8	172.1	-74.9	171.6	1	0	0	112.8	Q107 F108 R113	Q107-Q111 VanDerWaalsContact O-CG 3.29Å; Q107-Q111 WeakPolarHBondContact O-CG 3.43Å; Q107-Q111 PolarHBondContact O-N 2.79Å; F108-Q111 PolarHBondContact O-N 2.98Å; Q111-R113 PolarHBondContact O-N 3.25Å
112	R	90.3	Very high	94.7	Very high	104 Å²	104	57.8 Å²	57.8	39%	0.392	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	5.7	174.8	-68.9	-71.8	-170.1	160.2	5	113.8	F108 L109 L110 V114	F108-R112 HydrophobicContact CE1-CG 4.25Å; F108-R112 HydrophobicContact CE2-CG 4.39Å; F108-R112 HydrophobicContact CZ-CG 4.07Å; F108-R112 WeakPolarHBondContact O-CG 3.27Å; F108-R112 PolarHBondContact O-N 3.5Å; L109-R112 WeakPolarHBondContact O-CA 3.45Å; L109-R112 WeakPolarHBondContact O-CB 3.34Å; L109-R112 PolarHBondContact O-N 2.9Å; L109-R112 VanDerWaalsContact O-N 3.08Å; L110-R112 PolarHBondContact O-N 3.37Å; R112-V114 VanDerWaalsContact C-N 3.28Å; R112-V114 PolarHBondContact O-N 2.88Å
113	R	87.6	Confident	94.5	Very high	229 Å²	229	57 Å²	57	86%	0.864	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	43.4	-179.1	-57.7	-175	177.8	-171.6	-1.5	112.5	L110 Q111	L110-R113 PolarHBondContact O-N 3.27Å; Q111-R113 PolarHBondContact O-N 3.25Å
114	V	92.7	Very high	94.5	Very high	8 Å²	8	54.2 Å²	54.2	5%	0.048	24%	0.238	C	C	.	.			trans	-57.4	151.4	168.8	-66.2	0	0	0	0	110.1	V83 N84 L94 L109 L110 R112 V116	V83-V114 HydrophobicContact CB-CG1 3.96Å; V83-V114 HydrophobicContact CG2-CG1 3.67Å; N84-V114 WeakPolarHBondContact OD1-CA 3.41Å; N84-V114 WeakPolarHBondContact OD1-CB 3.35Å; L94-V114 HydrophobicContact CD2-CG2 3.82Å; L109-V114 HydrophobicContact CB-CG1 4.22Å; L109-V114 HydrophobicContact CB-CG2 4.21Å; L109-V114 HydrophobicContact CD2-CG1 4.31Å; L109-V114 WeakPolarHBondContact O-CG1 3.4Å; L109-V114 WeakPolarHBondContact O-CG2 3.33Å; L110-V114 HydrophobicContact CD2-CG2 4.2Å; R112-V114 VanDerWaalsContact C-N 3.28Å; R112-V114 PolarHBondContact O-N 2.88Å; V114-V116 HydrophobicContact CG2-CG1 4.49Å; V114-V116 PolarHBondContact O-N 3.42Å; V114-V116 VanDerWaalsContact O-N 3.09Å
115	K	94.9	Very high	94.5	Very high	141 Å²	141	49.5 Å²	49.5	61%	0.613	22%	0.216	S	C	*	.			trans	-70.9	107.7	173.4	-61.1	176.9	178.7	-176.6	0	108.2	N84 Q118	N84-K115 PolarHBondContact OD1-N 3.31Å; K115-Q118 HydrophobicContact CB-CG 3.68Å; K115-Q118 HydrophobicContact CD-CG 4.42Å
116	V	95.8	Very high	94.5	Very high	18 Å²	18	49.5 Å²	49.5	11%	0.109	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-26.6	-170.1	-66.1	0	0	0	0	114	L94 L110 V114 P126 A145 A147	L94-V116 HydrophobicContact CD2-CB 4.5Å; L94-V116 HydrophobicContact CD2-CG1 4.38Å; L110-V116 HydrophobicContact CD2-CG1 3.42Å; L110-V116 VanDerWaalsContact CD2-CG1 3.42Å; V114-V116 HydrophobicContact CG2-CG1 4.49Å; V114-V116 PolarHBondContact O-N 3.42Å; V114-V116 VanDerWaalsContact O-N 3.09Å; V116-P126 VanDerWaalsContact O-CD 3.25Å; V116-P126 WeakPolarHBondContact O-CD 3.32Å; V116-P126 VanDerWaalsContact O-CG 3.26Å; V116-P126 WeakPolarHBondContact O-CG 3.48Å; V116-A145 HydrophobicContact CG1-CB 4.23Å; V116-A147 HydrophobicContact CB-CB 4.24Å; V116-A147 HydrophobicContact CG2-CB 4.01Å
117	D	96.5	Very high	94.5	Very high	55 Å²	55	49.6 Å²	49.6	29%	0.294	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	15.6	-175.5	-54.5	-50.3	0	0	0	113.8	K119 A147 E148	D117-K119 PolarHBondContact O-N 3.1Å; D117-K119 VanDerWaalsContact O-N 3.14Å; D117-A147 VanDerWaalsContact OD1-CA 3.29Å; D117-A147 WeakPolarHBondContact OD1-CA 3.34Å; D117-E148 PolarHBondContact OD1-N 2.91Å
118	Q	95.6	Very high	94.5	Very high	24 Å²	24	45.5 Å²	45.5	11%	0.112	20%	0.198	C	C	.	.			trans	-61.3	124	175.9	-71.2	-170.6	76.6	0	0	109.5	N84 T92 H95 K115 P126	N84-Q118 PolarHBondContact OD1-NE2 3.17Å; T92-Q118 HydrophobicContact CG2-CB 4.33Å; H95-Q118 PolarHBondContact CE1-O 2.86Å; H95-Q118 PolarHBondContact NE2-O 2.77Å; K115-Q118 HydrophobicContact CB-CG 3.68Å; K115-Q118 HydrophobicContact CD-CG 4.42Å; Q118-P126 WeakPolarHBondContact O-CD 3.17Å
119	K	95.8	Very high	94.6	Very high	85 Å²	85	45 Å²	45	37%	0.37	20%	0.195	S	C	.	.			trans	-87.7	142.3	175.2	-63	-177.3	180	-169.9	0	110.8	D117 G123 A125 E152	D117-K119 PolarHBondContact O-N 3.1Å; D117-K119 VanDerWaalsContact O-N 3.14Å; K119-G123 WeakPolarHBondContact CD-O 2.95Å; K119-G123 WeakPolarHBondContact CG-O 3.35Å; K119-A125 HydrophobicContact CG-CB 4.27Å; K119-E152 PolarHBondContact NZ-O 3.36Å
120	D	93.3	Very high	94.7	Very high	4 Å²	4	45 Å²	45	2%	0.021	20%	0.195	C	C	.	.			trans	-75.6	-176.4	166.3	85.8	-8.5	0	0	0	111.6	H89 R91 H95 Y122 G123 M124	H89-D120 WeakPolarHBondContact O-CB 3.3Å; R91-D120 HydrophobicContact CG-CB 3.63Å; R91-D120 IonicContact NE-OD2 2.94Å; R91-D120 PolarHBondContact NE-OD2 3.18Å; R91-D120 IonicContact NH2-OD2 3.87Å; H95-D120 PolarHBondContact NE2-N 3.04Å; D120-Y122 PolarHBondContact O-N 3.11Å; D120-Y122 WeakPolarHBondContact OD1-CB 3.34Å; D120-Y122 PolarHBondContact OD1-N 3.35Å; D120-G123 PolarHBondContact O-N 3.11Å; D120-M124 PolarHBondContact N-O 2.95Å; D120-M124 WeakPolarHBondContact OD1-CB 3.37Å; D120-M124 PolarHBondContact OD1-N 3.47Å
121	K	91.9	Very high	94.8	Very high	54 Å²	54	43.8 Å²	43.8	24%	0.235	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-4.1	-178.9	66	161.3	166.1	167	0	115.8	H89	H89-K121 HydrophobicContact CB-CD 4.14Å; H89-K121 HydrophobicContact CB-CG 4.09Å; H89-K121 PolarHBondContact CE1-NZ 3.25Å; H89-K121 VanDerWaalsContact CE1-NZ 3.27Å; H89-K121 VanDerWaalsContact CG-CE 3.45Å; H89-K121 VanDerWaalsContact ND1-CE 3.27Å; H89-K121 WeakPolarHBondContact ND1-CE 3.37Å; H89-K121 PolarHBondContact ND1-NZ 3.43Å; H89-K121 PolarHBondContact O-N 2.95Å
122	Y	88.7	Confident	94.8	Very high	48 Å²	48	38.2 Å²	38.2	19%	0.188	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	10.8	176.8	-59.3	-58.5	0	0	0	111.8	F33 D120 M124 N153 E154	F33-Y122 PolarHBondContact O-OH 3.3Å; D120-Y122 PolarHBondContact O-N 3.11Å; D120-Y122 WeakPolarHBondContact OD1-CB 3.34Å; D120-Y122 PolarHBondContact OD1-N 3.35Å; Y122-M124 PolarHBondContact O-N 2.77Å; Y122-N153 WeakPolarHBondContact O-CB 3.22Å; Y122-E154 VanDerWaalsContact C-CD 3.49Å; Y122-E154 PolarHBondContact O-N 3.32Å; Y122-E154 VanDerWaalsContact O-N 3.1Å
123	G	94.3	Very high	95.1	Very high	4 Å²	4	34.1 Å²	34.1	4%	0.041	15%	0.147	C	C	.	.	S	Bend	trans	75.7	5.8	-172.7	0	0	0	0	0	114.1	K119 D120 A125 N153	K119-G123 WeakPolarHBondContact CD-O 2.95Å; K119-G123 WeakPolarHBondContact CG-O 3.35Å; D120-G123 PolarHBondContact O-N 3.11Å; G123-A125 PolarHBondContact O-N 3.41Å; G123-N153 WeakPolarHBondContact O-CA 3.37Å
124	M	95.3	Very high	95.5	Very high	9 Å²	9	23.8 Å²	23.8	4%	0.044	11%	0.112	C	C	.	.			trans	-76.9	108.4	-177.5	-64.9	-70.7	-73.9	0	0	110.4	H95 D120 Y122 H128 L129 N153	H95-M124 PolarHBondContact NE2-O 3.42Å; D120-M124 PolarHBondContact N-O 2.95Å; D120-M124 WeakPolarHBondContact OD1-CB 3.37Å; D120-M124 PolarHBondContact OD1-N 3.47Å; Y122-M124 PolarHBondContact O-N 2.77Å; M124-H128 HydrophobicContact CE-CB 3.47Å; M124-H128 VanDerWaalsContact CE-CB 3.47Å; M124-H128 HydrophobicContact SD-CB 3.9Å; M124-L129 HydrophobicContact CB-CD2 4.36Å; M124-L129 HydrophobicContact CE-CD2 3.85Å; M124-N153 HydrophobicContact CG-CB 4.45Å; M124-N153 HydrophobicContact SD-CB 3.81Å
125	A	97.4	Very high	95.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.			trans	-75.6	156.5	164.8	0	0	0	0	0	111.8	K119 G123 I127 H128 L129 V151	K119-A125 HydrophobicContact CG-CB 4.27Å; G123-A125 PolarHBondContact O-N 3.41Å; A125-I127 HydrophobicContact CB-CG2 4.37Å; A125-I127 PolarHBondContact O-N 3.37Å; A125-I127 VanDerWaalsContact O-N 3.09Å; A125-H128 PolarHBondContact N-ND1 3.18Å; A125-H128 WeakPolarHBondContact O-CB 3.5Å; A125-H128 PolarHBondContact O-N 3.45Å; A125-H128 PolarHBondContact O-ND1 2.95Å; A125-L129 PolarHBondContact O-N 2.9Å; A125-V151 HydrophobicContact CB-CG2 4.38Å
126	P	97.8	Very high	95.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-48.7	-36.1	175.6	-32.9	36.4	0	0	0	114.8	L94 V98 V116 Q118 H128 L129 A130 L142	L94-P126 HydrophobicContact CD2-CB 4.03Å; L94-P126 HydrophobicContact CD2-CG 3.74Å; L94-P126 HydrophobicContact CG-CB 4.08Å; L94-P126 HydrophobicContact CG-CG 3.94Å; V98-P126 WeakPolarHBondContact CG1-O 3.32Å; V98-P126 HydrophobicContact CG2-CB 4.2Å; V116-P126 VanDerWaalsContact O-CD 3.25Å; V116-P126 WeakPolarHBondContact O-CD 3.32Å; V116-P126 VanDerWaalsContact O-CG 3.26Å; V116-P126 WeakPolarHBondContact O-CG 3.48Å; Q118-P126 WeakPolarHBondContact O-CD 3.17Å; P126-H128 VanDerWaalsContact C-N 3.33Å; P126-H128 PolarHBondContact O-N 2.99Å; P126-L129 WeakPolarHBondContact O-CB 3.46Å; P126-L129 PolarHBondContact O-N 3.13Å; P126-L129 VanDerWaalsContact O-N 3.13Å; P126-A130 PolarHBondContact O-N 2.82Å; P126-L142 HydrophobicContact CB-CD1 4.14Å; P126-L142 HydrophobicContact CB-CD2 4.17Å
127	I	98.1	Very high	96	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-64.8	-35.1	178.5	-156.9	178.6	0	0	0	112.7	A125 A130 A131 L139 L142 V143 A147 Q149 V151 I159	A125-I127 HydrophobicContact CB-CG2 4.37Å; A125-I127 PolarHBondContact O-N 3.37Å; A125-I127 VanDerWaalsContact O-N 3.09Å; I127-A130 PolarHBondContact O-N 3.17Å; I127-A131 PolarHBondContact O-N 2.47Å; I127-A131 VanDerWaalsContact O-N 3.11Å; I127-L139 HydrophobicContact CD1-CD1 4.23Å; I127-L139 HydrophobicContact CG1-CD1 3.43Å; I127-L139 VanDerWaalsContact CG1-CD1 3.43Å; I127-L142 HydrophobicContact CB-CD1 4.34Å; I127-V143 HydrophobicContact CD1-CG2 4.08Å; I127-A147 HydrophobicContact CD1-CB 4.3Å; I127-Q149 HydrophobicContact CD1-CB 4.39Å; I127-Q149 HydrophobicContact CD1-CG 4.01Å; I127-V151 HydrophobicContact CG2-CG2 3.78Å; I127-I159 HydrophobicContact CB-CG2 4.32Å; I127-I159 HydrophobicContact CD1-CD1 4.5Å; I127-I159 HydrophobicContact CD1-CG2 4.32Å; I127-I159 HydrophobicContact CG1-CG2 3.95Å; I127-I159 HydrophobicContact CG2-CG2 3.85Å
128	H	97.6	Very high	96.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.9	-41.2	171.7	-58.1	100.7	0	0	0	111.2	M124 A125 P126 A130 A131 W132 V151 L157	M124-H128 HydrophobicContact CE-CB 3.47Å; M124-H128 VanDerWaalsContact CE-CB 3.47Å; M124-H128 HydrophobicContact SD-CB 3.9Å; A125-H128 PolarHBondContact N-ND1 3.18Å; A125-H128 WeakPolarHBondContact O-CB 3.5Å; A125-H128 PolarHBondContact O-N 3.45Å; A125-H128 PolarHBondContact O-ND1 2.95Å; P126-H128 VanDerWaalsContact C-N 3.33Å; P126-H128 PolarHBondContact O-N 2.99Å; H128-A130 VanDerWaalsContact C-N 3.34Å; H128-A131 PolarHBondContact O-N 3.38Å; H128-W132 WeakPolarHBondContact O-CB 3.42Å; H128-W132 PolarHBondContact O-N 2.91Å; H128-V151 WeakPolarHBondContact CE1-CG2 3.47Å; H128-V151 PolarHBondContact NE2-O 3.22Å; H128-L157 PolarHBondContact NE2-O 2.95Å
129	L	97.1	Very high	96.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-39.1	178.3	-61	176	0	0	0	111.3	W27 H95 V98 M124 A125 P126 A131 W132 F133	W27-L129 HydrophobicContact CH2-CD1 3.87Å; W27-L129 HydrophobicContact CZ2-CD1 3.71Å; W27-L129 HydrophobicContact CZ2-CD2 3.95Å; H95-L129 HydrophobicContact CB-CD1 3.93Å; V98-L129 HydrophobicContact CG1-CB 3.89Å; M124-L129 HydrophobicContact CB-CD2 4.36Å; M124-L129 HydrophobicContact CE-CD2 3.85Å; A125-L129 PolarHBondContact O-N 2.9Å; P126-L129 WeakPolarHBondContact O-CB 3.46Å; P126-L129 PolarHBondContact O-N 3.13Å; P126-L129 VanDerWaalsContact O-N 3.13Å; L129-A131 VanDerWaalsContact C-N 3.32Å; L129-A131 PolarHBondContact O-N 3.33Å; L129-W132 PolarHBondContact O-N 3.35Å; L129-F133 HydrophobicContact CB-CD2 4.29Å; L129-F133 HydrophobicContact CB-CE2 4.37Å; L129-F133 HydrophobicContact CD2-CE2 4.07Å; L129-F133 WeakPolarHBondContact O-CD2 3.27Å; L129-F133 PolarHBondContact O-N 3.35Å
130	A	98	Very high	96.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.4	-42.3	175.1	0	0	0	0	0	111.8	V98 P126 I127 H128 G134 S135 I138 L139 L142	V98-A130 HydrophobicContact CG1-CB 3.76Å; P126-A130 PolarHBondContact O-N 2.82Å; I127-A130 PolarHBondContact O-N 3.17Å; H128-A130 VanDerWaalsContact C-N 3.34Å; A130-G134 PolarHBondContact O-N 2.74Å; A130-S135 PolarHBondContact O-N 3.3Å; A130-I138 HydrophobicContact CB-CG2 3.98Å; A130-L139 HydrophobicContact CB-CB 4.05Å; A130-L139 HydrophobicContact CB-CD1 3.92Å; A130-L142 HydrophobicContact CB-CD1 3.89Å
131	A	97.9	Very high	96.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.9	-46	174.5	0	0	0	0	0	112.6	I127 H128 L129 F133 G134 L139 I159 C162 H168 I171	I127-A131 PolarHBondContact O-N 2.47Å; I127-A131 VanDerWaalsContact O-N 3.11Å; H128-A131 PolarHBondContact O-N 3.38Å; L129-A131 VanDerWaalsContact C-N 3.32Å; L129-A131 PolarHBondContact O-N 3.33Å; A131-F133 PolarHBondContact O-N 2.96Å; A131-G134 PolarHBondContact O-N 2.92Å; A131-L139 HydrophobicContact CB-CD1 4.46Å; A131-I159 HydrophobicContact CB-CB 3.92Å; A131-I159 HydrophobicContact CB-CG2 4.26Å; A131-I159 WeakPolarHBondContact CB-O 3.43Å; A131-C162 HydrophobicContact CB-CB 3.92Å; A131-H168 PolarHBondContact O-CD2 3.38Å; A131-H168 VanDerWaalsContact O-CD2 3.23Å; A131-I171 HydrophobicContact CB-CG2 4.26Å
132	W	95.3	Very high	96.9	Very high	19 Å²	19	17.8 Å²	17.8	7%	0.072	9%	0.087	C	C	.	.	H	α-helix	trans	-61.6	-44.2	-178.8	-175.1	-78.3	0	0	0	112.6	L22 H128 L129 C162 I165 N166 H168	L22-W132 HydrophobicContact CB-CD2 4.42Å; L22-W132 VanDerWaalsContact CB-CE2 3.43Å; L22-W132 HydrophobicContact CB-CH2 4.2Å; L22-W132 HydrophobicContact CB-CZ2 3.33Å; L22-W132 HydrophobicContact CD2-CD2 4.41Å; L22-W132 HydrophobicContact CD2-CG 4.49Å; L22-W132 PolarHBondContact O-NE1 2.94Å; H128-W132 WeakPolarHBondContact O-CB 3.42Å; H128-W132 PolarHBondContact O-N 2.91Å; L129-W132 PolarHBondContact O-N 3.35Å; W132-C162 HydrophobicContact CB-CB 4.11Å; W132-C162 HydrophobicContact CE3-CB 4.03Å; W132-I165 HydrophobicContact CH2-CD1 4.09Å; W132-I165 HydrophobicContact CH2-CG2 3.8Å; W132-I165 HydrophobicContact CZ2-CG2 4.21Å; W132-I165 HydrophobicContact CZ3-CD1 3.63Å; W132-I165 HydrophobicContact CZ3-CG2 4.17Å; W132-N166 VanDerWaalsContact CE2-ND2 3.28Å; W132-N166 WeakPolarHBondContact O-CB 3.4Å; W132-N166 PolarHBondContact O-ND2 3.11Å; W132-H168 PolarHBondContact O-CD2 3.39Å; W132-H168 PolarHBondContact O-NE2 2.92Å
133	F	94.8	Very high	97.3	Very high	17 Å²	17	16.9 Å²	16.9	8%	0.075	9%	0.087	C	C	.	.	H	α-helix	trans	-88.4	-7.6	-179.6	-65.4	-63.1	0	0	0	112.8	L22 L24 A99 K101 L129 A131 H168	L22-F133 HydrophobicContact CD2-CZ 4.21Å; L24-F133 HydrophobicContact CB-CD1 4.17Å; L24-F133 HydrophobicContact CB-CE1 3.62Å; L24-F133 HydrophobicContact CB-CZ 4.28Å; L24-F133 HydrophobicContact CD1-CD1 3.89Å; L24-F133 HydrophobicContact CD1-CD2 4.3Å; L24-F133 HydrophobicContact CD1-CE1 3.44Å; L24-F133 VanDerWaalsContact CD1-CE1 3.44Å; L24-F133 HydrophobicContact CD1-CE2 3.86Å; L24-F133 HydrophobicContact CD1-CG 4.32Å; L24-F133 HydrophobicContact CD1-CZ 3.41Å; L24-F133 VanDerWaalsContact CD1-CZ 3.41Å; L24-F133 HydrophobicContact CG-CD1 4.44Å; L24-F133 HydrophobicContact CG-CE1 4.07Å; L24-F133 HydrophobicContact CG-CZ 4.46Å; A99-F133 HydrophobicContact CB-CD2 3.99Å; A99-F133 HydrophobicContact CB-CE2 3.56Å; A99-F133 HydrophobicContact CB-CZ 4.37Å; K101-F133 WeakPolarHBondContact CE-O 3.39Å; K101-F133 PolarHBondContact NZ-O 3.43Å; L129-F133 HydrophobicContact CB-CD2 4.29Å; L129-F133 HydrophobicContact CB-CE2 4.37Å; L129-F133 HydrophobicContact CD2-CE2 4.07Å; L129-F133 WeakPolarHBondContact O-CD2 3.27Å; L129-F133 PolarHBondContact O-N 3.35Å; A131-F133 PolarHBondContact O-N 2.96Å; F133-H168 VanDerWaalsContact C-NE2 3.3Å; F133-H168 PolarHBondContact O-NE2 3.18Å
134	G	95.9	Very high	97.5	Very high	12 Å²	12	23.9 Å²	23.9	12%	0.124	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	50.9	176.1	0	0	0	0	0	112.9	A130 A131 H168	A130-G134 PolarHBondContact O-N 2.74Å; A131-G134 PolarHBondContact O-N 2.92Å; G134-H168 WeakPolarHBondContact CA-CD2 3.45Å; G134-H168 WeakPolarHBondContact CA-ND1 3.47Å; G134-H168 WeakPolarHBondContact CA-NE2 3.42Å; G134-H168 PolarHBondContact N-CD2 2.99Å; G134-H168 VanDerWaalsContact N-CD2 3.27Å; G134-H168 PolarHBondContact N-NE2 3.27Å
135	S	97.2	Very high	97.6	Very high	15 Å²	15	25.7 Å²	25.7	11%	0.105	13%	0.134	C	C	.	.			trans	-113.2	84.9	169.8	-171.5	0	0	0	0	109.8	A130 E137 I138 L139	A130-S135 PolarHBondContact O-N 3.3Å; S135-E137 PolarHBondContact O-N 3.45Å; S135-I138 PolarHBondContact O-N 2.89Å; S135-I138 WeakPolarHBondContact OG-CB 3.26Å; S135-I138 WeakPolarHBondContact OG-CD1 3.4Å; S135-I138 WeakPolarHBondContact OG-CG1 3.43Å; S135-L139 WeakPolarHBondContact O-CB 3.35Å; S135-L139 PolarHBondContact O-N 3.49Å
136	L	98.4	Very high	97.5	Very high	38 Å²	38	28.1 Å²	28.1	20%	0.199	16%	0.16	C	C	.	.	H	α-helix	trans	-56.9	-37.7	178.2	177.8	60.1	0	0	0	112.1	L139 K140 E170 I171 Y174	L136-L139 HydrophobicContact CD1-CD2 4.27Å; L136-L139 WeakPolarHBondContact O-CB 3.48Å; L136-L139 PolarHBondContact O-N 3.2Å; L136-K140 HydrophobicContact CD1-CD 4.46Å; L136-K140 HydrophobicContact CD1-CG 4.32Å; L136-K140 HydrophobicContact CG-CD 4.33Å; L136-K140 WeakPolarHBondContact O-CB 3.46Å; L136-K140 WeakPolarHBondContact O-CG 3.33Å; L136-K140 PolarHBondContact O-N 2.94Å; L136-E170 HydrophobicContact CB-CG 4.1Å; L136-E170 HydrophobicContact CD2-CB 4.1Å; L136-E170 HydrophobicContact CD2-CG 4.1Å; L136-I171 HydrophobicContact CB-CG1 4.14Å; L136-I171 HydrophobicContact CD1-CG1 4.2Å; L136-Y174 HydrophobicContact CD1-CD1 3.8Å; L136-Y174 HydrophobicContact CD1-CD2 4.37Å; L136-Y174 HydrophobicContact CD1-CG 3.63Å
137	E	98.3	Very high	97.5	Very high	111 Å²	111	28.2 Å²	28.2	52%	0.519	16%	0.16	S	C	.	.	H	α-helix	trans	-63.7	-44.5	177.8	-60.7	-166.1	144.9	0	0	112.4	K103 S135 K140 L141	K103-E137 VanDerWaalsContact CD-OE2 3.3Å; K103-E137 WeakPolarHBondContact CD-OE2 3.36Å; K103-E137 VanDerWaalsContact CE-OE2 3.29Å; K103-E137 WeakPolarHBondContact CE-OE2 3.34Å; K103-E137 VanDerWaalsContact NZ-CD 3.29Å; K103-E137 IonicContact NZ-OE1 2.64Å; K103-E137 PolarHBondContact NZ-OE1 2.89Å; K103-E137 IonicContact NZ-OE2 3.96Å; K103-E137 PolarHBondContact NZ-OE2 2.9Å; S135-E137 PolarHBondContact O-N 3.45Å; E137-K140 PolarHBondContact O-N 3.23Å; E137-L141 WeakPolarHBondContact O-CG 3.4Å; E137-L141 PolarHBondContact O-N 3.38Å
138	I	98.6	Very high	97.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.4	-38.9	176.9	-73	175.5	0	0	0	110.7	V98 K101 T106 A130 S135 K140 L141 L142	V98-I138 HydrophobicContact CB-CG2 4.2Å; V98-I138 HydrophobicContact CG1-CG2 3.77Å; V98-I138 HydrophobicContact CG2-CG2 3.75Å; K101-I138 VanDerWaalsContact C-CD1 3.49Å; T106-I138 HydrophobicContact CG2-CG2 4.03Å; A130-I138 HydrophobicContact CB-CG2 3.98Å; S135-I138 PolarHBondContact O-N 2.89Å; S135-I138 WeakPolarHBondContact OG-CB 3.26Å; S135-I138 WeakPolarHBondContact OG-CD1 3.4Å; S135-I138 WeakPolarHBondContact OG-CG1 3.43Å; I138-K140 VanDerWaalsContact C-N 3.33Å; I138-K140 PolarHBondContact O-N 2.85Å; I138-L141 WeakPolarHBondContact O-CB 3.5Å; I138-L141 PolarHBondContact O-N 2.92Å; I138-L142 HydrophobicContact CG2-CD1 4Å; I138-L142 HydrophobicContact CG2-CG 4.32Å; I138-L142 WeakPolarHBondContact O-CG 3.21Å; I138-L142 PolarHBondContact O-N 2.88Å
139	L	98.6	Very high	97.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.4	-48.4	173.6	-171	79.6	0	0	0	110.8	I127 A130 A131 S135 L136 L141 L142 V143 I171 Y174	I127-L139 HydrophobicContact CD1-CD1 4.23Å; I127-L139 HydrophobicContact CG1-CD1 3.43Å; I127-L139 VanDerWaalsContact CG1-CD1 3.43Å; A130-L139 HydrophobicContact CB-CB 4.05Å; A130-L139 HydrophobicContact CB-CD1 3.92Å; A131-L139 HydrophobicContact CB-CD1 4.46Å; S135-L139 WeakPolarHBondContact O-CB 3.35Å; S135-L139 PolarHBondContact O-N 3.49Å; L136-L139 HydrophobicContact CD1-CD2 4.27Å; L136-L139 WeakPolarHBondContact O-CB 3.48Å; L136-L139 PolarHBondContact O-N 3.2Å; L139-L141 VanDerWaalsContact C-N 3.34Å; L139-L141 PolarHBondContact O-N 3.48Å; L139-L142 PolarHBondContact O-N 3.05Å; L139-V143 WeakPolarHBondContact O-CG2 3.47Å; L139-V143 PolarHBondContact O-N 2.93Å; L139-I171 HydrophobicContact CD2-CB 4.39Å; L139-I171 HydrophobicContact CD2-CD1 4.39Å; L139-I171 HydrophobicContact CD2-CG1 4.24Å; L139-I171 HydrophobicContact CD2-CG2 3.6Å; L139-Y174 HydrophobicContact CD2-CD1 3.86Å; L139-Y174 HydrophobicContact CD2-CE1 4.28Å
140	K	98.6	Very high	97.5	Very high	73 Å²	73	41.4 Å²	41.4	32%	0.317	22%	0.22	S	C	.	.	H	α-helix	trans	-59.4	-42	175.3	-74.1	178.4	178.6	-172.9	0	112.1	L136 E137 I138 V143 Q144 Y174	L136-K140 HydrophobicContact CD1-CD 4.46Å; L136-K140 HydrophobicContact CD1-CG 4.32Å; L136-K140 HydrophobicContact CG-CD 4.33Å; L136-K140 WeakPolarHBondContact O-CB 3.46Å; L136-K140 WeakPolarHBondContact O-CG 3.33Å; L136-K140 PolarHBondContact O-N 2.94Å; E137-K140 PolarHBondContact O-N 3.23Å; I138-K140 VanDerWaalsContact C-N 3.33Å; I138-K140 PolarHBondContact O-N 2.85Å; K140-V143 PolarHBondContact O-N 3.29Å; K140-Q144 WeakPolarHBondContact O-CB 3.34Å; K140-Q144 VanDerWaalsContact O-CG 3.23Å; K140-Q144 WeakPolarHBondContact O-CG 3.5Å; K140-Q144 PolarHBondContact O-N 3.41Å; K140-Y174 HydrophobicContact CD-CE2 4.24Å; K140-Y174 VanDerWaalsContact CE-CE2 3.48Å; K140-Y174 HydrophobicContact CG-CD2 4.42Å; K140-Y174 HydrophobicContact CG-CE1 3.97Å; K140-Y174 HydrophobicContact CG-CE2 3.93Å
141	L	98.4	Very high	97.4	Very high	27 Å²	27	41.7 Å²	41.7	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-41.9	175.4	-73.1	174.6	0	0	0	112.3	K103 Q107 L110 E137 I138 L139 Q144 A145	K103-L141 HydrophobicContact CG-CD1 4.06Å; Q107-L141 HydrophobicContact CB-CD1 4.42Å; L110-L141 HydrophobicContact CD1-CB 3.89Å; E137-L141 WeakPolarHBondContact O-CG 3.4Å; E137-L141 PolarHBondContact O-N 3.38Å; I138-L141 WeakPolarHBondContact O-CB 3.5Å; I138-L141 PolarHBondContact O-N 2.92Å; L139-L141 VanDerWaalsContact C-N 3.34Å; L139-L141 PolarHBondContact O-N 3.48Å; L141-Q144 PolarHBondContact O-N 2.95Å; L141-A145 WeakPolarHBondContact O-CB 3.46Å; L141-A145 PolarHBondContact O-N 3.03Å
142	L	98.4	Very high	97.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-44.5	177.3	-69.3	169.5	0	0	0	111.3	L94 V98 L110 P126 I127 A130 I138 L139 Q144 A145 G146 A147	L94-L142 HydrophobicContact CD1-CD2 4.41Å; L94-L142 HydrophobicContact CD2-CD2 4.21Å; V98-L142 HydrophobicContact CG1-CD1 4.38Å; V98-L142 HydrophobicContact CG2-CD1 4.17Å; V98-L142 HydrophobicContact CG2-CD2 4.46Å; L110-L142 HydrophobicContact CD1-CD2 4.4Å; L110-L142 HydrophobicContact CD2-CD2 4.09Å; P126-L142 HydrophobicContact CB-CD1 4.14Å; P126-L142 HydrophobicContact CB-CD2 4.17Å; I127-L142 HydrophobicContact CB-CD1 4.34Å; A130-L142 HydrophobicContact CB-CD1 3.89Å; I138-L142 HydrophobicContact CG2-CD1 4Å; I138-L142 HydrophobicContact CG2-CG 4.32Å; I138-L142 WeakPolarHBondContact O-CG 3.21Å; I138-L142 PolarHBondContact O-N 2.88Å; L139-L142 PolarHBondContact O-N 3.05Å; L142-Q144 PolarHBondContact O-N 3.43Å; L142-A145 CarbonylContact O-C 3.59Å; L142-A145 PolarHBondContact O-N 3.3Å; L142-A145 VanDerWaalsContact O-N 3.15Å; L142-G146 PolarHBondContact O-N 3.25Å; L142-A147 HydrophobicContact CB-CB 3.99Å; L142-A147 WeakPolarHBondContact O-CB 3.25Å; L142-A147 PolarHBondContact O-N 2.93Å
143	V	97.9	Very high	97.3	Very high	29 Å²	29	44.4 Å²	44.4	18%	0.176	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-45.6	175.5	170.7	0	0	0	0	111	I127 L139 K140 A145 G146 Q149 M179	I127-V143 HydrophobicContact CD1-CG2 4.08Å; L139-V143 WeakPolarHBondContact O-CG2 3.47Å; L139-V143 PolarHBondContact O-N 2.93Å; K140-V143 PolarHBondContact O-N 3.29Å; V143-A145 PolarHBondContact O-N 3.09Å; V143-G146 PolarHBondContact O-N 3.15Å; V143-Q149 HydrophobicContact CG2-CG 4.13Å; V143-M179 HydrophobicContact CG1-SD 4.31Å; V143-M179 HydrophobicContact CG2-SD 3.89Å
144	Q	97.1	Very high	97.1	Very high	151 Å²	151	49 Å²	49	71%	0.706	26%	0.257	S	S	*	.	H	α-helix	trans	-62.8	-30.6	175.8	-73.5	170.5	1.6	0	0	113.1	K140 L141 L142 G146	K140-Q144 WeakPolarHBondContact O-CB 3.34Å; K140-Q144 VanDerWaalsContact O-CG 3.23Å; K140-Q144 WeakPolarHBondContact O-CG 3.5Å; K140-Q144 PolarHBondContact O-N 3.41Å; L141-Q144 PolarHBondContact O-N 2.95Å; L142-Q144 PolarHBondContact O-N 3.43Å; Q144-G146 PolarHBondContact O-N 3.29Å
145	A	97.3	Very high	96.9	Very high	46 Å²	46	51.3 Å²	51.3	38%	0.38	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.8	174.9	0	0	0	0	0	113.6	L110 V116 L141 L142 V143	L110-A145 HydrophobicContact CB-CB 4.35Å; L110-A145 HydrophobicContact CD1-CB 4.01Å; L110-A145 HydrophobicContact CD2-CB 3.78Å; L110-A145 HydrophobicContact CG-CB 4.25Å; V116-A145 HydrophobicContact CG1-CB 4.23Å; L141-A145 WeakPolarHBondContact O-CB 3.46Å; L141-A145 PolarHBondContact O-N 3.03Å; L142-A145 CarbonylContact O-C 3.59Å; L142-A145 PolarHBondContact O-N 3.3Å; L142-A145 VanDerWaalsContact O-N 3.15Å; V143-A145 PolarHBondContact O-N 3.09Å
146	G	96.7	Very high	96.8	Very high	52 Å²	52	50.7 Å²	50.7	54%	0.536	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	22.4	176.1	0	0	0	0	0	114.8	L142 V143 Q144	L142-G146 PolarHBondContact O-N 3.25Å; V143-G146 PolarHBondContact O-N 3.15Å; Q144-G146 PolarHBondContact O-N 3.29Å
147	A	97.6	Very high	96.8	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.008	25%	0.253	C	S	.	.			trans	-61.5	135.2	173.5	0	0	0	0	0	111	V116 D117 I127 L142 Q149	V116-A147 HydrophobicContact CB-CB 4.24Å; V116-A147 HydrophobicContact CG2-CB 4.01Å; D117-A147 VanDerWaalsContact OD1-CA 3.29Å; D117-A147 WeakPolarHBondContact OD1-CA 3.34Å; I127-A147 HydrophobicContact CD1-CB 4.3Å; L142-A147 HydrophobicContact CB-CB 3.99Å; L142-A147 WeakPolarHBondContact O-CB 3.25Å; L142-A147 PolarHBondContact O-N 2.93Å; A147-Q149 PolarHBondContact O-N 3.38Å; A147-Q149 PolarHBondContact O-NE2 2.78Å
148	E	97.5	Very high	96.8	Very high	109 Å²	109	44 Å²	44	51%	0.509	23%	0.229	S	C	.	.			trans	-69.8	124.1	179.3	-174.8	179.9	-167.7	0	0	110	D117 V151	D117-E148 PolarHBondContact OD1-N 2.91Å; E148-V151 HydrophobicContact CB-CG1 3.72Å; E148-V151 HydrophobicContact CG-CG1 3.66Å; E148-V151 VanDerWaalsContact O-CG2 3.28Å; E148-V151 WeakPolarHBondContact O-CG2 3.32Å; E148-V151 VanDerWaalsContact OE2-CG1 3.31Å; E148-V151 WeakPolarHBondContact OE2-CG1 3.41Å
149	Q	97.5	Very high	96.8	Very high	51 Å²	51	44 Å²	44	24%	0.238	23%	0.229	C	C	.	.	S	Bend	trans	-90.7	-20.6	-173.2	-53.8	81.4	6.6	0	0	113.6	I127 V143 A147 V151 I159 M179 M181	I127-Q149 HydrophobicContact CD1-CB 4.39Å; I127-Q149 HydrophobicContact CD1-CG 4.01Å; V143-Q149 HydrophobicContact CG2-CG 4.13Å; A147-Q149 PolarHBondContact O-N 3.38Å; A147-Q149 PolarHBondContact O-NE2 2.78Å; Q149-V151 VanDerWaalsContact C-N 3.28Å; Q149-I159 HydrophobicContact CB-CD1 4.41Å; Q149-M179 HydrophobicContact CG-SD 4.25Å; Q149-M181 HydrophobicContact CB-CE 3.82Å; Q149-M181 HydrophobicContact CB-SD 3.68Å; Q149-M181 HydrophobicContact CG-SD 4.2Å
150	K	97.1	Very high	96.8	Very high	118 Å²	118	44 Å²	44	51%	0.513	23%	0.229	S	C	.	.	S	Bend	trans	-88.2	5.1	-178.3	-62	-170.4	176.3	-166.4	0	113.3	M181 E183 L184	K150-M181 HydrophobicContact CD-CE 4.2Å; K150-M181 VanDerWaalsContact CE-CE 3.47Å; K150-M181 HydrophobicContact CG-CE 3.52Å; K150-E183 WeakPolarHBondContact CE-OE1 3.43Å; K150-E183 IonicContact NZ-OE1 2.78Å; K150-E183 PolarHBondContact NZ-OE1 2.98Å; K150-L184 HydrophobicContact CG-CD2 4.44Å
151	V	96.3	Very high	96.7	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.042	21%	0.214	C	C	.	.			trans	-63.6	148	177.6	-66.9	0	0	0	0	111.3	A125 I127 H128 E148 Q149	A125-V151 HydrophobicContact CB-CG2 4.38Å; I127-V151 HydrophobicContact CG2-CG2 3.78Å; H128-V151 WeakPolarHBondContact CE1-CG2 3.47Å; H128-V151 PolarHBondContact NE2-O 3.22Å; E148-V151 HydrophobicContact CB-CG1 3.72Å; E148-V151 HydrophobicContact CG-CG1 3.66Å; E148-V151 VanDerWaalsContact O-CG2 3.28Å; E148-V151 WeakPolarHBondContact O-CG2 3.32Å; E148-V151 VanDerWaalsContact OE2-CG1 3.31Å; E148-V151 WeakPolarHBondContact OE2-CG1 3.41Å; Q149-V151 VanDerWaalsContact C-N 3.28Å
152	E	96.3	Very high	96.7	Very high	61 Å²	61	39.2 Å²	39.2	29%	0.285	21%	0.207	S	C	.	.			trans	-122.8	150.2	171.4	-70.9	168.9	-172.2	0	0	110.3	K119 L157 N158 K186	K119-E152 PolarHBondContact NZ-O 3.36Å; E152-L157 CarbonylContact C-O 3.53Å; E152-L157 VanDerWaalsContact CA-O 3.27Å; E152-L157 WeakPolarHBondContact CA-O 3.17Å; E152-N158 HydrophobicContact CG-CB 4.31Å; E152-K186 WeakPolarHBondContact OE1-CE 3.47Å; E152-K186 IonicContact OE1-NZ 2.75Å; E152-K186 PolarHBondContact OE1-NZ 2.88Å
153	N	93.9	Very high	96.6	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.08	21%	0.207	C	C	.	.			trans	-78.3	-175.3	169.5	82.3	-12.5	0	0	0	111.5	Y122 G123 M124 E155 G156 L157	Y122-N153 WeakPolarHBondContact O-CB 3.22Å; G123-N153 WeakPolarHBondContact O-CA 3.37Å; M124-N153 HydrophobicContact CG-CB 4.45Å; M124-N153 HydrophobicContact SD-CB 3.81Å; N153-E155 PolarHBondContact O-N 3.27Å; N153-E155 VanDerWaalsContact O-N 3.16Å; N153-E155 WeakPolarHBondContact OD1-CA 3.35Å; N153-E155 PolarHBondContact OD1-N 2.92Å; N153-G156 PolarHBondContact O-N 3.01Å; N153-G156 VanDerWaalsContact O-N 3.11Å; N153-G156 PolarHBondContact OD1-N 3.21Å; N153-G156 VanDerWaalsContact OD1-N 3.13Å; N153-L157 PolarHBondContact N-O 3.22Å; N153-L157 WeakPolarHBondContact OD1-CB 3.41Å; N153-L157 PolarHBondContact OD1-N 2.97Å
154	E	92.5	Very high	96.6	Very high	112 Å²	112	37.8 Å²	37.8	52%	0.523	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.2	-179.4	-74.1	174.1	-174	0	0	114.5	Y122 Q189	Y122-E154 VanDerWaalsContact C-CD 3.49Å; Y122-E154 PolarHBondContact O-N 3.32Å; Y122-E154 VanDerWaalsContact O-N 3.1Å; E154-Q189 PolarHBondContact O-NE2 3.15Å; E154-Q189 PolarHBondContact O-OE1 3.43Å
155	E	91.3	Very high	96.5	Very high	62 Å²	62	31 Å²	31	29%	0.29	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	3.9	177.3	-64.7	172.5	177.7	0	0	112.3	P36 N153 L157 Q189	P36-E155 WeakPolarHBondContact CD-OE1 3.27Å; N153-E155 PolarHBondContact O-N 3.27Å; N153-E155 VanDerWaalsContact O-N 3.16Å; N153-E155 WeakPolarHBondContact OD1-CA 3.35Å; N153-E155 PolarHBondContact OD1-N 2.92Å; E155-L157 VanDerWaalsContact C-N 3.29Å; E155-L157 HydrophobicContact CB-CG 4.19Å; E155-Q189 VanDerWaalsContact C-CG 3.49Å; E155-Q189 VanDerWaalsContact O-CB 3.22Å; E155-Q189 WeakPolarHBondContact O-CB 3.44Å; E155-Q189 WeakPolarHBondContact O-CG 3.48Å; E155-Q189 PolarHBondContact O-N 2.98Å
156	G	95.6	Very high	96.3	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.021	16%	0.156	C	C	.	.	S	Bend	trans	78.6	7.9	-175.5	0	0	0	0	0	114.3	N153	N153-G156 PolarHBondContact O-N 3.01Å; N153-G156 VanDerWaalsContact O-N 3.11Å; N153-G156 PolarHBondContact OD1-N 3.21Å; N153-G156 VanDerWaalsContact OD1-N 3.13Å
157	L	97.2	Very high	96.3	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.037	14%	0.142	C	C	.	.			trans	-72	135	176	-54.7	179.4	0	0	0	109.8	H128 E152 N153 E155 H161 I165 D188 L197	H128-L157 PolarHBondContact NE2-O 2.95Å; E152-L157 CarbonylContact C-O 3.53Å; E152-L157 VanDerWaalsContact CA-O 3.27Å; E152-L157 WeakPolarHBondContact CA-O 3.17Å; N153-L157 PolarHBondContact N-O 3.22Å; N153-L157 WeakPolarHBondContact OD1-CB 3.41Å; N153-L157 PolarHBondContact OD1-N 2.97Å; E155-L157 VanDerWaalsContact C-N 3.29Å; E155-L157 HydrophobicContact CB-CG 4.19Å; L157-H161 HydrophobicContact CB-CB 4.07Å; L157-H161 HydrophobicContact CD2-CB 3.86Å; L157-I165 HydrophobicContact CD1-CD1 4.24Å; L157-D188 HydrophobicContact CD2-CB 3.83Å; L157-L197 HydrophobicContact CD2-CD1 4.04Å
158	N	97.9	Very high	96.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.			trans	-114.3	-178.3	174.4	67.9	40.3	0	0	0	109	E152 M160 H161 C162 L184	E152-N158 HydrophobicContact CG-CB 4.31Å; N158-M160 VanDerWaalsContact C-N 3.27Å; N158-M160 PolarHBondContact O-N 3.4Å; N158-M160 WeakPolarHBondContact OD1-CA 3.34Å; N158-M160 WeakPolarHBondContact OD1-CB 3.26Å; N158-M160 PolarHBondContact OD1-N 3.05Å; N158-H161 PolarHBondContact N-ND1 2.91Å; N158-H161 VanDerWaalsContact N-ND1 3.2Å; N158-H161 PolarHBondContact ND2-ND1 2.96Å; N158-H161 WeakPolarHBondContact O-CB 3.41Å; N158-H161 PolarHBondContact O-N 3.14Å; N158-H161 PolarHBondContact OD1-N 2.97Å; N158-H161 VanDerWaalsContact OD1-N 3.12Å; N158-H161 PolarHBondContact OD1-ND1 2.9Å; N158-C162 PolarHBondContact O-N 3.37Å; N158-C162 PolarHBondContact O-SG 2.92Å; N158-C162 VanDerWaalsContact O-SG 3.35Å; N158-L184 PolarHBondContact ND2-O 3.25Å
159	I	98.2	Very high	96.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-29.8	-177.6	59.3	171.4	0	0	0	114	I127 A131 Q149 A163 I175 M179 L184	I127-I159 HydrophobicContact CB-CG2 4.32Å; I127-I159 HydrophobicContact CD1-CD1 4.5Å; I127-I159 HydrophobicContact CD1-CG2 4.32Å; I127-I159 HydrophobicContact CG1-CG2 3.95Å; I127-I159 HydrophobicContact CG2-CG2 3.85Å; A131-I159 HydrophobicContact CB-CB 3.92Å; A131-I159 HydrophobicContact CB-CG2 4.26Å; A131-I159 WeakPolarHBondContact CB-O 3.43Å; Q149-I159 HydrophobicContact CB-CD1 4.41Å; I159-A163 WeakPolarHBondContact O-CB 3.49Å; I159-A163 PolarHBondContact O-N 3.33Å; I159-A163 VanDerWaalsContact O-N 3.11Å; I159-I175 HydrophobicContact CB-CD1 4.38Å; I159-I175 HydrophobicContact CD1-CD1 3.89Å; I159-I175 HydrophobicContact CD1-CG1 3.86Å; I159-I175 HydrophobicContact CG1-CD1 3.8Å; I159-I175 HydrophobicContact CG1-CG1 4.32Å; I159-M179 HydrophobicContact CD1-CE 3.86Å; I159-L184 HydrophobicContact CD1-CD1 3.88Å; I159-L184 HydrophobicContact CG1-CD1 3.69Å
160	M	98.4	Very high	96.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-72.2	-41.6	176.4	-170.3	178.5	-76.4	0	0	110.8	N158 A163 A164 V172 I175 I176 L184 N185 P194	N158-M160 VanDerWaalsContact C-N 3.27Å; N158-M160 PolarHBondContact O-N 3.4Å; N158-M160 WeakPolarHBondContact OD1-CA 3.34Å; N158-M160 WeakPolarHBondContact OD1-CB 3.26Å; N158-M160 PolarHBondContact OD1-N 3.05Å; M160-A163 PolarHBondContact O-N 3.11Å; M160-A164 WeakPolarHBondContact O-CB 3.36Å; M160-A164 PolarHBondContact O-N 2.94Å; M160-V172 HydrophobicContact CG-CG2 4.26Å; M160-I175 HydrophobicContact CB-CD1 4.15Å; M160-I175 HydrophobicContact CE-CB 4.33Å; M160-I175 HydrophobicContact CE-CG2 3.48Å; M160-I175 VanDerWaalsContact CE-CG2 3.48Å; M160-I176 HydrophobicContact CE-CD1 4.32Å; M160-I176 HydrophobicContact CE-CG1 3.91Å; M160-L184 HydrophobicContact CB-CB 4.12Å; M160-L184 HydrophobicContact CE-CB 4.2Å; M160-N185 HydrophobicContact SD-CB 3.89Å; M160-P194 HydrophobicContact CB-CG 4.28Å; M160-P194 HydrophobicContact CG-CB 3.99Å; M160-P194 HydrophobicContact CG-CG 3.77Å; M160-P194 HydrophobicContact SD-CB 4.33Å; M160-P194 HydrophobicContact SD-CG 3.84Å
161	H	98.1	Very high	96.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-51.1	171.8	-66	126.6	0	0	0	111.6	L157 N158 A163 A164 I165 K186 H192 P194 L197	L157-H161 HydrophobicContact CB-CB 4.07Å; L157-H161 HydrophobicContact CD2-CB 3.86Å; N158-H161 PolarHBondContact N-ND1 2.91Å; N158-H161 VanDerWaalsContact N-ND1 3.2Å; N158-H161 PolarHBondContact ND2-ND1 2.96Å; N158-H161 WeakPolarHBondContact O-CB 3.41Å; N158-H161 PolarHBondContact O-N 3.14Å; N158-H161 PolarHBondContact OD1-N 2.97Å; N158-H161 VanDerWaalsContact OD1-N 3.12Å; N158-H161 PolarHBondContact OD1-ND1 2.9Å; H161-A163 VanDerWaalsContact C-N 3.31Å; H161-A163 PolarHBondContact O-N 3.12Å; H161-A164 PolarHBondContact O-N 3.39Å; H161-I165 WeakPolarHBondContact O-CG1 3.34Å; H161-I165 PolarHBondContact O-N 3.27Å; H161-K186 PolarHBondContact CE1-O 2.85Å; H161-K186 PolarHBondContact NE2-O 3.38Å; H161-H192 PolarHBondContact NE2-O 3.21Å; H161-P194 WeakPolarHBondContact NE2-CD 3.47Å; H161-L197 HydrophobicContact CB-CD1 3.89Å
162	C	96.8	Very high	96.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-39.5	-178.8	-63.5	0	0	0	0	113	A131 W132 N158 N166	A131-C162 HydrophobicContact CB-CB 3.92Å; W132-C162 HydrophobicContact CB-CB 4.11Å; W132-C162 HydrophobicContact CE3-CB 4.03Å; N158-C162 PolarHBondContact O-N 3.37Å; N158-C162 PolarHBondContact O-SG 2.92Å; N158-C162 VanDerWaalsContact O-SG 3.35Å; C162-N166 PolarHBondContact O-ND2 3.02Å
163	A	97.9	Very high	96.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.7	-39.4	176.7	0	0	0	0	0	112.1	I159 M160 H161 N166 N167 H168 I171 V172	I159-A163 WeakPolarHBondContact O-CB 3.49Å; I159-A163 PolarHBondContact O-N 3.33Å; I159-A163 VanDerWaalsContact O-N 3.11Å; M160-A163 PolarHBondContact O-N 3.11Å; H161-A163 VanDerWaalsContact C-N 3.31Å; H161-A163 PolarHBondContact O-N 3.12Å; A163-N166 PolarHBondContact O-N 2.92Å; A163-N167 PolarHBondContact O-N 2.86Å; A163-H168 HydrophobicContact CB-CB 4.19Å; A163-H168 PolarHBondContact O-N 3.18Å; A163-I171 HydrophobicContact CB-CB 3.97Å; A163-I171 HydrophobicContact CB-CG2 3.7Å; A163-V172 HydrophobicContact CB-CG2 3.77Å
164	A	97.6	Very high	96.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.7	-42.7	178.6	0	0	0	0	0	113.1	M160 H161 N166 N167 P194 S203 M206	M160-A164 WeakPolarHBondContact O-CB 3.36Å; M160-A164 PolarHBondContact O-N 2.94Å; H161-A164 PolarHBondContact O-N 3.39Å; A164-N166 PolarHBondContact O-N 3.3Å; A164-N167 PolarHBondContact O-N 2.87Å; A164-P194 HydrophobicContact CB-CB 3.87Å; A164-P194 WeakPolarHBondContact CB-O 3.33Å; A164-S203 PolarHBondContact O-OG 3.03Å; A164-M206 HydrophobicContact CB-CG 4.02Å; A164-M206 HydrophobicContact CB-SD 4.36Å
165	I	94.9	Very high	97.1	Very high	7 Å²	7	19.3 Å²	19.3	4%	0.036	10%	0.095	C	C	.	.	H	α-helix	trans	-55.7	-37.9	176.8	-71.1	166.1	0	0	0	112.2	W132 L157 H161 L197 H201	W132-I165 HydrophobicContact CH2-CD1 4.09Å; W132-I165 HydrophobicContact CH2-CG2 3.8Å; W132-I165 HydrophobicContact CZ2-CG2 4.21Å; W132-I165 HydrophobicContact CZ3-CD1 3.63Å; W132-I165 HydrophobicContact CZ3-CG2 4.17Å; L157-I165 HydrophobicContact CD1-CD1 4.24Å; H161-I165 WeakPolarHBondContact O-CG1 3.34Å; H161-I165 PolarHBondContact O-N 3.27Å; I165-L197 HydrophobicContact CD1-CD1 4.06Å; I165-L197 HydrophobicContact CG1-CB 3.91Å; I165-L197 HydrophobicContact CG1-CD1 3.99Å; I165-L197 HydrophobicContact CG1-CG 4.4Å; I165-H201 WeakPolarHBondContact O-CB 3.41Å
166	N	92.5	Very high	97.5	Very high	30 Å²	30	17.3 Å²	17.3	16%	0.16	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	14.6	-173.5	-65	-75.3	0	0	0	113.7	W132 C162 A163 A164 H168	W132-N166 VanDerWaalsContact CE2-ND2 3.28Å; W132-N166 WeakPolarHBondContact O-CB 3.4Å; W132-N166 PolarHBondContact O-ND2 3.11Å; C162-N166 PolarHBondContact O-ND2 3.02Å; A163-N166 PolarHBondContact O-N 2.92Å; A164-N166 PolarHBondContact O-N 3.3Å; N166-H168 VanDerWaalsContact C-N 3.3Å; N166-H168 VanDerWaalsContact CB-CD2 3.49Å; N166-H168 WeakPolarHBondContact CB-CD2 3.49Å; N166-H168 WeakPolarHBondContact CB-NE2 3.47Å; N166-H168 PolarHBondContact O-N 3.2Å
167	N	96.8	Very high	97.6	Very high	45 Å²	45	20.9 Å²	20.9	24%	0.241	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	34.8	176.1	-156	32.9	0	0	0	114.4	A163 A164 T169 E205 M206	A163-N167 PolarHBondContact O-N 2.86Å; A164-N167 PolarHBondContact O-N 2.87Å; N167-T169 VanDerWaalsContact C-N 3.32Å; N167-T169 PolarHBondContact O-N 3.07Å; N167-T169 VanDerWaalsContact O-N 3.12Å; N167-E205 PolarHBondContact ND2-OE2 3.4Å; N167-M206 WeakPolarHBondContact OD1-CB 3.29Å; N167-M206 PolarHBondContact OD1-N 3.12Å
168	H	97.8	Very high	97.6	Very high	34 Å²	34	25.6 Å²	25.6	16%	0.157	13%	0.13	C	C	.	.			trans	-87.6	71.9	178.3	-64	-46.2	0	0	0	110.9	A131 W132 F133 G134 A163 N166 E170 I171 V172	A131-H168 PolarHBondContact O-CD2 3.38Å; A131-H168 VanDerWaalsContact O-CD2 3.23Å; W132-H168 PolarHBondContact O-CD2 3.39Å; W132-H168 PolarHBondContact O-NE2 2.92Å; F133-H168 VanDerWaalsContact C-NE2 3.3Å; F133-H168 PolarHBondContact O-NE2 3.18Å; G134-H168 WeakPolarHBondContact CA-CD2 3.45Å; G134-H168 WeakPolarHBondContact CA-ND1 3.47Å; G134-H168 WeakPolarHBondContact CA-NE2 3.42Å; G134-H168 PolarHBondContact N-CD2 2.99Å; G134-H168 VanDerWaalsContact N-CD2 3.27Å; G134-H168 PolarHBondContact N-NE2 3.27Å; A163-H168 HydrophobicContact CB-CB 4.19Å; A163-H168 PolarHBondContact O-N 3.18Å; N166-H168 VanDerWaalsContact C-N 3.3Å; N166-H168 VanDerWaalsContact CB-CD2 3.49Å; N166-H168 WeakPolarHBondContact CB-CD2 3.49Å; N166-H168 WeakPolarHBondContact CB-NE2 3.47Å; N166-H168 PolarHBondContact O-N 3.2Å; H168-E170 VanDerWaalsContact C-N 3.27Å; H168-E170 IonicContact ND1-OE1 3.33Å; H168-E170 PolarHBondContact O-N 2.91Å; H168-I171 HydrophobicContact CB-CB 4.35Å; H168-I171 HydrophobicContact CB-CD1 4.22Å; H168-I171 HydrophobicContact CB-CG1 4.34Å; H168-I171 WeakPolarHBondContact O-CB 3.28Å; H168-I171 PolarHBondContact O-N 3.03Å; H168-I171 VanDerWaalsContact O-N 3.08Å; H168-V172 PolarHBondContact O-N 3.31Å
169	T	98.2	Very high	97.6	Very high	34 Å²	34	27.1 Å²	27.1	21%	0.209	14%	0.137	C	C	.	.	H	α-helix	trans	-56.2	-37.6	-176.3	44.7	0	0	0	0	113.5	N167 I171 V172 E173 E205 M206 M209	N167-T169 VanDerWaalsContact C-N 3.32Å; N167-T169 PolarHBondContact O-N 3.07Å; N167-T169 VanDerWaalsContact O-N 3.12Å; T169-I171 PolarHBondContact O-N 3.38Å; T169-V172 PolarHBondContact O-N 3.2Å; T169-E173 WeakPolarHBondContact O-CB 3.21Å; T169-E173 PolarHBondContact O-N 3.41Å; T169-E205 HydrophobicContact CG2-CB 4Å; T169-M206 HydrophobicContact CG2-CB 4.48Å; T169-M206 HydrophobicContact CG2-CE 3.89Å; T169-M209 VanDerWaalsContact CB-CE 3.47Å; T169-M209 HydrophobicContact CG2-CB 4.42Å; T169-M209 HydrophobicContact CG2-CE 4.01Å; T169-M209 HydrophobicContact CG2-SD 3.91Å; T169-M209 VanDerWaalsContact O-SD 3.4Å
170	E	98.4	Very high	97.5	Very high	68 Å²	68	34.6 Å²	34.6	32%	0.318	17%	0.172	S	C	.	.	H	α-helix	trans	-64.6	-26.8	179	68.3	-78.4	-177.6	0	0	112.9	L136 H168 Y174	L136-E170 HydrophobicContact CB-CG 4.1Å; L136-E170 HydrophobicContact CD2-CB 4.1Å; L136-E170 HydrophobicContact CD2-CG 4.1Å; H168-E170 VanDerWaalsContact C-N 3.27Å; H168-E170 IonicContact ND1-OE1 3.33Å; H168-E170 PolarHBondContact O-N 2.91Å; E170-Y174 WeakPolarHBondContact O-CB 3.37Å; E170-Y174 PolarHBondContact O-N 3.29Å; E170-Y174 VanDerWaalsContact O-N 3.1Å
171	I	98.6	Very high	97.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-77.9	-41.3	175.6	-67.8	-174.4	0	0	0	110.3	A131 L136 L139 A163 H168 T169 E173 Y174 I175	A131-I171 HydrophobicContact CB-CG2 4.26Å; L136-I171 HydrophobicContact CB-CG1 4.14Å; L136-I171 HydrophobicContact CD1-CG1 4.2Å; L139-I171 HydrophobicContact CD2-CB 4.39Å; L139-I171 HydrophobicContact CD2-CD1 4.39Å; L139-I171 HydrophobicContact CD2-CG1 4.24Å; L139-I171 HydrophobicContact CD2-CG2 3.6Å; A163-I171 HydrophobicContact CB-CB 3.97Å; A163-I171 HydrophobicContact CB-CG2 3.7Å; H168-I171 HydrophobicContact CB-CB 4.35Å; H168-I171 HydrophobicContact CB-CD1 4.22Å; H168-I171 HydrophobicContact CB-CG1 4.34Å; H168-I171 WeakPolarHBondContact O-CB 3.28Å; H168-I171 PolarHBondContact O-N 3.03Å; H168-I171 VanDerWaalsContact O-N 3.08Å; T169-I171 PolarHBondContact O-N 3.38Å; I171-E173 VanDerWaalsContact C-N 3.34Å; I171-Y174 PolarHBondContact O-N 3.34Å; I171-I175 HydrophobicContact CG2-CD1 3.78Å; I171-I175 HydrophobicContact CG2-CG1 4.39Å; I171-I175 WeakPolarHBondContact O-CB 3.42Å; I171-I175 WeakPolarHBondContact O-CD1 3.5Å; I171-I175 WeakPolarHBondContact O-CG1 3.5Å; I171-I175 PolarHBondContact O-N 3.08Å
172	V	98.4	Very high	97.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-40	175.6	173.1	0	0	0	0	111	M160 A163 H168 T169 I175 I176 M206 M209 L210	M160-V172 HydrophobicContact CG-CG2 4.26Å; A163-V172 HydrophobicContact CB-CG2 3.77Å; H168-V172 PolarHBondContact O-N 3.31Å; T169-V172 PolarHBondContact O-N 3.2Å; V172-I175 PolarHBondContact O-N 3.24Å; V172-I176 HydrophobicContact CG1-CD1 3.54Å; V172-I176 HydrophobicContact CG1-CG1 4.43Å; V172-I176 WeakPolarHBondContact O-CD1 3.37Å; V172-I176 WeakPolarHBondContact O-CG1 3.32Å; V172-I176 PolarHBondContact O-N 3.26Å; V172-M206 HydrophobicContact CB-CE 4.1Å; V172-M206 HydrophobicContact CB-SD 4.09Å; V172-M206 HydrophobicContact CG1-SD 4.22Å; V172-M206 HydrophobicContact CG2-CE 3.54Å; V172-M206 HydrophobicContact CG2-SD 3.69Å; V172-M209 HydrophobicContact CB-SD 4.2Å; V172-M209 HydrophobicContact CG1-SD 4.17Å; V172-L210 HydrophobicContact CG1-CD2 4.09Å
173	E	98.3	Very high	97.4	Very high	92 Å²	92	44.9 Å²	44.9	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-57.2	-49.1	171.2	-175.6	176.1	-160.5	0	0	111.7	T169 I171 I175 I176 N177 M209	T169-E173 WeakPolarHBondContact O-CB 3.21Å; T169-E173 PolarHBondContact O-N 3.41Å; I171-E173 VanDerWaalsContact C-N 3.34Å; E173-I175 VanDerWaalsContact C-N 3.34Å; E173-I175 PolarHBondContact O-N 3.07Å; E173-I176 PolarHBondContact O-N 3.27Å; E173-N177 WeakPolarHBondContact CG-ND2 3.14Å; E173-N177 WeakPolarHBondContact O-CB 3.15Å; E173-N177 PolarHBondContact O-N 2.93Å; E173-M209 HydrophobicContact CB-CE 4.31Å
174	Y	98.6	Very high	97.4	Very high	25 Å²	25	45 Å²	45	10%	0.098	22%	0.22	C	C	.	.	I	π-helix	trans	-61.7	-39.3	176.2	177.9	-111.5	0	0	0	112.9	L136 L139 K140 E170 I171 I176 D178 M179	L136-Y174 HydrophobicContact CD1-CD1 3.8Å; L136-Y174 HydrophobicContact CD1-CD2 4.37Å; L136-Y174 HydrophobicContact CD1-CG 3.63Å; L139-Y174 HydrophobicContact CD2-CD1 3.86Å; L139-Y174 HydrophobicContact CD2-CE1 4.28Å; K140-Y174 HydrophobicContact CD-CE2 4.24Å; K140-Y174 VanDerWaalsContact CE-CE2 3.48Å; K140-Y174 HydrophobicContact CG-CD2 4.42Å; K140-Y174 HydrophobicContact CG-CE1 3.97Å; K140-Y174 HydrophobicContact CG-CE2 3.93Å; E170-Y174 WeakPolarHBondContact O-CB 3.37Å; E170-Y174 PolarHBondContact O-N 3.29Å; E170-Y174 VanDerWaalsContact O-N 3.1Å; I171-Y174 PolarHBondContact O-N 3.34Å; Y174-I176 PolarHBondContact O-N 3.48Å; Y174-D178 HydrophobicContact CD2-CB 3.38Å; Y174-D178 WeakPolarHBondContact CD2-OD2 3.31Å; Y174-D178 HydrophobicContact CE2-CB 3.42Å; Y174-D178 VanDerWaalsContact CE2-CB 3.42Å; Y174-D178 HydrophobicContact CG-CB 4.35Å; Y174-D178 WeakPolarHBondContact O-CB 3.38Å; Y174-D178 PolarHBondContact O-N 3.37Å; Y174-M179 HydrophobicContact CD1-CE 3.81Å; Y174-M179 HydrophobicContact CD1-CG 4.17Å; Y174-M179 HydrophobicContact CD1-SD 4.15Å; Y174-M179 HydrophobicContact CE1-CE 3.78Å; Y174-M179 HydrophobicContact CE1-CG 3.67Å; Y174-M179 HydrophobicContact CE1-SD 3.51Å; Y174-M179 VanDerWaalsContact CE1-SD 3.51Å; Y174-M179 HydrophobicContact CE2-CG 4.32Å; Y174-M179 PolarHBondContact O-N 3.23Å
175	I	98.3	Very high	97.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-61.4	-44.4	176.6	-70.5	161.3	0	0	0	111.2	I159 M160 I171 V172 E173 M179 Q180 M181 L184	I159-I175 HydrophobicContact CB-CD1 4.38Å; I159-I175 HydrophobicContact CD1-CD1 3.89Å; I159-I175 HydrophobicContact CD1-CG1 3.86Å; I159-I175 HydrophobicContact CG1-CD1 3.8Å; I159-I175 HydrophobicContact CG1-CG1 4.32Å; M160-I175 HydrophobicContact CB-CD1 4.15Å; M160-I175 HydrophobicContact CE-CB 4.33Å; M160-I175 HydrophobicContact CE-CG2 3.48Å; M160-I175 VanDerWaalsContact CE-CG2 3.48Å; I171-I175 HydrophobicContact CG2-CD1 3.78Å; I171-I175 HydrophobicContact CG2-CG1 4.39Å; I171-I175 WeakPolarHBondContact O-CB 3.42Å; I171-I175 WeakPolarHBondContact O-CD1 3.5Å; I171-I175 WeakPolarHBondContact O-CG1 3.5Å; I171-I175 PolarHBondContact O-N 3.08Å; V172-I175 PolarHBondContact O-N 3.24Å; E173-I175 VanDerWaalsContact C-N 3.34Å; E173-I175 PolarHBondContact O-N 3.07Å; I175-M179 HydrophobicContact CB-CE 3.98Å; I175-M179 HydrophobicContact CG1-CE 3.39Å; I175-M179 HydrophobicContact CG2-CE 4.44Å; I175-Q180 PolarHBondContact O-N 2.95Å; I175-M181 HydrophobicContact CG2-CB 4.09Å; I175-M181 PolarHBondContact O-N 2.71Å; I175-L184 HydrophobicContact CG2-CD1 3.88Å
176	I	98	Very high	97.5	Very high	19 Å²	19	51 Å²	51	10%	0.097	25%	0.247	C	C	.	.	I	π-helix	trans	-82.8	-45.3	-173.1	-63.3	161.5	0	0	0	111.8	M160 V172 E173 Y174 Q180 Y214 M216	M160-I176 HydrophobicContact CE-CD1 4.32Å; M160-I176 HydrophobicContact CE-CG1 3.91Å; V172-I176 HydrophobicContact CG1-CD1 3.54Å; V172-I176 HydrophobicContact CG1-CG1 4.43Å; V172-I176 WeakPolarHBondContact O-CD1 3.37Å; V172-I176 WeakPolarHBondContact O-CG1 3.32Å; V172-I176 PolarHBondContact O-N 3.26Å; E173-I176 PolarHBondContact O-N 3.27Å; Y174-I176 PolarHBondContact O-N 3.48Å; I176-Q180 VanDerWaalsContact O-CA 3.29Å; I176-Q180 WeakPolarHBondContact O-CA 3.45Å; I176-Q180 PolarHBondContact O-N 3.29Å; I176-Y214 HydrophobicContact CB-CD1 4.42Å; I176-Y214 HydrophobicContact CB-CE1 4.06Å; I176-Y214 HydrophobicContact CD1-CD1 3.94Å; I176-Y214 HydrophobicContact CD1-CD2 3.52Å; I176-Y214 HydrophobicContact CD1-CE1 4.06Å; I176-Y214 HydrophobicContact CD1-CE2 3.65Å; I176-Y214 HydrophobicContact CD1-CG 3.7Å; I176-Y214 HydrophobicContact CG2-CD1 3.66Å; I176-Y214 HydrophobicContact CG2-CE1 3.56Å; I176-Y214 HydrophobicContact CG2-CG 4.47Å; I176-M216 HydrophobicContact CD1-CE 3.41Å; I176-M216 VanDerWaalsContact CD1-CE 3.41Å; I176-M216 HydrophobicContact CG1-CE 3.77Å; I176-M216 HydrophobicContact CG2-CE 4.34Å
177	N	97.6	Very high	97.7	Very high	78 Å²	78	53 Å²	53	42%	0.417	26%	0.256	S	S	.	.	I	π-helix	trans	-88.5	-51.4	-170.4	-64.2	-24	0	0	0	112.1	E173 Y214	E173-N177 WeakPolarHBondContact CG-ND2 3.14Å; E173-N177 WeakPolarHBondContact O-CB 3.15Å; E173-N177 PolarHBondContact O-N 2.93Å; N177-Y214 PolarHBondContact ND2-OH 3Å
178	D	97.8	Very high	97.7	Very high	105 Å²	105	51.5 Å²	51.5	56%	0.561	25%	0.248	S	C	*	.	I	π-helix	trans	-82.3	-47.5	-176.3	-63.4	-100.1	0	0	0	112	Y174	Y174-D178 HydrophobicContact CD2-CB 3.38Å; Y174-D178 WeakPolarHBondContact CD2-OD2 3.31Å; Y174-D178 HydrophobicContact CE2-CB 3.42Å; Y174-D178 VanDerWaalsContact CE2-CB 3.42Å; Y174-D178 HydrophobicContact CG-CB 4.35Å; Y174-D178 WeakPolarHBondContact O-CB 3.38Å; Y174-D178 PolarHBondContact O-N 3.37Å
179	M	97.7	Very high	97.6	Very high	33 Å²	33	55.2 Å²	55.2	16%	0.163	27%	0.265	C	S	.	.	S	Bend	trans	-83.5	-16	-179.6	-60.8	-163.9	-68.4	0	0	113.1	V143 Q149 I159 Y174 I175 M181	V143-M179 HydrophobicContact CG1-SD 4.31Å; V143-M179 HydrophobicContact CG2-SD 3.89Å; Q149-M179 HydrophobicContact CG-SD 4.25Å; I159-M179 HydrophobicContact CD1-CE 3.86Å; Y174-M179 HydrophobicContact CD1-CE 3.81Å; Y174-M179 HydrophobicContact CD1-CG 4.17Å; Y174-M179 HydrophobicContact CD1-SD 4.15Å; Y174-M179 HydrophobicContact CE1-CE 3.78Å; Y174-M179 HydrophobicContact CE1-CG 3.67Å; Y174-M179 HydrophobicContact CE1-SD 3.51Å; Y174-M179 VanDerWaalsContact CE1-SD 3.51Å; Y174-M179 HydrophobicContact CE2-CG 4.32Å; Y174-M179 PolarHBondContact O-N 3.23Å; I175-M179 HydrophobicContact CB-CE 3.98Å; I175-M179 HydrophobicContact CG1-CE 3.39Å; I175-M179 HydrophobicContact CG2-CE 4.44Å; M179-M181 HydrophobicContact CB-CB 4.46Å; M179-M181 HydrophobicContact CB-CG 3.85Å; M179-M181 HydrophobicContact CB-SD 4.15Å; M179-M181 WeakPolarHBondContact O-CG 3.19Å; M179-M181 PolarHBondContact O-N 3.36Å; M179-M181 HydrophobicContact SD-SD 4.43Å
180	Q	97.6	Very high	97.4	Very high	156 Å²	156	56.5 Å²	56.5	73%	0.729	28%	0.276	S	S	*	.			trans	56.4	31.3	-177.8	-56.8	-175.9	7.5	0	0	113.9	I175 I176 K182	I175-Q180 PolarHBondContact O-N 2.95Å; I176-Q180 VanDerWaalsContact O-CA 3.29Å; I176-Q180 WeakPolarHBondContact O-CA 3.45Å; I176-Q180 PolarHBondContact O-N 3.29Å; Q180-K182 PolarHBondContact O-N 3Å
181	M	97.4	Very high	97.4	Very high	18 Å²	18	53.5 Å²	53.5	9%	0.089	26%	0.263	C	S	.	.			trans	-100.4	53.7	-173.4	-62.9	-172.7	75.5	0	0	112.7	Q149 K150 I175 M179 E183 L184	Q149-M181 HydrophobicContact CB-CE 3.82Å; Q149-M181 HydrophobicContact CB-SD 3.68Å; Q149-M181 HydrophobicContact CG-SD 4.2Å; K150-M181 HydrophobicContact CD-CE 4.2Å; K150-M181 VanDerWaalsContact CE-CE 3.47Å; K150-M181 HydrophobicContact CG-CE 3.52Å; I175-M181 HydrophobicContact CG2-CB 4.09Å; I175-M181 PolarHBondContact O-N 2.71Å; M179-M181 HydrophobicContact CB-CB 4.46Å; M179-M181 HydrophobicContact CB-CG 3.85Å; M179-M181 HydrophobicContact CB-SD 4.15Å; M179-M181 WeakPolarHBondContact O-CG 3.19Å; M179-M181 PolarHBondContact O-N 3.36Å; M179-M181 HydrophobicContact SD-SD 4.43Å; M181-E183 VanDerWaalsContact C-OE2 3.26Å; M181-E183 VanDerWaalsContact CA-OE2 3.25Å; M181-E183 WeakPolarHBondContact CA-OE2 3.45Å; M181-E183 PolarHBondContact O-N 3.48Å; M181-L184 HydrophobicContact CB-CD1 4Å; M181-L184 HydrophobicContact CB-CG 4.09Å; M181-L184 HydrophobicContact CE-CD1 4.08Å; M181-L184 HydrophobicContact CE-CD2 4.24Å; M181-L184 HydrophobicContact CE-CG 4.2Å; M181-L184 PolarHBondContact O-N 3.32Å; M181-L184 VanDerWaalsContact O-N 3.16Å; M181-L184 HydrophobicContact SD-CD1 4.32Å
182	K	96.1	Very high	97.3	Very high	105 Å²	105	54.1 Å²	54.1	46%	0.457	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62.3	-21.6	178	-178.5	159.7	179.6	164.9	0	112.2	Q180 L184 N185 Y214 M216	Q180-K182 PolarHBondContact O-N 3Å; K182-L184 PolarHBondContact O-N 3.41Å; K182-N185 WeakPolarHBondContact O-CB 3.37Å; K182-N185 PolarHBondContact O-N 3.1Å; K182-N185 VanDerWaalsContact O-N 3.1Å; K182-Y214 PolarHBondContact NZ-O 3.38Å; K182-M216 HydrophobicContact CB-CE 4.39Å; K182-M216 HydrophobicContact CD-CE 3.55Å; K182-M216 HydrophobicContact CG-CE 3.54Å; K182-M216 HydrophobicContact CG-SD 4.28Å
183	E	96.9	Very high	97.3	Very high	93 Å²	93	55.3 Å²	55.3	44%	0.435	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-65.7	-12.5	175.6	73.6	-90.6	-152.2	0	0	114.6	K150 M181 N185	K150-E183 WeakPolarHBondContact CE-OE1 3.43Å; K150-E183 IonicContact NZ-OE1 2.78Å; K150-E183 PolarHBondContact NZ-OE1 2.98Å; M181-E183 VanDerWaalsContact C-OE2 3.26Å; M181-E183 VanDerWaalsContact CA-OE2 3.25Å; M181-E183 WeakPolarHBondContact CA-OE2 3.45Å; M181-E183 PolarHBondContact O-N 3.48Å; E183-N185 PolarHBondContact O-N 3.32Å
184	L	97.6	Very high	97.3	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-71.4	-12.9	172.2	-63.8	-177.7	0	0	0	112.6	K150 N158 I159 M160 I175 M181 K182 K186	K150-L184 HydrophobicContact CG-CD2 4.44Å; N158-L184 PolarHBondContact ND2-O 3.25Å; I159-L184 HydrophobicContact CD1-CD1 3.88Å; I159-L184 HydrophobicContact CG1-CD1 3.69Å; M160-L184 HydrophobicContact CB-CB 4.12Å; M160-L184 HydrophobicContact CE-CB 4.2Å; I175-L184 HydrophobicContact CG2-CD1 3.88Å; M181-L184 HydrophobicContact CB-CD1 4Å; M181-L184 HydrophobicContact CB-CG 4.09Å; M181-L184 HydrophobicContact CE-CD1 4.08Å; M181-L184 HydrophobicContact CE-CD2 4.24Å; M181-L184 HydrophobicContact CE-CG 4.2Å; M181-L184 PolarHBondContact O-N 3.32Å; M181-L184 VanDerWaalsContact O-N 3.16Å; M181-L184 HydrophobicContact SD-CD1 4.32Å; K182-L184 PolarHBondContact O-N 3.41Å; L184-K186 VanDerWaalsContact C-N 3.27Å; L184-K186 PolarHBondContact O-N 2.81Å
185	N	97.6	Very high	97.3	Very high	43 Å²	43	49.7 Å²	49.7	23%	0.23	25%	0.247	C	C	.	.			trans	-75.3	78.4	167.1	-176.5	34.3	0	0	0	110.4	M160 K182 E183 P194 M216	M160-N185 HydrophobicContact SD-CB 3.89Å; K182-N185 WeakPolarHBondContact O-CB 3.37Å; K182-N185 PolarHBondContact O-N 3.1Å; K182-N185 VanDerWaalsContact O-N 3.1Å; E183-N185 PolarHBondContact O-N 3.32Å; N185-P194 WeakPolarHBondContact OD1-CD 3.39Å; N185-M216 HydrophobicContact CB-SD 3.75Å; N185-M216 PolarHBondContact ND2-SD 3.08Å
186	K	97.2	Very high	97.3	Very high	88 Å²	88	50 Å²	50	38%	0.383	25%	0.249	S	C	.	.	S	Bend	trans	-142.2	166.5	179	65.5	177.9	-174.9	167.3	0	110	E152 H161 L184 L193	E152-K186 WeakPolarHBondContact OE1-CE 3.47Å; E152-K186 IonicContact OE1-NZ 2.75Å; E152-K186 PolarHBondContact OE1-NZ 2.88Å; H161-K186 PolarHBondContact CE1-O 2.85Å; H161-K186 PolarHBondContact NE2-O 3.38Å; L184-K186 VanDerWaalsContact C-N 3.27Å; L184-K186 PolarHBondContact O-N 2.81Å; K186-L193 VanDerWaalsContact C-CD2 3.41Å
187	E	97.8	Very high	97.3	Very high	72 Å²	72	49.3 Å²	49.3	34%	0.336	25%	0.246	S	C	.	.			trans	-69.8	141.2	-176.3	-70.9	170.9	-160.7	0	0	112.9	H192 L193 K220	E187-H192 CarbonylContact C-O 3.56Å; E187-H192 WeakPolarHBondContact CA-O 3.46Å; E187-L193 HydrophobicContact CG-CD2 4.22Å; E187-L193 HydrophobicContact CG-CG 4.08Å; E187-K220 VanDerWaalsContact OE1-CE 3.22Å; E187-K220 WeakPolarHBondContact OE1-CE 3.26Å; E187-K220 IonicContact OE1-NZ 2.57Å; E187-K220 PolarHBondContact OE1-NZ 3.28Å
188	D	96.3	Very high	97.3	Very high	15 Å²	15	45.6 Å²	45.6	8%	0.08	23%	0.226	C	C	.	.			trans	-72	-175.1	163.1	78.1	-0.3	0	0	0	111.8	L157 S190 G191 H192	L157-D188 HydrophobicContact CD2-CB 3.83Å; D188-S190 PolarHBondContact O-N 3.25Å; D188-S190 VanDerWaalsContact OD1-C 3.27Å; D188-S190 VanDerWaalsContact OD1-CA 3.26Å; D188-S190 WeakPolarHBondContact OD1-CA 3.38Å; D188-S190 WeakPolarHBondContact OD1-CB 3.34Å; D188-S190 PolarHBondContact OD1-N 2.76Å; D188-G191 PolarHBondContact O-N 3.43Å; D188-G191 VanDerWaalsContact O-N 3.11Å; D188-G191 PolarHBondContact OD1-N 3.28Å; D188-H192 PolarHBondContact N-O 3.41Å; D188-H192 IonicContact OD1-CG 3.59Å; D188-H192 PolarHBondContact OD1-N 3.23Å; D188-H192 IonicContact OD1-ND1 2.66Å; D188-H192 IonicContact OD2-CG 3.17Å; D188-H192 IonicContact OD2-ND1 2.69Å; D188-H192 PolarHBondContact OD2-ND1 2.93Å; D188-H192 VanDerWaalsContact OD2-ND1 3.17Å
189	Q	95.4	Very high	97.4	Very high	111 Å²	111	40.6 Å²	40.6	52%	0.519	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.9	178.2	-72.2	179.4	7.5	0	0	114.4	E154 E155 K223	E154-Q189 PolarHBondContact O-NE2 3.15Å; E154-Q189 PolarHBondContact O-OE1 3.43Å; E155-Q189 VanDerWaalsContact C-CG 3.49Å; E155-Q189 VanDerWaalsContact O-CB 3.22Å; E155-Q189 WeakPolarHBondContact O-CB 3.44Å; E155-Q189 WeakPolarHBondContact O-CG 3.48Å; E155-Q189 PolarHBondContact O-N 2.98Å; Q189-K223 WeakPolarHBondContact O-CD 3.31Å; Q189-K223 WeakPolarHBondContact O-CE 3.44Å; Q189-K223 PolarHBondContact O-NZ 3.36Å
190	S	94.2	Very high	97.4	Very high	61 Å²	61	40.7 Å²	40.7	43%	0.427	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-2	175.6	-62.7	0	0	0	0	112.6	D188 H192 K223	D188-S190 PolarHBondContact O-N 3.25Å; D188-S190 VanDerWaalsContact OD1-C 3.27Å; D188-S190 VanDerWaalsContact OD1-CA 3.26Å; D188-S190 WeakPolarHBondContact OD1-CA 3.38Å; D188-S190 WeakPolarHBondContact OD1-CB 3.34Å; D188-S190 PolarHBondContact OD1-N 2.76Å; S190-H192 WeakPolarHBondContact CB-ND1 3.43Å; S190-K223 VanDerWaalsContact O-CB 3.27Å; S190-K223 WeakPolarHBondContact O-CB 3.37Å; S190-K223 WeakPolarHBondContact O-CG 3.29Å; S190-K223 PolarHBondContact O-N 2.89Å
191	G	97.4	Very high	97.3	Very high	5 Å²	5	35.9 Å²	35.9	5%	0.052	18%	0.176	C	C	.	.	S	Bend	trans	85.8	12	-177.3	0	0	0	0	0	114	D188	D188-G191 PolarHBondContact O-N 3.43Å; D188-G191 VanDerWaalsContact O-N 3.11Å; D188-G191 PolarHBondContact OD1-N 3.28Å
192	H	97.4	Very high	97.3	Very high	14 Å²	14	36.1 Å²	36.1	7%	0.065	18%	0.183	C	C	.	.			trans	-82.9	133.4	177.2	-54.5	115.6	0	0	0	111.2	H161 E187 D188 S190 A196 L197 N222	H161-H192 PolarHBondContact NE2-O 3.21Å; E187-H192 CarbonylContact C-O 3.56Å; E187-H192 WeakPolarHBondContact CA-O 3.46Å; D188-H192 PolarHBondContact N-O 3.41Å; D188-H192 IonicContact OD1-CG 3.59Å; D188-H192 PolarHBondContact OD1-N 3.23Å; D188-H192 IonicContact OD1-ND1 2.66Å; D188-H192 IonicContact OD2-CG 3.17Å; D188-H192 IonicContact OD2-ND1 2.69Å; D188-H192 PolarHBondContact OD2-ND1 2.93Å; D188-H192 VanDerWaalsContact OD2-ND1 3.17Å; S190-H192 WeakPolarHBondContact CB-ND1 3.43Å; H192-A196 HydrophobicContact CB-CB 4.43Å; H192-L197 HydrophobicContact CB-CD1 4.42Å; H192-L197 HydrophobicContact CB-CD2 3.74Å; H192-L197 HydrophobicContact CB-CG 3.82Å; H192-N222 PolarHBondContact NE2-ND2 2.98Å
193	L	98.3	Very high	97.4	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.126	16%	0.164	C	C	.	.			trans	-86	160.6	163.1	-72.5	161	0	0	0	110.1	K186 E187 F195 A196 L197 T218	K186-L193 VanDerWaalsContact C-CD2 3.41Å; E187-L193 HydrophobicContact CG-CD2 4.22Å; E187-L193 HydrophobicContact CG-CG 4.08Å; L193-F195 PolarHBondContact O-N 3.48Å; L193-F195 VanDerWaalsContact O-N 3.12Å; L193-A196 WeakPolarHBondContact O-CB 3.4Å; L193-A196 PolarHBondContact O-N 2.95Å; L193-L197 PolarHBondContact O-N 3.42Å; L193-L197 VanDerWaalsContact O-N 3.11Å; L193-T218 HydrophobicContact CD1-CG2 3.63Å
194	P	98.2	Very high	97.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-51.1	-37.2	173.8	-26	33.3	0	0	0	113.5	M160 H161 A164 N185 L197 A198	M160-P194 HydrophobicContact CB-CG 4.28Å; M160-P194 HydrophobicContact CG-CB 3.99Å; M160-P194 HydrophobicContact CG-CG 3.77Å; M160-P194 HydrophobicContact SD-CB 4.33Å; M160-P194 HydrophobicContact SD-CG 3.84Å; H161-P194 WeakPolarHBondContact NE2-CD 3.47Å; A164-P194 HydrophobicContact CB-CB 3.87Å; A164-P194 WeakPolarHBondContact CB-O 3.33Å; N185-P194 WeakPolarHBondContact OD1-CD 3.39Å; P194-L197 PolarHBondContact O-N 3.3Å; P194-A198 WeakPolarHBondContact O-CB 3.49Å; P194-A198 PolarHBondContact O-N 2.81Å
195	F	98.6	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-41	175.8	-174.9	-100.2	0	0	0	113.1	L193 A198 A199 L207 L210 M211 A217 T218 P228 L244 F248	L193-F195 PolarHBondContact O-N 3.48Å; L193-F195 VanDerWaalsContact O-N 3.12Å; F195-A198 PolarHBondContact O-N 3.44Å; F195-A199 PolarHBondContact O-N 3.49Å; F195-A199 VanDerWaalsContact O-N 3.14Å; F195-L207 HydrophobicContact CD2-CD2 3.71Å; F195-L207 HydrophobicContact CE1-CD2 4.28Å; F195-L207 HydrophobicContact CE2-CB 4.34Å; F195-L207 HydrophobicContact CE2-CD2 3.4Å; F195-L207 VanDerWaalsContact CE2-CD2 3.4Å; F195-L207 HydrophobicContact CE2-CG 4.49Å; F195-L207 HydrophobicContact CG-CD2 4.27Å; F195-L207 HydrophobicContact CZ-CD2 3.73Å; F195-L207 WeakPolarHBondContact O-CD2 3.08Å; F195-L210 HydrophobicContact CB-CD1 4.06Å; F195-L210 HydrophobicContact CD2-CB 3.82Å; F195-L210 HydrophobicContact CD2-CD1 4.08Å; F195-L210 HydrophobicContact CE2-CB 4.48Å; F195-M211 HydrophobicContact CE2-CE 3.84Å; F195-M211 HydrophobicContact CE2-CG 3.89Å; F195-M211 HydrophobicContact CZ-CE 3.52Å; F195-M211 HydrophobicContact CZ-CG 4.3Å; F195-A217 HydrophobicContact CD2-CB 3.98Å; F195-A217 HydrophobicContact CE1-CB 4.18Å; F195-A217 HydrophobicContact CE2-CB 3.47Å; F195-A217 VanDerWaalsContact CE2-CB 3.47Å; F195-A217 HydrophobicContact CZ-CB 3.58Å; F195-T218 HydrophobicContact CD1-CG2 4.27Å; F195-T218 WeakPolarHBondContact CD1-O 3.48Å; F195-T218 WeakPolarHBondContact CE1-O 3.34Å; F195-P228 HydrophobicContact CD1-CB 4.43Å; F195-P228 HydrophobicContact CD1-CG 4.07Å; F195-P228 HydrophobicContact CE1-CB 4.28Å; F195-P228 HydrophobicContact CE1-CG 4.23Å; F195-L244 HydrophobicContact CE1-CD2 3.9Å; F195-L244 HydrophobicContact CZ-CD2 3.7Å; F195-F248 HydrophobicContact CE1-CE2 4.33Å; F195-F248 HydrophobicContact CE1-CZ 4.42Å; F195-F248 HydrophobicContact CZ-CE2 4.08Å; F195-F248 HydrophobicContact CZ-CZ 4.34Å
196	A	98.3	Very high	97.5	Very high	5 Å²	5	30.9 Å²	30.9	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-41.1	177.4	0	0	0	0	0	111.6	H192 L193 A198 A199 E200 P228 L231	H192-A196 HydrophobicContact CB-CB 4.43Å; L193-A196 WeakPolarHBondContact O-CB 3.4Å; L193-A196 PolarHBondContact O-N 2.95Å; A196-A198 VanDerWaalsContact C-N 3.33Å; A196-A198 PolarHBondContact O-N 3.34Å; A196-A199 WeakPolarHBondContact O-CB 3.29Å; A196-A199 PolarHBondContact O-N 3.25Å; A196-E200 PolarHBondContact O-N 2.58Å; A196-P228 HydrophobicContact CB-CG 3.96Å; A196-L231 HydrophobicContact CB-CD1 4Å
197	L	97.9	Very high	97.6	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-65.8	-35.6	175	-63.9	175.2	0	0	0	112.1	L157 H161 I165 H192 L193 P194 A199 E200 H201	L157-L197 HydrophobicContact CD2-CD1 4.04Å; H161-L197 HydrophobicContact CB-CD1 3.89Å; I165-L197 HydrophobicContact CD1-CD1 4.06Å; I165-L197 HydrophobicContact CG1-CB 3.91Å; I165-L197 HydrophobicContact CG1-CD1 3.99Å; I165-L197 HydrophobicContact CG1-CG 4.4Å; H192-L197 HydrophobicContact CB-CD1 4.42Å; H192-L197 HydrophobicContact CB-CD2 3.74Å; H192-L197 HydrophobicContact CB-CG 3.82Å; L193-L197 PolarHBondContact O-N 3.42Å; L193-L197 VanDerWaalsContact O-N 3.11Å; P194-L197 PolarHBondContact O-N 3.3Å; L197-A199 VanDerWaalsContact C-N 3.3Å; L197-A199 PolarHBondContact O-N 3.01Å; L197-E200 PolarHBondContact O-N 3.42Å; L197-H201 PolarHBondContact O-CD2 2.93Å; L197-H201 PolarHBondContact O-N 3.35Å; L197-H201 VanDerWaalsContact O-N 3.08Å
198	A	98.5	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.4	-40.4	173	0	0	0	0	0	111.4	P194 F195 A196 G202 S203 M206 L207	P194-A198 WeakPolarHBondContact O-CB 3.49Å; P194-A198 PolarHBondContact O-N 2.81Å; F195-A198 PolarHBondContact O-N 3.44Å; A196-A198 VanDerWaalsContact C-N 3.33Å; A196-A198 PolarHBondContact O-N 3.34Å; A198-G202 PolarHBondContact O-N 2.84Å; A198-S203 PolarHBondContact O-N 3.16Å; A198-M206 HydrophobicContact CB-CB 4.02Å; A198-M206 HydrophobicContact CB-CG 3.68Å; A198-L207 HydrophobicContact CB-CD2 3.81Å; A198-L207 HydrophobicContact CB-CG 4.04Å
199	A	98.4	Very high	97.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.9	-45.5	174.2	0	0	0	0	0	112.3	F195 A196 L197 H201 G202 L207 P228 A232 L244	F195-A199 PolarHBondContact O-N 3.49Å; F195-A199 VanDerWaalsContact O-N 3.14Å; A196-A199 WeakPolarHBondContact O-CB 3.29Å; A196-A199 PolarHBondContact O-N 3.25Å; L197-A199 VanDerWaalsContact C-N 3.3Å; L197-A199 PolarHBondContact O-N 3.01Å; A199-H201 PolarHBondContact O-N 2.8Å; A199-G202 PolarHBondContact O-N 2.71Å; A199-G202 VanDerWaalsContact O-N 3.15Å; A199-L207 HydrophobicContact CB-CD1 4.46Å; A199-L207 HydrophobicContact CB-CD2 4.13Å; A199-P228 HydrophobicContact CB-CB 3.73Å; A199-P228 WeakPolarHBondContact CB-O 3.49Å; A199-A232 HydrophobicContact CB-CB 4.27Å; A199-A232 WeakPolarHBondContact O-CA 3.46Å; A199-L244 HydrophobicContact CB-CD1 3.97Å
200	E	98.1	Very high	97.8	Very high	34 Å²	34	24 Å²	24	16%	0.159	13%	0.128	C	C	.	.	H	α-helix	trans	-57	-31.2	177.7	-172.8	163.4	-157.3	0	0	113.2	A196 L197 L231 R234 N235 H237	A196-E200 PolarHBondContact O-N 2.58Å; L197-E200 PolarHBondContact O-N 3.42Å; E200-L231 HydrophobicContact CB-CB 3.81Å; E200-L231 HydrophobicContact CB-CD1 4.23Å; E200-L231 HydrophobicContact CG-CB 4.18Å; E200-R234 IonicContact OE1-NH2 3.85Å; E200-R234 PolarHBondContact OE1-NH2 3.46Å; E200-N235 PolarHBondContact O-ND2 2.79Å; E200-H237 PolarHBondContact O-CD2 3.41Å; E200-H237 PolarHBondContact O-NE2 3.01Å
201	H	96.3	Very high	97.9	Very high	55 Å²	55	21.9 Å²	21.9	26%	0.255	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	5.2	-178.9	-67.9	-63.9	0	0	0	114.6	I165 L197 A199 S203 H237	I165-H201 WeakPolarHBondContact O-CB 3.41Å; L197-H201 PolarHBondContact O-CD2 2.93Å; L197-H201 PolarHBondContact O-N 3.35Å; L197-H201 VanDerWaalsContact O-N 3.08Å; A199-H201 PolarHBondContact O-N 2.8Å; H201-S203 VanDerWaalsContact C-N 3.28Å; H201-S203 PolarHBondContact O-N 3.16Å; H201-H237 VanDerWaalsContact C-CD2 3.48Å; H201-H237 VanDerWaalsContact C-NE2 3.28Å
202	G	97.3	Very high	97.6	Very high	23 Å²	23	29.3 Å²	29.3	24%	0.237	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	29.6	177.7	0	0	0	0	0	113.7	A198 A199 I204 H237	A198-G202 PolarHBondContact O-N 2.84Å; A199-G202 PolarHBondContact O-N 2.71Å; A199-G202 VanDerWaalsContact O-N 3.15Å; G202-I204 PolarHBondContact O-N 3.11Å; G202-H237 VanDerWaalsContact CA-CG 3.5Å; G202-H237 PolarHBondContact N-CD2 2.95Å; G202-H237 PolarHBondContact N-NE2 2.95Å
203	S	97.6	Very high	97.5	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.042	17%	0.168	C	C	.	.			trans	-80.4	79.5	-179	-63.7	0	0	0	0	110.4	A164 A198 H201 E205 M206 L207	A164-S203 PolarHBondContact O-OG 3.03Å; A198-S203 PolarHBondContact O-N 3.16Å; H201-S203 VanDerWaalsContact C-N 3.28Å; H201-S203 PolarHBondContact O-N 3.16Å; S203-E205 PolarHBondContact O-N 3.36Å; S203-M206 WeakPolarHBondContact O-CB 3.3Å; S203-M206 PolarHBondContact O-N 3.45Å; S203-L207 WeakPolarHBondContact O-CG 3.18Å; S203-L207 PolarHBondContact O-N 3.32Å
204	I	97.6	Very high	97.4	Very high	22 Å²	22	32.9 Å²	32.9	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-44.2	-171	-55.8	-53	0	0	0	112.9	G202 M206 L207 K208 D239 A240 L243	G202-I204 PolarHBondContact O-N 3.11Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.19Å; I204-L207 HydrophobicContact CD1-CD1 4.41Å; I204-L207 PolarHBondContact O-N 2.83Å; I204-K208 HydrophobicContact CG2-CD 4.17Å; I204-K208 WeakPolarHBondContact O-CG 3.36Å; I204-K208 PolarHBondContact O-N 2.89Å; I204-D239 VanDerWaalsContact CD1-C 3.49Å; I204-D239 HydrophobicContact CD1-CB 3.65Å; I204-D239 HydrophobicContact CG1-CB 3.87Å; I204-A240 VanDerWaalsContact CD1-CA 3.44Å; I204-A240 HydrophobicContact CD1-CB 3.63Å; I204-L243 HydrophobicContact CG2-CD2 4.38Å
205	E	98.1	Very high	97.2	Very high	108 Å²	108	39.5 Å²	39.5	51%	0.505	20%	0.203	S	C	.	.	H	α-helix	trans	-63.3	-40.6	178.9	-66.7	70.7	-157.8	0	0	110.7	N167 T169 S203 K208 M209	N167-E205 PolarHBondContact ND2-OE2 3.4Å; T169-E205 HydrophobicContact CG2-CB 4Å; S203-E205 PolarHBondContact O-N 3.36Å; E205-K208 PolarHBondContact O-N 3.48Å; E205-M209 VanDerWaalsContact O-CB 3.26Å; E205-M209 WeakPolarHBondContact O-CB 3.37Å; E205-M209 PolarHBondContact O-N 2.98Å
206	M	98.5	Very high	97.1	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-45.5	172.9	-173.9	61.7	59.7	0	0	112.2	A164 N167 T169 V172 A198 S203 I204 K208 M209 L210	A164-M206 HydrophobicContact CB-CG 4.02Å; A164-M206 HydrophobicContact CB-SD 4.36Å; N167-M206 WeakPolarHBondContact OD1-CB 3.29Å; N167-M206 PolarHBondContact OD1-N 3.12Å; T169-M206 HydrophobicContact CG2-CB 4.48Å; T169-M206 HydrophobicContact CG2-CE 3.89Å; V172-M206 HydrophobicContact CB-CE 4.1Å; V172-M206 HydrophobicContact CB-SD 4.09Å; V172-M206 HydrophobicContact CG1-SD 4.22Å; V172-M206 HydrophobicContact CG2-CE 3.54Å; V172-M206 HydrophobicContact CG2-SD 3.69Å; A198-M206 HydrophobicContact CB-CB 4.02Å; A198-M206 HydrophobicContact CB-CG 3.68Å; S203-M206 WeakPolarHBondContact O-CB 3.3Å; S203-M206 PolarHBondContact O-N 3.45Å; I204-M206 VanDerWaalsContact C-N 3.3Å; I204-M206 PolarHBondContact O-N 3.19Å; M206-K208 PolarHBondContact O-N 3.45Å; M206-M209 PolarHBondContact O-N 3.23Å; M206-L210 HydrophobicContact CG-CD1 3.94Å; M206-L210 HydrophobicContact CG-CG 4.39Å; M206-L210 WeakPolarHBondContact O-CB 3.45Å; M206-L210 VanDerWaalsContact O-CG 3.31Å; M206-L210 WeakPolarHBondContact O-CG 3.44Å; M206-L210 PolarHBondContact O-N 3.17Å; M206-L210 HydrophobicContact SD-CD1 4.09Å; M206-L210 HydrophobicContact SD-CG 4.11Å
207	L	98.6	Very high	97	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-49.4	176.7	-72.6	174.3	0	0	0	111.3	F195 A198 A199 S203 I204 M209 L210 M211 A240 L243	F195-L207 HydrophobicContact CD2-CD2 3.71Å; F195-L207 HydrophobicContact CE1-CD2 4.28Å; F195-L207 HydrophobicContact CE2-CB 4.34Å; F195-L207 HydrophobicContact CE2-CD2 3.4Å; F195-L207 VanDerWaalsContact CE2-CD2 3.4Å; F195-L207 HydrophobicContact CE2-CG 4.49Å; F195-L207 HydrophobicContact CG-CD2 4.27Å; F195-L207 HydrophobicContact CZ-CD2 3.73Å; F195-L207 WeakPolarHBondContact O-CD2 3.08Å; A198-L207 HydrophobicContact CB-CD2 3.81Å; A198-L207 HydrophobicContact CB-CG 4.04Å; A199-L207 HydrophobicContact CB-CD1 4.46Å; A199-L207 HydrophobicContact CB-CD2 4.13Å; S203-L207 WeakPolarHBondContact O-CG 3.18Å; S203-L207 PolarHBondContact O-N 3.32Å; I204-L207 HydrophobicContact CD1-CD1 4.41Å; I204-L207 PolarHBondContact O-N 2.83Å; L207-M209 PolarHBondContact O-N 2.81Å; L207-L210 PolarHBondContact O-N 3.33Å; L207-M211 WeakPolarHBondContact O-CB 3.38Å; L207-M211 WeakPolarHBondContact O-CG 3.48Å; L207-M211 PolarHBondContact O-N 2.94Å; L207-A240 HydrophobicContact CD1-CB 3.85Å; L207-L243 HydrophobicContact CB-CD2 3.72Å; L207-L243 HydrophobicContact CD1-CD2 4.17Å
208	K	98.3	Very high	97	Very high	109 Å²	109	42.7 Å²	42.7	47%	0.474	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-43	177.9	-70.7	174.7	179.4	172.9	0	112.2	I204 E205 M206 M211 E212 L243	I204-K208 HydrophobicContact CG2-CD 4.17Å; I204-K208 WeakPolarHBondContact O-CG 3.36Å; I204-K208 PolarHBondContact O-N 2.89Å; E205-K208 PolarHBondContact O-N 3.48Å; M206-K208 PolarHBondContact O-N 3.45Å; K208-M211 PolarHBondContact O-N 2.89Å; K208-E212 PolarHBondContact O-N 3.14Å; K208-L243 HydrophobicContact CG-CD1 4.41Å; K208-L243 HydrophobicContact CG-CD2 3.89Å
209	M	98	Very high	96.9	Very high	30 Å²	30	43.8 Å²	43.8	15%	0.148	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-43	176.9	171.1	176.4	-82.2	0	0	111.9	T169 V172 E173 E205 M206 L207 P213 Y214	T169-M209 VanDerWaalsContact CB-CE 3.47Å; T169-M209 HydrophobicContact CG2-CB 4.42Å; T169-M209 HydrophobicContact CG2-CE 4.01Å; T169-M209 HydrophobicContact CG2-SD 3.91Å; T169-M209 VanDerWaalsContact O-SD 3.4Å; V172-M209 HydrophobicContact CB-SD 4.2Å; V172-M209 HydrophobicContact CG1-SD 4.17Å; E173-M209 HydrophobicContact CB-CE 4.31Å; E205-M209 VanDerWaalsContact O-CB 3.26Å; E205-M209 WeakPolarHBondContact O-CB 3.37Å; E205-M209 PolarHBondContact O-N 2.98Å; M206-M209 PolarHBondContact O-N 3.23Å; L207-M209 PolarHBondContact O-N 2.81Å; M209-P213 WeakPolarHBondContact O-CD 3.22Å; M209-P213 WeakPolarHBondContact O-CG 3.48Å; M209-Y214 HydrophobicContact CG-CD2 3.68Å; M209-Y214 HydrophobicContact CG-CE2 3.41Å; M209-Y214 VanDerWaalsContact CG-CE2 3.41Å; M209-Y214 WeakPolarHBondContact O-CD2 3.47Å; M209-Y214 HydrophobicContact SD-CE2 3.87Å
210	L	97.6	Very high	96.8	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-73.8	-28.7	179.3	-68.7	175.4	0	0	0	112.4	V172 F195 M206 L207 N215 M216 A217	V172-L210 HydrophobicContact CG1-CD2 4.09Å; F195-L210 HydrophobicContact CB-CD1 4.06Å; F195-L210 HydrophobicContact CD2-CB 3.82Å; F195-L210 HydrophobicContact CD2-CD1 4.08Å; F195-L210 HydrophobicContact CE2-CB 4.48Å; M206-L210 HydrophobicContact CG-CD1 3.94Å; M206-L210 HydrophobicContact CG-CG 4.39Å; M206-L210 WeakPolarHBondContact O-CB 3.45Å; M206-L210 VanDerWaalsContact O-CG 3.31Å; M206-L210 WeakPolarHBondContact O-CG 3.44Å; M206-L210 PolarHBondContact O-N 3.17Å; M206-L210 HydrophobicContact SD-CD1 4.09Å; M206-L210 HydrophobicContact SD-CG 4.11Å; L207-L210 PolarHBondContact O-N 3.33Å; L210-N215 PolarHBondContact O-N 3.42Å; L210-M216 HydrophobicContact CB-CB 4.43Å; L210-M216 HydrophobicContact CD2-CB 4.26Å; L210-M216 HydrophobicContact CD2-SD 4.36Å; L210-M216 PolarHBondContact O-N 2.98Å; L210-A217 PolarHBondContact O-N 3.12Å
211	M	96.5	Very high	96.8	Very high	17 Å²	17	50.5 Å²	50.5	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-64.8	174	-72.3	165.1	174.3	0	0	112.2	F195 L207 K208 N215 A217 L243 L244 F248	F195-M211 HydrophobicContact CE2-CE 3.84Å; F195-M211 HydrophobicContact CE2-CG 3.89Å; F195-M211 HydrophobicContact CZ-CE 3.52Å; F195-M211 HydrophobicContact CZ-CG 4.3Å; L207-M211 WeakPolarHBondContact O-CB 3.38Å; L207-M211 WeakPolarHBondContact O-CG 3.48Å; L207-M211 PolarHBondContact O-N 2.94Å; K208-M211 PolarHBondContact O-N 2.89Å; M211-N215 WeakPolarHBondContact O-CA 3.19Å; M211-N215 PolarHBondContact O-N 3.5Å; M211-A217 HydrophobicContact CB-CB 4.11Å; M211-A217 HydrophobicContact CG-CB 3.41Å; M211-A217 VanDerWaalsContact CG-CB 3.41Å; M211-L243 HydrophobicContact CE-CD2 4.13Å; M211-L243 HydrophobicContact CE-CG 3.99Å; M211-L243 HydrophobicContact SD-CD1 4.28Å; M211-L243 HydrophobicContact SD-CD2 4.09Å; M211-L243 HydrophobicContact SD-CG 4.12Å; M211-L244 HydrophobicContact CE-CD2 3.92Å; M211-F248 HydrophobicContact CE-CE2 3.93Å
212	E	92.6	Very high	96.8	Very high	161 Å²	161	48.5 Å²	48.5	75%	0.752	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-59.3	-160.9	-66.1	-62.4	143	0	0	112.3	K208 Y214	K208-E212 PolarHBondContact O-N 3.14Å; E212-Y214 VanDerWaalsContact C-N 3.32Å; E212-Y214 PolarHBondContact O-N 2.94Å
213	P	93.8	Very high	96.8	Very high	86 Å²	86	53.3 Å²	53.3	56%	0.558	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.4	176.9	-25.1	26.8	0	0	0	115.6	M209	M209-P213 WeakPolarHBondContact O-CD 3.22Å; M209-P213 WeakPolarHBondContact O-CG 3.48Å
214	Y	95.9	Very high	96.8	Very high	27 Å²	27	58 Å²	58	11%	0.106	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-10.4	-163.6	-60.6	-53.1	0	0	0	116	I176 N177 K182 M209 E212 M216	I176-Y214 HydrophobicContact CB-CD1 4.42Å; I176-Y214 HydrophobicContact CB-CE1 4.06Å; I176-Y214 HydrophobicContact CD1-CD1 3.94Å; I176-Y214 HydrophobicContact CD1-CD2 3.52Å; I176-Y214 HydrophobicContact CD1-CE1 4.06Å; I176-Y214 HydrophobicContact CD1-CE2 3.65Å; I176-Y214 HydrophobicContact CD1-CG 3.7Å; I176-Y214 HydrophobicContact CG2-CD1 3.66Å; I176-Y214 HydrophobicContact CG2-CE1 3.56Å; I176-Y214 HydrophobicContact CG2-CG 4.47Å; N177-Y214 PolarHBondContact ND2-OH 3Å; K182-Y214 PolarHBondContact NZ-O 3.38Å; M209-Y214 HydrophobicContact CG-CD2 3.68Å; M209-Y214 HydrophobicContact CG-CE2 3.41Å; M209-Y214 VanDerWaalsContact CG-CE2 3.41Å; M209-Y214 WeakPolarHBondContact O-CD2 3.47Å; M209-Y214 HydrophobicContact SD-CE2 3.87Å; E212-Y214 VanDerWaalsContact C-N 3.32Å; E212-Y214 PolarHBondContact O-N 2.94Å; Y214-M216 VanDerWaalsContact C-N 3.3Å; Y214-M216 HydrophobicContact CG-CE 4.34Å; Y214-M216 WeakPolarHBondContact O-CG 3.49Å; Y214-M216 PolarHBondContact O-N 3.04Å
215	N	95.6	Very high	96.8	Very high	140 Å²	140	57.5 Å²	57.5	75%	0.749	29%	0.288	S	S	*	.			trans	47.7	51.7	-178.9	-167.8	29.4	0	0	0	112.3	L210 M211	L210-N215 PolarHBondContact O-N 3.42Å; M211-N215 WeakPolarHBondContact O-CA 3.19Å; M211-N215 PolarHBondContact O-N 3.5Å
216	M	96.4	Very high	96.8	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.049	26%	0.264	C	S	.	.			trans	-114.8	3.9	178.8	-59.9	-157.7	-152.1	0	0	112.9	I176 K182 N185 L210 Y214	I176-M216 HydrophobicContact CD1-CE 3.41Å; I176-M216 VanDerWaalsContact CD1-CE 3.41Å; I176-M216 HydrophobicContact CG1-CE 3.77Å; I176-M216 HydrophobicContact CG2-CE 4.34Å; K182-M216 HydrophobicContact CB-CE 4.39Å; K182-M216 HydrophobicContact CD-CE 3.55Å; K182-M216 HydrophobicContact CG-CE 3.54Å; K182-M216 HydrophobicContact CG-SD 4.28Å; N185-M216 HydrophobicContact CB-SD 3.75Å; N185-M216 PolarHBondContact ND2-SD 3.08Å; L210-M216 HydrophobicContact CB-CB 4.43Å; L210-M216 HydrophobicContact CD2-CB 4.26Å; L210-M216 HydrophobicContact CD2-SD 4.36Å; L210-M216 PolarHBondContact O-N 2.98Å; Y214-M216 VanDerWaalsContact C-N 3.3Å; Y214-M216 HydrophobicContact CG-CE 4.34Å; Y214-M216 WeakPolarHBondContact O-CG 3.49Å; Y214-M216 PolarHBondContact O-N 3.04Å
217	A	96.3	Very high	96.8	Very high	27 Å²	27	52.8 Å²	52.8	22%	0.223	27%	0.266	C	S	.	.			trans	-69.2	142.8	176.7	0	0	0	0	0	111.2	F195 L210 M211 F248	F195-A217 HydrophobicContact CD2-CB 3.98Å; F195-A217 HydrophobicContact CE1-CB 4.18Å; F195-A217 HydrophobicContact CE2-CB 3.47Å; F195-A217 VanDerWaalsContact CE2-CB 3.47Å; F195-A217 HydrophobicContact CZ-CB 3.58Å; L210-A217 PolarHBondContact O-N 3.12Å; M211-A217 HydrophobicContact CB-CB 4.11Å; M211-A217 HydrophobicContact CG-CB 3.41Å; M211-A217 VanDerWaalsContact CG-CB 3.41Å; A217-F248 HydrophobicContact CB-CE2 4.47Å; A217-F248 HydrophobicContact CB-CZ 3.82Å
218	T	96.6	Very high	96.8	Very high	40 Å²	40	52.8 Å²	52.8	25%	0.245	27%	0.266	C	S	.	.			trans	-157.8	148.7	-176.3	179.2	0	0	0	0	110.4	L193 F195 K220 P228	L193-T218 HydrophobicContact CD1-CG2 3.63Å; F195-T218 HydrophobicContact CD1-CG2 4.27Å; F195-T218 WeakPolarHBondContact CD1-O 3.48Å; F195-T218 WeakPolarHBondContact CE1-O 3.34Å; T218-K220 HydrophobicContact CG2-CB 4.49Å; T218-K220 WeakPolarHBondContact OG1-CB 3.47Å; T218-K220 PolarHBondContact OG1-N 3.41Å; T218-P228 WeakPolarHBondContact O-CG 3.33Å
219	M	97.4	Very high	96.8	Very high	24 Å²	24	47.8 Å²	47.8	12%	0.118	24%	0.244	C	C	.	.			trans	-99.6	11.1	169.8	-77.9	-65.5	169.3	0	0	113.1	T227 P228 L229 L244 F248	M219-T227 WeakPolarHBondContact O-CB 3.49Å; M219-T227 WeakPolarHBondContact O-CG2 3.43Å; M219-P228 HydrophobicContact SD-CB 4.22Å; M219-P228 HydrophobicContact SD-CG 4.27Å; M219-L229 HydrophobicContact SD-CB 4.37Å; M219-L244 HydrophobicContact CE-CB 3.69Å; M219-L244 HydrophobicContact CE-CD1 4.26Å; M219-L244 HydrophobicContact CE-CD2 3.48Å; M219-L244 VanDerWaalsContact CE-CD2 3.48Å; M219-L244 HydrophobicContact CE-CG 3.96Å; M219-F248 HydrophobicContact CE-CB 3.94Å; M219-F248 HydrophobicContact CE-CD1 4.42Å; M219-F248 HydrophobicContact CE-CD2 3.19Å; M219-F248 HydrophobicContact CE-CE2 3.68Å; M219-F248 HydrophobicContact CE-CG 3.61Å; M219-F248 HydrophobicContact CE-CZ 4.47Å; M219-F248 HydrophobicContact CG-CB 4.03Å; M219-F248 HydrophobicContact CG-CD1 3.6Å; M219-F248 HydrophobicContact CG-CD2 4.08Å; M219-F248 HydrophobicContact CG-CE1 4Å; M219-F248 HydrophobicContact CG-CE2 4.41Å; M219-F248 HydrophobicContact CG-CG 3.64Å; M219-F248 HydrophobicContact CG-CZ 4.37Å
220	K	95.9	Very high	96.8	Very high	113 Å²	113	46.4 Å²	46.4	49%	0.491	24%	0.238	S	C	.	.			trans	-55.2	129.5	-178.6	-174.1	-179.8	-178.4	-174.5	0	110.5	E187 T218	E187-K220 VanDerWaalsContact OE1-CE 3.22Å; E187-K220 WeakPolarHBondContact OE1-CE 3.26Å; E187-K220 IonicContact OE1-NZ 2.57Å; E187-K220 PolarHBondContact OE1-NZ 3.28Å; T218-K220 HydrophobicContact CG2-CB 4.49Å; T218-K220 WeakPolarHBondContact OG1-CB 3.47Å; T218-K220 PolarHBondContact OG1-N 3.41Å
221	P	97.6	Very high	96.9	Very high	61 Å²	61	46.4 Å²	46.4	40%	0.396	24%	0.237	S	C	.	.			trans	-73	153.5	179.1	29	-34.8	0	0	0	112.4	G225 D226 T227	P221-G225 WeakPolarHBondContact CB-O 3.44Å; P221-D226 WeakPolarHBondContact CA-O 3.34Å; P221-T227 HydrophobicContact CB-CG2 4.28Å
222	N	97.1	Very high	97	Very high	13 Å²	13	45.6 Å²	45.6	7%	0.07	23%	0.233	C	C	.	.			trans	-74.5	-173.5	169.7	74.9	5.6	0	0	0	111.6	H192 R224 G225 D226	H192-N222 PolarHBondContact NE2-ND2 2.98Å; N222-R224 PolarHBondContact O-N 3.18Å; N222-R224 WeakPolarHBondContact OD1-CA 3.43Å; N222-R224 WeakPolarHBondContact OD1-CB 3.36Å; N222-R224 PolarHBondContact OD1-N 3.15Å; N222-G225 PolarHBondContact O-N 3.19Å; N222-G225 PolarHBondContact OD1-N 3.49Å; N222-G225 VanDerWaalsContact OD1-N 3.13Å; N222-D226 PolarHBondContact N-O 2.87Å; N222-D226 PolarHBondContact OD1-N 2.82Å
223	K	97.4	Very high	97.3	Very high	125 Å²	125	37.9 Å²	37.9	54%	0.543	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.9	179.3	-70.1	-177.9	-177.3	178.7	0	115	Q189 S190 M256	Q189-K223 WeakPolarHBondContact O-CD 3.31Å; Q189-K223 WeakPolarHBondContact O-CE 3.44Å; Q189-K223 PolarHBondContact O-NZ 3.36Å; S190-K223 VanDerWaalsContact O-CB 3.27Å; S190-K223 WeakPolarHBondContact O-CB 3.37Å; S190-K223 WeakPolarHBondContact O-CG 3.29Å; S190-K223 PolarHBondContact O-N 2.89Å; K223-M256 WeakPolarHBondContact O-CE 3.41Å
224	R	96.6	Very high	97.5	Very high	103 Å²	103	35.8 Å²	35.8	39%	0.389	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-1.9	171.6	-66.3	-164.9	-57.8	-127.1	-6.3	112.9	N222 D226 N255 M256	N222-R224 PolarHBondContact O-N 3.18Å; N222-R224 WeakPolarHBondContact OD1-CA 3.43Å; N222-R224 WeakPolarHBondContact OD1-CB 3.36Å; N222-R224 PolarHBondContact OD1-N 3.15Å; R224-D226 VanDerWaalsContact C-N 3.33Å; R224-D226 IonicContact CZ-OD2 2.75Å; R224-D226 IonicContact NE-OD2 2.71Å; R224-D226 PolarHBondContact NE-OD2 3.27Å; R224-D226 IonicContact NH2-OD2 3.09Å; R224-D226 PolarHBondContact NH2-OD2 2.91Å; R224-N255 WeakPolarHBondContact O-CB 3.37Å; R224-M256 WeakPolarHBondContact O-CB 3.31Å; R224-M256 VanDerWaalsContact O-CG 3.3Å; R224-M256 WeakPolarHBondContact O-CG 3.29Å; R224-M256 PolarHBondContact O-N 3.17Å
225	G	97.6	Very high	97.5	Very high	13 Å²	13	37.7 Å²	37.7	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	85.3	0.2	-172.6	0	0	0	0	0	114.1	P221 N222 T227	P221-G225 WeakPolarHBondContact CB-O 3.44Å; N222-G225 PolarHBondContact O-N 3.19Å; N222-G225 PolarHBondContact OD1-N 3.49Å; N222-G225 VanDerWaalsContact OD1-N 3.13Å; G225-T227 PolarHBondContact O-N 3.46Å
226	D	98.3	Very high	97.6	Very high	2 Å²	2	32 Å²	32	1%	0.011	17%	0.165	C	C	.	.			trans	-72.6	120.4	179.5	-60.5	-42	0	0	0	109.4	P221 N222 R224 H230 L231 R234 N255 Q264	P221-D226 WeakPolarHBondContact CA-O 3.34Å; N222-D226 PolarHBondContact N-O 2.87Å; N222-D226 PolarHBondContact OD1-N 2.82Å; R224-D226 VanDerWaalsContact C-N 3.33Å; R224-D226 IonicContact CZ-OD2 2.75Å; R224-D226 IonicContact NE-OD2 2.71Å; R224-D226 PolarHBondContact NE-OD2 3.27Å; R224-D226 IonicContact NH2-OD2 3.09Å; R224-D226 PolarHBondContact NH2-OD2 2.91Å; D226-H230 HydrophobicContact CB-CB 3.95Å; D226-L231 HydrophobicContact CB-CD2 3.75Å; D226-L231 HydrophobicContact CB-CG 4.16Å; D226-R234 IonicContact OD2-NH1 2.88Å; D226-R234 PolarHBondContact OD2-NH1 3.48Å; D226-R234 VanDerWaalsContact OD2-NH1 3.11Å; D226-N255 PolarHBondContact OD1-ND2 3.06Å; D226-Q264 PolarHBondContact OD1-NE2 2.95Å
227	T	98.6	Very high	97.7	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.043	18%	0.175	C	C	.	.			trans	-78.4	165.8	168.4	74.5	0	0	0	0	110.7	M219 P221 G225 L229 H230 L231 E253	M219-T227 WeakPolarHBondContact O-CB 3.49Å; M219-T227 WeakPolarHBondContact O-CG2 3.43Å; P221-T227 HydrophobicContact CB-CG2 4.28Å; G225-T227 PolarHBondContact O-N 3.46Å; T227-L229 PolarHBondContact O-N 3.12Å; T227-L229 VanDerWaalsContact O-N 3.12Å; T227-L229 PolarHBondContact OG1-N 3.2Å; T227-H230 PolarHBondContact N-ND1 2.94Å; T227-H230 VanDerWaalsContact N-ND1 3.19Å; T227-H230 VanDerWaalsContact O-CB 3.31Å; T227-H230 WeakPolarHBondContact O-CB 3.42Å; T227-H230 PolarHBondContact O-N 2.91Å; T227-H230 PolarHBondContact OG1-ND1 3.4Å; T227-L231 PolarHBondContact O-N 3.11Å; T227-L231 VanDerWaalsContact O-N 3.12Å; T227-E253 HydrophobicContact CG2-CB 4.33Å
228	P	98.6	Very high	97.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-53.5	-32.2	172.9	-29.9	38.7	0	0	0	114.1	F195 A196 A199 T218 M219 L231 A232 L244	F195-P228 HydrophobicContact CD1-CB 4.43Å; F195-P228 HydrophobicContact CD1-CG 4.07Å; F195-P228 HydrophobicContact CE1-CB 4.28Å; F195-P228 HydrophobicContact CE1-CG 4.23Å; A196-P228 HydrophobicContact CB-CG 3.96Å; A199-P228 HydrophobicContact CB-CB 3.73Å; A199-P228 WeakPolarHBondContact CB-O 3.49Å; T218-P228 WeakPolarHBondContact O-CG 3.33Å; M219-P228 HydrophobicContact SD-CB 4.22Å; M219-P228 HydrophobicContact SD-CG 4.27Å; P228-L231 PolarHBondContact O-N 3.18Å; P228-A232 WeakPolarHBondContact O-CB 3.42Å; P228-A232 PolarHBondContact O-N 3.34Å; P228-L244 HydrophobicContact CB-CD1 4.2Å
229	L	98.7	Very high	97.9	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-65.8	-41.6	175.3	-175.1	63.3	0	0	0	111.9	M219 T227 A232 A233 V241 L244 L245 A261 L277	M219-L229 HydrophobicContact SD-CB 4.37Å; T227-L229 PolarHBondContact O-N 3.12Å; T227-L229 VanDerWaalsContact O-N 3.12Å; T227-L229 PolarHBondContact OG1-N 3.2Å; L229-A232 PolarHBondContact O-N 3.36Å; L229-A233 WeakPolarHBondContact O-CB 3.41Å; L229-A233 PolarHBondContact O-N 2.73Å; L229-V241 HydrophobicContact CD1-CB 4.48Å; L229-V241 HydrophobicContact CD1-CG1 4.1Å; L229-V241 HydrophobicContact CD1-CG2 4.49Å; L229-L244 HydrophobicContact CD1-CB 4.15Å; L229-L244 HydrophobicContact CD1-CD1 4.46Å; L229-L245 HydrophobicContact CD1-CD2 4.02Å; L229-L245 HydrophobicContact CD1-CG 4.01Å; L229-L245 HydrophobicContact CD2-CD2 3.79Å; L229-A261 HydrophobicContact CB-CB 4.47Å; L229-A261 HydrophobicContact CD2-CB 4.13Å; L229-A261 HydrophobicContact CG-CB 3.77Å; L229-L277 HydrophobicContact CD1-CD2 4.15Å; L229-L277 HydrophobicContact CD2-CD2 4.18Å; L229-L277 HydrophobicContact CG-CD2 4.32Å
230	H	98.7	Very high	98	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-50.6	173.1	-68.9	81.6	0	0	0	110.8	D226 T227 A232 A233 R234 E253 E259 A261 Q264	D226-H230 HydrophobicContact CB-CB 3.95Å; T227-H230 PolarHBondContact N-ND1 2.94Å; T227-H230 VanDerWaalsContact N-ND1 3.19Å; T227-H230 VanDerWaalsContact O-CB 3.31Å; T227-H230 WeakPolarHBondContact O-CB 3.42Å; T227-H230 PolarHBondContact O-N 2.91Å; T227-H230 PolarHBondContact OG1-ND1 3.4Å; H230-A232 PolarHBondContact O-N 3.26Å; H230-A233 PolarHBondContact O-N 2.85Å; H230-R234 VanDerWaalsContact O-CB 3.29Å; H230-R234 WeakPolarHBondContact O-CB 3.43Å; H230-R234 PolarHBondContact O-N 3.49Å; H230-E253 PolarHBondContact CE1-O 3.14Å; H230-E253 PolarHBondContact NE2-O 3Å; H230-E253 VanDerWaalsContact NE2-O 3.11Å; H230-E259 PolarHBondContact NE2-O 3.08Å; H230-A261 PolarHBondContact CD2-N 2.95Å; H230-A261 PolarHBondContact NE2-N 3.05Å; H230-Q264 PolarHBondContact O-OE1 2.81Å
231	L	98.4	Very high	98.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-42	-177.1	-58.6	175.5	0	0	0	112.4	A196 E200 D226 T227 P228 N235	A196-L231 HydrophobicContact CB-CD1 4Å; E200-L231 HydrophobicContact CB-CB 3.81Å; E200-L231 HydrophobicContact CB-CD1 4.23Å; E200-L231 HydrophobicContact CG-CB 4.18Å; D226-L231 HydrophobicContact CB-CD2 3.75Å; D226-L231 HydrophobicContact CB-CG 4.16Å; T227-L231 PolarHBondContact O-N 3.11Å; T227-L231 VanDerWaalsContact O-N 3.12Å; P228-L231 PolarHBondContact O-N 3.18Å; L231-N235 PolarHBondContact O-N 3.24Å; L231-N235 PolarHBondContact O-ND2 3.37Å
232	A	98.6	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-44.4	176.2	0	0	0	0	0	112	A199 P228 L229 H230 N235 G236 H237 A240 V241 L244	A199-A232 HydrophobicContact CB-CB 4.27Å; A199-A232 WeakPolarHBondContact O-CA 3.46Å; P228-A232 WeakPolarHBondContact O-CB 3.42Å; P228-A232 PolarHBondContact O-N 3.34Å; L229-A232 PolarHBondContact O-N 3.36Å; H230-A232 PolarHBondContact O-N 3.26Å; A232-N235 PolarHBondContact O-N 3.49Å; A232-G236 PolarHBondContact O-N 2.66Å; A232-H237 HydrophobicContact CB-CB 4.43Å; A232-H237 PolarHBondContact O-N 3.12Å; A232-A240 HydrophobicContact CB-CB 3.96Å; A232-V241 HydrophobicContact CB-CG2 3.85Å; A232-L244 HydrophobicContact CB-CD1 4.07Å
233	A	98.6	Very high	98.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.7	-46.4	-178.7	0	0	0	0	0	112.1	L229 H230 N235 G236 V241 A261 A265 L277	L229-A233 WeakPolarHBondContact O-CB 3.41Å; L229-A233 PolarHBondContact O-N 2.73Å; H230-A233 PolarHBondContact O-N 2.85Å; A233-N235 VanDerWaalsContact C-N 3.26Å; A233-N235 PolarHBondContact O-N 3.38Å; A233-G236 PolarHBondContact O-N 3.15Å; A233-G236 VanDerWaalsContact O-N 3.15Å; A233-V241 HydrophobicContact CB-CG2 4.07Å; A233-A261 HydrophobicContact CB-CB 3.98Å; A233-A261 WeakPolarHBondContact CB-O 3.45Å; A233-A265 HydrophobicContact CB-CB 4.09Å; A233-L277 HydrophobicContact CB-CD1 3.96Å
234	R	98.3	Very high	98.3	Very high	41 Å²	41	26.6 Å²	26.6	16%	0.155	14%	0.135	C	C	.	.	H	α-helix	trans	-54.9	-41.1	175.9	-176	174.8	69.5	-147.3	1	112.6	E200 D226 H230 Q264 N268	E200-R234 IonicContact OE1-NH2 3.85Å; E200-R234 PolarHBondContact OE1-NH2 3.46Å; D226-R234 IonicContact OD2-NH1 2.88Å; D226-R234 PolarHBondContact OD2-NH1 3.48Å; D226-R234 VanDerWaalsContact OD2-NH1 3.11Å; H230-R234 VanDerWaalsContact O-CB 3.29Å; H230-R234 WeakPolarHBondContact O-CB 3.43Å; H230-R234 PolarHBondContact O-N 3.49Å; R234-Q264 HydrophobicContact CB-CB 4.06Å; R234-Q264 HydrophobicContact CG-CB 4.47Å; R234-N268 WeakPolarHBondContact O-CB 3.4Å
235	N	96.4	Very high	98.3	Very high	67 Å²	67	22.2 Å²	22.2	36%	0.358	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.8	-176.3	-71	-74	0	0	0	114	E200 L231 A232 A233	E200-N235 PolarHBondContact O-ND2 2.79Å; L231-N235 PolarHBondContact O-N 3.24Å; L231-N235 PolarHBondContact O-ND2 3.37Å; A232-N235 PolarHBondContact O-N 3.49Å; A233-N235 VanDerWaalsContact C-N 3.26Å; A233-N235 PolarHBondContact O-N 3.38Å
236	G	97.8	Very high	98.3	Very high	21 Å²	21	29.1 Å²	29.1	22%	0.216	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	26.1	175.3	0	0	0	0	0	114.4	A232 A233 L238 Q270 C273	A232-G236 PolarHBondContact O-N 2.66Å; A233-G236 PolarHBondContact O-N 3.15Å; A233-G236 VanDerWaalsContact O-N 3.15Å; G236-L238 PolarHBondContact O-N 3.12Å; G236-L238 VanDerWaalsContact O-N 3.12Å; G236-Q270 VanDerWaalsContact CA-CD 3.43Å; G236-Q270 VanDerWaalsContact CA-OE1 3.28Å; G236-C273 VanDerWaalsContact C-SG 3.56Å
237	H	98.5	Very high	98.2	Very high	56 Å²	56	31.8 Å²	31.8	26%	0.259	17%	0.167	S	C	.	.			trans	-87.3	75	-178.5	-64.1	-37.2	0	0	0	111.4	E200 H201 G202 A232 D239 A240 V241	E200-H237 PolarHBondContact O-CD2 3.41Å; E200-H237 PolarHBondContact O-NE2 3.01Å; H201-H237 VanDerWaalsContact C-CD2 3.48Å; H201-H237 VanDerWaalsContact C-NE2 3.28Å; G202-H237 VanDerWaalsContact CA-CG 3.5Å; G202-H237 PolarHBondContact N-CD2 2.95Å; G202-H237 PolarHBondContact N-NE2 2.95Å; A232-H237 HydrophobicContact CB-CB 4.43Å; A232-H237 PolarHBondContact O-N 3.12Å; H237-D239 PolarHBondContact O-N 2.85Å; H237-A240 HydrophobicContact CB-CB 3.92Å; H237-A240 WeakPolarHBondContact O-CA 3.48Å; H237-A240 WeakPolarHBondContact O-CB 3.41Å; H237-A240 PolarHBondContact O-N 2.88Å; H237-V241 WeakPolarHBondContact O-CG2 2.82Å; H237-V241 PolarHBondContact O-N 3.02Å
238	L	98.6	Very high	98.1	Very high	38 Å²	38	33.5 Å²	33.5	20%	0.199	17%	0.174	C	C	.	.	H	α-helix	trans	-50	-50.5	-175.7	178	63.9	0	0	0	113.3	G236 A240 V241 Q242 E272 A276	G236-L238 PolarHBondContact O-N 3.12Å; G236-L238 VanDerWaalsContact O-N 3.12Å; L238-A240 PolarHBondContact O-N 2.83Å; L238-V241 WeakPolarHBondContact O-CB 3.49Å; L238-V241 PolarHBondContact O-N 3.41Å; L238-Q242 HydrophobicContact CD1-CG 4.12Å; L238-Q242 HydrophobicContact CG-CG 4.42Å; L238-Q242 WeakPolarHBondContact O-CG 3.28Å; L238-Q242 PolarHBondContact O-N 3.36Å; L238-E272 HydrophobicContact CD1-CB 4.29Å; L238-E272 WeakPolarHBondContact CD1-O 3.2Å; L238-E272 HydrophobicContact CD2-CB 4.07Å; L238-A276 HydrophobicContact CD1-CB 3.64Å
239	D	98.6	Very high	97.9	Very high	103 Å²	103	40.8 Å²	40.8	55%	0.551	21%	0.213	S	C	*	.	H	α-helix	trans	-62	-33.8	-178.3	-64.7	-27	0	0	0	111.7	I204 H237 L243	I204-D239 VanDerWaalsContact CD1-C 3.49Å; I204-D239 HydrophobicContact CD1-CB 3.65Å; I204-D239 HydrophobicContact CG1-CB 3.87Å; H237-D239 PolarHBondContact O-N 2.85Å; D239-L243 VanDerWaalsContact O-CB 3.29Å; D239-L243 WeakPolarHBondContact O-CB 3.23Å; D239-L243 PolarHBondContact O-N 2.87Å
240	A	98.5	Very high	97.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-73	-44.8	176.8	0	0	0	0	0	110	I204 L207 A232 H237 L238 Q242 L243 L244	I204-A240 VanDerWaalsContact CD1-CA 3.44Å; I204-A240 HydrophobicContact CD1-CB 3.63Å; L207-A240 HydrophobicContact CD1-CB 3.85Å; A232-A240 HydrophobicContact CB-CB 3.96Å; H237-A240 HydrophobicContact CB-CB 3.92Å; H237-A240 WeakPolarHBondContact O-CA 3.48Å; H237-A240 WeakPolarHBondContact O-CB 3.41Å; H237-A240 PolarHBondContact O-N 2.88Å; L238-A240 PolarHBondContact O-N 2.83Å; A240-Q242 PolarHBondContact O-N 2.96Å; A240-L243 PolarHBondContact O-N 3.25Å; A240-L244 VanDerWaalsContact O-CB 3.31Å; A240-L244 WeakPolarHBondContact O-CB 3.16Å; A240-L244 WeakPolarHBondContact O-CG 3.45Å; A240-L244 PolarHBondContact O-N 2.71Å
241	V	98.8	Very high	97.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.1	-50.7	174	170.3	0	0	0	0	110.4	L229 A232 A233 H237 L238 L243 L244 L245 A276 L277	L229-V241 HydrophobicContact CD1-CB 4.48Å; L229-V241 HydrophobicContact CD1-CG1 4.1Å; L229-V241 HydrophobicContact CD1-CG2 4.49Å; A232-V241 HydrophobicContact CB-CG2 3.85Å; A233-V241 HydrophobicContact CB-CG2 4.07Å; H237-V241 WeakPolarHBondContact O-CG2 2.82Å; H237-V241 PolarHBondContact O-N 3.02Å; L238-V241 WeakPolarHBondContact O-CB 3.49Å; L238-V241 PolarHBondContact O-N 3.41Å; V241-L243 PolarHBondContact O-N 3Å; V241-L244 PolarHBondContact O-N 3.43Å; V241-L245 HydrophobicContact CG1-CD1 3.54Å; V241-L245 HydrophobicContact CG1-CG 4.22Å; V241-L245 WeakPolarHBondContact O-CB 3.1Å; V241-L245 WeakPolarHBondContact O-CG 3.13Å; V241-L245 PolarHBondContact O-N 3.12Å; V241-A276 HydrophobicContact CG1-CB 4.4Å; V241-L277 HydrophobicContact CG1-CD2 4.09Å; V241-L277 HydrophobicContact CG1-CG 4.05Å
242	Q	98.6	Very high	97.2	Very high	78 Å²	78	47.8 Å²	47.8	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-45.8	179	-72	179.4	-9.9	0	0	112.4	L238 A240 L244 L245 Q246 A276	L238-Q242 HydrophobicContact CD1-CG 4.12Å; L238-Q242 HydrophobicContact CG-CG 4.42Å; L238-Q242 WeakPolarHBondContact O-CG 3.28Å; L238-Q242 PolarHBondContact O-N 3.36Å; A240-Q242 PolarHBondContact O-N 2.96Å; Q242-L244 VanDerWaalsContact C-N 3.34Å; Q242-L244 PolarHBondContact O-N 3.38Å; Q242-L245 PolarHBondContact O-N 3.49Å; Q242-Q246 WeakPolarHBondContact O-CB 3.42Å; Q242-Q246 VanDerWaalsContact O-CG 3.22Å; Q242-Q246 WeakPolarHBondContact O-CG 3.45Å; Q242-Q246 PolarHBondContact O-N 3.3Å; Q242-A276 HydrophobicContact CG-CB 4.34Å
243	L	98.4	Very high	97.1	Very high	23 Å²	23	53.2 Å²	53.2	12%	0.12	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-45.7	177.3	179.1	65.4	0	0	0	111.4	I204 L207 K208 M211 D239 A240 V241 Q246 S247	I204-L243 HydrophobicContact CG2-CD2 4.38Å; L207-L243 HydrophobicContact CB-CD2 3.72Å; L207-L243 HydrophobicContact CD1-CD2 4.17Å; K208-L243 HydrophobicContact CG-CD1 4.41Å; K208-L243 HydrophobicContact CG-CD2 3.89Å; M211-L243 HydrophobicContact CE-CD2 4.13Å; M211-L243 HydrophobicContact CE-CG 3.99Å; M211-L243 HydrophobicContact SD-CD1 4.28Å; M211-L243 HydrophobicContact SD-CD2 4.09Å; M211-L243 HydrophobicContact SD-CG 4.12Å; D239-L243 VanDerWaalsContact O-CB 3.29Å; D239-L243 WeakPolarHBondContact O-CB 3.23Å; D239-L243 PolarHBondContact O-N 2.87Å; A240-L243 PolarHBondContact O-N 3.25Å; V241-L243 PolarHBondContact O-N 3Å; L243-Q246 PolarHBondContact O-N 3.37Å; L243-S247 WeakPolarHBondContact O-CB 3.34Å; L243-S247 PolarHBondContact O-N 2.87Å; L243-S247 PolarHBondContact O-OG 3.17Å
244	L	98.4	Very high	97.1	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-42.8	179.5	-70.2	174.3	0	0	0	111.6	F195 A199 M211 M219 P228 L229 A232 A240 V241 Q242 Q246 S247 F248	F195-L244 HydrophobicContact CE1-CD2 3.9Å; F195-L244 HydrophobicContact CZ-CD2 3.7Å; A199-L244 HydrophobicContact CB-CD1 3.97Å; M211-L244 HydrophobicContact CE-CD2 3.92Å; M219-L244 HydrophobicContact CE-CB 3.69Å; M219-L244 HydrophobicContact CE-CD1 4.26Å; M219-L244 HydrophobicContact CE-CD2 3.48Å; M219-L244 VanDerWaalsContact CE-CD2 3.48Å; M219-L244 HydrophobicContact CE-CG 3.96Å; P228-L244 HydrophobicContact CB-CD1 4.2Å; L229-L244 HydrophobicContact CD1-CB 4.15Å; L229-L244 HydrophobicContact CD1-CD1 4.46Å; A232-L244 HydrophobicContact CB-CD1 4.07Å; A240-L244 VanDerWaalsContact O-CB 3.31Å; A240-L244 WeakPolarHBondContact O-CB 3.16Å; A240-L244 WeakPolarHBondContact O-CG 3.45Å; A240-L244 PolarHBondContact O-N 2.71Å; V241-L244 PolarHBondContact O-N 3.43Å; Q242-L244 VanDerWaalsContact C-N 3.34Å; Q242-L244 PolarHBondContact O-N 3.38Å; L244-Q246 VanDerWaalsContact C-N 3.29Å; L244-Q246 PolarHBondContact O-N 3.29Å; L244-S247 PolarHBondContact O-N 3.46Å; L244-F248 HydrophobicContact CD2-CD2 4.42Å; L244-F248 HydrophobicContact CD2-CE2 4.2Å; L244-F248 WeakPolarHBondContact O-CD2 3.17Å; L244-F248 PolarHBondContact O-N 2.91Å
245	L	98	Very high	97.1	Very high	12 Å²	12	55.2 Å²	55.2	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-29.5	177.3	-70.7	170.2	0	0	0	112.9	L229 V241 Q242 R251 L277 A280	L229-L245 HydrophobicContact CD1-CD2 4.02Å; L229-L245 HydrophobicContact CD1-CG 4.01Å; L229-L245 HydrophobicContact CD2-CD2 3.79Å; V241-L245 HydrophobicContact CG1-CD1 3.54Å; V241-L245 HydrophobicContact CG1-CG 4.22Å; V241-L245 WeakPolarHBondContact O-CB 3.1Å; V241-L245 WeakPolarHBondContact O-CG 3.13Å; V241-L245 PolarHBondContact O-N 3.12Å; Q242-L245 PolarHBondContact O-N 3.49Å; L245-R251 VanDerWaalsContact CA-NH1 3.26Å; L245-R251 PolarHBondContact O-NH1 3.25Å; L245-R251 PolarHBondContact O-NH2 3.46Å; L245-L277 HydrophobicContact CD1-CD2 4.03Å; L245-L277 HydrophobicContact CD2-CD2 3.99Å; L245-L277 HydrophobicContact CG-CD2 4.46Å; L245-A280 HydrophobicContact CB-CB 4.45Å; L245-A280 HydrophobicContact CD1-CB 3.8Å; L245-A280 HydrophobicContact CD2-CB 4.08Å; L245-A280 HydrophobicContact CG-CB 4.33Å
246	Q	97.1	Very high	97.2	Very high	157 Å²	157	58.4 Å²	58.4	73%	0.734	30%	0.302	S	S	*	.	H	α-helix	trans	-78.6	-31.1	175	-72.8	168.3	9.8	0	0	112.4	Q242 L243 L244	Q242-Q246 WeakPolarHBondContact O-CB 3.42Å; Q242-Q246 VanDerWaalsContact O-CG 3.22Å; Q242-Q246 WeakPolarHBondContact O-CG 3.45Å; Q242-Q246 PolarHBondContact O-N 3.3Å; L243-Q246 PolarHBondContact O-N 3.37Å; L244-Q246 VanDerWaalsContact C-N 3.29Å; L244-Q246 PolarHBondContact O-N 3.29Å
247	S	96.9	Very high	97.1	Very high	58 Å²	58	61.8 Å²	61.8	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-92.5	-18.2	-173.3	-51.1	0	0	0	0	113.2	L243 L244	L243-S247 WeakPolarHBondContact O-CB 3.34Å; L243-S247 PolarHBondContact O-N 2.87Å; L243-S247 PolarHBondContact O-OG 3.17Å; L244-S247 PolarHBondContact O-N 3.46Å
248	F	96	Very high	97.1	Very high	44 Å²	44	59.5 Å²	59.5	19%	0.193	31%	0.308	C	S	.	.			trans	-136.8	146.7	-176.7	-61.4	-89.3	0	0	0	111.7	F195 M211 A217 M219 L244 T250	F195-F248 HydrophobicContact CE1-CE2 4.33Å; F195-F248 HydrophobicContact CE1-CZ 4.42Å; F195-F248 HydrophobicContact CZ-CE2 4.08Å; F195-F248 HydrophobicContact CZ-CZ 4.34Å; M211-F248 HydrophobicContact CE-CE2 3.93Å; A217-F248 HydrophobicContact CB-CE2 4.47Å; A217-F248 HydrophobicContact CB-CZ 3.82Å; M219-F248 HydrophobicContact CE-CB 3.94Å; M219-F248 HydrophobicContact CE-CD1 4.42Å; M219-F248 HydrophobicContact CE-CD2 3.19Å; M219-F248 HydrophobicContact CE-CE2 3.68Å; M219-F248 HydrophobicContact CE-CG 3.61Å; M219-F248 HydrophobicContact CE-CZ 4.47Å; M219-F248 HydrophobicContact CG-CB 4.03Å; M219-F248 HydrophobicContact CG-CD1 3.6Å; M219-F248 HydrophobicContact CG-CD2 4.08Å; M219-F248 HydrophobicContact CG-CE1 4Å; M219-F248 HydrophobicContact CG-CE2 4.41Å; M219-F248 HydrophobicContact CG-CG 3.64Å; M219-F248 HydrophobicContact CG-CZ 4.37Å; L244-F248 HydrophobicContact CD2-CD2 4.42Å; L244-F248 HydrophobicContact CD2-CE2 4.2Å; L244-F248 WeakPolarHBondContact O-CD2 3.17Å; L244-F248 PolarHBondContact O-N 2.91Å; F248-T250 PolarHBondContact O-N 3.31Å
249	D	93.3	Very high	97.1	Very high	153 Å²	153	59.4 Å²	59.4	82%	0.818	31%	0.306	S	S	*	.			trans	-82.9	3	176.4	-66.9	-35.6	0	0	0	113.6	R251	D249-R251 PolarHBondContact O-N 3.45Å
250	T	90.3	Very high	97.1	Very high	33 Å²	33	54.7 Å²	54.7	20%	0.202	28%	0.281	C	S	.	.			trans	-70.8	121.1	178.7	-51.2	0	0	0	0	110.7	F248 E253	F248-T250 PolarHBondContact O-N 3.31Å; T250-E253 HydrophobicContact CG2-CB 4.18Å; T250-E253 HydrophobicContact CG2-CG 3.34Å
251	R	93.4	Very high	97.1	Very high	63 Å²	63	54.7 Å²	54.7	24%	0.238	28%	0.281	C	S	.	.			trans	-120	-59.2	-179.9	-54.1	-60.9	173.2	-157.7	-6.2	112.4	L245 D249	L245-R251 VanDerWaalsContact CA-NH1 3.26Å; L245-R251 PolarHBondContact O-NH1 3.25Å; L245-R251 PolarHBondContact O-NH2 3.46Å; D249-R251 PolarHBondContact O-N 3.45Å
252	D	97.7	Very high	97.1	Very high	56 Å²	56	54.8 Å²	54.8	30%	0.299	28%	0.282	S	S	.	.	S	Bend	trans	-117.6	24.1	-160.9	-68.1	-42.7	0	0	0	113.8	C282 D283 I286	D252-C282 WeakPolarHBondContact OD1-CA 3.36Å; D252-C282 WeakPolarHBondContact OD1-CB 3.33Å; D252-D283 PolarHBondContact OD1-N 2.88Å; D252-I286 HydrophobicContact CB-CD1 3.45Å; D252-I286 VanDerWaalsContact CB-CD1 3.45Å
253	E	97.7	Very high	97.1	Very high	114 Å²	114	51.6 Å²	51.6	53%	0.533	27%	0.266	S	S	.	.			trans	-58.7	145.2	171.9	-64.5	-63.4	144.5	0	0	110.1	T227 H230 T250	T227-E253 HydrophobicContact CG2-CB 4.33Å; H230-E253 PolarHBondContact CE1-O 3.14Å; H230-E253 PolarHBondContact NE2-O 3Å; H230-E253 VanDerWaalsContact NE2-O 3.11Å; T250-E253 HydrophobicContact CG2-CB 4.18Å; T250-E253 HydrophobicContact CG2-CG 3.34Å
254	V	98.2	Very high	97.1	Very high	71 Å²	71	50.8 Å²	50.8	43%	0.43	26%	0.262	S	S	.	.			trans	-115.5	141	-179.7	-66.6	0	0	0	0	111	E259 T260 I286	V254-E259 WeakPolarHBondContact CA-O 3.41Å; V254-T260 HydrophobicContact CG1-CG2 3.75Å; V254-I286 HydrophobicContact CG1-CG2 3.88Å
255	N	97.9	Very high	97.1	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.059	26%	0.262	C	S	.	.			trans	-77.8	-173.7	172.8	77	2.3	0	0	0	111.9	R224 D226 D257 G258 E259 Q264	R224-N255 WeakPolarHBondContact O-CB 3.37Å; D226-N255 PolarHBondContact OD1-ND2 3.06Å; N255-D257 PolarHBondContact O-N 3.44Å; N255-D257 WeakPolarHBondContact OD1-CA 3.41Å; N255-D257 PolarHBondContact OD1-N 3.14Å; N255-G258 PolarHBondContact O-N 2.98Å; N255-G258 PolarHBondContact OD1-N 3.4Å; N255-E259 PolarHBondContact N-O 3.48Å; N255-E259 PolarHBondContact ND2-OE2 3.32Å; N255-E259 WeakPolarHBondContact OD1-CB 3.14Å; N255-E259 PolarHBondContact OD1-N 2.87Å; N255-Q264 PolarHBondContact ND2-NE2 3.1Å
256	M	98	Very high	97.1	Very high	134 Å²	134	50.2 Å²	50.2	66%	0.66	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.7	-179.5	-73.2	-175.4	177.1	0	0	114.2	K223 R224 G258	K223-M256 WeakPolarHBondContact O-CE 3.41Å; R224-M256 WeakPolarHBondContact O-CB 3.31Å; R224-M256 VanDerWaalsContact O-CG 3.3Å; R224-M256 WeakPolarHBondContact O-CG 3.29Å; R224-M256 PolarHBondContact O-N 3.17Å; M256-G258 VanDerWaalsContact C-N 3.29Å
257	D	97.3	Very high	97.2	Very high	92 Å²	92	46.3 Å²	46.3	49%	0.492	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	1.5	176.3	-65	-52.4	0	0	0	112.2	N255 E259 T288 V289	N255-D257 PolarHBondContact O-N 3.44Å; N255-D257 WeakPolarHBondContact OD1-CA 3.41Å; N255-D257 PolarHBondContact OD1-N 3.14Å; D257-E259 VanDerWaalsContact C-N 3.31Å; D257-E259 HydrophobicContact CB-CG 3.94Å; D257-T288 WeakPolarHBondContact O-CB 3.45Å; D257-V289 WeakPolarHBondContact O-CG2 3.39Å; D257-V289 PolarHBondContact O-N 2.99Å
258	G	98	Very high	97.1	Very high	9 Å²	9	46.9 Å²	46.9	9%	0.093	24%	0.242	C	C	.	.	S	Bend	trans	77.6	15.9	-177	0	0	0	0	0	113.3	N255 M256 T288	N255-G258 PolarHBondContact O-N 2.98Å; N255-G258 PolarHBondContact OD1-N 3.4Å; M256-G258 VanDerWaalsContact C-N 3.29Å; G258-T288 WeakPolarHBondContact O-CA 3.22Å
259	E	98.5	Very high	97.2	Very high	35 Å²	35	47.4 Å²	47.4	16%	0.164	25%	0.251	C	S	.	.			trans	-86.8	134.5	-177.5	-53.3	175.2	152.1	0	0	110.4	H230 V254 N255 D257 Y263 Q264 T288	H230-E259 PolarHBondContact NE2-O 3.08Å; V254-E259 WeakPolarHBondContact CA-O 3.41Å; N255-E259 PolarHBondContact N-O 3.48Å; N255-E259 PolarHBondContact ND2-OE2 3.32Å; N255-E259 WeakPolarHBondContact OD1-CB 3.14Å; N255-E259 PolarHBondContact OD1-N 2.87Å; D257-E259 VanDerWaalsContact C-N 3.31Å; D257-E259 HydrophobicContact CB-CG 3.94Å; E259-Y263 HydrophobicContact CB-CD1 3.71Å; E259-Y263 HydrophobicContact CB-CE1 4.33Å; E259-Y263 HydrophobicContact CB-CG 4.31Å; E259-Y263 HydrophobicContact CG-CD1 3.63Å; E259-Y263 HydrophobicContact CG-CE1 3.72Å; E259-Y263 HydrophobicContact CG-CG 4.48Å; E259-Y263 WeakPolarHBondContact OE1-CE1 3.38Å; E259-Q264 HydrophobicContact CB-CG 4.13Å; E259-Q264 PolarHBondContact OE2-NE2 3.44Å; E259-T288 HydrophobicContact CG-CG2 3.85Å
260	T	98.6	Very high	97.4	Very high	4 Å²	4	42 Å²	42	3%	0.025	22%	0.22	C	C	.	.			trans	-86.8	167.8	167.8	63.4	0	0	0	0	111.1	V254 L262 Y263 Q264 I286	V254-T260 HydrophobicContact CG1-CG2 3.75Å; T260-L262 PolarHBondContact O-N 3.2Å; T260-L262 PolarHBondContact OG1-N 2.99Å; T260-Y263 WeakPolarHBondContact O-CB 3.48Å; T260-Y263 PolarHBondContact O-N 3.43Å; T260-Y263 VanDerWaalsContact O-N 3.14Å; T260-Y263 PolarHBondContact OG1-N 2.96Å; T260-Y263 VanDerWaalsContact OG1-N 3.12Å; T260-Q264 PolarHBondContact O-N 3.08Å; T260-I286 HydrophobicContact CG2-CB 3.92Å; T260-I286 HydrophobicContact CG2-CD1 3.92Å; T260-I286 HydrophobicContact CG2-CG2 3.67Å
261	A	98.6	Very high	97.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-36.3	171	0	0	0	0	0	112.4	L229 H230 A233 Q264 A265 L277	L229-A261 HydrophobicContact CB-CB 4.47Å; L229-A261 HydrophobicContact CD2-CB 4.13Å; L229-A261 HydrophobicContact CG-CB 3.77Å; H230-A261 PolarHBondContact CD2-N 2.95Å; H230-A261 PolarHBondContact NE2-N 3.05Å; A233-A261 HydrophobicContact CB-CB 3.98Å; A233-A261 WeakPolarHBondContact CB-O 3.45Å; A261-Q264 PolarHBondContact O-N 3.26Å; A261-A265 WeakPolarHBondContact O-CB 3.49Å; A261-A265 PolarHBondContact O-N 2.92Å; A261-L277 HydrophobicContact CB-CD1 4.39Å; A261-L277 HydrophobicContact CB-CD2 4.29Å
262	L	98.7	Very high	98	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-44.5	175.3	-176.2	157.6	0	0	0	111.2	T260 A265 A266 L277 L278 C282 P284 A294 L310	T260-L262 PolarHBondContact O-N 3.2Å; T260-L262 PolarHBondContact OG1-N 2.99Å; L262-A265 PolarHBondContact O-N 3.02Å; L262-A266 WeakPolarHBondContact O-CB 3.14Å; L262-A266 PolarHBondContact O-N 2.65Å; L262-L277 HydrophobicContact CB-CB 4.35Å; L262-L277 HydrophobicContact CB-CD1 4.22Å; L262-L277 HydrophobicContact CD1-CB 4.38Å; L262-L278 HydrophobicContact CD1-CD2 3.54Å; L262-L278 HydrophobicContact CD1-CG 3.84Å; L262-C282 HydrophobicContact CD1-CB 4.03Å; L262-P284 HydrophobicContact CD1-CB 4.35Å; L262-P284 HydrophobicContact CD2-CB 4.24Å; L262-A294 HydrophobicContact CD2-CB 3.6Å; L262-L310 HydrophobicContact CD2-CD2 4.15Å
263	Y	98.6	Very high	98	Very high	10 Å²	10	44.6 Å²	44.6	4%	0.039	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-47.9	175.1	-179.2	-83.5	0	0	0	111.4	E259 T260 A265 A266 D267 T288 R292 V297	E259-Y263 HydrophobicContact CB-CD1 3.71Å; E259-Y263 HydrophobicContact CB-CE1 4.33Å; E259-Y263 HydrophobicContact CB-CG 4.31Å; E259-Y263 HydrophobicContact CG-CD1 3.63Å; E259-Y263 HydrophobicContact CG-CE1 3.72Å; E259-Y263 HydrophobicContact CG-CG 4.48Å; E259-Y263 WeakPolarHBondContact OE1-CE1 3.38Å; T260-Y263 WeakPolarHBondContact O-CB 3.48Å; T260-Y263 PolarHBondContact O-N 3.43Å; T260-Y263 VanDerWaalsContact O-N 3.14Å; T260-Y263 PolarHBondContact OG1-N 2.96Å; T260-Y263 VanDerWaalsContact OG1-N 3.12Å; Y263-A265 PolarHBondContact O-N 3.37Å; Y263-A266 PolarHBondContact O-N 3.04Å; Y263-D267 HydrophobicContact CE1-CB 4.34Å; Y263-D267 WeakPolarHBondContact O-CB 3.39Å; Y263-D267 PolarHBondContact O-N 2.73Å; Y263-T288 HydrophobicContact CD1-CG2 4.17Å; Y263-T288 HydrophobicContact CD2-CG2 3.74Å; Y263-T288 HydrophobicContact CE1-CG2 3.93Å; Y263-T288 HydrophobicContact CE2-CG2 3.46Å; Y263-T288 VanDerWaalsContact CE2-CG2 3.46Å; Y263-T288 HydrophobicContact CG-CG2 4.09Å; Y263-R292 HydrophobicContact CE2-CB 4.08Å; Y263-V297 HydrophobicContact CE1-CG1 4.32Å; Y263-V297 HydrophobicContact CE2-CG1 3.78Å; Y263-V297 HydrophobicContact CE2-CG2 4.17Å; Y263-V297 VanDerWaalsContact CZ-CG1 3.5Å; Y263-V297 WeakPolarHBondContact OH-CG1 3.49Å
264	Q	98.3	Very high	98.1	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.033	21%	0.206	C	C	.	.	H	α-helix	trans	-64.6	-37.6	-179.9	-71.4	-166.2	-11.9	0	0	112.8	D226 H230 R234 N255 E259 T260 A261 N268	D226-Q264 PolarHBondContact OD1-NE2 2.95Å; H230-Q264 PolarHBondContact O-OE1 2.81Å; R234-Q264 HydrophobicContact CB-CB 4.06Å; R234-Q264 HydrophobicContact CG-CB 4.47Å; N255-Q264 PolarHBondContact ND2-NE2 3.1Å; E259-Q264 HydrophobicContact CB-CG 4.13Å; E259-Q264 PolarHBondContact OE2-NE2 3.44Å; T260-Q264 PolarHBondContact O-N 3.08Å; A261-Q264 PolarHBondContact O-N 3.26Å; Q264-N268 WeakPolarHBondContact O-CB 3.48Å; Q264-N268 PolarHBondContact O-N 3.25Å; Q264-N268 PolarHBondContact O-ND2 3.15Å
265	A	98.6	Very high	98.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-42.8	172.3	0	0	0	0	0	111.9	A233 A261 L262 Y263 N268 S269 Q270 C273 V274 L277	A233-A265 HydrophobicContact CB-CB 4.09Å; A261-A265 WeakPolarHBondContact O-CB 3.49Å; A261-A265 PolarHBondContact O-N 2.92Å; L262-A265 PolarHBondContact O-N 3.02Å; Y263-A265 PolarHBondContact O-N 3.37Å; A265-N268 CarbonylContact O-C 3.58Å; A265-N268 PolarHBondContact O-N 3.29Å; A265-S269 PolarHBondContact O-N 3.45Å; A265-Q270 HydrophobicContact CB-CB 4.17Å; A265-Q270 PolarHBondContact O-N 2.8Å; A265-C273 HydrophobicContact CB-CB 4.05Å; A265-V274 HydrophobicContact CB-CG2 3.69Å; A265-L277 HydrophobicContact CB-CD1 4.14Å
266	A	98.3	Very high	98.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-43.8	179.2	0	0	0	0	0	112.4	L262 Y263 N268 S269 V274 A294 V297 V298	L262-A266 WeakPolarHBondContact O-CB 3.14Å; L262-A266 PolarHBondContact O-N 2.65Å; Y263-A266 PolarHBondContact O-N 3.04Å; A266-N268 PolarHBondContact O-N 2.85Å; A266-S269 PolarHBondContact O-N 3.19Å; A266-S269 VanDerWaalsContact O-N 3.16Å; A266-V274 HydrophobicContact CB-CG2 4.05Å; A266-A294 HydrophobicContact CB-CB 4.04Å; A266-V297 HydrophobicContact CB-CG2 4.25Å; A266-V298 HydrophobicContact CB-CG1 3.83Å
267	D	97.7	Very high	98.1	Very high	75 Å²	75	32.8 Å²	32.8	40%	0.401	17%	0.174	S	C	.	.	H	α-helix	trans	-63.3	-30.3	177.6	-169	53	0	0	0	112.4	Y263 V297	Y263-D267 HydrophobicContact CE1-CB 4.34Å; Y263-D267 WeakPolarHBondContact O-CB 3.39Å; Y263-D267 PolarHBondContact O-N 2.73Å; D267-V297 HydrophobicContact CB-CB 4.22Å; D267-V297 HydrophobicContact CB-CG1 4.3Å; D267-V297 HydrophobicContact CB-CG2 4.1Å; D267-V297 WeakPolarHBondContact OD1-CB 3.49Å; D267-V297 VanDerWaalsContact OD1-CG1 3.28Å; D267-V297 WeakPolarHBondContact OD1-CG1 3.28Å
268	N	96.4	Very high	98.2	Very high	70 Å²	70	28.8 Å²	28.8	37%	0.374	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	13.7	178	-70.1	-91.5	0	0	0	113.5	R234 Q264 A265 A266 Q270	R234-N268 WeakPolarHBondContact O-CB 3.4Å; Q264-N268 WeakPolarHBondContact O-CB 3.48Å; Q264-N268 PolarHBondContact O-N 3.25Å; Q264-N268 PolarHBondContact O-ND2 3.15Å; A265-N268 CarbonylContact O-C 3.58Å; A265-N268 PolarHBondContact O-N 3.29Å; A266-N268 PolarHBondContact O-N 2.85Å; N268-Q270 VanDerWaalsContact C-N 3.31Å; N268-Q270 HydrophobicContact CB-CG 4.09Å; N268-Q270 PolarHBondContact O-N 3.46Å; N268-Q270 PolarHBondContact O-NE2 3.2Å; N268-Q270 VanDerWaalsContact O-NE2 3.16Å
269	S	96.8	Very high	98.2	Very high	56 Å²	56	33.3 Å²	33.3	39%	0.392	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	39	178.7	-70.9	0	0	0	0	114.5	A265 A266 E271 D303	A265-S269 PolarHBondContact O-N 3.45Å; A266-S269 PolarHBondContact O-N 3.19Å; A266-S269 VanDerWaalsContact O-N 3.16Å; S269-E271 PolarHBondContact O-N 3.11Å; S269-D303 PolarHBondContact OG-OD2 3.16Å
270	Q	97.9	Very high	98.2	Very high	38 Å²	38	33.2 Å²	33.2	18%	0.178	18%	0.18	C	C	.	.			trans	-92.8	71.7	179.6	-53.9	-59.8	-18.6	0	0	111.2	G236 A265 N268 E272 C273 V274	G236-Q270 VanDerWaalsContact CA-CD 3.43Å; G236-Q270 VanDerWaalsContact CA-OE1 3.28Å; A265-Q270 HydrophobicContact CB-CB 4.17Å; A265-Q270 PolarHBondContact O-N 2.8Å; N268-Q270 VanDerWaalsContact C-N 3.31Å; N268-Q270 HydrophobicContact CB-CG 4.09Å; N268-Q270 PolarHBondContact O-N 3.46Å; N268-Q270 PolarHBondContact O-NE2 3.2Å; N268-Q270 VanDerWaalsContact O-NE2 3.16Å; Q270-E272 VanDerWaalsContact C-N 3.33Å; Q270-E272 PolarHBondContact O-N 3.44Å; Q270-C273 HydrophobicContact CB-CB 3.99Å; Q270-C273 PolarHBondContact O-N 3.35Å; Q270-V274 WeakPolarHBondContact O-CG2 3.32Å; Q270-V274 PolarHBondContact O-N 3.07Å
271	E	97.6	Very high	98.1	Very high	88 Å²	88	35.7 Å²	35.7	41%	0.411	21%	0.206	S	C	.	.	H	α-helix	trans	-50.8	-46.6	-173.6	-171.9	179.6	150.6	0	0	113.8	S269 C273 V274 L275 S305 L306	S269-E271 PolarHBondContact O-N 3.11Å; E271-C273 VanDerWaalsContact C-N 3.34Å; E271-C273 PolarHBondContact O-N 2.98Å; E271-V274 PolarHBondContact O-N 3.34Å; E271-L275 PolarHBondContact O-N 3.45Å; E271-S305 WeakPolarHBondContact OE2-CB 3.06Å; E271-L306 HydrophobicContact CB-CD2 4.11Å; E271-L306 HydrophobicContact CB-CG 4.34Å; E271-L306 HydrophobicContact CG-CD2 4.07Å; E271-L306 HydrophobicContact CG-CG 4.45Å
272	E	98.1	Very high	98.1	Very high	118 Å²	118	35.9 Å²	35.9	55%	0.551	21%	0.207	S	C	*	.	H	α-helix	trans	-65.1	-37.1	-179.3	-60.6	-179.7	168.9	0	0	112.5	L238 Q270 A276	L238-E272 HydrophobicContact CD1-CB 4.29Å; L238-E272 WeakPolarHBondContact CD1-O 3.2Å; L238-E272 HydrophobicContact CD2-CB 4.07Å; Q270-E272 VanDerWaalsContact C-N 3.33Å; Q270-E272 PolarHBondContact O-N 3.44Å; E272-A276 WeakPolarHBondContact O-CB 3.48Å; E272-A276 PolarHBondContact O-N 3.24Å
273	C	98.6	Very high	98	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-71.5	-39.8	177	-70	0	0	0	0	111.3	G236 A265 Q270 E271 L275 A276 L277	G236-C273 VanDerWaalsContact C-SG 3.56Å; A265-C273 HydrophobicContact CB-CB 4.05Å; Q270-C273 HydrophobicContact CB-CB 3.99Å; Q270-C273 PolarHBondContact O-N 3.35Å; E271-C273 VanDerWaalsContact C-N 3.34Å; E271-C273 PolarHBondContact O-N 2.98Å; C273-L275 VanDerWaalsContact C-N 3.34Å; C273-A276 PolarHBondContact O-N 2.87Å; C273-L277 WeakPolarHBondContact O-CB 3.17Å; C273-L277 WeakPolarHBondContact O-CD1 3.45Å; C273-L277 VanDerWaalsContact O-CG 3.23Å; C273-L277 WeakPolarHBondContact O-CG 3.28Å; C273-L277 PolarHBondContact O-N 3.14Å
274	V	98.8	Very high	98	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-46.9	174.7	174.2	0	0	0	0	110.3	A265 A266 Q270 E271 A276 L277 L278 L306 L309 L310	A265-V274 HydrophobicContact CB-CG2 3.69Å; A266-V274 HydrophobicContact CB-CG2 4.05Å; Q270-V274 WeakPolarHBondContact O-CG2 3.32Å; Q270-V274 PolarHBondContact O-N 3.07Å; E271-V274 PolarHBondContact O-N 3.34Å; V274-A276 PolarHBondContact O-N 2.93Å; V274-L277 PolarHBondContact O-N 3.29Å; V274-L278 HydrophobicContact CG1-CD1 3.76Å; V274-L278 HydrophobicContact CG1-CG 4.31Å; V274-L278 WeakPolarHBondContact O-CB 3.45Å; V274-L278 VanDerWaalsContact O-CG 3.29Å; V274-L278 WeakPolarHBondContact O-CG 3.39Å; V274-L278 PolarHBondContact O-N 3.22Å; V274-L306 HydrophobicContact CB-CD2 3.77Å; V274-L306 HydrophobicContact CG1-CD2 3.87Å; V274-L306 HydrophobicContact CG2-CD2 3.82Å; V274-L309 HydrophobicContact CB-CD2 4.31Å; V274-L309 HydrophobicContact CG1-CD2 3.89Å; V274-L310 HydrophobicContact CG1-CD2 4.2Å
275	L	98.6	Very high	97.9	Very high	68 Å²	68	40 Å²	40	36%	0.356	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-47.3	176.7	178.7	63	0	0	0	111.7	E271 C273 L277 L278 D279 L309 Y313	E271-L275 PolarHBondContact O-N 3.45Å; C273-L275 VanDerWaalsContact C-N 3.34Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 3.46Å; L275-L278 PolarHBondContact O-N 2.94Å; L275-D279 WeakPolarHBondContact O-CB 3.19Å; L275-D279 PolarHBondContact O-N 3.3Å; L275-L309 HydrophobicContact CB-CD2 3.99Å; L275-L309 HydrophobicContact CD1-CD1 3.72Å; L275-Y313 HydrophobicContact CD1-CE2 4.36Å
276	A	98.5	Very high	97.9	Very high	13 Å²	13	42 Å²	42	11%	0.107	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-36.7	179.4	0	0	0	0	0	113.1	L238 V241 Q242 E272 C273 V274 A280	L238-A276 HydrophobicContact CD1-CB 3.64Å; V241-A276 HydrophobicContact CG1-CB 4.4Å; Q242-A276 HydrophobicContact CG-CB 4.34Å; E272-A276 WeakPolarHBondContact O-CB 3.48Å; E272-A276 PolarHBondContact O-N 3.24Å; C273-A276 PolarHBondContact O-N 2.87Å; V274-A276 PolarHBondContact O-N 2.93Å; A276-A280 WeakPolarHBondContact O-CB 3.31Å; A276-A280 PolarHBondContact O-N 3.38Å; A276-A280 VanDerWaalsContact O-N 3.14Å
277	L	98.7	Very high	97.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-43.5	176.5	-72.3	161.5	0	0	0	111.5	L229 A233 V241 L245 A261 L262 A265 C273 V274 L275 A280 G281 C282	L229-L277 HydrophobicContact CD1-CD2 4.15Å; L229-L277 HydrophobicContact CD2-CD2 4.18Å; L229-L277 HydrophobicContact CG-CD2 4.32Å; A233-L277 HydrophobicContact CB-CD1 3.96Å; V241-L277 HydrophobicContact CG1-CD2 4.09Å; V241-L277 HydrophobicContact CG1-CG 4.05Å; L245-L277 HydrophobicContact CD1-CD2 4.03Å; L245-L277 HydrophobicContact CD2-CD2 3.99Å; L245-L277 HydrophobicContact CG-CD2 4.46Å; A261-L277 HydrophobicContact CB-CD1 4.39Å; A261-L277 HydrophobicContact CB-CD2 4.29Å; L262-L277 HydrophobicContact CB-CB 4.35Å; L262-L277 HydrophobicContact CB-CD1 4.22Å; L262-L277 HydrophobicContact CD1-CB 4.38Å; A265-L277 HydrophobicContact CB-CD1 4.14Å; C273-L277 WeakPolarHBondContact O-CB 3.17Å; C273-L277 WeakPolarHBondContact O-CD1 3.45Å; C273-L277 VanDerWaalsContact O-CG 3.23Å; C273-L277 WeakPolarHBondContact O-CG 3.28Å; C273-L277 PolarHBondContact O-N 3.14Å; V274-L277 PolarHBondContact O-N 3.29Å; L275-L277 VanDerWaalsContact C-N 3.31Å; L275-L277 PolarHBondContact O-N 3.46Å; L277-A280 CarbonylContact O-C 3.35Å; L277-A280 PolarHBondContact O-N 2.78Å; L277-G281 PolarHBondContact O-N 3.32Å; L277-C282 HydrophobicContact CB-CB 4.32Å; L277-C282 WeakPolarHBondContact O-CB 3.49Å; L277-C282 PolarHBondContact O-N 3.02Å; L277-C282 PolarHBondContact O-SG 2.92Å
278	L	98.5	Very high	97.9	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-44.6	175.5	-74.8	171.9	0	0	0	112.2	L262 V274 L275 A280 G281 P284 L309 L310 Y313	L262-L278 HydrophobicContact CD1-CD2 3.54Å; L262-L278 HydrophobicContact CD1-CG 3.84Å; V274-L278 HydrophobicContact CG1-CD1 3.76Å; V274-L278 HydrophobicContact CG1-CG 4.31Å; V274-L278 WeakPolarHBondContact O-CB 3.45Å; V274-L278 VanDerWaalsContact O-CG 3.29Å; V274-L278 WeakPolarHBondContact O-CG 3.39Å; V274-L278 PolarHBondContact O-N 3.22Å; L275-L278 PolarHBondContact O-N 2.94Å; L278-A280 PolarHBondContact O-N 3.29Å; L278-G281 WeakPolarHBondContact O-CA 3.13Å; L278-G281 PolarHBondContact O-N 2.84Å; L278-P284 HydrophobicContact CD2-CB 4.07Å; L278-P284 HydrophobicContact CD2-CG 4.01Å; L278-L309 HydrophobicContact CD1-CD1 4.23Å; L278-L309 HydrophobicContact CD1-CD2 4.21Å; L278-L309 HydrophobicContact CD1-CG 3.84Å; L278-L310 HydrophobicContact CD1-CD2 4.27Å; L278-Y313 HydrophobicContact CB-CD1 3.65Å; L278-Y313 HydrophobicContact CB-CD2 4.38Å; L278-Y313 HydrophobicContact CB-CE1 3.69Å; L278-Y313 HydrophobicContact CB-CE2 4.44Å; L278-Y313 HydrophobicContact CB-CG 4Å; L278-Y313 HydrophobicContact CD1-CD1 4.41Å; L278-Y313 HydrophobicContact CD1-CD2 3.84Å; L278-Y313 HydrophobicContact CD1-CE2 4.33Å; L278-Y313 HydrophobicContact CD1-CG 3.88Å; L278-Y313 HydrophobicContact CD2-CD1 4.11Å; L278-Y313 HydrophobicContact CD2-CG 3.98Å; L278-Y313 HydrophobicContact CG-CD1 4.28Å; L278-Y313 HydrophobicContact CG-CG 4.18Å
279	D	98.2	Very high	98	Very high	105 Å²	105	43.5 Å²	43.5	56%	0.561	25%	0.252	S	S	*	.	H	α-helix	trans	-62.4	-29.2	175.4	-80.3	-17.5	0	0	0	112.4	L275 G281 Y313	L275-D279 WeakPolarHBondContact O-CB 3.19Å; L275-D279 PolarHBondContact O-N 3.3Å; D279-G281 PolarHBondContact O-N 3.28Å; D279-Y313 PolarHBondContact OD1-OH 2.95Å
280	A	97.4	Very high	97.9	Very high	33 Å²	33	42.6 Å²	42.6	27%	0.273	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	2.8	173.7	0	0	0	0	0	113.8	L245 A276 L277 L278	L245-A280 HydrophobicContact CB-CB 4.45Å; L245-A280 HydrophobicContact CD1-CB 3.8Å; L245-A280 HydrophobicContact CD2-CB 4.08Å; L245-A280 HydrophobicContact CG-CB 4.33Å; A276-A280 WeakPolarHBondContact O-CB 3.31Å; A276-A280 PolarHBondContact O-N 3.38Å; A276-A280 VanDerWaalsContact O-N 3.14Å; L277-A280 CarbonylContact O-C 3.35Å; L277-A280 PolarHBondContact O-N 2.78Å; L278-A280 PolarHBondContact O-N 3.29Å
281	G	96.9	Very high	97.9	Very high	56 Å²	56	46.5 Å²	46.5	58%	0.577	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	19.6	175.1	0	0	0	0	0	115.4	L277 L278 D279	L277-G281 PolarHBondContact O-N 3.32Å; L278-G281 WeakPolarHBondContact O-CA 3.13Å; L278-G281 PolarHBondContact O-N 2.84Å; D279-G281 PolarHBondContact O-N 3.28Å
282	C	98.1	Very high	97.9	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.034	25%	0.254	C	S	.	.			trans	-69.1	141.5	173.2	-53.4	0	0	0	0	110.8	D252 L262 L277 P284	D252-C282 WeakPolarHBondContact OD1-CA 3.36Å; D252-C282 WeakPolarHBondContact OD1-CB 3.33Å; L262-C282 HydrophobicContact CD1-CB 4.03Å; L277-C282 HydrophobicContact CB-CB 4.32Å; L277-C282 WeakPolarHBondContact O-CB 3.49Å; L277-C282 PolarHBondContact O-N 3.02Å; L277-C282 PolarHBondContact O-SG 2.92Å; C282-P284 WeakPolarHBondContact O-CD 3.38Å
283	D	98.1	Very high	97.8	Very high	64 Å²	64	39.2 Å²	39.2	34%	0.342	23%	0.228	S	C	.	.			trans	-84.6	116.3	-175.6	-176.8	4.3	0	0	0	111.9	D252 N285 I286	D252-D283 PolarHBondContact OD1-N 2.88Å; D283-N285 PolarHBondContact O-N 3.45Å; D283-N285 VanDerWaalsContact OD1-CB 3.25Å; D283-N285 WeakPolarHBondContact OD1-CB 3.25Å; D283-N285 PolarHBondContact OD1-N 2.73Å; D283-N285 PolarHBondContact OD1-ND2 3.14Å; D283-I286 HydrophobicContact CB-CD1 4Å; D283-I286 HydrophobicContact CB-CG1 4.06Å
284	P	97.4	Very high	97.8	Very high	10 Å²	10	39.2 Å²	39.2	7%	0.065	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-7.3	177.4	30.3	-35.1	0	0	0	114.1	L262 L278 C282 L310 A315	L262-P284 HydrophobicContact CD1-CB 4.35Å; L262-P284 HydrophobicContact CD2-CB 4.24Å; L278-P284 HydrophobicContact CD2-CB 4.07Å; L278-P284 HydrophobicContact CD2-CG 4.01Å; C282-P284 WeakPolarHBondContact O-CD 3.38Å; P284-L310 HydrophobicContact CB-CD2 3.79Å; P284-A315 HydrophobicContact CB-CB 4.27Å; P284-A315 HydrophobicContact CG-CB 4.33Å
285	N	97.9	Very high	97.8	Very high	31 Å²	31	39.2 Å²	39.2	17%	0.166	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-1.2	-173.6	-58.3	-65.1	0	0	0	114.2	D283 L287 A315 H316	D283-N285 PolarHBondContact O-N 3.45Å; D283-N285 VanDerWaalsContact OD1-CB 3.25Å; D283-N285 WeakPolarHBondContact OD1-CB 3.25Å; D283-N285 PolarHBondContact OD1-N 2.73Å; D283-N285 PolarHBondContact OD1-ND2 3.14Å; N285-L287 WeakPolarHBondContact O-CD2 3.38Å; N285-L287 PolarHBondContact O-N 3.05Å; N285-A315 WeakPolarHBondContact OD1-CA 3.33Å; N285-H316 WeakPolarHBondContact OD1-CB 3.26Å; N285-H316 PolarHBondContact OD1-CD2 3.41Å; N285-H316 VanDerWaalsContact OD1-CG 3.22Å; N285-H316 PolarHBondContact OD1-N 3.13Å
286	I	98.1	Very high	97.8	Very high	43 Å²	43	36 Å²	36	22%	0.221	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-66.3	132	175.1	-63.5	171.8	0	0	0	109.3	D252 V254 T260 D283	D252-I286 HydrophobicContact CB-CD1 3.45Å; D252-I286 VanDerWaalsContact CB-CD1 3.45Å; V254-I286 HydrophobicContact CG1-CG2 3.88Å; T260-I286 HydrophobicContact CG2-CB 3.92Å; T260-I286 HydrophobicContact CG2-CD1 3.92Å; T260-I286 HydrophobicContact CG2-CG2 3.67Å; D283-I286 HydrophobicContact CB-CD1 4Å; D283-I286 HydrophobicContact CB-CG1 4.06Å
287	L	98.1	Very high	97.7	Very high	68 Å²	68	35.5 Å²	35.5	36%	0.356	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-102.8	139.5	-174.3	-53.4	-176.4	0	0	0	111.1	N285 R292 V319	N285-L287 WeakPolarHBondContact O-CD2 3.38Å; N285-L287 PolarHBondContact O-N 3.05Å; L287-R292 WeakPolarHBondContact CA-O 3.49Å; L287-V319 HydrophobicContact CD1-CG1 3.83Å; L287-V319 HydrophobicContact CD2-CG1 3.76Å; L287-V319 HydrophobicContact CG-CG1 4.48Å
288	T	98.2	Very high	97.6	Very high	11 Å²	11	35.5 Å²	35.5	7%	0.067	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-66.1	171.4	170.1	68.3	0	0	0	0	112	D257 G258 E259 Y263 A290 K291 R292	D257-T288 WeakPolarHBondContact O-CB 3.45Å; G258-T288 WeakPolarHBondContact O-CA 3.22Å; E259-T288 HydrophobicContact CG-CG2 3.85Å; Y263-T288 HydrophobicContact CD1-CG2 4.17Å; Y263-T288 HydrophobicContact CD2-CG2 3.74Å; Y263-T288 HydrophobicContact CE1-CG2 3.93Å; Y263-T288 HydrophobicContact CE2-CG2 3.46Å; Y263-T288 VanDerWaalsContact CE2-CG2 3.46Å; Y263-T288 HydrophobicContact CG-CG2 4.09Å; T288-A290 PolarHBondContact O-N 3.23Å; T288-A290 VanDerWaalsContact O-N 3.17Å; T288-A290 PolarHBondContact OG1-N 3.23Å; T288-K291 WeakPolarHBondContact O-CA 3.37Å; T288-K291 PolarHBondContact O-N 2.95Å; T288-R292 HydrophobicContact CG2-CB 4.47Å; T288-R292 PolarHBondContact N-O 2.85Å; T288-R292 WeakPolarHBondContact OG1-CB 3.49Å; T288-R292 PolarHBondContact OG1-N 3.25Å; T288-R292 VanDerWaalsContact OG1-N 3.14Å
289	V	97.4	Very high	97.6	Very high	96 Å²	96	35.1 Å²	35.1	58%	0.582	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-32.1	171.5	174.3	0	0	0	0	111.2	D257 K291 Q322	D257-V289 WeakPolarHBondContact O-CG2 3.39Å; D257-V289 PolarHBondContact O-N 2.99Å; V289-K291 PolarHBondContact O-N 3.3Å; V289-Q322 PolarHBondContact O-NE2 3.44Å
290	A	95.1	Very high	97.6	Very high	38 Å²	38	33.8 Å²	33.8	31%	0.314	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	8.1	174	0	0	0	0	0	114.3	T288 R292 Q322	T288-A290 PolarHBondContact O-N 3.23Å; T288-A290 VanDerWaalsContact O-N 3.17Å; T288-A290 PolarHBondContact OG1-N 3.23Å; A290-R292 HydrophobicContact CB-CG 4.03Å; A290-R292 PolarHBondContact O-N 2.97Å; A290-Q322 WeakPolarHBondContact O-CG 3.33Å; A290-Q322 PolarHBondContact O-N 3.28Å
291	K	97.4	Very high	97.5	Very high	120 Å²	120	35.2 Å²	35.2	52%	0.522	20%	0.204	S	C	.	.			trans	56.6	29.9	-173.5	-59.3	-174.7	175	-173.3	0	113.3	T288 V289 N321 Q322	T288-K291 WeakPolarHBondContact O-CA 3.37Å; T288-K291 PolarHBondContact O-N 2.95Å; V289-K291 PolarHBondContact O-N 3.3Å; K291-N321 WeakPolarHBondContact O-CA 3.29Å; K291-Q322 HydrophobicContact CB-CG 4.49Å; K291-Q322 HydrophobicContact CD-CG 4.5Å; K291-Q322 HydrophobicContact CG-CG 4.29Å
292	R	97.8	Very high	97.5	Very high	51 Å²	51	33.7 Å²	33.7	19%	0.192	19%	0.188	C	C	.	.			trans	-92.4	135.6	177.1	-58.7	-174.2	68.6	173.6	7.5	109.5	Y263 L287 T288 A290 H296 E300 N321	Y263-R292 HydrophobicContact CE2-CB 4.08Å; L287-R292 WeakPolarHBondContact CA-O 3.49Å; T288-R292 HydrophobicContact CG2-CB 4.47Å; T288-R292 PolarHBondContact N-O 2.85Å; T288-R292 WeakPolarHBondContact OG1-CB 3.49Å; T288-R292 PolarHBondContact OG1-N 3.25Å; T288-R292 VanDerWaalsContact OG1-N 3.14Å; A290-R292 HydrophobicContact CB-CG 4.03Å; A290-R292 PolarHBondContact O-N 2.97Å; R292-H296 HydrophobicContact CB-CB 4.3Å; R292-E300 IonicContact CZ-OE2 2.91Å; R292-E300 IonicContact NH1-OE2 3.2Å; R292-E300 PolarHBondContact NH1-OE2 3.12Å; R292-E300 IonicContact NH2-OE2 3.57Å; R292-E300 PolarHBondContact NH2-OE2 2.99Å; R292-N321 HydrophobicContact CG-CB 4.22Å
293	S	97.2	Very high	97.4	Very high	1 Å²	1	35 Å²	35	1%	0.007	20%	0.195	C	C	.	.			trans	-93.1	167.7	166	67.2	0	0	0	0	110.8	L295 H296	S293-L295 PolarHBondContact O-N 2.94Å; S293-L295 PolarHBondContact OG-N 3.45Å; S293-H296 PolarHBondContact N-ND1 3.29Å; S293-H296 WeakPolarHBondContact O-CB 3.44Å; S293-H296 PolarHBondContact O-N 2.84Å; S293-H296 PolarHBondContact OG-ND1 2.93Å
294	A	97.5	Very high	97.4	Very high	2 Å²	2	33.7 Å²	33.7	2%	0.017	19%	0.191	C	C	.	.	H	α-helix	trans	-54.7	-36.7	171.5	0	0	0	0	0	111.8	L262 A266 H296 V297 V298 L310	L262-A294 HydrophobicContact CD2-CB 3.6Å; A266-A294 HydrophobicContact CB-CB 4.04Å; A294-H296 PolarHBondContact O-N 3.06Å; A294-V297 WeakPolarHBondContact O-CG2 3.23Å; A294-V297 PolarHBondContact O-N 3.11Å; A294-V298 WeakPolarHBondContact O-CG2 3.41Å; A294-V298 PolarHBondContact O-N 2.81Å; A294-L310 HydrophobicContact CB-CD1 3.9Å; A294-L310 HydrophobicContact CB-CD2 4.19Å
295	L	98	Very high	97.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-28.7	177.9	-164.5	61.6	0	0	0	112.8	S293 V298 S299 V307 L310 L311 A315 T317 P327 L343	S293-L295 PolarHBondContact O-N 2.94Å; S293-L295 PolarHBondContact OG-N 3.45Å; L295-V298 HydrophobicContact CD1-CG2 4.1Å; L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 3.22Å; L295-S299 VanDerWaalsContact O-N 3.09Å; L295-S299 PolarHBondContact O-OG 3.4Å; L295-V307 HydrophobicContact CD1-CB 4.44Å; L295-V307 HydrophobicContact CD1-CG1 4.16Å; L295-V307 HydrophobicContact CD1-CG2 4.25Å; L295-L310 HydrophobicContact CD1-CB 4.25Å; L295-L310 HydrophobicContact CD1-CD1 4.34Å; L295-L311 HydrophobicContact CD2-CD2 4.13Å; L295-A315 HydrophobicContact CD2-CB 4.45Å; L295-T317 HydrophobicContact CD2-CG2 4.21Å; L295-P327 HydrophobicContact CB-CG 4.16Å; L295-P327 HydrophobicContact CD2-CB 4.28Å; L295-P327 HydrophobicContact CD2-CG 4.03Å; L295-P327 HydrophobicContact CG-CB 4.01Å; L295-P327 HydrophobicContact CG-CG 3.96Å; L295-L343 HydrophobicContact CD1-CD2 4.26Å; L295-L343 HydrophobicContact CD2-CD2 3.95Å; L295-L343 HydrophobicContact CG-CD2 4.28Å
296	H	98.4	Very high	97.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.4	-47.8	176.1	-72.3	79.3	0	0	0	112.2	R292 S293 A294 S299 E300 V319 N321 E325 L330	R292-H296 HydrophobicContact CB-CB 4.3Å; S293-H296 PolarHBondContact N-ND1 3.29Å; S293-H296 WeakPolarHBondContact O-CB 3.44Å; S293-H296 PolarHBondContact O-N 2.84Å; S293-H296 PolarHBondContact OG-ND1 2.93Å; A294-H296 PolarHBondContact O-N 3.06Å; H296-S299 PolarHBondContact O-N 3.07Å; H296-E300 WeakPolarHBondContact O-CB 3.47Å; H296-E300 PolarHBondContact O-N 3.41Å; H296-V319 PolarHBondContact CE1-O 3.29Å; H296-V319 PolarHBondContact NE2-O 3.21Å; H296-V319 VanDerWaalsContact NE2-O 3.14Å; H296-N321 PolarHBondContact NE2-N 3.36Å; H296-E325 PolarHBondContact NE2-O 3.23Å; H296-L330 HydrophobicContact CB-CD1 3.95Å; H296-L330 WeakPolarHBondContact O-CD1 3.46Å
297	V	97.3	Very high	97.4	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-67.3	-42.7	-176.8	-70.7	0	0	0	0	111.3	Y263 A266 D267 A294 S299 E300 S301	Y263-V297 HydrophobicContact CE1-CG1 4.32Å; Y263-V297 HydrophobicContact CE2-CG1 3.78Å; Y263-V297 HydrophobicContact CE2-CG2 4.17Å; Y263-V297 VanDerWaalsContact CZ-CG1 3.5Å; Y263-V297 WeakPolarHBondContact OH-CG1 3.49Å; A266-V297 HydrophobicContact CB-CG2 4.25Å; D267-V297 HydrophobicContact CB-CB 4.22Å; D267-V297 HydrophobicContact CB-CG1 4.3Å; D267-V297 HydrophobicContact CB-CG2 4.1Å; D267-V297 WeakPolarHBondContact OD1-CB 3.49Å; D267-V297 VanDerWaalsContact OD1-CG1 3.28Å; D267-V297 WeakPolarHBondContact OD1-CG1 3.28Å; A294-V297 WeakPolarHBondContact O-CG2 3.23Å; A294-V297 PolarHBondContact O-N 3.11Å; V297-S299 VanDerWaalsContact C-N 3.31Å; V297-S299 PolarHBondContact O-N 3.36Å; V297-E300 PolarHBondContact O-N 3.41Å; V297-S301 PolarHBondContact O-N 3.01Å; V297-S301 PolarHBondContact O-OG 3.16Å
298	V	97.7	Very high	97.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.5	-30.4	177.8	-57.1	0	0	0	0	112.4	A266 A294 L295 S301 G302 D303 L306 V307 L310	A266-V298 HydrophobicContact CB-CG1 3.83Å; A294-V298 WeakPolarHBondContact O-CG2 3.41Å; A294-V298 PolarHBondContact O-N 2.81Å; L295-V298 HydrophobicContact CD1-CG2 4.1Å; V298-S301 WeakPolarHBondContact CA-OG 3.33Å; V298-S301 PolarHBondContact O-OG 3.33Å; V298-G302 PolarHBondContact O-N 2.86Å; V298-D303 PolarHBondContact O-N 3.31Å; V298-D303 VanDerWaalsContact O-N 3.14Å; V298-L306 HydrophobicContact CB-CB 4.1Å; V298-L306 HydrophobicContact CG1-CB 3.79Å; V298-L306 HydrophobicContact CG1-CD1 3.8Å; V298-L306 HydrophobicContact CG1-CG 4.42Å; V298-V307 HydrophobicContact CB-CG2 4.13Å; V298-V307 HydrophobicContact CG2-CB 4.49Å; V298-V307 HydrophobicContact CG2-CG2 3.48Å; V298-V307 VanDerWaalsContact CG2-CG2 3.48Å; V298-L310 HydrophobicContact CG1-CD1 4.19Å; V298-L310 HydrophobicContact CG2-CD1 3.67Å
299	S	98.1	Very high	97.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-73.5	-30.3	175.4	-62.7	0	0	0	0	112.5	L295 H296 V297 P327 A331 H336	L295-S299 WeakPolarHBondContact O-CB 3.33Å; L295-S299 PolarHBondContact O-N 3.22Å; L295-S299 VanDerWaalsContact O-N 3.09Å; L295-S299 PolarHBondContact O-OG 3.4Å; H296-S299 PolarHBondContact O-N 3.07Å; V297-S299 VanDerWaalsContact C-N 3.31Å; V297-S299 PolarHBondContact O-N 3.36Å; S299-P327 WeakPolarHBondContact CB-O 3.33Å; S299-A331 WeakPolarHBondContact O-CA 3.3Å; S299-H336 PolarHBondContact O-CD2 3.42Å
300	E	97.5	Very high	97.4	Very high	78 Å²	78	29.2 Å²	29.2	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-73.8	-43.2	173.8	-176.4	170.3	-139.6	0	0	111.7	R292 H296 V297 G302 L330 H336	R292-E300 IonicContact CZ-OE2 2.91Å; R292-E300 IonicContact NH1-OE2 3.2Å; R292-E300 PolarHBondContact NH1-OE2 3.12Å; R292-E300 IonicContact NH2-OE2 3.57Å; R292-E300 PolarHBondContact NH2-OE2 2.99Å; H296-E300 WeakPolarHBondContact O-CB 3.47Å; H296-E300 PolarHBondContact O-N 3.41Å; V297-E300 PolarHBondContact O-N 3.41Å; E300-G302 VanDerWaalsContact C-N 3.31Å; E300-G302 PolarHBondContact O-N 2.88Å; E300-L330 HydrophobicContact CB-CB 4.23Å; E300-L330 HydrophobicContact CB-CD1 4.28Å; E300-H336 PolarHBondContact O-CD2 3.48Å; E300-H336 PolarHBondContact O-NE2 3.16Å
301	S	96.1	Very high	97.5	Very high	62 Å²	62	28.9 Å²	28.9	43%	0.434	16%	0.157	S	C	.	.	H	α-helix	trans	-70.7	-26.7	178.4	69.8	0	0	0	0	113.1	V297 V298 H336	V297-S301 PolarHBondContact O-N 3.01Å; V297-S301 PolarHBondContact O-OG 3.16Å; V298-S301 WeakPolarHBondContact CA-OG 3.33Å; V298-S301 PolarHBondContact O-OG 3.33Å; S301-H336 PolarHBondContact O-NE2 3.03Å
302	G	96.7	Very high	97.5	Very high	24 Å²	24	30 Å²	30	25%	0.247	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	16.2	178.9	0	0	0	0	0	114.3	V298 E300 S304 H336	V298-G302 PolarHBondContact O-N 2.86Å; E300-G302 VanDerWaalsContact C-N 3.31Å; E300-G302 PolarHBondContact O-N 2.88Å; G302-S304 PolarHBondContact O-N 2.87Å; G302-H336 WeakPolarHBondContact CA-CD2 3.39Å; G302-H336 WeakPolarHBondContact CA-NE2 3.45Å; G302-H336 PolarHBondContact N-CD2 3.42Å; G302-H336 PolarHBondContact N-NE2 2.86Å
303	D	96.4	Very high	97.5	Very high	32 Å²	32	31.1 Å²	31.1	17%	0.171	17%	0.169	C	C	.	.			trans	-76.5	90.6	-179.2	-165.6	-31.3	0	0	0	111	S269 V298 S305 L306 V307	S269-D303 PolarHBondContact OG-OD2 3.16Å; V298-D303 PolarHBondContact O-N 3.31Å; V298-D303 VanDerWaalsContact O-N 3.14Å; D303-S305 VanDerWaalsContact C-N 3.26Å; D303-S305 PolarHBondContact O-N 2.86Å; D303-S305 PolarHBondContact OD1-N 3.26Å; D303-L306 HydrophobicContact CB-CB 4.11Å; D303-L306 HydrophobicContact CB-CD1 4.38Å; D303-L306 PolarHBondContact O-N 3.31Å; D303-L306 PolarHBondContact OD1-N 2.61Å; D303-L306 WeakPolarHBondContact OD2-CD1 3.36Å; D303-V307 VanDerWaalsContact O-CG2 3.3Å; D303-V307 WeakPolarHBondContact O-CG2 3.36Å; D303-V307 PolarHBondContact O-N 3.42Å
304	S	96.6	Very high	97.5	Very high	37 Å²	37	37.3 Å²	37.3	26%	0.259	20%	0.202	S	C	.	.	H	α-helix	trans	-65.2	-28.4	-178	57.6	0	0	0	0	113.8	G302 Q308	G302-S304 PolarHBondContact O-N 2.87Å; S304-Q308 WeakPolarHBondContact O-CG 3.49Å; S304-Q308 PolarHBondContact O-N 3.12Å; S304-Q308 VanDerWaalsContact O-N 3.09Å
305	S	97.1	Very high	97.5	Very high	52 Å²	52	37.6 Å²	37.6	36%	0.364	20%	0.204	S	C	.	.	H	α-helix	trans	-69	-49	178.6	-59.6	0	0	0	0	109.8	E271 D303 V307 Q308 L309	E271-S305 WeakPolarHBondContact OE2-CB 3.06Å; D303-S305 VanDerWaalsContact C-N 3.26Å; D303-S305 PolarHBondContact O-N 2.86Å; D303-S305 PolarHBondContact OD1-N 3.26Å; S305-V307 VanDerWaalsContact C-N 3.34Å; S305-V307 PolarHBondContact O-N 2.94Å; S305-Q308 PolarHBondContact O-N 3.42Å; S305-L309 PolarHBondContact O-N 3.2Å
306	L	98.1	Very high	97.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-36.5	176.4	-83.5	-178.5	0	0	0	113.3	E271 V274 V298 D303 L309 L310	E271-L306 HydrophobicContact CB-CD2 4.11Å; E271-L306 HydrophobicContact CB-CG 4.34Å; E271-L306 HydrophobicContact CG-CD2 4.07Å; E271-L306 HydrophobicContact CG-CG 4.45Å; V274-L306 HydrophobicContact CB-CD2 3.77Å; V274-L306 HydrophobicContact CG1-CD2 3.87Å; V274-L306 HydrophobicContact CG2-CD2 3.82Å; V298-L306 HydrophobicContact CB-CB 4.1Å; V298-L306 HydrophobicContact CG1-CB 3.79Å; V298-L306 HydrophobicContact CG1-CD1 3.8Å; V298-L306 HydrophobicContact CG1-CG 4.42Å; D303-L306 HydrophobicContact CB-CB 4.11Å; D303-L306 HydrophobicContact CB-CD1 4.38Å; D303-L306 PolarHBondContact O-N 3.31Å; D303-L306 PolarHBondContact OD1-N 2.61Å; D303-L306 WeakPolarHBondContact OD2-CD1 3.36Å; L306-L309 HydrophobicContact CD2-CD2 4.14Å; L306-L309 PolarHBondContact O-N 3.35Å; L306-L310 WeakPolarHBondContact O-CB 3.33Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 2.56Å
307	V	98.4	Very high	97.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-48.6	173.3	166.6	0	0	0	0	110.5	L295 V298 D303 S305 L309 L310 L311 V339 L343	L295-V307 HydrophobicContact CD1-CB 4.44Å; L295-V307 HydrophobicContact CD1-CG1 4.16Å; L295-V307 HydrophobicContact CD1-CG2 4.25Å; V298-V307 HydrophobicContact CB-CG2 4.13Å; V298-V307 HydrophobicContact CG2-CB 4.49Å; V298-V307 HydrophobicContact CG2-CG2 3.48Å; V298-V307 VanDerWaalsContact CG2-CG2 3.48Å; D303-V307 VanDerWaalsContact O-CG2 3.3Å; D303-V307 WeakPolarHBondContact O-CG2 3.36Å; D303-V307 PolarHBondContact O-N 3.42Å; S305-V307 VanDerWaalsContact C-N 3.34Å; S305-V307 PolarHBondContact O-N 2.94Å; V307-L309 VanDerWaalsContact C-N 3.34Å; V307-L309 PolarHBondContact O-N 2.86Å; V307-L310 PolarHBondContact O-N 3.22Å; V307-L311 HydrophobicContact CG1-CD1 3.72Å; V307-L311 HydrophobicContact CG1-CG 4.41Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 WeakPolarHBondContact O-CD1 3.5Å; V307-L311 WeakPolarHBondContact O-CG 3.33Å; V307-L311 PolarHBondContact O-N 3.23Å; V307-V339 HydrophobicContact CG1-CG1 4.37Å; V307-V339 HydrophobicContact CG2-CG1 3.9Å; V307-V339 HydrophobicContact CG2-CG2 4.04Å; V307-L343 HydrophobicContact CG1-CD2 4.2Å; V307-L343 HydrophobicContact CG1-CG 4.32Å
308	Q	98.1	Very high	97.3	Very high	97 Å²	97	46.7 Å²	46.7	45%	0.453	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-45.5	178	-73.9	174.3	7.7	0	0	111.4	S304 S305 L310 L311 E312 S342	S304-Q308 WeakPolarHBondContact O-CG 3.49Å; S304-Q308 PolarHBondContact O-N 3.12Å; S304-Q308 VanDerWaalsContact O-N 3.09Å; S305-Q308 PolarHBondContact O-N 3.42Å; Q308-L310 PolarHBondContact O-N 3.32Å; Q308-L311 PolarHBondContact O-N 2.98Å; Q308-E312 WeakPolarHBondContact O-CG 3.49Å; Q308-E312 PolarHBondContact O-N 3.23Å; Q308-S342 PolarHBondContact NE2-OG 3.37Å
309	L	98.1	Very high	97.2	Very high	16 Å²	16	48 Å²	48	8%	0.084	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-49.5	177.1	178.2	61.5	0	0	0	112	V274 L275 L278 S305 L306 V307 L311 E312 Y313	V274-L309 HydrophobicContact CB-CD2 4.31Å; V274-L309 HydrophobicContact CG1-CD2 3.89Å; L275-L309 HydrophobicContact CB-CD2 3.99Å; L275-L309 HydrophobicContact CD1-CD1 3.72Å; L278-L309 HydrophobicContact CD1-CD1 4.23Å; L278-L309 HydrophobicContact CD1-CD2 4.21Å; L278-L309 HydrophobicContact CD1-CG 3.84Å; S305-L309 PolarHBondContact O-N 3.2Å; L306-L309 HydrophobicContact CD2-CD2 4.14Å; L306-L309 PolarHBondContact O-N 3.35Å; V307-L309 VanDerWaalsContact C-N 3.34Å; V307-L309 PolarHBondContact O-N 2.86Å; L309-L311 VanDerWaalsContact C-N 3.3Å; L309-L311 PolarHBondContact O-N 3.47Å; L309-E312 WeakPolarHBondContact O-CB 3.44Å; L309-E312 PolarHBondContact O-N 3.45Å; L309-Y313 HydrophobicContact CD1-CD2 3.97Å; L309-Y313 HydrophobicContact CD1-CE2 3.64Å; L309-Y313 WeakPolarHBondContact O-CD2 3.46Å; L309-Y313 PolarHBondContact O-N 3.09Å
310	L	98.2	Very high	97.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-37.2	179	-72.4	171.3	0	0	0	112.2	L262 V274 L278 P284 A294 L295 V298 L306 V307 Q308 Y313 N314 A315	L262-L310 HydrophobicContact CD2-CD2 4.15Å; V274-L310 HydrophobicContact CG1-CD2 4.2Å; L278-L310 HydrophobicContact CD1-CD2 4.27Å; P284-L310 HydrophobicContact CB-CD2 3.79Å; A294-L310 HydrophobicContact CB-CD1 3.9Å; A294-L310 HydrophobicContact CB-CD2 4.19Å; L295-L310 HydrophobicContact CD1-CB 4.25Å; L295-L310 HydrophobicContact CD1-CD1 4.34Å; V298-L310 HydrophobicContact CG1-CD1 4.19Å; V298-L310 HydrophobicContact CG2-CD1 3.67Å; L306-L310 WeakPolarHBondContact O-CB 3.33Å; L306-L310 WeakPolarHBondContact O-CG 3.4Å; L306-L310 PolarHBondContact O-N 2.56Å; V307-L310 PolarHBondContact O-N 3.22Å; Q308-L310 PolarHBondContact O-N 3.32Å; L310-Y313 CarbonylContact O-C 3.42Å; L310-Y313 PolarHBondContact O-N 2.95Å; L310-N314 PolarHBondContact O-N 2.89Å; L310-A315 HydrophobicContact CB-CB 3.83Å; L310-A315 WeakPolarHBondContact O-CB 3.34Å; L310-A315 PolarHBondContact O-N 3.4Å
311	L	97.8	Very high	97.1	Very high	32 Å²	32	48.2 Å²	48.2	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-36.9	176.3	-66.9	168.3	0	0	0	112.3	L295 V307 Q308 L309 Y313 N314 T317 L343 A346	L295-L311 HydrophobicContact CD2-CD2 4.13Å; V307-L311 HydrophobicContact CG1-CD1 3.72Å; V307-L311 HydrophobicContact CG1-CG 4.41Å; V307-L311 WeakPolarHBondContact O-CB 3.47Å; V307-L311 WeakPolarHBondContact O-CD1 3.5Å; V307-L311 WeakPolarHBondContact O-CG 3.33Å; V307-L311 PolarHBondContact O-N 3.23Å; Q308-L311 PolarHBondContact O-N 2.98Å; L309-L311 VanDerWaalsContact C-N 3.3Å; L309-L311 PolarHBondContact O-N 3.47Å; L311-Y313 PolarHBondContact O-N 3.06Å; L311-N314 PolarHBondContact O-N 3.48Å; L311-N314 VanDerWaalsContact O-N 3.12Å; L311-T317 HydrophobicContact CD2-CG2 3.34Å; L311-L343 HydrophobicContact CD1-CD2 4.4Å; L311-L343 HydrophobicContact CD2-CD2 4.4Å; L311-A346 HydrophobicContact CD1-CB 3.91Å; L311-A346 HydrophobicContact CD2-CB 4.01Å; L311-A346 HydrophobicContact CG-CB 4.43Å
312	E	97.6	Very high	97.1	Very high	143 Å²	143	50.7 Å²	50.7	67%	0.668	26%	0.264	S	S	*	.	H	α-helix	trans	-60.8	-31.4	173.4	-73.9	176	-178	0	0	111.9	Q308 L309 N314	Q308-E312 WeakPolarHBondContact O-CG 3.49Å; Q308-E312 PolarHBondContact O-N 3.23Å; L309-E312 WeakPolarHBondContact O-CB 3.44Å; L309-E312 PolarHBondContact O-N 3.45Å; E312-N314 VanDerWaalsContact C-N 3.34Å
313	Y	97.8	Very high	96.9	Very high	75 Å²	75	53.7 Å²	53.7	29%	0.294	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	33.2	175	-70	-107	0	0	0	112.8	L275 L278 D279 L309 L310 L311 A315	L275-Y313 HydrophobicContact CD1-CE2 4.36Å; L278-Y313 HydrophobicContact CB-CD1 3.65Å; L278-Y313 HydrophobicContact CB-CD2 4.38Å; L278-Y313 HydrophobicContact CB-CE1 3.69Å; L278-Y313 HydrophobicContact CB-CE2 4.44Å; L278-Y313 HydrophobicContact CB-CG 4Å; L278-Y313 HydrophobicContact CD1-CD1 4.41Å; L278-Y313 HydrophobicContact CD1-CD2 3.84Å; L278-Y313 HydrophobicContact CD1-CE2 4.33Å; L278-Y313 HydrophobicContact CD1-CG 3.88Å; L278-Y313 HydrophobicContact CD2-CD1 4.11Å; L278-Y313 HydrophobicContact CD2-CG 3.98Å; L278-Y313 HydrophobicContact CG-CD1 4.28Å; L278-Y313 HydrophobicContact CG-CG 4.18Å; D279-Y313 PolarHBondContact OD1-OH 2.95Å; L309-Y313 HydrophobicContact CD1-CD2 3.97Å; L309-Y313 HydrophobicContact CD1-CE2 3.64Å; L309-Y313 WeakPolarHBondContact O-CD2 3.46Å; L309-Y313 PolarHBondContact O-N 3.09Å; L310-Y313 CarbonylContact O-C 3.42Å; L310-Y313 PolarHBondContact O-N 2.95Å; L311-Y313 PolarHBondContact O-N 3.06Å; Y313-A315 VanDerWaalsContact C-N 3.3Å; Y313-A315 PolarHBondContact O-N 2.77Å
314	N	95.8	Very high	97	Very high	130 Å²	130	56 Å²	56	70%	0.695	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	30.7	170.6	-58.3	110.3	0	0	0	115.4	L310 L311 E312 H316	L310-N314 PolarHBondContact O-N 2.89Å; L311-N314 PolarHBondContact O-N 3.48Å; L311-N314 VanDerWaalsContact O-N 3.12Å; E312-N314 VanDerWaalsContact C-N 3.34Å; N314-H316 PolarHBondContact O-N 3.39Å
315	A	97.4	Very high	97	Very high	8 Å²	8	55.6 Å²	55.6	7%	0.066	28%	0.277	C	S	.	.			trans	-60.3	133.4	171.4	0	0	0	0	0	111.7	P284 N285 L295 L310 Y313 T317	P284-A315 HydrophobicContact CB-CB 4.27Å; P284-A315 HydrophobicContact CG-CB 4.33Å; N285-A315 WeakPolarHBondContact OD1-CA 3.33Å; L295-A315 HydrophobicContact CD2-CB 4.45Å; L310-A315 HydrophobicContact CB-CB 3.83Å; L310-A315 WeakPolarHBondContact O-CB 3.34Å; L310-A315 PolarHBondContact O-N 3.4Å; Y313-A315 VanDerWaalsContact C-N 3.3Å; Y313-A315 PolarHBondContact O-N 2.77Å; A315-T317 PolarHBondContact O-N 3.04Å
316	H	97.4	Very high	97	Very high	110 Å²	110	53.2 Å²	53.2	51%	0.509	26%	0.261	S	S	.	.			trans	-70	119.1	-179.6	-64.3	-26	0	0	0	111.6	N285 N314 V319	N285-H316 WeakPolarHBondContact OD1-CB 3.26Å; N285-H316 PolarHBondContact OD1-CD2 3.41Å; N285-H316 VanDerWaalsContact OD1-CG 3.22Å; N285-H316 PolarHBondContact OD1-N 3.13Å; N314-H316 PolarHBondContact O-N 3.39Å; H316-V319 HydrophobicContact CB-CG2 3.45Å; H316-V319 VanDerWaalsContact CB-CG2 3.45Å
317	T	96.5	Very high	97	Very high	23 Å²	23	53.2 Å²	53.2	14%	0.141	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-26.6	-174.9	43.6	0	0	0	0	114.8	L295 L311 A315 P327 L343 A346 C348	L295-T317 HydrophobicContact CD2-CG2 4.21Å; L311-T317 HydrophobicContact CD2-CG2 3.34Å; A315-T317 PolarHBondContact O-N 3.04Å; T317-P327 WeakPolarHBondContact O-CD 3.44Å; T317-L343 HydrophobicContact CG2-CD2 4.31Å; T317-A346 HydrophobicContact CG2-CB 4.48Å; T317-C348 HydrophobicContact CG2-CB 4.13Å
318	D	95.4	Very high	97	Very high	61 Å²	61	53.4 Å²	53.4	33%	0.326	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	9.1	-167.1	-60.1	-30.3	0	0	0	113.4	Q320 C348 N349 V352	D318-Q320 PolarHBondContact O-N 3.27Å; D318-C348 WeakPolarHBondContact OD1-CA 3.35Å; D318-C348 WeakPolarHBondContact OD1-CB 3.48Å; D318-N349 VanDerWaalsContact CG-N 3.34Å; D318-N349 PolarHBondContact OD1-N 3.24Å; D318-N349 VanDerWaalsContact OD2-CB 3.28Å; D318-N349 WeakPolarHBondContact OD2-CB 3.41Å; D318-N349 PolarHBondContact OD2-N 3.46Å; D318-V352 HydrophobicContact CB-CG2 4.45Å
319	V	95.9	Very high	97	Very high	29 Å²	29	48.9 Å²	48.9	18%	0.176	24%	0.241	C	C	.	.			trans	-62	136	175.8	-178.1	0	0	0	0	109.1	L287 H296 H316 A326 P327	L287-V319 HydrophobicContact CD1-CG1 3.83Å; L287-V319 HydrophobicContact CD2-CG1 3.76Å; L287-V319 HydrophobicContact CG-CG1 4.48Å; H296-V319 PolarHBondContact CE1-O 3.29Å; H296-V319 PolarHBondContact NE2-O 3.21Å; H296-V319 VanDerWaalsContact NE2-O 3.14Å; H316-V319 HydrophobicContact CB-CG2 3.45Å; H316-V319 VanDerWaalsContact CB-CG2 3.45Å; V319-A326 WeakPolarHBondContact O-CA 3.28Å; V319-P327 VanDerWaalsContact O-CD 3.28Å; V319-P327 WeakPolarHBondContact O-CD 3.42Å
320	Q	96.9	Very high	97	Very high	68 Å²	68	48.5 Å²	48.5	32%	0.318	24%	0.239	S	C	.	.			trans	-108.4	130.7	180	-66.8	-176.3	-74.5	0	0	111.4	D318 L324 E325 A326 V352 A353	D318-Q320 PolarHBondContact O-N 3.27Å; Q320-L324 HydrophobicContact CB-CD2 4.49Å; Q320-L324 PolarHBondContact NE2-O 3.05Å; Q320-E325 WeakPolarHBondContact CA-O 3.11Å; Q320-A326 HydrophobicContact CG-CB 4.44Å; Q320-V352 VanDerWaalsContact CD-CG1 3.49Å; Q320-V352 HydrophobicContact CG-CG1 3.8Å; Q320-A353 PolarHBondContact NE2-O 3.23Å
321	N	96.6	Very high	97	Very high	14 Å²	14	48.5 Å²	48.5	8%	0.075	24%	0.239	C	C	.	.			trans	-70.1	-175.5	174.8	74.8	9.6	0	0	0	112.7	K291 R292 H296 Q323 L324 E325	K291-N321 WeakPolarHBondContact O-CA 3.29Å; R292-N321 HydrophobicContact CG-CB 4.22Å; H296-N321 PolarHBondContact NE2-N 3.36Å; N321-Q323 PolarHBondContact O-N 3.43Å; N321-Q323 VanDerWaalsContact O-N 3.14Å; N321-Q323 VanDerWaalsContact OD1-CA 3.32Å; N321-Q323 WeakPolarHBondContact OD1-CA 3.45Å; N321-Q323 WeakPolarHBondContact OD1-CB 3.5Å; N321-Q323 PolarHBondContact OD1-N 2.67Å; N321-L324 WeakPolarHBondContact O-CA 3.41Å; N321-L324 PolarHBondContact O-N 3.5Å; N321-L324 PolarHBondContact OD1-N 3Å; N321-E325 PolarHBondContact N-O 2.95Å; N321-E325 PolarHBondContact ND2-OE2 3.03Å; N321-E325 PolarHBondContact OD1-N 3.21Å
322	Q	95.7	Very high	97	Very high	113 Å²	113	47 Å²	47	53%	0.528	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22	176.5	-78.6	-178.4	-1.2	0	0	115.3	V289 A290 K291 L324	V289-Q322 PolarHBondContact O-NE2 3.44Å; A290-Q322 WeakPolarHBondContact O-CG 3.33Å; A290-Q322 PolarHBondContact O-N 3.28Å; K291-Q322 HydrophobicContact CB-CG 4.49Å; K291-Q322 HydrophobicContact CD-CG 4.5Å; K291-Q322 HydrophobicContact CG-CG 4.29Å; Q322-L324 VanDerWaalsContact C-N 3.29Å
323	Q	94	Very high	97	Very high	87 Å²	87	43.5 Å²	43.5	41%	0.407	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.1	173	-56.9	-54.7	-26.9	0	0	113	N321 E325 K355	N321-Q323 PolarHBondContact O-N 3.43Å; N321-Q323 VanDerWaalsContact O-N 3.14Å; N321-Q323 VanDerWaalsContact OD1-CA 3.32Å; N321-Q323 WeakPolarHBondContact OD1-CA 3.45Å; N321-Q323 WeakPolarHBondContact OD1-CB 3.5Å; N321-Q323 PolarHBondContact OD1-N 2.67Å; Q323-E325 HydrophobicContact CB-CG 3.98Å; Q323-E325 PolarHBondContact O-N 3.09Å; Q323-K355 WeakPolarHBondContact O-CB 3.44Å; Q323-K355 PolarHBondContact O-N 3.4Å; Q323-K355 VanDerWaalsContact O-N 3.08Å; Q323-K355 VanDerWaalsContact OE1-CD 3.32Å
324	L	96.8	Very high	96.9	Very high	80 Å²	80	43.6 Å²	43.6	42%	0.419	22%	0.219	S	C	.	.	S	Bend	trans	59.2	21.4	-173.5	-57	178.8	0	0	0	113.4	Q320 N321 Q322 D354 K355	Q320-L324 HydrophobicContact CB-CD2 4.49Å; Q320-L324 PolarHBondContact NE2-O 3.05Å; N321-L324 WeakPolarHBondContact O-CA 3.41Å; N321-L324 PolarHBondContact O-N 3.5Å; N321-L324 PolarHBondContact OD1-N 3Å; Q322-L324 VanDerWaalsContact C-N 3.29Å; L324-D354 WeakPolarHBondContact O-CA 3.47Å; L324-K355 HydrophobicContact CB-CB 4.49Å
325	E	97.6	Very high	96.9	Very high	29 Å²	29	38.2 Å²	38.2	14%	0.136	20%	0.195	C	C	.	.			trans	-86.7	124	178.5	-59.4	169.4	120.7	0	0	109.5	H296 Q320 N321 Q323 H329 L330 K333 D354	H296-E325 PolarHBondContact NE2-O 3.23Å; Q320-E325 WeakPolarHBondContact CA-O 3.11Å; N321-E325 PolarHBondContact N-O 2.95Å; N321-E325 PolarHBondContact ND2-OE2 3.03Å; N321-E325 PolarHBondContact OD1-N 3.21Å; Q323-E325 HydrophobicContact CB-CG 3.98Å; Q323-E325 PolarHBondContact O-N 3.09Å; E325-H329 HydrophobicContact CB-CB 4.11Å; E325-L330 HydrophobicContact CB-CD2 4.32Å; E325-K333 IonicContact OE1-NZ 3.02Å; E325-K333 PolarHBondContact OE1-NZ 3.46Å; E325-D354 HydrophobicContact CG-CB 4.21Å
326	A	97.7	Very high	96.9	Very high	2 Å²	2	40.2 Å²	40.2	2%	0.017	20%	0.203	C	C	.	.			trans	-79.6	160.2	165.4	0	0	0	0	0	111.6	V319 Q320 L328 H329 V352	V319-A326 WeakPolarHBondContact O-CA 3.28Å; Q320-A326 HydrophobicContact CG-CB 4.44Å; A326-L328 PolarHBondContact O-N 3.16Å; A326-H329 PolarHBondContact N-ND1 3.14Å; A326-H329 WeakPolarHBondContact O-CB 3.48Å; A326-H329 PolarHBondContact O-N 3.47Å; A326-H329 PolarHBondContact O-ND1 3.28Å; A326-V352 HydrophobicContact CB-CG1 4.1Å
327	P	98.1	Very high	96.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-46	-39.4	175.7	-31	33.8	0	0	0	114.5	L295 S299 T317 V319 H329 L330 A331 L343	L295-P327 HydrophobicContact CB-CG 4.16Å; L295-P327 HydrophobicContact CD2-CB 4.28Å; L295-P327 HydrophobicContact CD2-CG 4.03Å; L295-P327 HydrophobicContact CG-CB 4.01Å; L295-P327 HydrophobicContact CG-CG 3.96Å; S299-P327 WeakPolarHBondContact CB-O 3.33Å; T317-P327 WeakPolarHBondContact O-CD 3.44Å; V319-P327 VanDerWaalsContact O-CD 3.28Å; V319-P327 WeakPolarHBondContact O-CD 3.42Å; P327-H329 VanDerWaalsContact C-N 3.32Å; P327-H329 PolarHBondContact O-N 3.28Å; P327-L330 PolarHBondContact O-N 2.85Å; P327-A331 PolarHBondContact O-N 2.85Å; P327-L343 HydrophobicContact CB-CD1 4.23Å
328	L	97.9	Very high	96.9	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-38.3	176.2	-176.5	64.5	0	0	0	112.8	A326 L330 A331 V332 I340 L343 V344 I350 A360 L376	A326-L328 PolarHBondContact O-N 3.16Å; L328-L330 PolarHBondContact O-N 3.22Å; L328-A331 PolarHBondContact O-N 3.49Å; L328-V332 HydrophobicContact CD1-CG2 4.29Å; L328-V332 HydrophobicContact CG-CG2 4.41Å; L328-V332 WeakPolarHBondContact O-CB 3.44Å; L328-V332 WeakPolarHBondContact O-CG2 3.46Å; L328-V332 PolarHBondContact O-N 3.22Å; L328-I340 HydrophobicContact CD1-CG2 3.97Å; L328-L343 HydrophobicContact CB-CD1 4.3Å; L328-L343 HydrophobicContact CD1-CB 4.39Å; L328-L343 HydrophobicContact CD1-CD1 4.34Å; L328-V344 HydrophobicContact CD1-CG2 4.29Å; L328-I350 HydrophobicContact CD2-CB 4.34Å; L328-I350 HydrophobicContact CD2-CG2 4.06Å; L328-A360 HydrophobicContact CD2-CB 3.65Å; L328-A360 HydrophobicContact CG-CB 3.92Å; L328-L376 HydrophobicContact CD2-CD2 4.48Å
329	H	98.3	Very high	97	Very high	2 Å²	2	38 Å²	38	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-43.4	177.8	-62.6	84.7	0	0	0	111.1	E325 A326 P327 V332 K333 V352 Q358 L363	E325-H329 HydrophobicContact CB-CB 4.11Å; A326-H329 PolarHBondContact N-ND1 3.14Å; A326-H329 WeakPolarHBondContact O-CB 3.48Å; A326-H329 PolarHBondContact O-N 3.47Å; A326-H329 PolarHBondContact O-ND1 3.28Å; P327-H329 VanDerWaalsContact C-N 3.32Å; P327-H329 PolarHBondContact O-N 3.28Å; H329-V332 PolarHBondContact O-N 3.06Å; H329-K333 WeakPolarHBondContact O-CB 3.21Å; H329-K333 WeakPolarHBondContact O-CG 3.45Å; H329-K333 PolarHBondContact O-N 3.49Å; H329-V352 PolarHBondContact CE1-O 2.94Å; H329-V352 VanDerWaalsContact CE1-O 3.23Å; H329-V352 PolarHBondContact NE2-O 3.24Å; H329-Q358 PolarHBondContact NE2-O 3.35Å; H329-L363 HydrophobicContact CB-CD1 3.99Å
330	L	97.9	Very high	97.1	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-42.3	179.5	-59.2	179.7	0	0	0	111.2	H296 E300 E325 P327 L328 V332 K333 N334	H296-L330 HydrophobicContact CB-CD1 3.95Å; H296-L330 WeakPolarHBondContact O-CD1 3.46Å; E300-L330 HydrophobicContact CB-CB 4.23Å; E300-L330 HydrophobicContact CB-CD1 4.28Å; E325-L330 HydrophobicContact CB-CD2 4.32Å; P327-L330 PolarHBondContact O-N 2.85Å; L328-L330 PolarHBondContact O-N 3.22Å; L330-V332 VanDerWaalsContact C-N 3.35Å; L330-V332 PolarHBondContact O-N 3.35Å; L330-K333 PolarHBondContact O-N 2.99Å; L330-N334 PolarHBondContact O-N 3.03Å; L330-N334 VanDerWaalsContact O-N 3.09Å; L330-N334 PolarHBondContact O-ND2 3.16Å
331	A	98.1	Very high	97.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-41.7	175.3	0	0	0	0	0	111.9	S299 P327 L328 G335 H336 V339 I340 L343	S299-A331 WeakPolarHBondContact O-CA 3.3Å; P327-A331 PolarHBondContact O-N 2.85Å; L328-A331 PolarHBondContact O-N 3.49Å; A331-G335 PolarHBondContact O-N 2.85Å; A331-H336 PolarHBondContact O-N 3.42Å; A331-V339 HydrophobicContact CB-CB 4.22Å; A331-V339 HydrophobicContact CB-CG1 3.57Å; A331-I340 HydrophobicContact CB-CG1 3.71Å; A331-L343 HydrophobicContact CB-CD1 4.31Å
332	V	97.9	Very high	97.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.6	-43.1	176.5	172.8	0	0	0	0	111.9	L328 H329 L330 N334 G335 I340 A360 L363 R369 V372	L328-V332 HydrophobicContact CD1-CG2 4.29Å; L328-V332 HydrophobicContact CG-CG2 4.41Å; L328-V332 WeakPolarHBondContact O-CB 3.44Å; L328-V332 WeakPolarHBondContact O-CG2 3.46Å; L328-V332 PolarHBondContact O-N 3.22Å; H329-V332 PolarHBondContact O-N 3.06Å; L330-V332 VanDerWaalsContact C-N 3.35Å; L330-V332 PolarHBondContact O-N 3.35Å; V332-N334 VanDerWaalsContact C-N 3.28Å; V332-N334 PolarHBondContact O-N 3.39Å; V332-G335 PolarHBondContact O-N 3.47Å; V332-I340 HydrophobicContact CB-CD1 4.48Å; V332-I340 HydrophobicContact CG2-CD1 3.88Å; V332-I340 HydrophobicContact CG2-CG1 4.09Å; V332-A360 HydrophobicContact CG2-CB 4.19Å; V332-L363 HydrophobicContact CG1-CB 3.86Å; V332-R369 VanDerWaalsContact O-CD 3.26Å; V332-R369 WeakPolarHBondContact O-CD 3.14Å; V332-R369 PolarHBondContact O-NE 3.09Å; V332-V372 HydrophobicContact CG1-CG1 4.29Å; V332-V372 HydrophobicContact CG2-CG1 3.9Å
333	K	97	Very high	97.2	Very high	69 Å²	69	33.1 Å²	33.1	30%	0.3	17%	0.173	S	C	.	.	H	α-helix	trans	-60	-40.1	178.3	-78.1	178.9	-177.9	179.6	0	111.6	E325 H329 L330 D354 L363 R369	E325-K333 IonicContact OE1-NZ 3.02Å; E325-K333 PolarHBondContact OE1-NZ 3.46Å; H329-K333 WeakPolarHBondContact O-CB 3.21Å; H329-K333 WeakPolarHBondContact O-CG 3.45Å; H329-K333 PolarHBondContact O-N 3.49Å; L330-K333 PolarHBondContact O-N 2.99Å; K333-D354 IonicContact NZ-OD2 2.73Å; K333-L363 HydrophobicContact CD-CD1 4.43Å; K333-L363 HydrophobicContact CG-CD1 4.08Å; K333-R369 PolarHBondContact O-NH2 3.2Å
334	N	95.8	Very high	97.3	Very high	77 Å²	77	30 Å²	30	41%	0.412	16%	0.16	S	C	.	.	H	α-helix	trans	-88.4	-19.2	180	-67.4	-61.5	0	0	0	114.2	L330 V332 H336 R369	L330-N334 PolarHBondContact O-N 3.03Å; L330-N334 VanDerWaalsContact O-N 3.09Å; L330-N334 PolarHBondContact O-ND2 3.16Å; V332-N334 VanDerWaalsContact C-N 3.28Å; V332-N334 PolarHBondContact O-N 3.39Å; N334-H336 WeakPolarHBondContact CB-NE2 3.46Å; N334-R369 PolarHBondContact O-NH2 2.89Å
335	G	95.3	Very high	97.2	Very high	18 Å²	18	29.9 Å²	29.9	19%	0.186	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	23.2	173.1	0	0	0	0	0	115.7	A331 V332 I337	A331-G335 PolarHBondContact O-N 2.85Å; V332-G335 PolarHBondContact O-N 3.47Å; G335-I337 VanDerWaalsContact C-N 3.31Å; G335-I337 PolarHBondContact O-N 2.92Å
336	H	97.7	Very high	97	Very high	50 Å²	50	31.1 Å²	31.1	23%	0.231	19%	0.185	C	C	.	.			trans	-81.4	76.9	-173.9	-60.7	-46.9	0	0	0	110.6	S299 E300 S301 G302 A331 N334 P338 V339 I340	S299-H336 PolarHBondContact O-CD2 3.42Å; E300-H336 PolarHBondContact O-CD2 3.48Å; E300-H336 PolarHBondContact O-NE2 3.16Å; S301-H336 PolarHBondContact O-NE2 3.03Å; G302-H336 WeakPolarHBondContact CA-CD2 3.39Å; G302-H336 WeakPolarHBondContact CA-NE2 3.45Å; G302-H336 PolarHBondContact N-CD2 3.42Å; G302-H336 PolarHBondContact N-NE2 2.86Å; A331-H336 PolarHBondContact O-N 3.42Å; N334-H336 WeakPolarHBondContact CB-NE2 3.46Å; H336-P338 VanDerWaalsContact C-CD 3.45Å; H336-P338 VanDerWaalsContact C-N 3.33Å; H336-V339 HydrophobicContact CB-CB 3.95Å; H336-V339 HydrophobicContact CB-CG2 4.02Å; H336-V339 WeakPolarHBondContact O-CB 3.47Å; H336-V339 PolarHBondContact O-N 3.48Å; H336-I340 WeakPolarHBondContact O-CG1 3.32Å; H336-I340 PolarHBondContact O-N 2.98Å
337	I	96.7	Very high	96.8	Very high	70 Å²	70	33.8 Å²	33.8	36%	0.359	21%	0.213	S	C	.	.	H	α-helix	trans	-49.6	-44.4	-176.7	-64.3	173.3	0	0	0	113.1	G335 V339 I340 H341 E371 V372 M375	G335-I337 VanDerWaalsContact C-N 3.31Å; G335-I337 PolarHBondContact O-N 2.92Å; I337-V339 VanDerWaalsContact C-N 3.33Å; I337-V339 PolarHBondContact O-N 2.84Å; I337-I340 PolarHBondContact O-N 2.92Å; I337-H341 WeakPolarHBondContact O-CB 3.45Å; I337-H341 PolarHBondContact O-N 2.77Å; I337-E371 HydrophobicContact CD1-CB 3.8Å; I337-E371 HydrophobicContact CD1-CG 4.13Å; I337-V372 HydrophobicContact CG1-CG2 4.24Å; I337-M375 HydrophobicContact CG2-CE 4.1Å
338	P	97.8	Very high	96.6	Very high	77 Å²	77	34.2 Å²	34.2	50%	0.5	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-36.1	178.2	-24.4	36.4	0	0	0	113.8	H336 S342	H336-P338 VanDerWaalsContact C-CD 3.45Å; H336-P338 VanDerWaalsContact C-N 3.33Å; P338-S342 WeakPolarHBondContact O-CB 3.34Å; P338-S342 PolarHBondContact O-N 3.35Å; P338-S342 PolarHBondContact O-OG 3.29Å
339	V	98.2	Very high	96.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.2	-47.9	174.9	170.4	0	0	0	0	110.3	V307 A331 H336 I337 H341 S342 L343	V307-V339 HydrophobicContact CG1-CG1 4.37Å; V307-V339 HydrophobicContact CG2-CG1 3.9Å; V307-V339 HydrophobicContact CG2-CG2 4.04Å; A331-V339 HydrophobicContact CB-CB 4.22Å; A331-V339 HydrophobicContact CB-CG1 3.57Å; H336-V339 HydrophobicContact CB-CB 3.95Å; H336-V339 HydrophobicContact CB-CG2 4.02Å; H336-V339 WeakPolarHBondContact O-CB 3.47Å; H336-V339 PolarHBondContact O-N 3.48Å; I337-V339 VanDerWaalsContact C-N 3.33Å; I337-V339 PolarHBondContact O-N 2.84Å; V339-H341 VanDerWaalsContact C-N 3.28Å; V339-H341 PolarHBondContact O-N 3.34Å; V339-S342 PolarHBondContact O-N 3.45Å; V339-S342 VanDerWaalsContact O-N 3.08Å; V339-L343 HydrophobicContact CG1-CD1 3.83Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CG 3.44Å; V339-L343 PolarHBondContact O-N 2.73Å
340	I	97.9	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.3	-46.6	177.9	-62	165.3	0	0	0	109.8	L328 A331 V332 H336 I337 S342 L343 V344 V372 M375	L328-I340 HydrophobicContact CD1-CG2 3.97Å; A331-I340 HydrophobicContact CB-CG1 3.71Å; V332-I340 HydrophobicContact CB-CD1 4.48Å; V332-I340 HydrophobicContact CG2-CD1 3.88Å; V332-I340 HydrophobicContact CG2-CG1 4.09Å; H336-I340 WeakPolarHBondContact O-CG1 3.32Å; H336-I340 PolarHBondContact O-N 2.98Å; I337-I340 PolarHBondContact O-N 2.92Å; I340-S342 PolarHBondContact O-N 3.44Å; I340-L343 PolarHBondContact O-N 2.78Å; I340-V344 HydrophobicContact CG2-CG2 4.35Å; I340-V344 WeakPolarHBondContact O-CB 3.46Å; I340-V344 VanDerWaalsContact O-CG2 3.26Å; I340-V344 WeakPolarHBondContact O-CG2 3.44Å; I340-V344 PolarHBondContact O-N 3.34Å; I340-V372 HydrophobicContact CD1-CB 4.44Å; I340-V372 HydrophobicContact CD1-CG1 4.04Å; I340-V372 HydrophobicContact CD1-CG2 3.51Å; I340-V372 HydrophobicContact CG2-CG1 4.28Å; I340-M375 HydrophobicContact CB-SD 4.45Å; I340-M375 HydrophobicContact CG2-SD 3.73Å
341	H	96.4	Very high	96.2	Very high	109 Å²	109	40.2 Å²	40.2	51%	0.505	25%	0.248	S	C	.	.	H	α-helix	trans	-58.4	-46.4	176.1	-178.8	-84.8	0	0	0	112.1	I337 V339 V344 A345 M375	I337-H341 WeakPolarHBondContact O-CB 3.45Å; I337-H341 PolarHBondContact O-N 2.77Å; V339-H341 VanDerWaalsContact C-N 3.28Å; V339-H341 PolarHBondContact O-N 3.34Å; H341-V344 PolarHBondContact O-N 3.23Å; H341-A345 WeakPolarHBondContact O-CB 3.46Å; H341-A345 PolarHBondContact O-N 3.2Å; H341-M375 VanDerWaalsContact CA-SD 3.57Å; H341-M375 HydrophobicContact CB-CE 3.81Å; H341-M375 HydrophobicContact CB-SD 4.06Å
342	S	97.4	Very high	96.2	Very high	11 Å²	11	41 Å²	41	8%	0.077	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-43.1	-178.9	-56.7	0	0	0	0	111.8	Q308 P338 V339 I340 A345 A346	Q308-S342 PolarHBondContact NE2-OG 3.37Å; P338-S342 WeakPolarHBondContact O-CB 3.34Å; P338-S342 PolarHBondContact O-N 3.35Å; P338-S342 PolarHBondContact O-OG 3.29Å; V339-S342 PolarHBondContact O-N 3.45Å; V339-S342 VanDerWaalsContact O-N 3.08Å; I340-S342 PolarHBondContact O-N 3.44Å; S342-A345 PolarHBondContact O-N 2.93Å; S342-A346 WeakPolarHBondContact O-CB 3.42Å; S342-A346 PolarHBondContact O-N 3.36Å
343	L	97.2	Very high	96.1	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-44	177.1	-68.6	172.4	0	0	0	112.4	L295 V307 L311 T317 P327 L328 A331 V339 I340 A346 G347 C348	L295-L343 HydrophobicContact CD1-CD2 4.26Å; L295-L343 HydrophobicContact CD2-CD2 3.95Å; L295-L343 HydrophobicContact CG-CD2 4.28Å; V307-L343 HydrophobicContact CG1-CD2 4.2Å; V307-L343 HydrophobicContact CG1-CG 4.32Å; L311-L343 HydrophobicContact CD1-CD2 4.4Å; L311-L343 HydrophobicContact CD2-CD2 4.4Å; T317-L343 HydrophobicContact CG2-CD2 4.31Å; P327-L343 HydrophobicContact CB-CD1 4.23Å; L328-L343 HydrophobicContact CB-CD1 4.3Å; L328-L343 HydrophobicContact CD1-CB 4.39Å; L328-L343 HydrophobicContact CD1-CD1 4.34Å; A331-L343 HydrophobicContact CB-CD1 4.31Å; V339-L343 HydrophobicContact CG1-CD1 3.83Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CG 3.44Å; V339-L343 PolarHBondContact O-N 2.73Å; I340-L343 PolarHBondContact O-N 2.78Å; L343-A346 PolarHBondContact O-N 3.43Å; L343-G347 PolarHBondContact O-N 3.02Å; L343-C348 WeakPolarHBondContact O-CB 3.2Å; L343-C348 PolarHBondContact O-N 3.05Å; L343-C348 PolarHBondContact O-SG 2.99Å
344	V	95.4	Very high	96	Very high	23 Å²	23	39.2 Å²	39.2	14%	0.139	25%	0.25	C	S	.	.	H	α-helix	trans	-66	-41.4	177.8	172.2	0	0	0	0	110.8	L328 I340 H341 A346 G347 I350 M375 L376 S379	L328-V344 HydrophobicContact CD1-CG2 4.29Å; I340-V344 HydrophobicContact CG2-CG2 4.35Å; I340-V344 WeakPolarHBondContact O-CB 3.46Å; I340-V344 VanDerWaalsContact O-CG2 3.26Å; I340-V344 WeakPolarHBondContact O-CG2 3.44Å; I340-V344 PolarHBondContact O-N 3.34Å; H341-V344 PolarHBondContact O-N 3.23Å; V344-A346 VanDerWaalsContact C-N 3.27Å; V344-A346 PolarHBondContact O-N 3.24Å; V344-G347 PolarHBondContact O-N 2.89Å; V344-I350 HydrophobicContact CG2-CG2 4.14Å; V344-M375 HydrophobicContact CG2-SD 4.46Å; V344-L376 HydrophobicContact CG2-CD2 4.17Å; V344-S379 WeakPolarHBondContact CG1-OG 3.23Å
345	A	94.6	Very high	96	Very high	77 Å²	77	41.1 Å²	41.1	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-64.9	-31.3	176.2	0	0	0	0	0	112.7	H341 S342 G347	H341-A345 WeakPolarHBondContact O-CB 3.46Å; H341-A345 PolarHBondContact O-N 3.2Å; S342-A345 PolarHBondContact O-N 2.93Å; A345-G347 PolarHBondContact O-N 2.91Å
346	A	94.7	Very high	96	Very high	54 Å²	54	45.1 Å²	45.1	45%	0.446	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-0.3	173.3	0	0	0	0	0	113.9	L311 T317 S342 L343 V344	L311-A346 HydrophobicContact CD1-CB 3.91Å; L311-A346 HydrophobicContact CD2-CB 4.01Å; L311-A346 HydrophobicContact CG-CB 4.43Å; T317-A346 HydrophobicContact CG2-CB 4.48Å; S342-A346 WeakPolarHBondContact O-CB 3.42Å; S342-A346 PolarHBondContact O-N 3.36Å; L343-A346 PolarHBondContact O-N 3.43Å; V344-A346 VanDerWaalsContact C-N 3.27Å; V344-A346 PolarHBondContact O-N 3.24Å
347	G	92.2	Very high	96	Very high	59 Å²	59	47 Å²	47	61%	0.608	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	27.2	175.7	0	0	0	0	0	114.4	L343 V344 A345	L343-G347 PolarHBondContact O-N 3.02Å; V344-G347 PolarHBondContact O-N 2.89Å; A345-G347 PolarHBondContact O-N 2.91Å
348	C	94.3	Very high	96	Very high	9 Å²	9	43.8 Å²	43.8	6%	0.061	26%	0.259	C	S	.	.			trans	-57.4	149.7	171.9	71.2	0	0	0	0	112	T317 D318 L343 I350	T317-C348 HydrophobicContact CG2-CB 4.13Å; D318-C348 WeakPolarHBondContact OD1-CA 3.35Å; D318-C348 WeakPolarHBondContact OD1-CB 3.48Å; L343-C348 WeakPolarHBondContact O-CB 3.2Å; L343-C348 PolarHBondContact O-N 3.05Å; L343-C348 PolarHBondContact O-SG 2.99Å; C348-I350 PolarHBondContact O-N 3.22Å
349	N	95.3	Very high	96	Very high	76 Å²	76	40.1 Å²	40.1	41%	0.406	24%	0.236	S	C	.	.			trans	-73	96.4	175.5	-177.7	1.8	0	0	0	110.5	D318 N351 V352	D318-N349 VanDerWaalsContact CG-N 3.34Å; D318-N349 PolarHBondContact OD1-N 3.24Å; D318-N349 VanDerWaalsContact OD2-CB 3.28Å; D318-N349 WeakPolarHBondContact OD2-CB 3.41Å; D318-N349 PolarHBondContact OD2-N 3.46Å; N349-N351 PolarHBondContact O-N 3.15Å; N349-N351 VanDerWaalsContact O-N 3.09Å; N349-N351 WeakPolarHBondContact OD1-CB 3.31Å; N349-N351 PolarHBondContact OD1-N 3.31Å; N349-V352 HydrophobicContact CB-CG2 3.75Å; N349-V352 WeakPolarHBondContact O-CG2 3.37Å; N349-V352 PolarHBondContact O-N 3.48Å
350	I	95.3	Very high	96	Very high	15 Å²	15	40.2 Å²	40.2	8%	0.077	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.5	178.2	62.9	-176.2	0	0	0	114.5	L328 V344 C348 L376 V381	L328-I350 HydrophobicContact CD2-CB 4.34Å; L328-I350 HydrophobicContact CD2-CG2 4.06Å; V344-I350 HydrophobicContact CG2-CG2 4.14Å; C348-I350 PolarHBondContact O-N 3.22Å; I350-L376 HydrophobicContact CB-CD2 4.3Å; I350-L376 HydrophobicContact CG2-CD2 4.05Å; I350-V381 HydrophobicContact CD1-CB 3.73Å; I350-V381 HydrophobicContact CD1-CG2 4.25Å; I350-V381 HydrophobicContact CG1-CB 4.3Å; I350-V381 HydrophobicContact CG1-CG2 4.28Å
351	N	96.1	Very high	96	Very high	49 Å²	49	40.2 Å²	40.2	26%	0.262	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	1.9	-178.1	-65.2	-37.3	0	0	0	113.4	N349 A353 V381 D382 I385	N349-N351 PolarHBondContact O-N 3.15Å; N349-N351 VanDerWaalsContact O-N 3.09Å; N349-N351 WeakPolarHBondContact OD1-CB 3.31Å; N349-N351 PolarHBondContact OD1-N 3.31Å; N351-A353 PolarHBondContact O-N 3.41Å; N351-V381 VanDerWaalsContact OD1-CG2 3.28Å; N351-V381 WeakPolarHBondContact OD1-CG2 3.26Å; N351-D382 PolarHBondContact OD1-N 2.91Å; N351-I385 HydrophobicContact CB-CD1 3.66Å
352	V	96.1	Very high	96.1	Very high	16 Å²	16	35.1 Å²	35.1	10%	0.097	21%	0.213	C	C	.	.			trans	-58.1	138.6	171.8	178	0	0	0	0	108.8	D318 Q320 A326 H329 N349 T359	D318-V352 HydrophobicContact CB-CG2 4.45Å; Q320-V352 VanDerWaalsContact CD-CG1 3.49Å; Q320-V352 HydrophobicContact CG-CG1 3.8Å; A326-V352 HydrophobicContact CB-CG1 4.1Å; H329-V352 PolarHBondContact CE1-O 2.94Å; H329-V352 VanDerWaalsContact CE1-O 3.23Å; H329-V352 PolarHBondContact NE2-O 3.24Å; N349-V352 HydrophobicContact CB-CG2 3.75Å; N349-V352 WeakPolarHBondContact O-CG2 3.37Å; N349-V352 PolarHBondContact O-N 3.48Å; V352-T359 WeakPolarHBondContact O-CA 3.44Å
353	A	96	Very high	96.1	Very high	26 Å²	26	35 Å²	35	22%	0.215	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-115.9	138.1	-177.1	0	0	0	0	0	110.7	Q320 N351 Q358 T359	Q320-A353 PolarHBondContact NE2-O 3.23Å; N351-A353 PolarHBondContact O-N 3.41Å; A353-Q358 WeakPolarHBondContact CA-O 3.39Å; A353-T359 HydrophobicContact CB-CG2 4.34Å
354	D	96.2	Very high	96.1	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.032	21%	0.21	C	C	.	.			trans	-75.9	-174.1	176.6	78.7	1.9	0	0	0	113	L324 E325 K333 R356 L357 Q358	L324-D354 WeakPolarHBondContact O-CA 3.47Å; E325-D354 HydrophobicContact CG-CB 4.21Å; K333-D354 IonicContact NZ-OD2 2.73Å; D354-R356 PolarHBondContact O-N 3.44Å; D354-R356 VanDerWaalsContact O-N 3.11Å; D354-R356 VanDerWaalsContact OD1-CA 3.31Å; D354-R356 WeakPolarHBondContact OD1-CA 3.34Å; D354-R356 WeakPolarHBondContact OD1-CB 3.4Å; D354-R356 PolarHBondContact OD1-N 2.87Å; D354-L357 WeakPolarHBondContact O-CA 3.28Å; D354-L357 PolarHBondContact O-N 3.4Å; D354-L357 PolarHBondContact OD1-N 3.32Å; D354-Q358 PolarHBondContact N-O 3.09Å; D354-Q358 WeakPolarHBondContact OD1-CB 3.43Å; D354-Q358 PolarHBondContact OD1-N 2.95Å
355	K	96.3	Very high	96.3	Very high	117 Å²	117	33.8 Å²	33.8	51%	0.509	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.7	178.9	-174.1	177.4	-175.6	177.7	0	114.4	Q323 L324 L357	Q323-K355 WeakPolarHBondContact O-CB 3.44Å; Q323-K355 PolarHBondContact O-N 3.4Å; Q323-K355 VanDerWaalsContact O-N 3.08Å; Q323-K355 VanDerWaalsContact OE1-CD 3.32Å; L324-K355 HydrophobicContact CB-CB 4.49Å; K355-L357 VanDerWaalsContact C-N 3.31Å
356	R	95.3	Very high	96.4	Very high	103 Å²	103	32.6 Å²	32.6	39%	0.389	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	10.6	171.9	-64.1	178.2	60.7	-168.7	-8.2	111.9	D354 Q358 R388	D354-R356 PolarHBondContact O-N 3.44Å; D354-R356 VanDerWaalsContact O-N 3.11Å; D354-R356 VanDerWaalsContact OD1-CA 3.31Å; D354-R356 WeakPolarHBondContact OD1-CA 3.34Å; D354-R356 WeakPolarHBondContact OD1-CB 3.4Å; D354-R356 PolarHBondContact OD1-N 2.87Å; R356-Q358 HydrophobicContact CB-CG 3.94Å; R356-Q358 VanDerWaalsContact NE-OE1 3.15Å; R356-Q358 PolarHBondContact O-N 3.08Å; R356-R388 WeakPolarHBondContact O-CB 3.49Å; R356-R388 PolarHBondContact O-N 3.45Å
357	L	96.9	Very high	96.5	Very high	90 Å²	90	34.1 Å²	34.1	47%	0.471	19%	0.185	S	C	.	.	S	Bend	trans	56.7	23.8	-171	-52.9	177.5	0	0	0	112.6	D354 K355 D387	D354-L357 WeakPolarHBondContact O-CA 3.28Å; D354-L357 PolarHBondContact O-N 3.4Å; D354-L357 PolarHBondContact OD1-N 3.32Å; K355-L357 VanDerWaalsContact C-N 3.31Å; L357-D387 WeakPolarHBondContact O-CA 3.41Å
358	Q	97.4	Very high	96.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.167	C	C	.	.			trans	-87.3	127.5	177.5	-66	-175.7	-84.9	0	0	109.4	H329 A353 D354 R356 H362 L363 E366 D387	H329-Q358 PolarHBondContact NE2-O 3.35Å; A353-Q358 WeakPolarHBondContact CA-O 3.39Å; D354-Q358 PolarHBondContact N-O 3.09Å; D354-Q358 WeakPolarHBondContact OD1-CB 3.43Å; D354-Q358 PolarHBondContact OD1-N 2.95Å; R356-Q358 HydrophobicContact CB-CG 3.94Å; R356-Q358 VanDerWaalsContact NE-OE1 3.15Å; R356-Q358 PolarHBondContact O-N 3.08Å; Q358-H362 HydrophobicContact CB-CB 3.86Å; Q358-H362 HydrophobicContact CG-CB 4.18Å; Q358-L363 HydrophobicContact CB-CD2 4.17Å; Q358-L363 HydrophobicContact CB-CG 4.31Å; Q358-E366 PolarHBondContact NE2-OE2 3.06Å; Q358-D387 HydrophobicContact CG-CB 4.05Å
359	T	97.8	Very high	96.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-84.1	172	169.8	68.1	0	0	0	0	111.1	V352 A353 L361 H362 L363 I385	V352-T359 WeakPolarHBondContact O-CA 3.44Å; A353-T359 HydrophobicContact CB-CG2 4.34Å; T359-L361 PolarHBondContact O-N 3.02Å; T359-L361 VanDerWaalsContact O-N 3.16Å; T359-L361 PolarHBondContact OG1-N 3.06Å; T359-H362 PolarHBondContact N-ND1 2.8Å; T359-H362 WeakPolarHBondContact O-CB 3.42Å; T359-H362 PolarHBondContact O-N 3.42Å; T359-H362 PolarHBondContact OG1-ND1 3.35Å; T359-L363 PolarHBondContact O-N 2.98Å; T359-I385 HydrophobicContact CG2-CB 4.22Å; T359-I385 HydrophobicContact CG2-CD1 3.89Å; T359-I385 HydrophobicContact CG2-CG2 3.68Å
360	A	97.5	Very high	96.8	Very high	1 Å²	1	33 Å²	33	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-52	-35.8	171.3	0	0	0	0	0	112.8	L328 V332 S364 L376	L328-A360 HydrophobicContact CD2-CB 3.65Å; L328-A360 HydrophobicContact CG-CB 3.92Å; V332-A360 HydrophobicContact CG2-CB 4.19Å; A360-S364 WeakPolarHBondContact O-CB 3.14Å; A360-S364 PolarHBondContact O-N 3.22Å; A360-S364 PolarHBondContact O-OG 2.95Å; A360-L376 HydrophobicContact CB-CD1 3.79Å; A360-L376 HydrophobicContact CB-CD2 4.31Å
361	L	98.1	Very high	96.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-69.7	-40.6	176.9	-172.7	67.9	0	0	0	112.2	T359 L363 S364 A365 V373 L376 L377 V381 L383 A393	T359-L361 PolarHBondContact O-N 3.02Å; T359-L361 VanDerWaalsContact O-N 3.16Å; T359-L361 PolarHBondContact OG1-N 3.06Å; L361-L363 VanDerWaalsContact C-N 3.35Å; L361-L363 PolarHBondContact O-N 3Å; L361-S364 WeakPolarHBondContact CA-OG 3.18Å; L361-S364 PolarHBondContact O-OG 3.35Å; L361-S364 VanDerWaalsContact O-OG 3.1Å; L361-A365 WeakPolarHBondContact O-CB 3.42Å; L361-A365 PolarHBondContact O-N 3.03Å; L361-V373 HydrophobicContact CD1-CG1 4.2Å; L361-V373 HydrophobicContact CD1-CG2 4.45Å; L361-L376 HydrophobicContact CB-CD1 4.38Å; L361-L376 HydrophobicContact CD1-CB 4.3Å; L361-L376 HydrophobicContact CD1-CD1 4.49Å; L361-L377 HydrophobicContact CD1-CD2 4.08Å; L361-L377 HydrophobicContact CD1-CG 4.34Å; L361-L377 HydrophobicContact CD2-CD2 4.19Å; L361-V381 HydrophobicContact CB-CG2 4.17Å; L361-V381 HydrophobicContact CD2-CG1 3.82Å; L361-V381 HydrophobicContact CD2-CG2 4.26Å; L361-L383 HydrophobicContact CD2-CD2 3.55Å; L361-A393 HydrophobicContact CB-CB 4.28Å; L361-A393 HydrophobicContact CD2-CB 3.55Å; L361-A393 HydrophobicContact CG-CB 3.59Å
362	H	98.4	Very high	96.9	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-45.8	174.5	-69.1	85.6	0	0	0	111.3	Q358 T359 A365 E366 I385 K391 A393	Q358-H362 HydrophobicContact CB-CB 3.86Å; Q358-H362 HydrophobicContact CG-CB 4.18Å; T359-H362 PolarHBondContact N-ND1 2.8Å; T359-H362 WeakPolarHBondContact O-CB 3.42Å; T359-H362 PolarHBondContact O-N 3.42Å; T359-H362 PolarHBondContact OG1-ND1 3.35Å; H362-A365 PolarHBondContact O-N 2.94Å; H362-E366 WeakPolarHBondContact O-CB 3.42Å; H362-E366 PolarHBondContact O-N 3.1Å; H362-I385 PolarHBondContact CE1-O 3.24Å; H362-I385 PolarHBondContact NE2-O 2.86Å; H362-K391 PolarHBondContact NE2-O 3.05Å; H362-A393 PolarHBondContact NE2-N 2.96Å
363	L	97.8	Very high	96.9	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-46.6	-179.4	-66.2	176	0	0	0	112.2	H329 V332 K333 Q358 T359 L361 A365 E366 L367	H329-L363 HydrophobicContact CB-CD1 3.99Å; V332-L363 HydrophobicContact CG1-CB 3.86Å; K333-L363 HydrophobicContact CD-CD1 4.43Å; K333-L363 HydrophobicContact CG-CD1 4.08Å; Q358-L363 HydrophobicContact CB-CD2 4.17Å; Q358-L363 HydrophobicContact CB-CG 4.31Å; T359-L363 PolarHBondContact O-N 2.98Å; L361-L363 VanDerWaalsContact C-N 3.35Å; L361-L363 PolarHBondContact O-N 3Å; L363-A365 VanDerWaalsContact C-N 3.31Å; L363-A365 PolarHBondContact O-N 2.83Å; L363-E366 PolarHBondContact O-N 3.01Å; L363-L367 VanDerWaalsContact O-CB 3.31Å; L363-L367 WeakPolarHBondContact O-CB 3.34Å; L363-L367 WeakPolarHBondContact O-CG 3.39Å; L363-L367 PolarHBondContact O-N 3.42Å
364	S	97.6	Very high	96.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.9	-33.2	178	51.9	0	0	0	0	112.9	A360 L361 G368 R369	A360-S364 WeakPolarHBondContact O-CB 3.14Å; A360-S364 PolarHBondContact O-N 3.22Å; A360-S364 PolarHBondContact O-OG 2.95Å; L361-S364 WeakPolarHBondContact CA-OG 3.18Å; L361-S364 PolarHBondContact O-OG 3.35Å; L361-S364 VanDerWaalsContact O-OG 3.1Å; S364-G368 PolarHBondContact O-N 2.94Å; S364-R369 PolarHBondContact O-N 3.47Å
365	A	97.6	Very high	96.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-42.8	172.7	0	0	0	0	0	112.7	L361 H362 L363 L367 G368 A397 I405 I409	L361-A365 WeakPolarHBondContact O-CB 3.42Å; L361-A365 PolarHBondContact O-N 3.03Å; H362-A365 PolarHBondContact O-N 2.94Å; L363-A365 VanDerWaalsContact C-N 3.31Å; L363-A365 PolarHBondContact O-N 2.83Å; A365-L367 VanDerWaalsContact C-N 3.3Å; A365-L367 PolarHBondContact O-N 2.97Å; A365-G368 PolarHBondContact O-N 2.97Å; A365-A397 HydrophobicContact CB-CB 4.09Å; A365-I405 HydrophobicContact CB-CG2 3.93Å; A365-I409 HydrophobicContact CB-CD1 4.45Å
366	E	96.9	Very high	96.8	Very high	52 Å²	52	28.6 Å²	28.6	24%	0.243	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-33.1	176.6	-175.2	163.8	-147.3	0	0	112.4	Q358 H362 L363 V396 R399	Q358-E366 PolarHBondContact NE2-OE2 3.06Å; H362-E366 WeakPolarHBondContact O-CB 3.42Å; H362-E366 PolarHBondContact O-N 3.1Å; L363-E366 PolarHBondContact O-N 3.01Å; E366-V396 HydrophobicContact CB-CG1 3.68Å; E366-V396 HydrophobicContact CG-CG1 4.37Å; E366-R399 IonicContact OE1-CZ 3.94Å; E366-R399 IonicContact OE1-NH1 2.8Å; E366-R399 IonicContact OE1-NH2 3.16Å; E366-R399 PolarHBondContact OE1-NH2 2.89Å
367	L	96.6	Very high	96.8	Very high	86 Å²	86	23.7 Å²	23.7	45%	0.45	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	4.1	-177.5	-63.8	173.9	0	0	0	114.1	L363 A365 R369	L363-L367 VanDerWaalsContact O-CB 3.31Å; L363-L367 WeakPolarHBondContact O-CB 3.34Å; L363-L367 WeakPolarHBondContact O-CG 3.39Å; L363-L367 PolarHBondContact O-N 3.42Å; A365-L367 VanDerWaalsContact C-N 3.3Å; A365-L367 PolarHBondContact O-N 2.97Å; L367-R369 VanDerWaalsContact C-N 3.3Å; L367-R369 HydrophobicContact CB-CG 3.94Å; L367-R369 PolarHBondContact O-N 3.37Å
368	G	96.4	Very high	96.6	Very high	21 Å²	21	23.7 Å²	23.7	22%	0.216	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	21.2	177.9	0	0	0	0	0	115.2	S364 A365 T370 E402	S364-G368 PolarHBondContact O-N 2.94Å; A365-G368 PolarHBondContact O-N 2.97Å; G368-T370 PolarHBondContact O-N 3.21Å; G368-E402 VanDerWaalsContact CA-CD 3.45Å
369	R	96	Very high	96.2	Very high	70 Å²	70	26.3 Å²	26.3	26%	0.264	14%	0.136	S	C	.	.			trans	-84.9	77.4	-171	-62.3	-174.4	-178.7	-82.5	10.7	112.1	V332 K333 N334 S364 L367 E371 V372 V373	V332-R369 VanDerWaalsContact O-CD 3.26Å; V332-R369 WeakPolarHBondContact O-CD 3.14Å; V332-R369 PolarHBondContact O-NE 3.09Å; K333-R369 PolarHBondContact O-NH2 3.2Å; N334-R369 PolarHBondContact O-NH2 2.89Å; S364-R369 PolarHBondContact O-N 3.47Å; L367-R369 VanDerWaalsContact C-N 3.3Å; L367-R369 HydrophobicContact CB-CG 3.94Å; L367-R369 PolarHBondContact O-N 3.37Å; R369-E371 VanDerWaalsContact C-N 3.33Å; R369-E371 PolarHBondContact O-N 2.9Å; R369-V372 HydrophobicContact CB-CB 3.96Å; R369-V372 HydrophobicContact CB-CG2 4Å; R369-V372 PolarHBondContact O-N 3.26Å; R369-V373 WeakPolarHBondContact O-CG2 3.41Å; R369-V373 PolarHBondContact O-N 3.42Å
370	T	96.4	Very high	95.4	Very high	30 Å²	30	28.4 Å²	28.4	18%	0.184	16%	0.157	C	C	.	.	H	α-helix	trans	-57.8	-38.4	-171.4	73.9	0	0	0	0	114.4	G368 V372 V373 E374 I404 I405	G368-T370 PolarHBondContact O-N 3.21Å; T370-V372 VanDerWaalsContact C-N 3.34Å; T370-V372 PolarHBondContact O-N 2.81Å; T370-V373 PolarHBondContact O-N 2.99Å; T370-E374 WeakPolarHBondContact O-CB 3.49Å; T370-E374 PolarHBondContact O-N 3.25Å; T370-I404 HydrophobicContact CG2-CG2 4.45Å; T370-I405 HydrophobicContact CG2-CD1 4.37Å; T370-I405 HydrophobicContact CG2-CG1 4.19Å
371	E	95.8	Very high	95.1	Very high	87 Å²	87	28.7 Å²	28.7	41%	0.407	16%	0.159	S	C	.	.	H	α-helix	trans	-64.4	-39.3	177.7	-73.9	59	-134.2	0	0	112	I337 R369 M375 K438	I337-E371 HydrophobicContact CD1-CB 3.8Å; I337-E371 HydrophobicContact CD1-CG 4.13Å; R369-E371 VanDerWaalsContact C-N 3.33Å; R369-E371 PolarHBondContact O-N 2.9Å; E371-M375 PolarHBondContact O-N 3.32Å; E371-M375 VanDerWaalsContact O-N 3.11Å; E371-K438 IonicContact OE1-NZ 2.71Å; E371-K438 PolarHBondContact OE1-NZ 3.15Å
372	V	96.8	Very high	95	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	18%	0.178	C	C	.	.	H	α-helix	trans	-72.2	-43.7	179.7	177	0	0	0	0	110.1	V332 I337 I340 R369 T370 E374 M375 L376	V332-V372 HydrophobicContact CG1-CG1 4.29Å; V332-V372 HydrophobicContact CG2-CG1 3.9Å; I337-V372 HydrophobicContact CG1-CG2 4.24Å; I340-V372 HydrophobicContact CD1-CB 4.44Å; I340-V372 HydrophobicContact CD1-CG1 4.04Å; I340-V372 HydrophobicContact CD1-CG2 3.51Å; I340-V372 HydrophobicContact CG2-CG1 4.28Å; R369-V372 HydrophobicContact CB-CB 3.96Å; R369-V372 HydrophobicContact CB-CG2 4Å; R369-V372 PolarHBondContact O-N 3.26Å; T370-V372 VanDerWaalsContact C-N 3.34Å; T370-V372 PolarHBondContact O-N 2.81Å; V372-E374 VanDerWaalsContact C-N 3.33Å; V372-E374 PolarHBondContact O-N 3.12Å; V372-M375 WeakPolarHBondContact O-CB 3.39Å; V372-M375 PolarHBondContact O-N 3.4Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.27Å; V372-L376 WeakPolarHBondContact O-CG 3.36Å; V372-L376 PolarHBondContact O-N 3.5Å
373	V	97.6	Very high	94.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56.7	-49.2	173.6	171.4	0	0	0	0	110.2	L361 R369 T370 M375 L376 L377 I405 M408	L361-V373 HydrophobicContact CD1-CG1 4.2Å; L361-V373 HydrophobicContact CD1-CG2 4.45Å; R369-V373 WeakPolarHBondContact O-CG2 3.41Å; R369-V373 PolarHBondContact O-N 3.42Å; T370-V373 PolarHBondContact O-N 2.99Å; V373-M375 VanDerWaalsContact C-N 3.28Å; V373-M375 PolarHBondContact O-N 3.45Å; V373-L376 PolarHBondContact O-N 3.47Å; V373-L377 HydrophobicContact CG1-CD1 3.62Å; V373-L377 HydrophobicContact CG1-CG 3.99Å; V373-L377 WeakPolarHBondContact O-CB 3.34Å; V373-L377 WeakPolarHBondContact O-CG 3.14Å; V373-L377 PolarHBondContact O-N 3.05Å; V373-I405 HydrophobicContact CG1-CG2 4.09Å; V373-I405 HydrophobicContact CG2-CD1 4.01Å; V373-I405 HydrophobicContact CG2-CG1 4.1Å; V373-I405 HydrophobicContact CG2-CG2 4.02Å; V373-M408 HydrophobicContact CB-CE 4.25Å; V373-M408 HydrophobicContact CG1-CB 4.39Å; V373-M408 HydrophobicContact CG1-CE 3.89Å; V373-M408 HydrophobicContact CG1-SD 4.42Å
374	E	95.6	Very high	94.7	Very high	13 Å²	13	37.8 Å²	37.8	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-55.4	-44.3	177.7	178.2	70	176.4	0	0	112	T370 V372 K378 M408 T436 F437 K438	T370-E374 WeakPolarHBondContact O-CB 3.49Å; T370-E374 PolarHBondContact O-N 3.25Å; V372-E374 VanDerWaalsContact C-N 3.33Å; V372-E374 PolarHBondContact O-N 3.12Å; E374-K378 VanDerWaalsContact CD-CE 3.42Å; E374-K378 WeakPolarHBondContact O-CG 3.21Å; E374-K378 PolarHBondContact O-N 3.22Å; E374-K378 WeakPolarHBondContact OE1-CE 3.33Å; E374-K378 IonicContact OE1-NZ 3.71Å; E374-K378 PolarHBondContact OE1-NZ 3.41Å; E374-M408 HydrophobicContact CB-CE 3.63Å; E374-M408 WeakPolarHBondContact OE2-CE 3.47Å; E374-T436 WeakPolarHBondContact OE1-CA 3.45Å; E374-T436 WeakPolarHBondContact OE1-CB 3.23Å; E374-T436 PolarHBondContact OE1-OG1 3.02Å; E374-T436 VanDerWaalsContact OE1-OG1 3.08Å; E374-F437 PolarHBondContact OE1-N 3.2Å; E374-F437 WeakPolarHBondContact OE2-CA 3.44Å; E374-F437 WeakPolarHBondContact OE2-CB 3.22Å; E374-F437 PolarHBondContact OE2-N 2.91Å; E374-K438 HydrophobicContact CB-CG 4.43Å; E374-K438 HydrophobicContact CG-CG 4.21Å; E374-K438 PolarHBondContact OE2-N 3.15Å
375	M	94.5	Very high	94.7	Very high	34 Å²	34	39.7 Å²	39.7	17%	0.167	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-50.7	179	-171.8	-174.6	-60.1	0	0	111.6	I337 I340 H341 V344 E371 V372 V373 L377 K378 S379	I337-M375 HydrophobicContact CG2-CE 4.1Å; I340-M375 HydrophobicContact CB-SD 4.45Å; I340-M375 HydrophobicContact CG2-SD 3.73Å; H341-M375 VanDerWaalsContact CA-SD 3.57Å; H341-M375 HydrophobicContact CB-CE 3.81Å; H341-M375 HydrophobicContact CB-SD 4.06Å; V344-M375 HydrophobicContact CG2-SD 4.46Å; E371-M375 PolarHBondContact O-N 3.32Å; E371-M375 VanDerWaalsContact O-N 3.11Å; V372-M375 WeakPolarHBondContact O-CB 3.39Å; V372-M375 PolarHBondContact O-N 3.4Å; V373-M375 VanDerWaalsContact C-N 3.28Å; V373-M375 PolarHBondContact O-N 3.45Å; M375-L377 PolarHBondContact O-N 3.44Å; M375-K378 PolarHBondContact O-N 3.27Å; M375-S379 PolarHBondContact O-N 3Å; M375-S379 PolarHBondContact O-OG 2.89Å
376	L	95.4	Very high	94.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-39.5	-178.9	-67	174.9	0	0	0	112.3	L328 V344 I350 A360 L361 V372 V373 K378 S379	L328-L376 HydrophobicContact CD2-CD2 4.48Å; V344-L376 HydrophobicContact CG2-CD2 4.17Å; I350-L376 HydrophobicContact CB-CD2 4.3Å; I350-L376 HydrophobicContact CG2-CD2 4.05Å; A360-L376 HydrophobicContact CB-CD1 3.79Å; A360-L376 HydrophobicContact CB-CD2 4.31Å; L361-L376 HydrophobicContact CB-CD1 4.38Å; L361-L376 HydrophobicContact CD1-CB 4.3Å; L361-L376 HydrophobicContact CD1-CD1 4.49Å; V372-L376 HydrophobicContact CG1-CD1 3.89Å; V372-L376 HydrophobicContact CG1-CG 4.27Å; V372-L376 WeakPolarHBondContact O-CG 3.36Å; V372-L376 PolarHBondContact O-N 3.5Å; V373-L376 PolarHBondContact O-N 3.47Å; L376-K378 VanDerWaalsContact C-N 3.32Å; L376-K378 PolarHBondContact O-N 3.49Å; L376-S379 PolarHBondContact O-N 3.33Å
377	L	95.5	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-39.9	177.6	-71.2	179.3	0	0	0	111.3	L361 V373 M375 S379 G380 V381 L383 M408 I409 A412 Y416 F437	L361-L377 HydrophobicContact CD1-CD2 4.08Å; L361-L377 HydrophobicContact CD1-CG 4.34Å; L361-L377 HydrophobicContact CD2-CD2 4.19Å; V373-L377 HydrophobicContact CG1-CD1 3.62Å; V373-L377 HydrophobicContact CG1-CG 3.99Å; V373-L377 WeakPolarHBondContact O-CB 3.34Å; V373-L377 WeakPolarHBondContact O-CG 3.14Å; V373-L377 PolarHBondContact O-N 3.05Å; M375-L377 PolarHBondContact O-N 3.44Å; L377-S379 VanDerWaalsContact C-N 3.27Å; L377-S379 PolarHBondContact O-N 3.47Å; L377-G380 PolarHBondContact O-N 3.46Å; L377-V381 HydrophobicContact CD2-CG1 4.07Å; L377-L383 HydrophobicContact CD2-CD2 3.56Å; L377-M408 HydrophobicContact CD1-CB 3.95Å; L377-I409 HydrophobicContact CD1-CG1 4.43Å; L377-I409 HydrophobicContact CD2-CG1 4.42Å; L377-A412 HydrophobicContact CB-CB 4.26Å; L377-A412 HydrophobicContact CD1-CB 3.98Å; L377-A412 HydrophobicContact CD2-CB 3.77Å; L377-A412 HydrophobicContact CG-CB 4.22Å; L377-Y416 WeakPolarHBondContact O-CE2 3.36Å; L377-Y416 PolarHBondContact O-OH 3.3Å; L377-F437 HydrophobicContact CB-CD2 3.63Å; L377-F437 HydrophobicContact CB-CE2 3.8Å; L377-F437 HydrophobicContact CD1-CB 4.24Å; L377-F437 HydrophobicContact CD1-CD2 4.1Å; L377-F437 HydrophobicContact CD1-CG 4.31Å
378	K	92.4	Very high	94.6	Very high	90 Å²	90	47.1 Å²	47.1	39%	0.391	23%	0.234	S	C	.	.	H	α-helix	trans	-66.9	-28.4	176.7	-72.8	178.3	-167.8	-177.3	0	113.4	E374 M375 L376 G380 Y416 L435 F437	E374-K378 VanDerWaalsContact CD-CE 3.42Å; E374-K378 WeakPolarHBondContact O-CG 3.21Å; E374-K378 PolarHBondContact O-N 3.22Å; E374-K378 WeakPolarHBondContact OE1-CE 3.33Å; E374-K378 IonicContact OE1-NZ 3.71Å; E374-K378 PolarHBondContact OE1-NZ 3.41Å; M375-K378 PolarHBondContact O-N 3.27Å; L376-K378 VanDerWaalsContact C-N 3.32Å; L376-K378 PolarHBondContact O-N 3.49Å; K378-G380 PolarHBondContact O-N 2.95Å; K378-Y416 PolarHBondContact O-OH 3.25Å; K378-L435 WeakPolarHBondContact CE-O 3.36Å; K378-L435 HydrophobicContact CG-CD2 4.48Å; K378-L435 PolarHBondContact NZ-O 3.17Å; K378-F437 HydrophobicContact CG-CD2 4.5Å; K378-F437 HydrophobicContact CG-CE2 4.19Å
379	S	88.6	Confident	94.5	Very high	56 Å²	56	51.7 Å²	51.7	39%	0.392	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	6	-178.7	-60.5	0	0	0	0	114.4	V344 M375 L376 L377	V344-S379 WeakPolarHBondContact CG1-OG 3.23Å; M375-S379 PolarHBondContact O-N 3Å; M375-S379 PolarHBondContact O-OG 2.89Å; L376-S379 PolarHBondContact O-N 3.33Å; L377-S379 VanDerWaalsContact C-N 3.27Å; L377-S379 PolarHBondContact O-N 3.47Å
380	G	82.1	Confident	94.5	Very high	44 Å²	44	49.9 Å²	49.9	45%	0.454	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	35.2	174.8	0	0	0	0	0	114.1	L377 K378	L377-G380 PolarHBondContact O-N 3.46Å; K378-G380 PolarHBondContact O-N 2.95Å
381	V	92	Very high	94.5	Very high	8 Å²	8	53.4 Å²	53.4	5%	0.048	27%	0.266	C	S	.	.			trans	-55.8	146	175.2	67.1	0	0	0	0	112.1	I350 N351 L361 L377 L383	I350-V381 HydrophobicContact CD1-CB 3.73Å; I350-V381 HydrophobicContact CD1-CG2 4.25Å; I350-V381 HydrophobicContact CG1-CB 4.3Å; I350-V381 HydrophobicContact CG1-CG2 4.28Å; N351-V381 VanDerWaalsContact OD1-CG2 3.28Å; N351-V381 WeakPolarHBondContact OD1-CG2 3.26Å; L361-V381 HydrophobicContact CB-CG2 4.17Å; L361-V381 HydrophobicContact CD2-CG1 3.82Å; L361-V381 HydrophobicContact CD2-CG2 4.26Å; L377-V381 HydrophobicContact CD2-CG1 4.07Å; V381-L383 HydrophobicContact CG1-CD2 3.67Å; V381-L383 HydrophobicContact CG1-CG 4.4Å; V381-L383 PolarHBondContact O-N 3.27Å
382	D	94.4	Very high	94.6	Very high	76 Å²	76	49.5 Å²	49.5	41%	0.406	25%	0.248	S	C	.	.			trans	-76.8	108.6	173.2	-174.9	-3.7	0	0	0	110.1	N351 Q384 I385	N351-D382 PolarHBondContact OD1-N 2.91Å; D382-Q384 PolarHBondContact O-N 3.06Å; D382-Q384 WeakPolarHBondContact OD1-CB 3.33Å; D382-Q384 PolarHBondContact OD1-N 3.49Å; D382-I385 HydrophobicContact CB-CD1 3.82Å; D382-I385 HydrophobicContact CB-CG1 3.95Å
383	L	95.4	Very high	94.6	Very high	16 Å²	16	49.6 Å²	49.6	8%	0.084	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.9	-177.5	-57.7	171.6	0	0	0	112.9	L361 L377 V381 A412 E413 Y416	L361-L383 HydrophobicContact CD2-CD2 3.55Å; L377-L383 HydrophobicContact CD2-CD2 3.56Å; V381-L383 HydrophobicContact CG1-CD2 3.67Å; V381-L383 HydrophobicContact CG1-CG 4.4Å; V381-L383 PolarHBondContact O-N 3.27Å; L383-A412 HydrophobicContact CD1-CB 4.24Å; L383-E413 HydrophobicContact CB-CG 4.16Å; L383-E413 HydrophobicContact CD1-CB 4.21Å; L383-E413 HydrophobicContact CD1-CG 3.54Å; L383-E413 HydrophobicContact CG-CG 4.39Å; L383-Y416 HydrophobicContact CD1-CD2 4.35Å
384	Q	95.3	Very high	94.6	Very high	109 Å²	109	49.7 Å²	49.7	51%	0.509	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-6.9	-175.7	-56.5	-54.9	-54.3	0	0	113.6	D382 R386	D382-Q384 PolarHBondContact O-N 3.06Å; D382-Q384 WeakPolarHBondContact OD1-CB 3.33Å; D382-Q384 PolarHBondContact OD1-N 3.49Å; Q384-R386 PolarHBondContact O-N 3.48Å
385	I	96.5	Very high	94.7	Very high	39 Å²	39	50 Å²	50	20%	0.2	26%	0.256	C	S	.	.			trans	-62.3	136.5	176.2	-61.9	173.8	0	0	0	109.1	N351 T359 H362 D382 T392	N351-I385 HydrophobicContact CB-CD1 3.66Å; T359-I385 HydrophobicContact CG2-CB 4.22Å; T359-I385 HydrophobicContact CG2-CD1 3.89Å; T359-I385 HydrophobicContact CG2-CG2 3.68Å; H362-I385 PolarHBondContact CE1-O 3.24Å; H362-I385 PolarHBondContact NE2-O 2.86Å; D382-I385 HydrophobicContact CB-CD1 3.82Å; D382-I385 HydrophobicContact CB-CG1 3.95Å; I385-T392 WeakPolarHBondContact O-CA 3.26Å
386	R	97.1	Very high	94.8	Very high	111 Å²	111	48.3 Å²	48.3	42%	0.419	25%	0.248	S	C	.	.			trans	-113.7	137.4	-179.1	-66.3	178.4	-179.1	-92.2	-3	110.4	Q384 G390 K391 T392 E477	Q384-R386 PolarHBondContact O-N 3.48Å; R386-G390 WeakPolarHBondContact CD-O 3.4Å; R386-G390 PolarHBondContact NH1-O 2.81Å; R386-K391 CarbonylContact C-O 3.59Å; R386-K391 WeakPolarHBondContact CA-O 3.43Å; R386-T392 HydrophobicContact CG-CG2 3.91Å; R386-E477 IonicContact CZ-OE1 2.71Å; R386-E477 IonicContact NH1-OE1 3.36Å; R386-E477 IonicContact NH2-OE1 2.94Å; R386-E477 PolarHBondContact NH2-OE1 3.44Å; R386-E477 IonicContact NH2-OE2 3.67Å
387	D	96.5	Very high	94.9	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.032	25%	0.248	C	C	.	.			trans	-69.7	-179.6	171.7	73.5	6.5	0	0	0	112.1	L357 Q358 Q389 G390 K391 V396	L357-D387 WeakPolarHBondContact O-CA 3.41Å; Q358-D387 HydrophobicContact CG-CB 4.05Å; D387-Q389 PolarHBondContact O-N 3.21Å; D387-Q389 VanDerWaalsContact O-N 3.16Å; D387-Q389 VanDerWaalsContact OD1-C 3.29Å; D387-Q389 VanDerWaalsContact OD1-CA 3.26Å; D387-Q389 WeakPolarHBondContact OD1-CA 3.42Å; D387-Q389 WeakPolarHBondContact OD1-CB 3.43Å; D387-Q389 PolarHBondContact OD1-N 2.91Å; D387-Q389 PolarHBondContact OD2-OE1 3.29Å; D387-G390 WeakPolarHBondContact O-CA 3.24Å; D387-G390 PolarHBondContact O-N 2.9Å; D387-G390 PolarHBondContact OD1-N 3.45Å; D387-K391 PolarHBondContact N-O 3.08Å; D387-K391 PolarHBondContact OD1-N 3.19Å; D387-V396 WeakPolarHBondContact OD2-CG2 3.49Å
388	R	96.2	Very high	94.9	Very high	177 Å²	177	48.7 Å²	48.7	67%	0.668	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.7	178.4	-175.3	171.9	-180	178	-0.3	113.5	R356 G390	R356-R388 WeakPolarHBondContact O-CB 3.49Å; R356-R388 PolarHBondContact O-N 3.45Å; R388-G390 VanDerWaalsContact C-N 3.3Å
389	Q	94.8	Very high	95	Very high	117 Å²	117	51.1 Å²	51.1	55%	0.547	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	2.1	173.8	-68.9	75.2	24.6	0	0	112.5	D387 K391	D387-Q389 PolarHBondContact O-N 3.21Å; D387-Q389 VanDerWaalsContact O-N 3.16Å; D387-Q389 VanDerWaalsContact OD1-C 3.29Å; D387-Q389 VanDerWaalsContact OD1-CA 3.26Å; D387-Q389 WeakPolarHBondContact OD1-CA 3.42Å; D387-Q389 WeakPolarHBondContact OD1-CB 3.43Å; D387-Q389 PolarHBondContact OD1-N 2.91Å; D387-Q389 PolarHBondContact OD2-OE1 3.29Å; Q389-K391 VanDerWaalsContact C-N 3.28Å; Q389-K391 HydrophobicContact CB-CG 4.34Å; Q389-K391 PolarHBondContact O-N 3.27Å
390	G	96.1	Very high	95.3	Very high	33 Å²	33	50 Å²	50	34%	0.34	25%	0.251	S	S	.	.	S	Bend	trans	75.7	13.8	-178.1	0	0	0	0	0	113.6	R386 D387 R388	R386-G390 WeakPolarHBondContact CD-O 3.4Å; R386-G390 PolarHBondContact NH1-O 2.81Å; D387-G390 WeakPolarHBondContact O-CA 3.24Å; D387-G390 PolarHBondContact O-N 2.9Å; D387-G390 PolarHBondContact OD1-N 3.45Å; R388-G390 VanDerWaalsContact C-N 3.3Å
391	K	95.9	Very high	95.8	Very high	103 Å²	103	52.6 Å²	52.6	45%	0.448	26%	0.255	S	S	.	.			trans	-94.5	137.1	179.9	-63.4	-66.6	-172.4	172	0	110	H362 R386 D387 Q389 V396	H362-K391 PolarHBondContact NE2-O 3.05Å; R386-K391 CarbonylContact C-O 3.59Å; R386-K391 WeakPolarHBondContact CA-O 3.43Å; D387-K391 PolarHBondContact N-O 3.08Å; D387-K391 PolarHBondContact OD1-N 3.19Å; Q389-K391 VanDerWaalsContact C-N 3.28Å; Q389-K391 HydrophobicContact CB-CG 4.34Å; Q389-K391 PolarHBondContact O-N 3.27Å; K391-V396 HydrophobicContact CB-CG2 4.06Å
392	T	97.4	Very high	96	Very high	6 Å²	6	55.1 Å²	55.1	4%	0.037	27%	0.266	C	S	.	.			trans	-75.1	171.4	165.7	60.2	0	0	0	0	110.2	I385 R386 L394 G395 V396	I385-T392 WeakPolarHBondContact O-CA 3.26Å; R386-T392 HydrophobicContact CG-CG2 3.91Å; T392-L394 PolarHBondContact O-N 3.49Å; T392-G395 WeakPolarHBondContact O-CA 3.19Å; T392-G395 PolarHBondContact O-N 2.74Å; T392-V396 PolarHBondContact O-N 3.47Å
393	A	97.4	Very high	96	Very high	3 Å²	3	53.1 Å²	53.1	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-56.6	-33.3	174.6	0	0	0	0	0	112.9	L361 H362 V396 A397 I409	L361-A393 HydrophobicContact CB-CB 4.28Å; L361-A393 HydrophobicContact CD2-CB 3.55Å; L361-A393 HydrophobicContact CG-CB 3.59Å; H362-A393 PolarHBondContact NE2-N 2.96Å; A393-V396 PolarHBondContact O-N 2.99Å; A393-A397 WeakPolarHBondContact O-CB 3.27Å; A393-A397 PolarHBondContact O-N 3.46Å; A393-I409 HydrophobicContact CB-CD1 4.11Å
394	L	97.9	Very high	96	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-47.7	172.2	177.9	60.5	0	0	0	111.6	T392 V396 A397 A398 V406 I409 I410 Q478 A481	T392-L394 PolarHBondContact O-N 3.49Å; L394-V396 VanDerWaalsContact C-N 3.31Å; L394-V396 PolarHBondContact O-N 3.21Å; L394-A397 PolarHBondContact O-N 3.1Å; L394-A398 WeakPolarHBondContact O-CB 3.32Å; L394-A398 PolarHBondContact O-N 3.47Å; L394-V406 HydrophobicContact CD1-CB 4.43Å; L394-V406 HydrophobicContact CD1-CG1 3.92Å; L394-I409 HydrophobicContact CB-CG2 3.86Å; L394-I409 HydrophobicContact CD1-CB 4.33Å; L394-I409 HydrophobicContact CD1-CG2 4.23Å; L394-I410 HydrophobicContact CD1-CD1 4.14Å; L394-I410 HydrophobicContact CD1-CG1 3.67Å; L394-I410 HydrophobicContact CD2-CG1 4.21Å; L394-Q478 HydrophobicContact CD2-CG 4.12Å; L394-A481 HydrophobicContact CD1-CB 3.79Å; L394-A481 HydrophobicContact CD2-CB 4.14Å; L394-A481 HydrophobicContact CG-CB 3.83Å
395	G	96.9	Very high	96.2	Very high	18 Å²	18	50.6 Å²	50.6	19%	0.186	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-33.7	178.3	0	0	0	0	0	112.9	T392 R399	T392-G395 WeakPolarHBondContact O-CA 3.19Å; T392-G395 PolarHBondContact O-N 2.74Å; G395-R399 WeakPolarHBondContact O-CB 3.34Å; G395-R399 PolarHBondContact O-N 3.31Å
396	V	97	Very high	96.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-46.5	173.7	173	0	0	0	0	111.2	E366 D387 K391 T392 A393 L394 A398 R399 A400	E366-V396 HydrophobicContact CB-CG1 3.68Å; E366-V396 HydrophobicContact CG-CG1 4.37Å; D387-V396 WeakPolarHBondContact OD2-CG2 3.49Å; K391-V396 HydrophobicContact CB-CG2 4.06Å; T392-V396 PolarHBondContact O-N 3.47Å; A393-V396 PolarHBondContact O-N 2.99Å; L394-V396 VanDerWaalsContact C-N 3.31Å; L394-V396 PolarHBondContact O-N 3.21Å; V396-A398 VanDerWaalsContact C-N 3.32Å; V396-A398 PolarHBondContact O-N 3.27Å; V396-R399 PolarHBondContact O-N 3.06Å; V396-A400 WeakPolarHBondContact O-CB 3.46Å; V396-A400 PolarHBondContact O-N 3.47Å
397	A	97.4	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-44.5	175.5	0	0	0	0	0	111.7	A365 A393 L394 A400 N401 E402 I405 V406 I409	A365-A397 HydrophobicContact CB-CB 4.09Å; A393-A397 WeakPolarHBondContact O-CB 3.27Å; A393-A397 PolarHBondContact O-N 3.46Å; L394-A397 PolarHBondContact O-N 3.1Å; A397-A400 PolarHBondContact O-N 3.39Å; A397-N401 PolarHBondContact O-N 3.11Å; A397-N401 VanDerWaalsContact O-N 3.15Å; A397-E402 PolarHBondContact O-N 2.87Å; A397-I405 HydrophobicContact CB-CB 4.31Å; A397-I405 HydrophobicContact CB-CG2 3.73Å; A397-V406 HydrophobicContact CB-CG2 3.74Å; A397-I409 HydrophobicContact CB-CD1 4.23Å
398	A	95.9	Very high	96.2	Very high	8 Å²	8	43.5 Å²	43.5	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-45.5	177.9	0	0	0	0	0	111.7	L394 V396 A400 N401 V406 A481 Q485	L394-A398 WeakPolarHBondContact O-CB 3.32Å; L394-A398 PolarHBondContact O-N 3.47Å; V396-A398 VanDerWaalsContact C-N 3.32Å; V396-A398 PolarHBondContact O-N 3.27Å; A398-A400 VanDerWaalsContact C-N 3.3Å; A398-A400 PolarHBondContact O-N 2.95Å; A398-N401 PolarHBondContact O-N 2.99Å; A398-N401 VanDerWaalsContact O-N 3.12Å; A398-V406 HydrophobicContact CB-CG2 4.15Å; A398-A481 HydrophobicContact CB-CB 4.07Å; A398-Q485 VanDerWaalsContact CA-NE2 3.31Å; A398-Q485 PolarHBondContact O-NE2 3.13Å
399	R	94.7	Very high	96.3	Very high	141 Å²	141	35.1 Å²	35.1	53%	0.532	19%	0.185	S	C	.	.	H	α-helix	trans	-62.1	-36.2	175.7	-178.7	-175.4	62.8	78.8	-4	112.6	E366 G395 V396 N401	E366-R399 IonicContact OE1-CZ 3.94Å; E366-R399 IonicContact OE1-NH1 2.8Å; E366-R399 IonicContact OE1-NH2 3.16Å; E366-R399 PolarHBondContact OE1-NH2 2.89Å; G395-R399 WeakPolarHBondContact O-CB 3.34Å; G395-R399 PolarHBondContact O-N 3.31Å; V396-R399 PolarHBondContact O-N 3.06Å; R399-N401 PolarHBondContact O-N 3.35Å
400	A	94	Very high	96.4	Very high	32 Å²	32	29.6 Å²	29.6	26%	0.264	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.5	178.3	0	0	0	0	0	113.4	V396 A397 A398 E402	V396-A400 WeakPolarHBondContact O-CB 3.46Å; V396-A400 PolarHBondContact O-N 3.47Å; A397-A400 PolarHBondContact O-N 3.39Å; A398-A400 VanDerWaalsContact C-N 3.3Å; A398-A400 PolarHBondContact O-N 2.95Å; A400-E402 VanDerWaalsContact C-N 3.26Å; A400-E402 HydrophobicContact CB-CG 4Å; A400-E402 PolarHBondContact O-N 3.23Å
401	N	93.6	Very high	96.4	Very high	98 Å²	98	28.4 Å²	28.4	52%	0.524	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	31.6	-175	-163.4	46.6	0	0	0	113.6	A397 A398 R399 V403 Q485	A397-N401 PolarHBondContact O-N 3.11Å; A397-N401 VanDerWaalsContact O-N 3.15Å; A398-N401 PolarHBondContact O-N 2.99Å; A398-N401 VanDerWaalsContact O-N 3.12Å; R399-N401 PolarHBondContact O-N 3.35Å; N401-V403 PolarHBondContact O-N 3.06Å; N401-Q485 VanDerWaalsContact C-OE1 3.3Å; N401-Q485 PolarHBondContact OD1-OE1 2.95Å
402	E	95.9	Very high	96.3	Very high	62 Å²	62	23.5 Å²	23.5	29%	0.29	12%	0.123	S	C	.	.			trans	-90	71.5	179.6	-69.5	-62.3	162.6	0	0	111.1	G368 A397 A400 I404 I405 V406	G368-E402 VanDerWaalsContact CA-CD 3.45Å; A397-E402 PolarHBondContact O-N 2.87Å; A400-E402 VanDerWaalsContact C-N 3.26Å; A400-E402 HydrophobicContact CB-CG 4Å; A400-E402 PolarHBondContact O-N 3.23Å; E402-I404 VanDerWaalsContact C-N 3.3Å; E402-I404 PolarHBondContact O-N 3.42Å; E402-I405 HydrophobicContact CB-CB 4.07Å; E402-I405 HydrophobicContact CB-CD1 4.02Å; E402-I405 HydrophobicContact CB-CG1 4.43Å; E402-I405 HydrophobicContact CG-CD1 4.31Å; E402-I405 PolarHBondContact O-N 3.48Å; E402-V406 PolarHBondContact O-N 3.35Å
403	V	94.6	Very high	96.2	Very high	33 Å²	33	23.9 Å²	23.9	20%	0.2	13%	0.125	C	C	.	.	H	α-helix	trans	-47.9	-46.9	-174.4	176.5	0	0	0	0	113.3	N401 I405 V406 D407 Q485 W486 R498	N401-V403 PolarHBondContact O-N 3.06Å; V403-I405 VanDerWaalsContact C-N 3.35Å; V403-I405 PolarHBondContact O-N 3.24Å; V403-V406 WeakPolarHBondContact O-CB 3.38Å; V403-V406 PolarHBondContact O-N 3.37Å; V403-D407 PolarHBondContact O-N 2.86Å; V403-D407 VanDerWaalsContact O-N 3.12Å; V403-Q485 HydrophobicContact CG2-CB 4.11Å; V403-Q485 HydrophobicContact CG2-CG 4.14Å; V403-W486 HydrophobicContact CB-CH2 4.45Å; V403-W486 HydrophobicContact CG1-CH2 3.43Å; V403-W486 VanDerWaalsContact CG1-CH2 3.43Å; V403-W486 HydrophobicContact CG1-CZ2 4.13Å; V403-W486 HydrophobicContact CG1-CZ3 4.13Å; V403-W486 HydrophobicContact CG2-CH2 4.12Å; V403-W486 HydrophobicContact CG2-CZ2 4.2Å; V403-R498 PolarHBondContact O-NH2 3.39Å
404	I	95.8	Very high	96	Very high	72 Å²	72	24.8 Å²	24.8	37%	0.369	13%	0.128	S	C	.	.	H	α-helix	trans	-65.8	-41.7	-177.5	-61.3	177.9	0	0	0	110.2	T370 E402 D407 M408 L439	T370-I404 HydrophobicContact CG2-CG2 4.45Å; E402-I404 VanDerWaalsContact C-N 3.3Å; E402-I404 PolarHBondContact O-N 3.42Å; I404-D407 PolarHBondContact O-N 3.01Å; I404-M408 HydrophobicContact CG2-CG 4.39Å; I404-M408 HydrophobicContact CG2-SD 3.96Å; I404-M408 VanDerWaalsContact O-CG 3.23Å; I404-M408 WeakPolarHBondContact O-CG 3.49Å; I404-M408 PolarHBondContact O-N 3.5Å; I404-L439 HydrophobicContact CD1-CD1 4.03Å; I404-L439 HydrophobicContact CG1-CD1 4.1Å; I404-L439 HydrophobicContact CG2-CD1 4.42Å; I404-L439 HydrophobicContact CG2-CG 4.33Å
405	I	97.7	Very high	95.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.4	-37.4	180	-69	167.2	0	0	0	110.8	A365 T370 V373 A397 E402 V403 D407 M408 I409	A365-I405 HydrophobicContact CB-CG2 3.93Å; T370-I405 HydrophobicContact CG2-CD1 4.37Å; T370-I405 HydrophobicContact CG2-CG1 4.19Å; V373-I405 HydrophobicContact CG1-CG2 4.09Å; V373-I405 HydrophobicContact CG2-CD1 4.01Å; V373-I405 HydrophobicContact CG2-CG1 4.1Å; V373-I405 HydrophobicContact CG2-CG2 4.02Å; A397-I405 HydrophobicContact CB-CB 4.31Å; A397-I405 HydrophobicContact CB-CG2 3.73Å; E402-I405 HydrophobicContact CB-CB 4.07Å; E402-I405 HydrophobicContact CB-CD1 4.02Å; E402-I405 HydrophobicContact CB-CG1 4.43Å; E402-I405 HydrophobicContact CG-CD1 4.31Å; E402-I405 PolarHBondContact O-N 3.48Å; V403-I405 VanDerWaalsContact C-N 3.35Å; V403-I405 PolarHBondContact O-N 3.24Å; I405-D407 VanDerWaalsContact C-N 3.3Å; I405-D407 PolarHBondContact O-N 3.03Å; I405-M408 PolarHBondContact O-N 3.13Å; I405-I409 HydrophobicContact CG2-CD1 3.65Å; I405-I409 HydrophobicContact CG2-CG1 4.14Å; I405-I409 VanDerWaalsContact O-CG1 3.32Å; I405-I409 WeakPolarHBondContact O-CG1 3.42Å; I405-I409 PolarHBondContact O-N 3.03Å
406	V	97.4	Very high	95.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.3	-49.7	170.5	170.8	0	0	0	0	109.9	L394 A397 A398 E402 V403 M408 I409 I410 A481	L394-V406 HydrophobicContact CD1-CB 4.43Å; L394-V406 HydrophobicContact CD1-CG1 3.92Å; A397-V406 HydrophobicContact CB-CG2 3.74Å; A398-V406 HydrophobicContact CB-CG2 4.15Å; E402-V406 PolarHBondContact O-N 3.35Å; V403-V406 WeakPolarHBondContact O-CB 3.38Å; V403-V406 PolarHBondContact O-N 3.37Å; V406-M408 PolarHBondContact O-N 3.18Å; V406-I409 PolarHBondContact O-N 3.19Å; V406-I410 HydrophobicContact CG1-CD1 3.8Å; V406-I410 HydrophobicContact CG1-CG1 4.49Å; V406-I410 VanDerWaalsContact O-CG1 3.23Å; V406-I410 WeakPolarHBondContact O-CG1 3.4Å; V406-I410 PolarHBondContact O-N 2.71Å; V406-A481 HydrophobicContact CG1-CB 4.11Å
407	D	96.8	Very high	95	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-42	179	-69	-10.2	0	0	0	112.2	V403 I404 I405 K411 R498 I502	V403-D407 PolarHBondContact O-N 2.86Å; V403-D407 VanDerWaalsContact O-N 3.12Å; I404-D407 PolarHBondContact O-N 3.01Å; I405-D407 VanDerWaalsContact C-N 3.3Å; I405-D407 PolarHBondContact O-N 3.03Å; D407-K411 WeakPolarHBondContact O-CB 3.3Å; D407-K411 VanDerWaalsContact O-CG 3.22Å; D407-K411 WeakPolarHBondContact O-CG 3.31Å; D407-K411 PolarHBondContact O-N 3.35Å; D407-R498 IonicContact OD1-CZ 2.94Å; D407-R498 IonicContact OD1-NE 3.46Å; D407-R498 PolarHBondContact OD1-NE 2.93Å; D407-R498 IonicContact OD1-NH2 3.47Å; D407-R498 PolarHBondContact OD1-NH2 2.87Å; D407-R498 IonicContact OD2-CZ 3.89Å; D407-R498 IonicContact OD2-NE 3.44Å; D407-R498 PolarHBondContact OD2-NE 3.41Å; D407-R498 VanDerWaalsContact OD2-NE 3.13Å; D407-R498 IonicContact OD2-NH2 2.65Å; D407-I502 HydrophobicContact CB-CD1 4.35Å; D407-I502 HydrophobicContact CB-CG1 4.32Å
408	M	97.7	Very high	94.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-61.2	-46.8	178	-69.9	171.9	70.7	0	0	112	V373 E374 L377 I404 I405 V406 K411 A412 F437 K438	V373-M408 HydrophobicContact CB-CE 4.25Å; V373-M408 HydrophobicContact CG1-CB 4.39Å; V373-M408 HydrophobicContact CG1-CE 3.89Å; V373-M408 HydrophobicContact CG1-SD 4.42Å; E374-M408 HydrophobicContact CB-CE 3.63Å; E374-M408 WeakPolarHBondContact OE2-CE 3.47Å; L377-M408 HydrophobicContact CD1-CB 3.95Å; I404-M408 HydrophobicContact CG2-CG 4.39Å; I404-M408 HydrophobicContact CG2-SD 3.96Å; I404-M408 VanDerWaalsContact O-CG 3.23Å; I404-M408 WeakPolarHBondContact O-CG 3.49Å; I404-M408 PolarHBondContact O-N 3.5Å; I405-M408 PolarHBondContact O-N 3.13Å; V406-M408 PolarHBondContact O-N 3.18Å; M408-K411 PolarHBondContact O-N 2.71Å; M408-A412 PolarHBondContact O-N 2.97Å; M408-F437 HydrophobicContact CB-CB 4.13Å; M408-F437 HydrophobicContact CG-CB 4.35Å; M408-F437 VanDerWaalsContact CG-O 3.29Å; M408-F437 WeakPolarHBondContact CG-O 3.46Å; M408-K438 HydrophobicContact CE-CG 4.07Å
409	I	97.6	Very high	94.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-44.7	-179.7	-66.4	170.8	0	0	0	110.2	A365 L377 A393 L394 A397 I405 V406 K411 A412 E413	A365-I409 HydrophobicContact CB-CD1 4.45Å; L377-I409 HydrophobicContact CD1-CG1 4.43Å; L377-I409 HydrophobicContact CD2-CG1 4.42Å; A393-I409 HydrophobicContact CB-CD1 4.11Å; L394-I409 HydrophobicContact CB-CG2 3.86Å; L394-I409 HydrophobicContact CD1-CB 4.33Å; L394-I409 HydrophobicContact CD1-CG2 4.23Å; A397-I409 HydrophobicContact CB-CD1 4.23Å; I405-I409 HydrophobicContact CG2-CD1 3.65Å; I405-I409 HydrophobicContact CG2-CG1 4.14Å; I405-I409 VanDerWaalsContact O-CG1 3.32Å; I405-I409 WeakPolarHBondContact O-CG1 3.42Å; I405-I409 PolarHBondContact O-N 3.03Å; V406-I409 PolarHBondContact O-N 3.19Å; I409-K411 VanDerWaalsContact C-N 3.34Å; I409-K411 PolarHBondContact O-N 3.24Å; I409-A412 PolarHBondContact O-N 2.75Å; I409-A412 VanDerWaalsContact O-N 3.14Å; I409-E413 HydrophobicContact CG2-CG 4.32Å; I409-E413 WeakPolarHBondContact O-CG 3.45Å; I409-E413 PolarHBondContact O-N 2.71Å
410	I	96.9	Very high	93.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-42	178.4	-61	172.7	0	0	0	110.8	L394 V406 A412 E413 R414 F474 Q478 I482 I502	L394-I410 HydrophobicContact CD1-CD1 4.14Å; L394-I410 HydrophobicContact CD1-CG1 3.67Å; L394-I410 HydrophobicContact CD2-CG1 4.21Å; V406-I410 HydrophobicContact CG1-CD1 3.8Å; V406-I410 HydrophobicContact CG1-CG1 4.49Å; V406-I410 VanDerWaalsContact O-CG1 3.23Å; V406-I410 WeakPolarHBondContact O-CG1 3.4Å; V406-I410 PolarHBondContact O-N 2.71Å; I410-A412 VanDerWaalsContact C-N 3.32Å; I410-A412 PolarHBondContact O-N 3.16Å; I410-E413 PolarHBondContact O-N 2.98Å; I410-R414 HydrophobicContact CG2-CG 4.38Å; I410-R414 WeakPolarHBondContact O-CB 3.45Å; I410-R414 VanDerWaalsContact O-CG 3.28Å; I410-R414 WeakPolarHBondContact O-CG 3.48Å; I410-R414 PolarHBondContact O-N 3.2Å; I410-F474 HydrophobicContact CG2-CD1 4.26Å; I410-F474 HydrophobicContact CG2-CE1 3.93Å; I410-Q478 HydrophobicContact CD1-CB 4.18Å; I410-Q478 HydrophobicContact CD1-CG 4.49Å; I410-Q478 HydrophobicContact CG1-CB 4.31Å; I410-Q478 HydrophobicContact CG1-CG 4.07Å; I410-Q478 HydrophobicContact CG2-CB 4.24Å; I410-Q478 HydrophobicContact CG2-CG 3.94Å; I410-I482 HydrophobicContact CD1-CD1 3.89Å; I410-I482 HydrophobicContact CD1-CG1 3.66Å; I410-I502 HydrophobicContact CB-CD1 4.17Å; I410-I502 HydrophobicContact CB-CG2 4.34Å; I410-I502 HydrophobicContact CD1-CD1 4.12Å; I410-I502 HydrophobicContact CG2-CD1 4.16Å; I410-I502 HydrophobicContact CG2-CG2 3.66Å
411	K	95.5	Very high	93.4	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-44.7	173.9	-74.5	169.7	-175.4	172.7	0	111.4	D407 M408 I409 R414 Y415 F437 K438 I502 H505	D407-K411 WeakPolarHBondContact O-CB 3.3Å; D407-K411 VanDerWaalsContact O-CG 3.22Å; D407-K411 WeakPolarHBondContact O-CG 3.31Å; D407-K411 PolarHBondContact O-N 3.35Å; M408-K411 PolarHBondContact O-N 2.71Å; I409-K411 VanDerWaalsContact C-N 3.34Å; I409-K411 PolarHBondContact O-N 3.24Å; K411-R414 PolarHBondContact O-N 3.32Å; K411-Y415 VanDerWaalsContact O-CB 3.25Å; K411-Y415 WeakPolarHBondContact O-CB 3.15Å; K411-Y415 PolarHBondContact O-N 3.37Å; K411-F437 HydrophobicContact CB-CD1 3.89Å; K411-F437 VanDerWaalsContact CD-O 3.28Å; K411-F437 WeakPolarHBondContact CD-O 3.36Å; K411-F437 PolarHBondContact NZ-O 3.18Å; K411-K438 PolarHBondContact NZ-O 3.36Å; K411-I502 HydrophobicContact CG-CB 4.37Å; K411-I502 HydrophobicContact CG-CG1 4.23Å; K411-I502 HydrophobicContact CG-CG2 4.1Å; K411-H505 HydrophobicContact CD-CB 4.2Å; K411-H505 HydrophobicContact CG-CB 4.18Å
412	A	95.3	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-47.1	178	0	0	0	0	0	112.6	L377 L383 M408 I409 I410 R414 Y415 Y416 F437	L377-A412 HydrophobicContact CB-CB 4.26Å; L377-A412 HydrophobicContact CD1-CB 3.98Å; L377-A412 HydrophobicContact CD2-CB 3.77Å; L377-A412 HydrophobicContact CG-CB 4.22Å; L383-A412 HydrophobicContact CD1-CB 4.24Å; M408-A412 PolarHBondContact O-N 2.97Å; I409-A412 PolarHBondContact O-N 2.75Å; I409-A412 VanDerWaalsContact O-N 3.14Å; I410-A412 VanDerWaalsContact C-N 3.32Å; I410-A412 PolarHBondContact O-N 3.16Å; A412-R414 VanDerWaalsContact C-N 3.28Å; A412-R414 PolarHBondContact O-N 3.38Å; A412-Y415 PolarHBondContact O-N 3.28Å; A412-Y416 HydrophobicContact CB-CD2 4.34Å; A412-Y416 HydrophobicContact CB-CE2 4.3Å; A412-Y416 WeakPolarHBondContact O-CD2 3.48Å; A412-Y416 PolarHBondContact O-N 3.45Å; A412-F437 VanDerWaalsContact CA-CE1 3.46Å; A412-F437 HydrophobicContact CB-CD1 3.99Å; A412-F437 HydrophobicContact CB-CD2 4.31Å; A412-F437 HydrophobicContact CB-CE1 3.82Å; A412-F437 HydrophobicContact CB-CE2 4.13Å; A412-F437 HydrophobicContact CB-CG 4.22Å; A412-F437 HydrophobicContact CB-CZ 3.88Å
413	E	95.2	Very high	92.2	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.065	21%	0.212	C	C	.	.	H	α-helix	trans	-54.8	-46	175.9	-73	-178.5	161.4	0	0	111.6	L383 I409 I410 S417 Q478	L383-E413 HydrophobicContact CB-CG 4.16Å; L383-E413 HydrophobicContact CD1-CB 4.21Å; L383-E413 HydrophobicContact CD1-CG 3.54Å; L383-E413 HydrophobicContact CG-CG 4.39Å; I409-E413 HydrophobicContact CG2-CG 4.32Å; I409-E413 WeakPolarHBondContact O-CG 3.45Å; I409-E413 PolarHBondContact O-N 2.71Å; I410-E413 PolarHBondContact O-N 2.98Å; E413-S417 VanDerWaalsContact O-CB 3.23Å; E413-S417 WeakPolarHBondContact O-CB 3.37Å; E413-S417 PolarHBondContact O-N 3.3Å; E413-S417 PolarHBondContact O-OG 3.24Å; E413-Q478 WeakPolarHBondContact OE2-CG 3.23Å; E413-Q478 PolarHBondContact OE2-NE2 2.89Å
414	R	92.8	Very high	91.1	Very high	22 Å²	22	47.5 Å²	47.5	8%	0.083	24%	0.244	C	C	.	.	H	α-helix	trans	-67.8	-42	179.3	-69.5	179.1	69.9	80.1	2.2	111.8	I410 K411 A412 W418 W472	I410-R414 HydrophobicContact CG2-CG 4.38Å; I410-R414 WeakPolarHBondContact O-CB 3.45Å; I410-R414 VanDerWaalsContact O-CG 3.28Å; I410-R414 WeakPolarHBondContact O-CG 3.48Å; I410-R414 PolarHBondContact O-N 3.2Å; K411-R414 PolarHBondContact O-N 3.32Å; A412-R414 VanDerWaalsContact C-N 3.28Å; A412-R414 PolarHBondContact O-N 3.38Å; R414-W418 WeakPolarHBondContact O-CB 3.28Å; R414-W418 PolarHBondContact O-N 2.89Å; R414-W472 PolarHBondContact NH1-O 2.97Å; R414-W472 PolarHBondContact NH2-O 2.89Å
415	Y	90.9	Very high	89.6	Confident	32 Å²	32	47.9 Å²	47.9	13%	0.125	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-50.9	177.2	171	-106.9	0	0	0	111.9	K411 A412 W418 R419 L435 F437 L509	K411-Y415 VanDerWaalsContact O-CB 3.25Å; K411-Y415 WeakPolarHBondContact O-CB 3.15Å; K411-Y415 PolarHBondContact O-N 3.37Å; A412-Y415 PolarHBondContact O-N 3.28Å; Y415-W418 PolarHBondContact O-N 3.03Å; Y415-R419 HydrophobicContact CD2-CG 4.49Å; Y415-R419 HydrophobicContact CE1-CG 4.45Å; Y415-R419 HydrophobicContact CE2-CG 4.14Å; Y415-R419 PolarHBondContact O-N 3.42Å; Y415-R419 VanDerWaalsContact OH-CD 3.31Å; Y415-R419 WeakPolarHBondContact OH-CD 3.45Å; Y415-R419 PolarHBondContact OH-NH1 2.86Å; Y415-L435 HydrophobicContact CD1-CD1 4.49Å; Y415-L435 HydrophobicContact CD1-CD2 4.45Å; Y415-L435 HydrophobicContact CD2-CD1 4.39Å; Y415-L435 HydrophobicContact CE1-CD1 4.13Å; Y415-L435 HydrophobicContact CE1-CD2 3.66Å; Y415-L435 HydrophobicContact CE2-CD1 4.03Å; Y415-F437 HydrophobicContact CD1-CE1 4.05Å; Y415-F437 AromaticContact CD1-CZ 3.81Å; Y415-F437 HydrophobicContact CD1-CZ 3.81Å; Y415-F437 HydrophobicContact CE1-CZ 4.33Å; Y415-F437 HydrophobicContact CG-CE1 4.13Å; Y415-F437 HydrophobicContact CG-CZ 4.36Å; Y415-L509 HydrophobicContact CD2-CD1 3.54Å; Y415-L509 HydrophobicContact CE2-CD1 3.92Å; Y415-L509 HydrophobicContact CG-CD1 4.38Å
416	Y	90	Very high	87.6	Confident	52 Å²	52	52.3 Å²	52.3	20%	0.204	27%	0.27	C	S	.	.	H	α-helix	trans	-69	-35.9	-179.4	-72.4	-62.9	0	0	0	112.6	L377 K378 L383 A412 W418 R419 K420 F437	L377-Y416 WeakPolarHBondContact O-CE2 3.36Å; L377-Y416 PolarHBondContact O-OH 3.3Å; K378-Y416 PolarHBondContact O-OH 3.25Å; L383-Y416 HydrophobicContact CD1-CD2 4.35Å; A412-Y416 HydrophobicContact CB-CD2 4.34Å; A412-Y416 HydrophobicContact CB-CE2 4.3Å; A412-Y416 WeakPolarHBondContact O-CD2 3.48Å; A412-Y416 PolarHBondContact O-N 3.45Å; Y416-W418 VanDerWaalsContact C-N 3.34Å; Y416-R419 PolarHBondContact O-N 2.75Å; Y416-K420 WeakPolarHBondContact O-CB 3.42Å; Y416-K420 PolarHBondContact O-N 3.42Å; Y416-F437 HydrophobicContact CE2-CZ 4.21Å
417	S	90.1	Very high	85.2	Confident	81 Å²	81	61 Å²	61	57%	0.566	31%	0.31	S	S	*	.	H	α-helix	trans	-61.8	-43.2	172.4	-61.6	0	0	0	0	111.7	E413 K420 A421	E413-S417 VanDerWaalsContact O-CB 3.23Å; E413-S417 WeakPolarHBondContact O-CB 3.37Å; E413-S417 PolarHBondContact O-N 3.3Å; E413-S417 PolarHBondContact O-OG 3.24Å; S417-K420 PolarHBondContact O-N 3.35Å; S417-A421 PolarHBondContact O-N 2.97Å; S417-A421 VanDerWaalsContact O-N 3.15Å
418	W	88	Confident	82.7	Confident	25 Å²	25	64.4 Å²	64.4	10%	0.095	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-44.8	175.9	172.3	73.1	0	0	0	112.1	R414 Y415 Y416 K420 A421 N422 L425 V429 A510	R414-W418 WeakPolarHBondContact O-CB 3.28Å; R414-W418 PolarHBondContact O-N 2.89Å; Y415-W418 PolarHBondContact O-N 3.03Å; Y416-W418 VanDerWaalsContact C-N 3.34Å; W418-K420 VanDerWaalsContact C-N 3.32Å; W418-K420 PolarHBondContact O-N 3.42Å; W418-A421 PolarHBondContact O-N 3.41Å; W418-A421 VanDerWaalsContact O-N 3.13Å; W418-N422 PolarHBondContact NE1-ND2 3Å; W418-N422 PolarHBondContact O-N 3.14Å; W418-N422 PolarHBondContact O-ND2 3.45Å; W418-L425 HydrophobicContact CZ2-CD1 4.27Å; W418-V429 HydrophobicContact CH2-CG2 4.31Å; W418-A510 HydrophobicContact CZ2-CB 3.97Å
419	R	85.4	Confident	80.4	Confident	86 Å²	86	66.9 Å²	66.9	33%	0.325	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-42.8	176.7	-78.5	-170.9	69	-170.1	4.4	112.4	Y415 Y416 A421 N422 N426	Y415-R419 HydrophobicContact CD2-CG 4.49Å; Y415-R419 HydrophobicContact CE1-CG 4.45Å; Y415-R419 HydrophobicContact CE2-CG 4.14Å; Y415-R419 PolarHBondContact O-N 3.42Å; Y415-R419 VanDerWaalsContact OH-CD 3.31Å; Y415-R419 WeakPolarHBondContact OH-CD 3.45Å; Y415-R419 PolarHBondContact OH-NH1 2.86Å; Y416-R419 PolarHBondContact O-N 2.75Å; R419-A421 VanDerWaalsContact C-N 3.27Å; R419-A421 PolarHBondContact O-N 3.44Å; R419-N422 CarbonylContact O-C 3.46Å; R419-N422 PolarHBondContact O-N 3Å; R419-N426 PolarHBondContact NE-OD1 3.23Å; R419-N426 PolarHBondContact NH2-OD1 3.12Å
420	K	87.4	Confident	78.1	Confident	187 Å²	187	74.5 Å²	74.5	81%	0.813	39%	0.385	S	S	*	.	H	α-helix	trans	-62.8	-35.3	176.8	-170.9	177.4	-179.3	178.7	0	112.3	Y416 S417 W418	Y416-K420 WeakPolarHBondContact O-CB 3.42Å; Y416-K420 PolarHBondContact O-N 3.42Å; S417-K420 PolarHBondContact O-N 3.35Å; W418-K420 VanDerWaalsContact C-N 3.32Å; W418-K420 PolarHBondContact O-N 3.42Å
421	A	87.4	Confident	76.1	Confident	76 Å²	76	76.8 Å²	76.8	63%	0.628	40%	0.401	S	S	*	.	H	α-helix	trans	-78.5	-17.4	177.5	0	0	0	0	0	114	S417 W418 R419 P423	S417-A421 PolarHBondContact O-N 2.97Å; S417-A421 VanDerWaalsContact O-N 3.15Å; W418-A421 PolarHBondContact O-N 3.41Å; W418-A421 VanDerWaalsContact O-N 3.13Å; R419-A421 VanDerWaalsContact C-N 3.27Å; R419-A421 PolarHBondContact O-N 3.44Å; A421-P423 VanDerWaalsContact C-CD 3.48Å
422	N	84.6	Confident	74.4	Confident	61 Å²	61	85.1 Å²	85.1	33%	0.326	44%	0.44	S	S	.	.			trans	-130.2	63.5	-175	-60.4	-91.9	0	0	0	111.8	W418 R419 E424 L425	W418-N422 PolarHBondContact NE1-ND2 3Å; W418-N422 PolarHBondContact O-N 3.14Å; W418-N422 PolarHBondContact O-ND2 3.45Å; R419-N422 CarbonylContact O-C 3.46Å; R419-N422 PolarHBondContact O-N 3Å; N422-E424 VanDerWaalsContact C-N 3.32Å; N422-E424 PolarHBondContact O-N 2.94Å; N422-L425 HydrophobicContact CB-CD1 4.18Å; N422-L425 PolarHBondContact O-N 3.03Å
423	P	78.3	Confident	73.2	Confident	88 Å²	88	88.4 Å²	88.4	57%	0.571	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-66.8	-28.2	-174.2	26.3	-34.2	0	0	0	113.9	A421 L425 N426	A421-P423 VanDerWaalsContact C-CD 3.48Å; P423-L425 VanDerWaalsContact C-N 3.34Å; P423-L425 PolarHBondContact O-N 3.38Å; P423-N426 WeakPolarHBondContact O-CB 3.49Å; P423-N426 PolarHBondContact O-N 3.33Å
424	E	71.9	Confident	72.5	Confident	184 Å²	184	93.2 Å²	93.2	86%	0.86	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-71.3	-26.8	-177.8	-59.7	-175.3	-177.1	0	0	113.3	N422 N426	N422-E424 VanDerWaalsContact C-N 3.32Å; N422-E424 PolarHBondContact O-N 2.94Å; E424-N426 PolarHBondContact O-N 2.94Å
425	L	64.6	Low	72.2	Confident	80 Å²	80	94.2 Å²	94.2	42%	0.419	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-79.3	-3.4	176.5	-67.5	170.7	0	0	0	112.3	W418 N422 P423 E427 S428 V429	W418-L425 HydrophobicContact CZ2-CD1 4.27Å; N422-L425 HydrophobicContact CB-CD1 4.18Å; N422-L425 PolarHBondContact O-N 3.03Å; P423-L425 VanDerWaalsContact C-N 3.34Å; P423-L425 PolarHBondContact O-N 3.38Å; L425-E427 VanDerWaalsContact C-N 3.32Å; L425-E427 PolarHBondContact O-N 2.88Å; L425-S428 PolarHBondContact O-N 2.64Å; L425-V429 HydrophobicContact CB-CG2 4.29Å; L425-V429 WeakPolarHBondContact O-CG2 3.34Å; L425-V429 PolarHBondContact O-N 3.43Å
426	N	56.7	Low	72.3	Confident	94 Å²	94	95.3 Å²	95.3	50%	0.503	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-71.5	-24.6	-172.1	-160.8	35.2	0	0	0	113.6	R419 P423 E424	R419-N426 PolarHBondContact NE-OD1 3.23Å; R419-N426 PolarHBondContact NH2-OD1 3.12Å; P423-N426 WeakPolarHBondContact O-CB 3.49Å; P423-N426 PolarHBondContact O-N 3.33Å; E424-N426 PolarHBondContact O-N 2.94Å
427	E	47	Very low	72.5	Confident	181 Å²	181	92.8 Å²	92.8	85%	0.846	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-83.6	-21.7	178.7	-69.6	-175.9	172.5	0	0	113.2	L425	L425-E427 VanDerWaalsContact C-N 3.32Å; L425-E427 PolarHBondContact O-N 2.88Å
428	S	43.8	Very low	72.6	Confident	79 Å²	79	92.3 Å²	92.3	55%	0.552	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-4.2	-169.9	88.5	0	0	0	0	115.6	L425 H430	L425-S428 PolarHBondContact O-N 2.64Å; S428-H430 PolarHBondContact O-N 3.04Å
429	V	49.7	Very low	72.7	Confident	53 Å²	53	94 Å²	94	32%	0.321	49%	0.493	S	S	.	.			trans	-81.1	67.7	178.6	-177.5	0	0	0	0	109.2	W418 L425 S431	W418-V429 HydrophobicContact CH2-CG2 4.31Å; L425-V429 HydrophobicContact CB-CG2 4.29Å; L425-V429 WeakPolarHBondContact O-CG2 3.34Å; L425-V429 PolarHBondContact O-N 3.43Å; V429-S431 PolarHBondContact O-N 2.82Å; V429-S431 VanDerWaalsContact O-N 3.1Å
430	H	47.7	Very low	72.9	Confident	161 Å²	161	91.5 Å²	91.5	75%	0.745	49%	0.486	S	S	*	.			trans	-75.3	85.8	157.9	-66.7	-53.8	0	0	0	107.3	S428 E432	S428-H430 PolarHBondContact O-N 3.04Å; H430-E432 PolarHBondContact O-N 3.13Å
431	S	55.4	Low	72.9	Confident	48 Å²	48	89.4 Å²	89.4	34%	0.336	48%	0.479	S	S	.	.			trans	-60.3	131.4	164.1	166.6	0	0	0	0	108.1	V429 H433	V429-S431 PolarHBondContact O-N 2.82Å; V429-S431 VanDerWaalsContact O-N 3.1Å; S431-H433 WeakPolarHBondContact CB-O 3.4Å; S431-H433 PolarHBondContact O-N 3.34Å; S431-H433 PolarHBondContact OG-N 3.38Å; S431-H433 PolarHBondContact OG-O 3.01Å
432	E	60.7	Low	72.9	Confident	184 Å²	184	89 Å²	89	86%	0.86	46%	0.461	S	S	*	.	S	Bend	trans	-54.9	-19.9	172.8	-68.8	-178.7	164.6	0	0	112.3	H430	H430-E432 PolarHBondContact O-N 3.13Å
433	H	68.8	Low	72.9	Confident	69 Å²	69	92.1 Å²	92.1	32%	0.319	48%	0.478	S	S	.	.	S	Bend	trans	-119.4	141.6	-177	-58.4	80.6	0	0	0	111.9	S431	S431-H433 WeakPolarHBondContact CB-O 3.4Å; S431-H433 PolarHBondContact O-N 3.34Å; S431-H433 PolarHBondContact OG-N 3.38Å; S431-H433 PolarHBondContact OG-O 3.01Å
434	P	80.6	Confident	73.3	Confident	115 Å²	115	94.2 Å²	94.2	75%	0.747	48%	0.48	S	S	*	.			trans	-57.7	141.7	173.5	-23.2	33.7	0	0	0	112.2	T436	P434-T436 PolarHBondContact O-N 2.98Å
435	L	88	Confident	74	Confident	42 Å²	42	85.7 Å²	85.7	22%	0.22	44%	0.441	C	S	.	.			trans	-54	130.7	174	177.8	65.3	0	0	0	110	K378 Y415 F437 L509	K378-L435 WeakPolarHBondContact CE-O 3.36Å; K378-L435 HydrophobicContact CG-CD2 4.48Å; K378-L435 PolarHBondContact NZ-O 3.17Å; Y415-L435 HydrophobicContact CD1-CD1 4.49Å; Y415-L435 HydrophobicContact CD1-CD2 4.45Å; Y415-L435 HydrophobicContact CD2-CD1 4.39Å; Y415-L435 HydrophobicContact CE1-CD1 4.13Å; Y415-L435 HydrophobicContact CE1-CD2 3.66Å; Y415-L435 HydrophobicContact CE2-CD1 4.03Å; L435-F437 HydrophobicContact CD1-CE1 4.06Å; L435-F437 HydrophobicContact CD1-CZ 3.99Å; L435-F437 HydrophobicContact CD2-CE2 4.16Å; L435-F437 HydrophobicContact CD2-CZ 3.9Å; L435-F437 HydrophobicContact CG-CE2 4.31Å; L435-F437 HydrophobicContact CG-CZ 4.1Å; L435-L509 HydrophobicContact CD1-CD1 4.01Å; L435-L509 HydrophobicContact CD1-CD2 4.34Å
436	T	91.2	Very high	75.1	Confident	55 Å²	55	87.8 Å²	87.8	34%	0.337	45%	0.446	S	S	.	.			trans	-144.8	141.9	173.9	176.4	0	0	0	0	110.3	E374 P434 K438 H505	E374-T436 WeakPolarHBondContact OE1-CA 3.45Å; E374-T436 WeakPolarHBondContact OE1-CB 3.23Å; E374-T436 PolarHBondContact OE1-OG1 3.02Å; E374-T436 VanDerWaalsContact OE1-OG1 3.08Å; P434-T436 PolarHBondContact O-N 2.98Å; T436-K438 PolarHBondContact OG1-N 3.13Å; T436-H505 PolarHBondContact O-NE2 2.76Å
437	F	94.3	Very high	76.6	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	45%	0.449	C	S	.	.			trans	-103.8	-9.7	173.1	-58	-67.7	0	0	0	112.3	E374 L377 K378 M408 K411 A412 Y415 Y416 L435 H505	E374-F437 PolarHBondContact OE1-N 3.2Å; E374-F437 WeakPolarHBondContact OE2-CA 3.44Å; E374-F437 WeakPolarHBondContact OE2-CB 3.22Å; E374-F437 PolarHBondContact OE2-N 2.91Å; L377-F437 HydrophobicContact CB-CD2 3.63Å; L377-F437 HydrophobicContact CB-CE2 3.8Å; L377-F437 HydrophobicContact CD1-CB 4.24Å; L377-F437 HydrophobicContact CD1-CD2 4.1Å; L377-F437 HydrophobicContact CD1-CG 4.31Å; K378-F437 HydrophobicContact CG-CD2 4.5Å; K378-F437 HydrophobicContact CG-CE2 4.19Å; M408-F437 HydrophobicContact CB-CB 4.13Å; M408-F437 HydrophobicContact CG-CB 4.35Å; M408-F437 VanDerWaalsContact CG-O 3.29Å; M408-F437 WeakPolarHBondContact CG-O 3.46Å; K411-F437 HydrophobicContact CB-CD1 3.89Å; K411-F437 VanDerWaalsContact CD-O 3.28Å; K411-F437 WeakPolarHBondContact CD-O 3.36Å; K411-F437 PolarHBondContact NZ-O 3.18Å; A412-F437 VanDerWaalsContact CA-CE1 3.46Å; A412-F437 HydrophobicContact CB-CD1 3.99Å; A412-F437 HydrophobicContact CB-CD2 4.31Å; A412-F437 HydrophobicContact CB-CE1 3.82Å; A412-F437 HydrophobicContact CB-CE2 4.13Å; A412-F437 HydrophobicContact CB-CG 4.22Å; A412-F437 HydrophobicContact CB-CZ 3.88Å; Y415-F437 HydrophobicContact CD1-CE1 4.05Å; Y415-F437 AromaticContact CD1-CZ 3.81Å; Y415-F437 HydrophobicContact CD1-CZ 3.81Å; Y415-F437 HydrophobicContact CE1-CZ 4.33Å; Y415-F437 HydrophobicContact CG-CE1 4.13Å; Y415-F437 HydrophobicContact CG-CZ 4.36Å; Y416-F437 HydrophobicContact CE2-CZ 4.21Å; L435-F437 HydrophobicContact CD1-CE1 4.06Å; L435-F437 HydrophobicContact CD1-CZ 3.99Å; L435-F437 HydrophobicContact CD2-CE2 4.16Å; L435-F437 HydrophobicContact CD2-CZ 3.9Å; L435-F437 HydrophobicContact CG-CE2 4.31Å; L435-F437 HydrophobicContact CG-CZ 4.1Å; F437-H505 AromaticContact CD1-CE1 3.79Å
438	K	93.7	Very high	78.5	Confident	70 Å²	70	82.5 Å²	82.5	30%	0.304	42%	0.419	S	S	.	.	S	Bend	trans	-56.8	169.2	175	-63.4	-165	177.4	-163.3	0	112.4	E371 E374 M408 K411 T436 D440	E371-K438 IonicContact OE1-NZ 2.71Å; E371-K438 PolarHBondContact OE1-NZ 3.15Å; E374-K438 HydrophobicContact CB-CG 4.43Å; E374-K438 HydrophobicContact CG-CG 4.21Å; E374-K438 PolarHBondContact OE2-N 3.15Å; M408-K438 HydrophobicContact CE-CG 4.07Å; K411-K438 PolarHBondContact NZ-O 3.36Å; T436-K438 PolarHBondContact OG1-N 3.13Å; K438-D440 PolarHBondContact O-N 3.02Å
439	L	90.3	Very high	80.7	Confident	62 Å²	62	81.3 Å²	81.3	33%	0.325	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-58.7	136.2	174.1	-70	171.3	0	0	0	110.5	I404 H441	I404-L439 HydrophobicContact CD1-CD1 4.03Å; I404-L439 HydrophobicContact CG1-CD1 4.1Å; I404-L439 HydrophobicContact CG2-CD1 4.42Å; I404-L439 HydrophobicContact CG2-CG 4.33Å; L439-H441 WeakPolarHBondContact CB-NE2 3.34Å; L439-H441 PolarHBondContact O-CD2 3.39Å
440	D	89.1	Confident	82.5	Confident	32 Å²	32	81.7 Å²	81.7	17%	0.171	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-85	119.1	-179.3	-173.1	17.1	0	0	0	110.9	K438 R442 T445 R449	K438-D440 PolarHBondContact O-N 3.02Å; D440-R442 WeakPolarHBondContact OD1-CB 3.29Å; D440-R442 VanDerWaalsContact OD1-CG 3.31Å; D440-R442 WeakPolarHBondContact OD1-CG 3.23Å; D440-R442 IonicContact OD1-CZ 2.65Å; D440-R442 PolarHBondContact OD1-N 3.41Å; D440-R442 IonicContact OD1-NE 3.46Å; D440-R442 PolarHBondContact OD1-NE 2.91Å; D440-R442 IonicContact OD1-NH2 3.86Å; D440-R442 IonicContact OD2-CZ 3.68Å; D440-R442 IonicContact OD2-NE 3.81Å; D440-R442 PolarHBondContact OD2-NE 2.88Å; D440-R442 IonicContact OD2-NH2 2.92Å; D440-R442 PolarHBondContact OD2-NH2 3.4Å; D440-T445 VanDerWaalsContact OD2-CB 3.25Å; D440-T445 WeakPolarHBondContact OD2-CB 3.47Å; D440-T445 WeakPolarHBondContact OD2-CG2 3.31Å; D440-T445 PolarHBondContact OD2-OG1 3.28Å; D440-R449 WeakPolarHBondContact O-CD 3.45Å; D440-R449 PolarHBondContact O-NE 3.13Å; D440-R449 PolarHBondContact O-NH1 3.47Å
441	H	87.6	Confident	84.5	Confident	143 Å²	143	74.7 Å²	74.7	66%	0.662	38%	0.378	S	S	*	.			trans	-116.9	8.2	178	-61.4	-64.1	0	0	0	112.7	L439	L439-H441 WeakPolarHBondContact CB-NE2 3.34Å; L439-H441 PolarHBondContact O-CD2 3.39Å
442	R	87.2	Confident	86.2	Confident	69 Å²	69	72.8 Å²	72.8	26%	0.26	37%	0.365	S	S	.	.			trans	-59.1	146.1	179	-75.2	178.8	-61.7	167.7	7.6	112.3	D440 E444 T445 R449 E508	D440-R442 WeakPolarHBondContact OD1-CB 3.29Å; D440-R442 VanDerWaalsContact OD1-CG 3.31Å; D440-R442 WeakPolarHBondContact OD1-CG 3.23Å; D440-R442 IonicContact OD1-CZ 2.65Å; D440-R442 PolarHBondContact OD1-N 3.41Å; D440-R442 IonicContact OD1-NE 3.46Å; D440-R442 PolarHBondContact OD1-NE 2.91Å; D440-R442 IonicContact OD1-NH2 3.86Å; D440-R442 IonicContact OD2-CZ 3.68Å; D440-R442 IonicContact OD2-NE 3.81Å; D440-R442 PolarHBondContact OD2-NE 2.88Å; D440-R442 IonicContact OD2-NH2 2.92Å; D440-R442 PolarHBondContact OD2-NH2 3.4Å; R442-E444 WeakPolarHBondContact CB-OE2 3.25Å; R442-T445 HydrophobicContact CB-CG2 4.22Å; R442-T445 PolarHBondContact O-OG1 3.17Å; R442-R449 PolarHBondContact O-NH2 3.31Å; R442-E508 IonicContact CZ-OE2 3.34Å; R442-E508 IonicContact NH2-OE2 2.65Å; R442-E508 PolarHBondContact NH2-OE2 3.47Å
443	N	85.4	Confident	87.7	Confident	126 Å²	126	69.1 Å²	69.1	67%	0.674	34%	0.343	S	S	*	.	S	Bend	trans	-74.9	-33.5	-179.2	-78.8	-31.1	0	0	0	111.1	T445 K446	N443-T445 PolarHBondContact O-N 2.96Å; N443-K446 WeakPolarHBondContact O-CB 3.36Å; N443-K446 PolarHBondContact O-N 3.07Å; N443-K446 VanDerWaalsContact O-N 3.14Å
444	E	85.1	Confident	88.7	Confident	131 Å²	131	69.5 Å²	69.5	61%	0.612	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-37.6	179.1	-59.4	73	-157.2	0	0	110.9	R442	R442-E444 WeakPolarHBondContact CB-OE2 3.25Å
445	T	87	Confident	89.2	Confident	6 Å²	6	64 Å²	64	4%	0.037	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-2.1	-177.1	72.3	0	0	0	0	112.9	D440 R442 N443 Q447 L448 R449 E508	D440-T445 VanDerWaalsContact OD2-CB 3.25Å; D440-T445 WeakPolarHBondContact OD2-CB 3.47Å; D440-T445 WeakPolarHBondContact OD2-CG2 3.31Å; D440-T445 PolarHBondContact OD2-OG1 3.28Å; R442-T445 HydrophobicContact CB-CG2 4.22Å; R442-T445 PolarHBondContact O-OG1 3.17Å; N443-T445 PolarHBondContact O-N 2.96Å; T445-Q447 VanDerWaalsContact C-N 3.3Å; T445-Q447 PolarHBondContact O-N 2.89Å; T445-L448 PolarHBondContact O-N 3.43Å; T445-L448 VanDerWaalsContact O-N 3.11Å; T445-R449 WeakPolarHBondContact O-CG 3.44Å; T445-R449 PolarHBondContact O-N 3.25Å; T445-R449 PolarHBondContact OG1-NE 3.08Å; T445-R449 VanDerWaalsContact OG1-NE 3.1Å; T445-E508 WeakPolarHBondContact CB-OE1 3.25Å; T445-E508 WeakPolarHBondContact CG2-OE1 3.46Å
446	K	88.2	Confident	89.4	Confident	123 Å²	123	62 Å²	62	54%	0.535	30%	0.296	S	S	.	.	H	α-helix	trans	-55.3	-44	-175	-175.8	179.5	178.7	-180	0	112.3	N443 R449 S450	N443-K446 WeakPolarHBondContact O-CB 3.36Å; N443-K446 PolarHBondContact O-N 3.07Å; N443-K446 VanDerWaalsContact O-N 3.14Å; K446-R449 PolarHBondContact O-N 3.29Å; K446-S450 WeakPolarHBondContact O-CB 3.17Å; K446-S450 PolarHBondContact O-N 2.76Å; K446-S450 PolarHBondContact O-OG 3.48Å; K446-S450 VanDerWaalsContact O-OG 3.11Å
447	Q	86.9	Confident	89.4	Confident	122 Å²	122	61.7 Å²	61.7	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-64.1	-43.2	179.7	-67.9	-174.1	-12.8	0	0	112	T445 S450 A451	T445-Q447 VanDerWaalsContact C-N 3.3Å; T445-Q447 PolarHBondContact O-N 2.89Å; Q447-S450 PolarHBondContact O-N 2.73Å; Q447-A451 WeakPolarHBondContact O-CB 2.79Å; Q447-A451 PolarHBondContact O-N 3.31Å
448	L	87.1	Confident	89.2	Confident	42 Å²	42	66.7 Å²	66.7	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-42.1	177.5	-65.4	170.3	0	0	0	111.1	T445 S450 A451 A452 L504 P514 S515	T445-L448 PolarHBondContact O-N 3.43Å; T445-L448 VanDerWaalsContact O-N 3.11Å; L448-S450 PolarHBondContact O-N 2.84Å; L448-A451 PolarHBondContact O-N 2.94Å; L448-A452 WeakPolarHBondContact O-CB 3.29Å; L448-A452 PolarHBondContact O-N 2.77Å; L448-L504 HydrophobicContact CB-CD1 4.11Å; L448-L504 HydrophobicContact CB-CD2 3.79Å; L448-L504 HydrophobicContact CD1-CD1 3.96Å; L448-L504 HydrophobicContact CG-CD1 4.5Å; L448-P514 HydrophobicContact CD1-CG 4.28Å; L448-S515 WeakPolarHBondContact CD2-OG 3.31Å
449	R	89.9	Confident	89	Confident	55 Å²	55	65.2 Å²	65.2	21%	0.208	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-41.2	175.1	-67.2	-174.6	-67.3	118	-4.9	112.1	D440 R442 T445 K446 A452 W453 L501 L504	D440-R449 WeakPolarHBondContact O-CD 3.45Å; D440-R449 PolarHBondContact O-NE 3.13Å; D440-R449 PolarHBondContact O-NH1 3.47Å; R442-R449 PolarHBondContact O-NH2 3.31Å; T445-R449 WeakPolarHBondContact O-CG 3.44Å; T445-R449 PolarHBondContact O-N 3.25Å; T445-R449 PolarHBondContact OG1-NE 3.08Å; T445-R449 VanDerWaalsContact OG1-NE 3.1Å; K446-R449 PolarHBondContact O-N 3.29Å; R449-A452 PolarHBondContact O-N 3.22Å; R449-W453 PolarHBondContact O-N 2.89Å; R449-L501 HydrophobicContact CB-CD2 4.27Å; R449-L501 HydrophobicContact CG-CD2 3.83Å; R449-L504 HydrophobicContact CG-CD2 4.21Å
450	S	89.5	Confident	88.9	Confident	60 Å²	60	62.6 Å²	62.6	42%	0.42	29%	0.294	S	S	.	.	H	α-helix	trans	-65.7	-36.6	173.8	-65	0	0	0	0	112.6	K446 Q447 L448 R454	K446-S450 WeakPolarHBondContact O-CB 3.17Å; K446-S450 PolarHBondContact O-N 2.76Å; K446-S450 PolarHBondContact O-OG 3.48Å; K446-S450 VanDerWaalsContact O-OG 3.11Å; Q447-S450 PolarHBondContact O-N 2.73Å; L448-S450 PolarHBondContact O-N 2.84Å; S450-R454 WeakPolarHBondContact O-CG 2.96Å; S450-R454 PolarHBondContact O-N 3.08Å; S450-R454 VanDerWaalsContact O-N 3.07Å
451	A	88.6	Confident	89	Confident	15 Å²	15	68 Å²	68	12%	0.124	32%	0.315	C	S	.	.	H	α-helix	trans	-66.1	-43.6	173.2	0	0	0	0	0	111.6	Q447 L448 W453 R454 L455	Q447-A451 WeakPolarHBondContact O-CB 2.79Å; Q447-A451 PolarHBondContact O-N 3.31Å; L448-A451 PolarHBondContact O-N 2.94Å; A451-W453 VanDerWaalsContact C-N 3.32Å; A451-W453 PolarHBondContact O-N 3.5Å; A451-R454 PolarHBondContact O-N 3.42Å; A451-L455 WeakPolarHBondContact O-CB 3.45Å; A451-L455 PolarHBondContact O-N 3.4Å
452	A	90.2	Very high	89.1	Confident	7 Å²	7	65.8 Å²	65.8	6%	0.058	31%	0.314	C	S	.	.	H	α-helix	trans	-59.6	-41.6	174.9	0	0	0	0	0	112.1	L448 R449 A456 L500 L501	L448-A452 WeakPolarHBondContact O-CB 3.29Å; L448-A452 PolarHBondContact O-N 2.77Å; R449-A452 PolarHBondContact O-N 3.22Å; A452-A456 WeakPolarHBondContact O-CB 3.49Å; A452-A456 PolarHBondContact O-N 2.91Å; A452-L500 HydrophobicContact CB-CB 3.86Å; A452-L500 HydrophobicContact CB-CD1 4.27Å; A452-L500 WeakPolarHBondContact O-CD1 3.35Å; A452-L501 HydrophobicContact CB-CD2 4.47Å
453	W	92.9	Very high	89	Confident	107 Å²	107	64 Å²	64	41%	0.405	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-51.4	174.8	-173.3	91.7	0	0	0	111.6	R449 A451 L455 A456 Y457 H497	R449-W453 PolarHBondContact O-N 2.89Å; A451-W453 VanDerWaalsContact C-N 3.32Å; A451-W453 PolarHBondContact O-N 3.5Å; W453-L455 VanDerWaalsContact C-N 3.31Å; W453-L455 PolarHBondContact O-N 2.86Å; W453-A456 PolarHBondContact O-N 3.06Å; W453-A456 VanDerWaalsContact O-N 3.16Å; W453-Y457 AromaticContact CD1-CD2 3.68Å; W453-Y457 AromaticContact CD1-CE2 3.44Å; W453-Y457 VanDerWaalsContact CD1-CE2 3.44Å; W453-Y457 AromaticContact CD2-CD2 3.95Å; W453-Y457 HydrophobicContact CD2-CD2 3.95Å; W453-Y457 HydrophobicContact CD2-CE2 4.44Å; W453-Y457 HydrophobicContact CD2-CG 4.38Å; W453-Y457 AromaticContact CE2-CD2 3.64Å; W453-Y457 AromaticContact CE2-CE2 3.92Å; W453-Y457 AromaticContact CE2-CG 3.85Å; W453-Y457 AromaticContact CG-CD2 3.98Å; W453-Y457 HydrophobicContact CG-CD2 3.98Å; W453-Y457 HydrophobicContact CG-CE2 4.18Å; W453-Y457 HydrophobicContact CZ2-CD1 4.21Å; W453-Y457 HydrophobicContact CZ2-CD2 4.2Å; W453-Y457 AromaticContact CZ2-CG 3.93Å; W453-Y457 HydrophobicContact CZ2-CG 3.93Å; W453-Y457 AromaticContact NE1-CD2 3.46Å; W453-Y457 AromaticContact NE1-CE2 3.25Å; W453-Y457 AromaticContact NE1-CZ 3.68Å; W453-Y457 WeakPolarHBondContact O-CD2 3.36Å; W453-Y457 PolarHBondContact O-N 3.28Å; W453-H497 AromaticContact CD1-NE2 4Å
454	R	90.7	Very high	89.3	Confident	78 Å²	78	58.6 Å²	58.6	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-41.7	179.8	-72	-176.2	-64.4	152.1	7.3	111.9	S450 A451 A456 E458 L459 D537	S450-R454 WeakPolarHBondContact O-CG 2.96Å; S450-R454 PolarHBondContact O-N 3.08Å; S450-R454 VanDerWaalsContact O-N 3.07Å; A451-R454 PolarHBondContact O-N 3.42Å; R454-A456 PolarHBondContact O-N 3.46Å; R454-E458 WeakPolarHBondContact O-CA 3.44Å; R454-E458 VanDerWaalsContact O-CB 3.26Å; R454-E458 WeakPolarHBondContact O-CB 3.42Å; R454-E458 PolarHBondContact O-N 3.28Å; R454-L459 PolarHBondContact O-N 3.18Å; R454-D537 IonicContact CZ-OD2 3.78Å; R454-D537 VanDerWaalsContact NH1-CG 3.29Å; R454-D537 IonicContact NH1-OD1 3.86Å; R454-D537 IonicContact NH1-OD2 2.7Å; R454-D537 PolarHBondContact NH1-OD2 3.04Å; R454-D537 IonicContact NH2-OD2 2.61Å; R454-D537 PolarHBondContact NH2-OD2 2.9Å
455	L	90	Very high	89.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-54.9	-54.3	174.2	-179.7	52.3	0	0	0	110.6	A451 W453 L459 L460 L500 L518 L522 A530 I534	A451-L455 WeakPolarHBondContact O-CB 3.45Å; A451-L455 PolarHBondContact O-N 3.4Å; W453-L455 VanDerWaalsContact C-N 3.31Å; W453-L455 PolarHBondContact O-N 2.86Å; L455-L459 HydrophobicContact CD1-CB 4.03Å; L455-L459 HydrophobicContact CD1-CD1 4.38Å; L455-L459 PolarHBondContact O-N 2.88Å; L455-L459 VanDerWaalsContact O-N 3.13Å; L455-L460 HydrophobicContact CD1-CD2 3.75Å; L455-L460 HydrophobicContact CD1-CG 3.98Å; L455-L460 HydrophobicContact CG-CD1 4.37Å; L455-L460 HydrophobicContact CG-CD2 4.23Å; L455-L460 HydrophobicContact CG-CG 4.09Å; L455-L460 WeakPolarHBondContact O-CG 3.34Å; L455-L460 PolarHBondContact O-N 3.35Å; L455-L500 HydrophobicContact CB-CD1 4.12Å; L455-L500 HydrophobicContact CD2-CD1 3.82Å; L455-L500 HydrophobicContact CD2-CD2 3.73Å; L455-L500 HydrophobicContact CD2-CG 4.46Å; L455-L500 HydrophobicContact CG-CD1 3.99Å; L455-L518 HydrophobicContact CD2-CD1 4.01Å; L455-L518 HydrophobicContact CD2-CD2 4.25Å; L455-L518 HydrophobicContact CD2-CG 4.49Å; L455-L522 HydrophobicContact CD1-CD1 4.3Å; L455-L522 HydrophobicContact CD1-CD2 4.04Å; L455-L522 HydrophobicContact CD2-CD1 4.16Å; L455-L522 HydrophobicContact CD2-CD2 4.21Å; L455-A530 HydrophobicContact CD1-CB 3.88Å; L455-I534 HydrophobicContact CB-CD1 4.05Å; L455-I534 HydrophobicContact CD1-CD1 3.81Å; L455-I534 HydrophobicContact CD2-CD1 3.85Å; L455-I534 HydrophobicContact CG-CD1 4.1Å
456	A	91.9	Very high	89.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.272	C	S	.	.	I	π-helix	trans	-65.5	-43.3	-175.8	0	0	0	0	0	114.2	A452 W453 R454 R493 H497 L500	A452-A456 WeakPolarHBondContact O-CB 3.49Å; A452-A456 PolarHBondContact O-N 2.91Å; W453-A456 PolarHBondContact O-N 3.06Å; W453-A456 VanDerWaalsContact O-N 3.16Å; R454-A456 PolarHBondContact O-N 3.46Å; A456-R493 WeakPolarHBondContact CB-O 3.42Å; A456-H497 HydrophobicContact CB-CB 3.7Å; A456-L500 HydrophobicContact CB-CD1 4.09Å
457	Y	92	Very high	90	Very high	47 Å²	47	56.8 Å²	56.8	18%	0.184	27%	0.273	C	S	.	.	I	π-helix	trans	-91.4	-28.7	-171.9	-75.9	-100.8	0	0	0	114.4	W453 R493 E494 H497	W453-Y457 AromaticContact CD1-CD2 3.68Å; W453-Y457 AromaticContact CD1-CE2 3.44Å; W453-Y457 VanDerWaalsContact CD1-CE2 3.44Å; W453-Y457 AromaticContact CD2-CD2 3.95Å; W453-Y457 HydrophobicContact CD2-CD2 3.95Å; W453-Y457 HydrophobicContact CD2-CE2 4.44Å; W453-Y457 HydrophobicContact CD2-CG 4.38Å; W453-Y457 AromaticContact CE2-CD2 3.64Å; W453-Y457 AromaticContact CE2-CE2 3.92Å; W453-Y457 AromaticContact CE2-CG 3.85Å; W453-Y457 AromaticContact CG-CD2 3.98Å; W453-Y457 HydrophobicContact CG-CD2 3.98Å; W453-Y457 HydrophobicContact CG-CE2 4.18Å; W453-Y457 HydrophobicContact CZ2-CD1 4.21Å; W453-Y457 HydrophobicContact CZ2-CD2 4.2Å; W453-Y457 AromaticContact CZ2-CG 3.93Å; W453-Y457 HydrophobicContact CZ2-CG 3.93Å; W453-Y457 AromaticContact NE1-CD2 3.46Å; W453-Y457 AromaticContact NE1-CE2 3.25Å; W453-Y457 AromaticContact NE1-CZ 3.68Å; W453-Y457 WeakPolarHBondContact O-CD2 3.36Å; W453-Y457 PolarHBondContact O-N 3.28Å; Y457-R493 HydrophobicContact CD1-CB 3.91Å; Y457-R493 HydrophobicContact CE1-CB 4.1Å; Y457-R493 HydrophobicContact CG-CB 4.19Å; Y457-E494 WeakPolarHBondContact CE1-OE1 3.47Å; Y457-E494 VanDerWaalsContact CZ-OE1 3.23Å; Y457-E494 PolarHBondContact OH-OE1 3.4Å; Y457-E494 PolarHBondContact OH-OE2 3.48Å; Y457-H497 HydrophobicContact CE2-CB 3.88Å
458	E	90.4	Very high	90.1	Very high	106 Å²	106	51 Å²	51	50%	0.495	25%	0.246	S	C	.	.	I	π-helix	trans	-108.4	-31.4	-174.5	-55.7	-179.5	-170.4	0	0	113.5	R454 K533	R454-E458 WeakPolarHBondContact O-CA 3.44Å; R454-E458 VanDerWaalsContact O-CB 3.26Å; R454-E458 WeakPolarHBondContact O-CB 3.42Å; R454-E458 PolarHBondContact O-N 3.28Å; E458-K533 IonicContact OE2-NZ 3.99Å
459	L	88.4	Confident	90.4	Very high	38 Å²	38	49 Å²	49	20%	0.199	24%	0.236	C	C	.	.	I	π-helix	trans	-112.2	-32.9	-165.3	-52.1	-179.9	0	0	0	114.2	R454 L455 A530 K533 I534	R454-L459 PolarHBondContact O-N 3.18Å; L455-L459 HydrophobicContact CD1-CB 4.03Å; L455-L459 HydrophobicContact CD1-CD1 4.38Å; L455-L459 PolarHBondContact O-N 2.88Å; L455-L459 VanDerWaalsContact O-N 3.13Å; L459-A530 HydrophobicContact CB-CB 3.86Å; L459-A530 HydrophobicContact CD1-CB 4.15Å; L459-K533 HydrophobicContact CD1-CB 4.37Å; L459-K533 HydrophobicContact CD1-CD 4.18Å; L459-K533 HydrophobicContact CD2-CD 3.6Å; L459-I534 HydrophobicContact CD1-CG1 4.37Å
460	L	89.6	Confident	90.4	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.037	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-76.9	143.6	177.6	-64.6	-174.4	0	0	0	112.1	L455 D464 W465 L468 Y492	L455-L460 HydrophobicContact CD1-CD2 3.75Å; L455-L460 HydrophobicContact CD1-CG 3.98Å; L455-L460 HydrophobicContact CG-CD1 4.37Å; L455-L460 HydrophobicContact CG-CD2 4.23Å; L455-L460 HydrophobicContact CG-CG 4.09Å; L455-L460 WeakPolarHBondContact O-CG 3.34Å; L455-L460 PolarHBondContact O-N 3.35Å; L460-D464 HydrophobicContact CB-CB 4.31Å; L460-D464 HydrophobicContact CD2-CB 3.91Å; L460-W465 HydrophobicContact CD1-CB 4.31Å; L460-L468 HydrophobicContact CD1-CD1 4.07Å; L460-L468 HydrophobicContact CD2-CD1 3.82Å; L460-Y492 WeakPolarHBondContact O-CE2 3.21Å
461	K	90.3	Very high	90.4	Very high	145 Å²	145	53.6 Å²	53.6	63%	0.63	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-99.3	165.1	170.5	-57.7	178.2	-178.4	176.6	0	110.9	G463 D464	K461-G463 PolarHBondContact O-N 2.83Å; K461-D464 WeakPolarHBondContact CA-OD2 3.47Å; K461-D464 WeakPolarHBondContact CB-OD2 3.24Å; K461-D464 PolarHBondContact N-OD2 3Å; K461-D464 WeakPolarHBondContact O-CB 3.28Å; K461-D464 PolarHBondContact O-N 3.32Å; K461-D464 VanDerWaalsContact O-N 3.08Å
462	P	89.3	Confident	90.5	Very high	97 Å²	97	53.6 Å²	53.6	63%	0.63	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	125.5	171.6	-25.7	34.5	0	0	0	111.4	Y492	P462-Y492 HydrophobicContact CB-CD1 4.36Å; P462-Y492 HydrophobicContact CB-CG 4.48Å; P462-Y492 HydrophobicContact CG-CD1 3.99Å; P462-Y492 HydrophobicContact CG-CE1 3.78Å; P462-Y492 HydrophobicContact CG-CG 4.44Å
463	G	86.6	Confident	90.6	Very high	31 Å²	31	56.9 Å²	56.9	32%	0.32	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-20	-179.2	0	0	0	0	0	115.5	K461 W465 K466 R467	K461-G463 PolarHBondContact O-N 2.83Å; G463-W465 VanDerWaalsContact C-N 3.29Å; G463-W465 PolarHBondContact O-N 3.47Å; G463-K466 PolarHBondContact O-N 3.41Å; G463-R467 PolarHBondContact O-N 2.99Å
464	D	90.3	Very high	90.7	Very high	14 Å²	14	52.4 Å²	52.4	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-37	-180	-68.4	-19.6	0	0	0	111.6	L460 K461 K466 R467 L468 N527	L460-D464 HydrophobicContact CB-CB 4.31Å; L460-D464 HydrophobicContact CD2-CB 3.91Å; K461-D464 WeakPolarHBondContact CA-OD2 3.47Å; K461-D464 WeakPolarHBondContact CB-OD2 3.24Å; K461-D464 PolarHBondContact N-OD2 3Å; K461-D464 WeakPolarHBondContact O-CB 3.28Å; K461-D464 PolarHBondContact O-N 3.32Å; K461-D464 VanDerWaalsContact O-N 3.08Å; D464-K466 VanDerWaalsContact C-N 3.32Å; D464-K466 PolarHBondContact O-N 3.19Å; D464-R467 PolarHBondContact O-N 3.32Å; D464-L468 WeakPolarHBondContact O-CG 3.43Å; D464-L468 PolarHBondContact O-N 3.27Å; D464-N527 PolarHBondContact OD2-OD1 3.11Å
465	W	91.9	Very high	90.9	Very high	6 Å²	6	51.7 Å²	51.7	2%	0.023	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-37.1	177.3	78	-88.3	0	0	0	112.3	L460 G463 L468 A469 V479 I482 E483 H495 M499	L460-W465 HydrophobicContact CD1-CB 4.31Å; G463-W465 VanDerWaalsContact C-N 3.29Å; G463-W465 PolarHBondContact O-N 3.47Å; W465-L468 PolarHBondContact O-N 3.01Å; W465-A469 WeakPolarHBondContact O-CB 3.41Å; W465-A469 PolarHBondContact O-N 3.05Å; W465-V479 HydrophobicContact CH2-CG1 3.67Å; W465-V479 HydrophobicContact CZ3-CG1 3.84Å; W465-I482 HydrophobicContact CZ3-CG2 4.35Å; W465-E483 HydrophobicContact CH2-CB 4.23Å; W465-E483 HydrophobicContact CZ2-CB 4.43Å; W465-H495 HydrophobicContact CD2-CB 3.84Å; W465-H495 HydrophobicContact CE3-CB 4.04Å; W465-H495 HydrophobicContact CG-CB 4.48Å; W465-H495 HydrophobicContact CH2-CB 3.93Å; W465-H495 HydrophobicContact CZ2-CB 3.72Å; W465-H495 AromaticContact CZ2-CG 3.99Å; W465-H495 AromaticContact CZ2-ND1 3.68Å; W465-H495 HydrophobicContact CZ3-CB 4.08Å; W465-M499 HydrophobicContact CB-CE 4.15Å; W465-M499 HydrophobicContact CE3-SD 3.96Å; W465-M499 WeakPolarHBondContact O-CE 3.34Å
466	K	91.8	Very high	91.1	Very high	68 Å²	68	60.8 Å²	60.8	30%	0.296	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-40.3	176.8	-68.3	-172	175.9	-174.9	0	111.6	G463 D464 L468 A469 E470 V479 E483	G463-K466 PolarHBondContact O-N 3.41Å; D464-K466 VanDerWaalsContact C-N 3.32Å; D464-K466 PolarHBondContact O-N 3.19Å; K466-L468 VanDerWaalsContact C-N 3.32Å; K466-L468 PolarHBondContact O-N 3.06Å; K466-A469 WeakPolarHBondContact O-CB 3.41Å; K466-A469 PolarHBondContact O-N 3.37Å; K466-E470 WeakPolarHBondContact O-CG 3.47Å; K466-E470 PolarHBondContact O-N 3.08Å; K466-V479 HydrophobicContact CG-CG1 4.36Å; K466-E483 VanDerWaalsContact CE-OE1 3.3Å; K466-E483 WeakPolarHBondContact CE-OE1 3.35Å; K466-E483 WeakPolarHBondContact CE-OE2 3.41Å; K466-E483 IonicContact NZ-OE1 3.78Å; K466-E483 PolarHBondContact NZ-OE1 2.94Å; K466-E483 IonicContact NZ-OE2 3.48Å; K466-E483 PolarHBondContact NZ-OE2 3.48Å
467	R	91	Very high	91.2	Very high	147 Å²	147	64.9 Å²	64.9	56%	0.555	33%	0.326	S	S	*	.	H	α-helix	trans	-62.1	-41.1	174.4	-65.1	178.7	-177.9	-178.1	0.5	111.6	G463 D464 N471	G463-R467 PolarHBondContact O-N 2.99Å; D464-R467 PolarHBondContact O-N 3.32Å; R467-N471 VanDerWaalsContact O-CB 3.29Å; R467-N471 WeakPolarHBondContact O-CB 3.22Å; R467-N471 PolarHBondContact O-N 2.9Å; R467-N471 VanDerWaalsContact O-N 3.08Å
468	L	90.9	Very high	91.4	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-42.4	173.1	-71.6	165.6	0	0	0	111.4	L460 D464 W465 K466 E470 N471 W472 M499 L522 T525	L460-L468 HydrophobicContact CD1-CD1 4.07Å; L460-L468 HydrophobicContact CD2-CD1 3.82Å; D464-L468 WeakPolarHBondContact O-CG 3.43Å; D464-L468 PolarHBondContact O-N 3.27Å; W465-L468 PolarHBondContact O-N 3.01Å; K466-L468 VanDerWaalsContact C-N 3.32Å; K466-L468 PolarHBondContact O-N 3.06Å; L468-E470 PolarHBondContact O-N 3.36Å; L468-N471 PolarHBondContact O-N 3.22Å; L468-W472 HydrophobicContact CB-CE3 4.31Å; L468-W472 HydrophobicContact CB-CH2 4.23Å; L468-W472 HydrophobicContact CB-CZ3 4.13Å; L468-W472 HydrophobicContact CD1-CH2 4.48Å; L468-W472 HydrophobicContact CD2-CH2 4.18Å; L468-W472 HydrophobicContact CD2-CZ2 3.98Å; L468-W472 WeakPolarHBondContact O-CB 3.48Å; L468-W472 PolarHBondContact O-N 2.95Å; L468-M499 HydrophobicContact CB-CE 3.66Å; L468-M499 HydrophobicContact CD1-CE 4.35Å; L468-L522 HydrophobicContact CD1-CD2 4.22Å; L468-L522 HydrophobicContact CD2-CD2 4.09Å; L468-T525 HydrophobicContact CD2-CG2 3.76Å; L468-T525 WeakPolarHBondContact CD2-OG1 3.45Å; L468-T525 HydrophobicContact CG-CG2 4.32Å
469	A	91.9	Very high	91.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.7	-48.9	177.1	0	0	0	0	0	111.8	W465 K466 N471 W472 A473 F474 V479 M499	W465-A469 WeakPolarHBondContact O-CB 3.41Å; W465-A469 PolarHBondContact O-N 3.05Å; K466-A469 WeakPolarHBondContact O-CB 3.41Å; K466-A469 PolarHBondContact O-N 3.37Å; A469-N471 VanDerWaalsContact C-N 3.34Å; A469-N471 PolarHBondContact O-N 3.48Å; A469-W472 CarbonylContact O-C 3.41Å; A469-W472 PolarHBondContact O-N 3.44Å; A469-A473 PolarHBondContact O-N 2.51Å; A469-A473 VanDerWaalsContact O-N 3.17Å; A469-F474 HydrophobicContact CB-CB 3.97Å; A469-F474 HydrophobicContact CB-CD2 4.27Å; A469-F474 HydrophobicContact CB-CG 4.2Å; A469-F474 WeakPolarHBondContact O-CB 3.36Å; A469-F474 WeakPolarHBondContact O-CD2 3.49Å; A469-F474 PolarHBondContact O-N 3.36Å; A469-V479 HydrophobicContact CB-CG2 3.74Å; A469-M499 HydrophobicContact CB-CG 4.47Å; A469-M499 HydrophobicContact CB-SD 3.42Å; A469-M499 WeakPolarHBondContact CB-SD 3.43Å
470	E	90.8	Very high	91.9	Very high	143 Å²	143	59 Å²	59	67%	0.668	31%	0.308	S	S	*	.	H	α-helix	trans	-58.9	-45.9	177.3	-73.6	171.1	-179.9	0	0	111.2	K466 L468 W472 A473	K466-E470 WeakPolarHBondContact O-CG 3.47Å; K466-E470 PolarHBondContact O-N 3.08Å; L468-E470 PolarHBondContact O-N 3.36Å; E470-W472 VanDerWaalsContact C-N 3.31Å; E470-W472 PolarHBondContact O-N 3.21Å; E470-A473 PolarHBondContact O-N 3.47Å
471	N	90	Very high	92.1	Very high	69 Å²	69	58.9 Å²	58.9	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-32	178.4	-173.8	74.1	0	0	0	112.9	R467 L468 A469 A473 E521 T525	R467-N471 VanDerWaalsContact O-CB 3.29Å; R467-N471 WeakPolarHBondContact O-CB 3.22Å; R467-N471 PolarHBondContact O-N 2.9Å; R467-N471 VanDerWaalsContact O-N 3.08Å; L468-N471 PolarHBondContact O-N 3.22Å; A469-N471 VanDerWaalsContact C-N 3.34Å; A469-N471 PolarHBondContact O-N 3.48Å; N471-A473 PolarHBondContact O-N 3.46Å; N471-E521 PolarHBondContact ND2-OE2 2.9Å; N471-T525 HydrophobicContact CB-CG2 4.03Å
472	W	90.3	Very high	92.3	Very high	15 Å²	15	52 Å²	52	6%	0.057	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	15.7	172.6	-63.9	-26.8	0	0	0	114.1	R414 L468 A469 E470 F474 M499 L500 W503 L518 E521	R414-W472 PolarHBondContact NH1-O 2.97Å; R414-W472 PolarHBondContact NH2-O 2.89Å; L468-W472 HydrophobicContact CB-CE3 4.31Å; L468-W472 HydrophobicContact CB-CH2 4.23Å; L468-W472 HydrophobicContact CB-CZ3 4.13Å; L468-W472 HydrophobicContact CD1-CH2 4.48Å; L468-W472 HydrophobicContact CD2-CH2 4.18Å; L468-W472 HydrophobicContact CD2-CZ2 3.98Å; L468-W472 WeakPolarHBondContact O-CB 3.48Å; L468-W472 PolarHBondContact O-N 2.95Å; A469-W472 CarbonylContact O-C 3.41Å; A469-W472 PolarHBondContact O-N 3.44Å; E470-W472 VanDerWaalsContact C-N 3.31Å; E470-W472 PolarHBondContact O-N 3.21Å; W472-F474 VanDerWaalsContact C-N 3.25Å; W472-F474 HydrophobicContact CB-CD2 3.89Å; W472-F474 HydrophobicContact CB-CE2 3.94Å; W472-F474 HydrophobicContact CE3-CE2 4.21Å; W472-F474 PolarHBondContact O-N 3.25Å; W472-M499 HydrophobicContact CE3-CE 4.02Å; W472-M499 HydrophobicContact CE3-CG 4.47Å; W472-M499 HydrophobicContact CE3-SD 4.41Å; W472-M499 HydrophobicContact CH2-CE 4.39Å; W472-M499 HydrophobicContact CZ3-CE 3.49Å; W472-M499 VanDerWaalsContact CZ3-CE 3.49Å; W472-M499 HydrophobicContact CZ3-SD 4.42Å; W472-L500 HydrophobicContact CH2-CD2 3.44Å; W472-L500 VanDerWaalsContact CH2-CD2 3.44Å; W472-L500 HydrophobicContact CH2-CG 4.46Å; W472-L500 HydrophobicContact CZ3-CD2 3.81Å; W472-L500 HydrophobicContact CZ3-CG 4.41Å; W472-W503 AromaticContact CD1-CD1 3.89Å; W472-W503 AromaticContact CD1-NE1 3.62Å; W472-W503 HydrophobicContact CD2-CB 4.37Å; W472-W503 AromaticContact CD2-CD1 3.37Å; W472-W503 HydrophobicContact CD2-CD2 4.23Å; W472-W503 AromaticContact CD2-CG 3.73Å; W472-W503 HydrophobicContact CD2-CG 3.73Å; W472-W503 AromaticContact CD2-NE1 3.69Å; W472-W503 AromaticContact CE2-CD1 3.8Å; W472-W503 AromaticContact CE2-CE2 3.81Å; W472-W503 AromaticContact CE2-NE1 3.63Å; W472-W503 HydrophobicContact CE3-CB 3.79Å; W472-W503 AromaticContact CE3-CD1 3.7Å; W472-W503 HydrophobicContact CE3-CD2 4.29Å; W472-W503 AromaticContact CE3-CG 3.62Å; W472-W503 HydrophobicContact CE3-CG 3.62Å; W472-W503 AromaticContact CG-CD1 3.47Å; W472-W503 VanDerWaalsContact CG-CD1 3.47Å; W472-W503 HydrophobicContact CG-CG 4.29Å; W472-W503 AromaticContact CG-NE1 3.7Å; W472-W503 HydrophobicContact CH2-CD2 4.14Å; W472-W503 HydrophobicContact CH2-CE3 4.34Å; W472-W503 HydrophobicContact CH2-CG 4.29Å; W472-W503 HydrophobicContact CZ2-CD2 4.06Å; W472-W503 HydrophobicContact CZ2-CE3 4.47Å; W472-W503 HydrophobicContact CZ2-CG 4.37Å; W472-W503 HydrophobicContact CZ2-CZ2 4.42Å; W472-W503 HydrophobicContact CZ3-CB 3.97Å; W472-W503 HydrophobicContact CZ3-CD2 4.21Å; W472-W503 AromaticContact CZ3-CG 3.9Å; W472-W503 HydrophobicContact CZ3-CG 3.9Å; W472-W503 AromaticContact NE1-CE2 3.96Å; W472-W503 AromaticContact NE1-NE1 3.55Å; W472-L518 HydrophobicContact CH2-CD1 3.92Å; W472-L518 HydrophobicContact CZ2-CD1 3.81Å; W472-E521 HydrophobicContact CZ2-CB 4.46Å
473	A	91.1	Very high	92.5	Very high	77 Å²	77	50.9 Å²	50.9	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.5	177.5	0	0	0	0	0	113.7	A469 E470 N471	A469-A473 PolarHBondContact O-N 2.51Å; A469-A473 VanDerWaalsContact O-N 3.17Å; E470-A473 PolarHBondContact O-N 3.47Å; N471-A473 PolarHBondContact O-N 3.46Å
474	F	94.9	Very high	92.6	Very high	13 Å²	13	54.8 Å²	54.8	6%	0.057	28%	0.278	C	S	.	.			trans	-67.1	136.8	164.3	-78.9	-107.6	0	0	0	109.3	I410 A469 W472 Q478 V479 I482 M499 I502 W503	I410-F474 HydrophobicContact CG2-CD1 4.26Å; I410-F474 HydrophobicContact CG2-CE1 3.93Å; A469-F474 HydrophobicContact CB-CB 3.97Å; A469-F474 HydrophobicContact CB-CD2 4.27Å; A469-F474 HydrophobicContact CB-CG 4.2Å; A469-F474 WeakPolarHBondContact O-CB 3.36Å; A469-F474 WeakPolarHBondContact O-CD2 3.49Å; A469-F474 PolarHBondContact O-N 3.36Å; W472-F474 VanDerWaalsContact C-N 3.25Å; W472-F474 HydrophobicContact CB-CD2 3.89Å; W472-F474 HydrophobicContact CB-CE2 3.94Å; W472-F474 HydrophobicContact CE3-CE2 4.21Å; W472-F474 PolarHBondContact O-N 3.25Å; F474-Q478 HydrophobicContact CD1-CB 4.16Å; F474-V479 HydrophobicContact CB-CG2 3.84Å; F474-I482 HydrophobicContact CD1-CD1 4.5Å; F474-I482 HydrophobicContact CE1-CD1 4.32Å; F474-M499 HydrophobicContact CD2-CG 4.43Å; F474-M499 HydrophobicContact CE1-CG 4.06Å; F474-M499 HydrophobicContact CE2-CG 3.9Å; F474-M499 HydrophobicContact CZ-CG 3.69Å; F474-I502 HydrophobicContact CE1-CB 4.31Å; F474-I502 HydrophobicContact CE1-CG2 3.77Å; F474-I502 HydrophobicContact CZ-CB 4.18Å; F474-I502 HydrophobicContact CZ-CG2 3.77Å; F474-W503 HydrophobicContact CE2-CB 4.4Å; F474-W503 HydrophobicContact CZ-CB 4.46Å
475	T	94.8	Very high	92.2	Very high	63 Å²	63	54.6 Å²	54.6	39%	0.387	28%	0.276	S	S	.	.			trans	-72.7	158.1	177.1	76.4	0	0	0	0	110.4	E477 Q478 V479	T475-E477 PolarHBondContact O-N 2.68Å; T475-E477 PolarHBondContact OG1-N 3.32Å; T475-Q478 PolarHBondContact O-N 3.38Å; T475-Q478 VanDerWaalsContact O-N 3.13Å; T475-Q478 VanDerWaalsContact OG1-CG 3.24Å; T475-Q478 WeakPolarHBondContact OG1-CG 3.44Å; T475-Q478 PolarHBondContact OG1-N 3.36Å; T475-Q478 VanDerWaalsContact OG1-N 3.1Å; T475-V479 WeakPolarHBondContact O-CG2 3.34Å; T475-V479 PolarHBondContact O-N 2.71Å
476	K	94.4	Very high	91.9	Very high	191 Å²	191	58.7 Å²	58.7	83%	0.83	29%	0.292	S	S	*	.	H	α-helix	trans	-57.6	-36.2	174.2	-67.5	-176.2	179.5	179.4	0	111.9	A480	K476-A480 VanDerWaalsContact O-CB 3.27Å; K476-A480 WeakPolarHBondContact O-CB 3.41Å; K476-A480 PolarHBondContact O-N 3.26Å
477	E	93.8	Very high	91.3	Very high	86 Å²	86	62 Å²	62	40%	0.402	32%	0.318	S	S	.	.	H	α-helix	trans	-66.5	-41.6	176.9	-65.3	-178.4	160	0	0	111.5	R386 T475 A480 A481	R386-E477 IonicContact CZ-OE1 2.71Å; R386-E477 IonicContact NH1-OE1 3.36Å; R386-E477 IonicContact NH2-OE1 2.94Å; R386-E477 PolarHBondContact NH2-OE1 3.44Å; R386-E477 IonicContact NH2-OE2 3.67Å; T475-E477 PolarHBondContact O-N 2.68Å; T475-E477 PolarHBondContact OG1-N 3.32Å; E477-A480 PolarHBondContact O-N 3.12Å; E477-A481 VanDerWaalsContact O-CB 3.31Å; E477-A481 WeakPolarHBondContact O-CB 3.05Å; E477-A481 PolarHBondContact O-N 3.24Å
478	Q	96.1	Very high	90.9	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.028	32%	0.318	C	S	.	.	H	α-helix	trans	-64.4	-45.4	175.5	-68.2	170.7	-12.8	0	0	112.2	L394 I410 E413 F474 T475 A481 I482	L394-Q478 HydrophobicContact CD2-CG 4.12Å; I410-Q478 HydrophobicContact CD1-CB 4.18Å; I410-Q478 HydrophobicContact CD1-CG 4.49Å; I410-Q478 HydrophobicContact CG1-CB 4.31Å; I410-Q478 HydrophobicContact CG1-CG 4.07Å; I410-Q478 HydrophobicContact CG2-CB 4.24Å; I410-Q478 HydrophobicContact CG2-CG 3.94Å; E413-Q478 WeakPolarHBondContact OE2-CG 3.23Å; E413-Q478 PolarHBondContact OE2-NE2 2.89Å; F474-Q478 HydrophobicContact CD1-CB 4.16Å; T475-Q478 PolarHBondContact O-N 3.38Å; T475-Q478 VanDerWaalsContact O-N 3.13Å; T475-Q478 VanDerWaalsContact OG1-CG 3.24Å; T475-Q478 WeakPolarHBondContact OG1-CG 3.44Å; T475-Q478 PolarHBondContact OG1-N 3.36Å; T475-Q478 VanDerWaalsContact OG1-N 3.1Å; Q478-A481 PolarHBondContact O-N 3.21Å; Q478-I482 WeakPolarHBondContact O-CG1 3.35Å; Q478-I482 PolarHBondContact O-N 3.31Å
479	V	95.5	Very high	90.2	Very high	20 Å²	20	66.6 Å²	66.6	12%	0.121	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-43.9	177.7	174.7	0	0	0	0	110.8	W465 K466 A469 F474 T475 I482 E483	W465-V479 HydrophobicContact CH2-CG1 3.67Å; W465-V479 HydrophobicContact CZ3-CG1 3.84Å; K466-V479 HydrophobicContact CG-CG1 4.36Å; A469-V479 HydrophobicContact CB-CG2 3.74Å; F474-V479 HydrophobicContact CB-CG2 3.84Å; T475-V479 WeakPolarHBondContact O-CG2 3.34Å; T475-V479 PolarHBondContact O-N 2.71Å; V479-I482 PolarHBondContact O-N 3.3Å; V479-E483 WeakPolarHBondContact O-CB 3.45Å; V479-E483 PolarHBondContact O-N 3.35Å
480	A	94.4	Very high	89.9	Confident	41 Å²	41	75.3 Å²	75.3	34%	0.339	39%	0.393	S	S	.	.	H	α-helix	trans	-63	-43.8	176.2	0	0	0	0	0	111.7	K476 E477 I482 E483 D484	K476-A480 VanDerWaalsContact O-CB 3.27Å; K476-A480 WeakPolarHBondContact O-CB 3.41Å; K476-A480 PolarHBondContact O-N 3.26Å; E477-A480 PolarHBondContact O-N 3.12Å; A480-I482 VanDerWaalsContact C-N 3.3Å; A480-I482 PolarHBondContact O-N 3.35Å; A480-E483 PolarHBondContact O-N 3.13Å; A480-E483 VanDerWaalsContact O-N 3.13Å; A480-D484 WeakPolarHBondContact O-CB 3.41Å; A480-D484 PolarHBondContact O-N 3.16Å
481	A	95.1	Very high	89.9	Confident	5 Å²	5	69.6 Å²	69.6	4%	0.041	37%	0.369	C	S	.	.	H	α-helix	trans	-61.7	-35.8	177.6	0	0	0	0	0	113	L394 A398 V406 E477 Q478 Q485	L394-A481 HydrophobicContact CD1-CB 3.79Å; L394-A481 HydrophobicContact CD2-CB 4.14Å; L394-A481 HydrophobicContact CG-CB 3.83Å; A398-A481 HydrophobicContact CB-CB 4.07Å; V406-A481 HydrophobicContact CG1-CB 4.11Å; E477-A481 VanDerWaalsContact O-CB 3.31Å; E477-A481 WeakPolarHBondContact O-CB 3.05Å; E477-A481 PolarHBondContact O-N 3.24Å; Q478-A481 PolarHBondContact O-N 3.21Å; A481-Q485 WeakPolarHBondContact O-CG 3.38Å
482	I	94.4	Very high	89.9	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-68.9	-43	173.6	-67	168.4	0	0	0	110.7	I410 W465 F474 Q478 V479 A480 H495 M499 I502	I410-I482 HydrophobicContact CD1-CD1 3.89Å; I410-I482 HydrophobicContact CD1-CG1 3.66Å; W465-I482 HydrophobicContact CZ3-CG2 4.35Å; F474-I482 HydrophobicContact CD1-CD1 4.5Å; F474-I482 HydrophobicContact CE1-CD1 4.32Å; Q478-I482 WeakPolarHBondContact O-CG1 3.35Å; Q478-I482 PolarHBondContact O-N 3.31Å; V479-I482 PolarHBondContact O-N 3.3Å; A480-I482 VanDerWaalsContact C-N 3.3Å; A480-I482 PolarHBondContact O-N 3.35Å; I482-H495 HydrophobicContact CG2-CB 3.85Å; I482-H495 PolarHBondContact O-CD2 2.63Å; I482-M499 HydrophobicContact CD1-CB 4.39Å; I482-I502 HydrophobicContact CD1-CD1 3.98Å
483	E	92.1	Very high	90	Very high	74 Å²	74	70.4 Å²	70.4	35%	0.346	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-34.5	-177.3	-174.9	164.5	-138.6	0	0	113.2	W465 K466 V479 A480 Q485	W465-E483 HydrophobicContact CH2-CB 4.23Å; W465-E483 HydrophobicContact CZ2-CB 4.43Å; K466-E483 VanDerWaalsContact CE-OE1 3.3Å; K466-E483 WeakPolarHBondContact CE-OE1 3.35Å; K466-E483 WeakPolarHBondContact CE-OE2 3.41Å; K466-E483 IonicContact NZ-OE1 3.78Å; K466-E483 PolarHBondContact NZ-OE1 2.94Å; K466-E483 IonicContact NZ-OE2 3.48Å; K466-E483 PolarHBondContact NZ-OE2 3.48Å; V479-E483 WeakPolarHBondContact O-CB 3.45Å; V479-E483 PolarHBondContact O-N 3.35Å; A480-E483 PolarHBondContact O-N 3.13Å; A480-E483 VanDerWaalsContact O-N 3.13Å; E483-Q485 PolarHBondContact O-N 2.85Å; E483-Q485 VanDerWaalsContact O-N 3.16Å
484	D	88.1	Confident	90.1	Very high	112 Å²	112	69.5 Å²	69.5	60%	0.599	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-16	-179.7	-79.3	-9.2	0	0	0	113.2	A480	A480-D484 WeakPolarHBondContact O-CB 3.41Å; A480-D484 PolarHBondContact O-N 3.16Å
485	Q	83.8	Confident	90	Very high	11 Å²	11	69 Å²	69	5%	0.051	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-28.3	-175.9	-59.2	-55.2	-90	0	0	114.4	A398 N401 V403 A481 E483	A398-Q485 VanDerWaalsContact CA-NE2 3.31Å; A398-Q485 PolarHBondContact O-NE2 3.13Å; N401-Q485 VanDerWaalsContact C-OE1 3.3Å; N401-Q485 PolarHBondContact OD1-OE1 2.95Å; V403-Q485 HydrophobicContact CG2-CB 4.11Å; V403-Q485 HydrophobicContact CG2-CG 4.14Å; A481-Q485 WeakPolarHBondContact O-CG 3.38Å; E483-Q485 PolarHBondContact O-N 2.85Å; E483-Q485 VanDerWaalsContact O-N 3.16Å
486	W	84.1	Confident	89.9	Confident	91 Å²	91	66 Å²	66	35%	0.345	33%	0.329	S	S	.	.			trans	-134.8	136.7	176.6	-70.9	-81.3	0	0	0	112.8	V403 S491 E494 H495	V403-W486 HydrophobicContact CB-CH2 4.45Å; V403-W486 HydrophobicContact CG1-CH2 3.43Å; V403-W486 VanDerWaalsContact CG1-CH2 3.43Å; V403-W486 HydrophobicContact CG1-CZ2 4.13Å; V403-W486 HydrophobicContact CG1-CZ3 4.13Å; V403-W486 HydrophobicContact CG2-CH2 4.12Å; V403-W486 HydrophobicContact CG2-CZ2 4.2Å; W486-S491 WeakPolarHBondContact O-CB 3.27Å; W486-E494 HydrophobicContact CD2-CB 4.15Å; W486-E494 HydrophobicContact CD2-CG 4.43Å; W486-E494 HydrophobicContact CE3-CB 3.89Å; W486-E494 HydrophobicContact CZ3-CB 4.1Å; W486-H495 AromaticContact CE3-CD2 3.98Å; W486-H495 PolarHBondContact O-CE1 3.36Å; W486-H495 PolarHBondContact O-NE2 2.76Å
487	T	79.7	Confident	89.9	Confident	138 Å²	138	58.5 Å²	58.5	85%	0.847	30%	0.297	S	S	*	.			trans	-110.8	155.2	176.4	61.6	0	0	0	0	111
488	G	82.4	Confident	90	Very high	53 Å²	53	54.9 Å²	54.9	55%	0.546	28%	0.28	S	S	.	.	S	Bend	trans	114.7	168.1	175.9	0	0	0	0	0	114.8	R490 S491	G488-R490 PolarHBondContact O-N 2.62Å; G488-S491 WeakPolarHBondContact O-CB 3.19Å; G488-S491 PolarHBondContact O-N 2.92Å; G488-S491 PolarHBondContact O-OG 2.97Å
489	Q	77.3	Confident	89.9	Confident	191 Å²	191	54.6 Å²	54.6	89%	0.893	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.7	-168.8	-65.5	-177.6	-4.1	0	0	114.8	Y492	Q489-Y492 WeakPolarHBondContact O-CD1 3.31Å
490	R	85.3	Confident	89.8	Confident	182 Å²	182	53.8 Å²	53.8	69%	0.687	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	1.4	178.7	-64.5	-175.1	-178.5	178.7	1.2	114	G488 Y492 R493	G488-R490 PolarHBondContact O-N 2.62Å; R490-Y492 PolarHBondContact O-N 3.1Å; R490-R493 PolarHBondContact O-N 3.09Å; R490-R493 VanDerWaalsContact O-N 3.13Å
491	S	89.6	Confident	89.8	Confident	24 Å²	24	53.6 Å²	53.6	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-56.3	-31.3	179.8	57.6	0	0	0	0	113.2	W486 G488 R493 E494 H495	W486-S491 WeakPolarHBondContact O-CB 3.27Å; G488-S491 WeakPolarHBondContact O-CB 3.19Å; G488-S491 PolarHBondContact O-N 2.92Å; G488-S491 PolarHBondContact O-OG 2.97Å; S491-R493 PolarHBondContact O-N 3.45Å; S491-E494 WeakPolarHBondContact O-CB 3.25Å; S491-E494 PolarHBondContact O-N 3.33Å; S491-H495 PolarHBondContact O-N 3.4Å
492	Y	90.4	Very high	89.8	Confident	29 Å²	29	53.4 Å²	53.4	11%	0.114	26%	0.264	C	S	.	.	H	α-helix	trans	-55.6	-24.6	177.9	80.2	-90.5	0	0	0	114	L460 P462 Q489 R490 G496	L460-Y492 WeakPolarHBondContact O-CE2 3.21Å; P462-Y492 HydrophobicContact CB-CD1 4.36Å; P462-Y492 HydrophobicContact CB-CG 4.48Å; P462-Y492 HydrophobicContact CG-CD1 3.99Å; P462-Y492 HydrophobicContact CG-CE1 3.78Å; P462-Y492 HydrophobicContact CG-CG 4.44Å; Q489-Y492 WeakPolarHBondContact O-CD1 3.31Å; R490-Y492 PolarHBondContact O-N 3.1Å; Y492-G496 PolarHBondContact O-N 3.48Å
493	R	93.2	Very high	89.7	Confident	72 Å²	72	53.8 Å²	53.8	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-44.6	175.7	-61.4	178.7	-179.5	-170.4	-6.4	111.1	A456 Y457 R490 S491 G496 H497	A456-R493 WeakPolarHBondContact CB-O 3.42Å; Y457-R493 HydrophobicContact CD1-CB 3.91Å; Y457-R493 HydrophobicContact CE1-CB 4.1Å; Y457-R493 HydrophobicContact CG-CB 4.19Å; R490-R493 PolarHBondContact O-N 3.09Å; R490-R493 VanDerWaalsContact O-N 3.13Å; S491-R493 PolarHBondContact O-N 3.45Å; R493-G496 PolarHBondContact O-N 3.16Å; R493-H497 WeakPolarHBondContact O-CB 3.33Å; R493-H497 PolarHBondContact O-N 3.13Å
494	E	92.6	Very high	89.6	Confident	58 Å²	58	50.8 Å²	50.8	27%	0.271	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-45.7	174.6	-61.6	-59.5	151.4	0	0	110.9	Y457 W486 S491 G496 H497 R498	Y457-E494 WeakPolarHBondContact CE1-OE1 3.47Å; Y457-E494 VanDerWaalsContact CZ-OE1 3.23Å; Y457-E494 PolarHBondContact OH-OE1 3.4Å; Y457-E494 PolarHBondContact OH-OE2 3.48Å; W486-E494 HydrophobicContact CD2-CB 4.15Å; W486-E494 HydrophobicContact CD2-CG 4.43Å; W486-E494 HydrophobicContact CE3-CB 3.89Å; W486-E494 HydrophobicContact CZ3-CB 4.1Å; S491-E494 WeakPolarHBondContact O-CB 3.25Å; S491-E494 PolarHBondContact O-N 3.33Å; E494-G496 VanDerWaalsContact C-N 3.35Å; E494-G496 PolarHBondContact O-N 3.04Å; E494-H497 PolarHBondContact O-N 2.91Å; E494-R498 PolarHBondContact O-N 3.43Å
495	H	93.3	Very high	89.8	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-47.2	177.2	-56.6	159.3	0	0	0	111.2	W465 I482 W486 S491 M499	W465-H495 HydrophobicContact CD2-CB 3.84Å; W465-H495 HydrophobicContact CE3-CB 4.04Å; W465-H495 HydrophobicContact CG-CB 4.48Å; W465-H495 HydrophobicContact CH2-CB 3.93Å; W465-H495 HydrophobicContact CZ2-CB 3.72Å; W465-H495 AromaticContact CZ2-CG 3.99Å; W465-H495 AromaticContact CZ2-ND1 3.68Å; W465-H495 HydrophobicContact CZ3-CB 4.08Å; I482-H495 HydrophobicContact CG2-CB 3.85Å; I482-H495 PolarHBondContact O-CD2 2.63Å; W486-H495 AromaticContact CE3-CD2 3.98Å; W486-H495 PolarHBondContact O-CE1 3.36Å; W486-H495 PolarHBondContact O-NE2 2.76Å; S491-H495 PolarHBondContact O-N 3.4Å; H495-M499 VanDerWaalsContact O-CB 3.24Å; H495-M499 WeakPolarHBondContact O-CB 3.48Å; H495-M499 PolarHBondContact O-N 3.44Å
496	G	92.9	Very high	89.9	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-42.6	176	0	0	0	0	0	112.8	Y492 R493 E494 L500	Y492-G496 PolarHBondContact O-N 3.48Å; R493-G496 PolarHBondContact O-N 3.16Å; E494-G496 VanDerWaalsContact C-N 3.35Å; E494-G496 PolarHBondContact O-N 3.04Å; G496-L500 WeakPolarHBondContact O-CB 3.33Å; G496-L500 WeakPolarHBondContact O-CD1 3.42Å; G496-L500 VanDerWaalsContact O-CG 3.22Å; G496-L500 WeakPolarHBondContact O-CG 3.2Å; G496-L500 PolarHBondContact O-N 3.1Å
497	H	94.4	Very high	90	Very high	34 Å²	34	44.9 Å²	44.9	16%	0.157	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-50	179.6	-177.4	44	0	0	0	111.9	W453 A456 Y457 R493 E494 L500 L501	W453-H497 AromaticContact CD1-NE2 4Å; A456-H497 HydrophobicContact CB-CB 3.7Å; Y457-H497 HydrophobicContact CE2-CB 3.88Å; R493-H497 WeakPolarHBondContact O-CB 3.33Å; R493-H497 PolarHBondContact O-N 3.13Å; E494-H497 PolarHBondContact O-N 2.91Å; H497-L500 WeakPolarHBondContact O-CB 3.38Å; H497-L500 PolarHBondContact O-N 3.13Å; H497-L501 WeakPolarHBondContact O-CG 3.41Å; H497-L501 PolarHBondContact O-N 2.95Å
498	R	94.3	Very high	90.1	Very high	10 Å²	10	40.3 Å²	40.3	4%	0.038	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-45.5	178.2	-75.6	171	68.8	-158.7	2.4	112.8	V403 D407 E494 L500 L501 I502	V403-R498 PolarHBondContact O-NH2 3.39Å; D407-R498 IonicContact OD1-CZ 2.94Å; D407-R498 IonicContact OD1-NE 3.46Å; D407-R498 PolarHBondContact OD1-NE 2.93Å; D407-R498 IonicContact OD1-NH2 3.47Å; D407-R498 PolarHBondContact OD1-NH2 2.87Å; D407-R498 IonicContact OD2-CZ 3.89Å; D407-R498 IonicContact OD2-NE 3.44Å; D407-R498 PolarHBondContact OD2-NE 3.41Å; D407-R498 VanDerWaalsContact OD2-NE 3.13Å; D407-R498 IonicContact OD2-NH2 2.65Å; E494-R498 PolarHBondContact O-N 3.43Å; R498-L500 VanDerWaalsContact C-N 3.25Å; R498-L500 PolarHBondContact O-N 3.24Å; R498-L501 PolarHBondContact O-N 2.93Å; R498-I502 WeakPolarHBondContact O-CG1 3.12Å; R498-I502 PolarHBondContact O-N 3.23Å
499	M	94.9	Very high	89.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.2	-42.9	176.3	178	-162.9	74.6	0	0	111.2	W465 L468 A469 W472 F474 I482 H495 I502 W503	W465-M499 HydrophobicContact CB-CE 4.15Å; W465-M499 HydrophobicContact CE3-SD 3.96Å; W465-M499 WeakPolarHBondContact O-CE 3.34Å; L468-M499 HydrophobicContact CB-CE 3.66Å; L468-M499 HydrophobicContact CD1-CE 4.35Å; A469-M499 HydrophobicContact CB-CG 4.47Å; A469-M499 HydrophobicContact CB-SD 3.42Å; A469-M499 WeakPolarHBondContact CB-SD 3.43Å; W472-M499 HydrophobicContact CE3-CE 4.02Å; W472-M499 HydrophobicContact CE3-CG 4.47Å; W472-M499 HydrophobicContact CE3-SD 4.41Å; W472-M499 HydrophobicContact CH2-CE 4.39Å; W472-M499 HydrophobicContact CZ3-CE 3.49Å; W472-M499 VanDerWaalsContact CZ3-CE 3.49Å; W472-M499 HydrophobicContact CZ3-SD 4.42Å; F474-M499 HydrophobicContact CD2-CG 4.43Å; F474-M499 HydrophobicContact CE1-CG 4.06Å; F474-M499 HydrophobicContact CE2-CG 3.9Å; F474-M499 HydrophobicContact CZ-CG 3.69Å; I482-M499 HydrophobicContact CD1-CB 4.39Å; H495-M499 VanDerWaalsContact O-CB 3.24Å; H495-M499 WeakPolarHBondContact O-CB 3.48Å; H495-M499 PolarHBondContact O-N 3.44Å; M499-I502 PolarHBondContact O-N 3.18Å; M499-W503 WeakPolarHBondContact O-CB 3.46Å; M499-W503 PolarHBondContact O-N 3.48Å
500	L	93.6	Very high	89.9	Confident	3 Å²	3	31 Å²	31	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-41.4	175.5	-77	161.6	0	0	0	112.3	A452 L455 A456 W472 G496 H497 R498 W503 L504 L518	A452-L500 HydrophobicContact CB-CB 3.86Å; A452-L500 HydrophobicContact CB-CD1 4.27Å; A452-L500 WeakPolarHBondContact O-CD1 3.35Å; L455-L500 HydrophobicContact CB-CD1 4.12Å; L455-L500 HydrophobicContact CD2-CD1 3.82Å; L455-L500 HydrophobicContact CD2-CD2 3.73Å; L455-L500 HydrophobicContact CD2-CG 4.46Å; L455-L500 HydrophobicContact CG-CD1 3.99Å; A456-L500 HydrophobicContact CB-CD1 4.09Å; W472-L500 HydrophobicContact CH2-CD2 3.44Å; W472-L500 VanDerWaalsContact CH2-CD2 3.44Å; W472-L500 HydrophobicContact CH2-CG 4.46Å; W472-L500 HydrophobicContact CZ3-CD2 3.81Å; W472-L500 HydrophobicContact CZ3-CG 4.41Å; G496-L500 WeakPolarHBondContact O-CB 3.33Å; G496-L500 WeakPolarHBondContact O-CD1 3.42Å; G496-L500 VanDerWaalsContact O-CG 3.22Å; G496-L500 WeakPolarHBondContact O-CG 3.2Å; G496-L500 PolarHBondContact O-N 3.1Å; H497-L500 WeakPolarHBondContact O-CB 3.38Å; H497-L500 PolarHBondContact O-N 3.13Å; R498-L500 VanDerWaalsContact C-N 3.25Å; R498-L500 PolarHBondContact O-N 3.24Å; L500-W503 PolarHBondContact O-N 3.26Å; L500-L504 VanDerWaalsContact O-CB 3.27Å; L500-L504 WeakPolarHBondContact O-CB 3.47Å; L500-L504 PolarHBondContact O-N 3Å; L500-L518 HydrophobicContact CD2-CD1 4.06Å
501	L	94	Very high	89.3	Confident	36 Å²	36	28.7 Å²	28.7	19%	0.188	14%	0.135	C	C	.	.	H	α-helix	trans	-66.9	-38.8	176.8	-65.7	179	0	0	0	112.4	R449 A452 H497 R498 H505	R449-L501 HydrophobicContact CB-CD2 4.27Å; R449-L501 HydrophobicContact CG-CD2 3.83Å; A452-L501 HydrophobicContact CB-CD2 4.47Å; H497-L501 WeakPolarHBondContact O-CG 3.41Å; H497-L501 PolarHBondContact O-N 2.95Å; R498-L501 PolarHBondContact O-N 2.93Å; L501-H505 PolarHBondContact O-N 3.46Å; L501-H505 VanDerWaalsContact O-N 3.13Å
502	I	94.6	Very high	88.6	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-43.3	174.1	-67.3	165.3	0	0	0	110.6	D407 I410 K411 F474 I482 R498 M499	D407-I502 HydrophobicContact CB-CD1 4.35Å; D407-I502 HydrophobicContact CB-CG1 4.32Å; I410-I502 HydrophobicContact CB-CD1 4.17Å; I410-I502 HydrophobicContact CB-CG2 4.34Å; I410-I502 HydrophobicContact CD1-CD1 4.12Å; I410-I502 HydrophobicContact CG2-CD1 4.16Å; I410-I502 HydrophobicContact CG2-CG2 3.66Å; K411-I502 HydrophobicContact CG-CB 4.37Å; K411-I502 HydrophobicContact CG-CG1 4.23Å; K411-I502 HydrophobicContact CG-CG2 4.1Å; F474-I502 HydrophobicContact CE1-CB 4.31Å; F474-I502 HydrophobicContact CE1-CG2 3.77Å; F474-I502 HydrophobicContact CZ-CB 4.18Å; F474-I502 HydrophobicContact CZ-CG2 3.77Å; I482-I502 HydrophobicContact CD1-CD1 3.98Å; R498-I502 WeakPolarHBondContact O-CG1 3.12Å; R498-I502 PolarHBondContact O-N 3.23Å; M499-I502 PolarHBondContact O-N 3.18Å
503	W	92.9	Very high	88.2	Confident	9 Å²	9	33.2 Å²	33.2	3%	0.034	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-45.9	176.7	171.8	80.5	0	0	0	111.5	W472 F474 M499 L500 H505 R506 E507 P514 Q517 L518	W472-W503 AromaticContact CD1-CD1 3.89Å; W472-W503 AromaticContact CD1-NE1 3.62Å; W472-W503 HydrophobicContact CD2-CB 4.37Å; W472-W503 AromaticContact CD2-CD1 3.37Å; W472-W503 HydrophobicContact CD2-CD2 4.23Å; W472-W503 AromaticContact CD2-CG 3.73Å; W472-W503 HydrophobicContact CD2-CG 3.73Å; W472-W503 AromaticContact CD2-NE1 3.69Å; W472-W503 AromaticContact CE2-CD1 3.8Å; W472-W503 AromaticContact CE2-CE2 3.81Å; W472-W503 AromaticContact CE2-NE1 3.63Å; W472-W503 HydrophobicContact CE3-CB 3.79Å; W472-W503 AromaticContact CE3-CD1 3.7Å; W472-W503 HydrophobicContact CE3-CD2 4.29Å; W472-W503 AromaticContact CE3-CG 3.62Å; W472-W503 HydrophobicContact CE3-CG 3.62Å; W472-W503 AromaticContact CG-CD1 3.47Å; W472-W503 VanDerWaalsContact CG-CD1 3.47Å; W472-W503 HydrophobicContact CG-CG 4.29Å; W472-W503 AromaticContact CG-NE1 3.7Å; W472-W503 HydrophobicContact CH2-CD2 4.14Å; W472-W503 HydrophobicContact CH2-CE3 4.34Å; W472-W503 HydrophobicContact CH2-CG 4.29Å; W472-W503 HydrophobicContact CZ2-CD2 4.06Å; W472-W503 HydrophobicContact CZ2-CE3 4.47Å; W472-W503 HydrophobicContact CZ2-CG 4.37Å; W472-W503 HydrophobicContact CZ2-CZ2 4.42Å; W472-W503 HydrophobicContact CZ3-CB 3.97Å; W472-W503 HydrophobicContact CZ3-CD2 4.21Å; W472-W503 AromaticContact CZ3-CG 3.9Å; W472-W503 HydrophobicContact CZ3-CG 3.9Å; W472-W503 AromaticContact NE1-CE2 3.96Å; W472-W503 AromaticContact NE1-NE1 3.55Å; F474-W503 HydrophobicContact CE2-CB 4.4Å; F474-W503 HydrophobicContact CZ-CB 4.46Å; M499-W503 WeakPolarHBondContact O-CB 3.46Å; M499-W503 PolarHBondContact O-N 3.48Å; L500-W503 PolarHBondContact O-N 3.26Å; W503-H505 VanDerWaalsContact C-N 3.31Å; W503-H505 PolarHBondContact O-N 3.18Å; W503-R506 WeakPolarHBondContact O-CB 3.33Å; W503-R506 PolarHBondContact O-N 3.35Å; W503-R506 VanDerWaalsContact O-N 3.16Å; W503-E507 HydrophobicContact CD2-CG 4.25Å; W503-E507 HydrophobicContact CH2-CG 4.14Å; W503-E507 HydrophobicContact CZ2-CG 3.61Å; W503-E507 PolarHBondContact O-N 3Å; W503-P514 HydrophobicContact CH2-CB 4.38Å; W503-P514 WeakPolarHBondContact CH2-O 3.38Å; W503-Q517 HydrophobicContact CH2-CB 4.41Å; W503-Q517 HydrophobicContact CZ2-CB 4.11Å; W503-L518 HydrophobicContact CH2-CB 3.74Å; W503-L518 HydrophobicContact CH2-CD1 4.27Å; W503-L518 HydrophobicContact CZ3-CB 4.11Å; W503-L518 HydrophobicContact CZ3-CD1 4.09Å; W503-L518 HydrophobicContact CZ3-CG 4.49Å
504	L	91	Very high	87.7	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.052	15%	0.153	C	C	.	.	H	α-helix	trans	-57.4	-43.7	178.9	-179.9	64.1	0	0	0	111.9	L448 R449 L500 R506 E507 E508 P514	L448-L504 HydrophobicContact CB-CD1 4.11Å; L448-L504 HydrophobicContact CB-CD2 3.79Å; L448-L504 HydrophobicContact CD1-CD1 3.96Å; L448-L504 HydrophobicContact CG-CD1 4.5Å; R449-L504 HydrophobicContact CG-CD2 4.21Å; L500-L504 VanDerWaalsContact O-CB 3.27Å; L500-L504 WeakPolarHBondContact O-CB 3.47Å; L500-L504 PolarHBondContact O-N 3Å; L504-R506 VanDerWaalsContact C-N 3.29Å; L504-R506 PolarHBondContact O-N 3.01Å; L504-E507 PolarHBondContact O-N 3.35Å; L504-E507 VanDerWaalsContact O-N 3.12Å; L504-E508 HydrophobicContact CD1-CG 4.3Å; L504-E508 HydrophobicContact CG-CG 4.41Å; L504-E508 WeakPolarHBondContact O-CG 3.46Å; L504-E508 PolarHBondContact O-N 3.11Å; L504-P514 HydrophobicContact CD1-CB 3.75Å; L504-P514 HydrophobicContact CD1-CG 4.11Å
505	H	90.4	Very high	87.1	Confident	17 Å²	17	30.2 Å²	30.2	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-55.4	-41.8	177.9	173.2	-94.2	0	0	0	112.9	K411 T436 F437 L501 W503 L509	K411-H505 HydrophobicContact CD-CB 4.2Å; K411-H505 HydrophobicContact CG-CB 4.18Å; T436-H505 PolarHBondContact O-NE2 2.76Å; F437-H505 AromaticContact CD1-CE1 3.79Å; L501-H505 PolarHBondContact O-N 3.46Å; L501-H505 VanDerWaalsContact O-N 3.13Å; W503-H505 VanDerWaalsContact C-N 3.31Å; W503-H505 PolarHBondContact O-N 3.18Å; H505-L509 WeakPolarHBondContact CE1-CD1 3.48Å; H505-L509 WeakPolarHBondContact O-CG 2.96Å; H505-L509 PolarHBondContact O-N 3Å
506	R	87.3	Confident	86.6	Confident	68 Å²	68	36.4 Å²	36.4	26%	0.257	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-47.2	175.6	-178.3	-153.3	-177	-90.9	1.9	111.5	W503 L504 E508 L509 A510	W503-R506 WeakPolarHBondContact O-CB 3.33Å; W503-R506 PolarHBondContact O-N 3.35Å; W503-R506 VanDerWaalsContact O-N 3.16Å; L504-R506 VanDerWaalsContact C-N 3.29Å; L504-R506 PolarHBondContact O-N 3.01Å; R506-E508 VanDerWaalsContact C-N 3.31Å; R506-E508 PolarHBondContact O-N 2.64Å; R506-L509 PolarHBondContact O-N 3.21Å; R506-A510 PolarHBondContact O-N 2.88Å
507	E	85.9	Confident	86.2	Confident	5 Å²	5	38.8 Å²	38.8	2%	0.023	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-35.4	-175.8	-68.5	-44.3	128.3	0	0	112.6	W503 L504 A510 Q511 T512 P514 Q517	W503-E507 HydrophobicContact CD2-CG 4.25Å; W503-E507 HydrophobicContact CH2-CG 4.14Å; W503-E507 HydrophobicContact CZ2-CG 3.61Å; W503-E507 PolarHBondContact O-N 3Å; L504-E507 PolarHBondContact O-N 3.35Å; L504-E507 VanDerWaalsContact O-N 3.12Å; E507-A510 PolarHBondContact O-N 3Å; E507-Q511 PolarHBondContact O-N 2.95Å; E507-T512 WeakPolarHBondContact CB-OG1 3.32Å; E507-T512 PolarHBondContact O-N 3.19Å; E507-T512 PolarHBondContact O-OG1 3.41Å; E507-T512 PolarHBondContact OE2-OG1 3.46Å; E507-P514 HydrophobicContact CB-CB 4.28Å; E507-P514 HydrophobicContact CB-CG 4.27Å; E507-Q517 VanDerWaalsContact OE2-CD 3.28Å; E507-Q517 PolarHBondContact OE2-NE2 2.9Å; E507-Q517 PolarHBondContact OE2-OE1 3.14Å
508	E	81.6	Confident	85.7	Confident	42 Å²	42	37.9 Å²	37.9	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-41.6	173.1	-70.9	177.9	164	0	0	112.2	R442 T445 L504 R506 A510 Q511	R442-E508 IonicContact CZ-OE2 3.34Å; R442-E508 IonicContact NH2-OE2 2.65Å; R442-E508 PolarHBondContact NH2-OE2 3.47Å; T445-E508 WeakPolarHBondContact CB-OE1 3.25Å; T445-E508 WeakPolarHBondContact CG2-OE1 3.46Å; L504-E508 HydrophobicContact CD1-CG 4.3Å; L504-E508 HydrophobicContact CG-CG 4.41Å; L504-E508 WeakPolarHBondContact O-CG 3.46Å; L504-E508 PolarHBondContact O-N 3.11Å; R506-E508 VanDerWaalsContact C-N 3.31Å; R506-E508 PolarHBondContact O-N 2.64Å; E508-A510 VanDerWaalsContact C-N 3.29Å; E508-A510 PolarHBondContact O-N 3.21Å; E508-Q511 PolarHBondContact O-N 3.47Å
509	L	78.6	Confident	85.2	Confident	24 Å²	24	40.5 Å²	40.5	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-69.1	-27.9	176.4	-69.7	173.2	0	0	0	112.8	Y415 L435 H505 R506 Q511	Y415-L509 HydrophobicContact CD2-CD1 3.54Å; Y415-L509 HydrophobicContact CE2-CD1 3.92Å; Y415-L509 HydrophobicContact CG-CD1 4.38Å; L435-L509 HydrophobicContact CD1-CD1 4.01Å; L435-L509 HydrophobicContact CD1-CD2 4.34Å; H505-L509 WeakPolarHBondContact CE1-CD1 3.48Å; H505-L509 WeakPolarHBondContact O-CG 2.96Å; H505-L509 PolarHBondContact O-N 3Å; R506-L509 PolarHBondContact O-N 3.21Å; L509-Q511 PolarHBondContact O-N 3.04Å
510	A	76.4	Confident	84.7	Confident	24 Å²	24	45 Å²	45	20%	0.198	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.4	174.6	0	0	0	0	0	113.4	W418 R506 E507 E508 T512	W418-A510 HydrophobicContact CZ2-CB 3.97Å; R506-A510 PolarHBondContact O-N 2.88Å; E507-A510 PolarHBondContact O-N 3Å; E508-A510 VanDerWaalsContact C-N 3.29Å; E508-A510 PolarHBondContact O-N 3.21Å; A510-T512 HydrophobicContact CB-CG2 3.85Å; A510-T512 PolarHBondContact O-N 2.86Å; A510-T512 VanDerWaalsContact O-N 3.13Å
511	Q	72.9	Confident	84.2	Confident	135 Å²	135	47 Å²	47	63%	0.631	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	30.6	-175.7	-59.7	-176.1	-2.4	0	0	113.5	E507 E508 L509	E507-Q511 PolarHBondContact O-N 2.95Å; E508-Q511 PolarHBondContact O-N 3.47Å; L509-Q511 PolarHBondContact O-N 3.04Å
512	T	75.8	Confident	83.7	Confident	48 Å²	48	45.3 Å²	45.3	29%	0.294	22%	0.223	S	C	.	.			trans	-85.4	164.9	176.7	65.3	0	0	0	0	110	E507 A510 P514 Q517	E507-T512 WeakPolarHBondContact CB-OG1 3.32Å; E507-T512 PolarHBondContact O-N 3.19Å; E507-T512 PolarHBondContact O-OG1 3.41Å; E507-T512 PolarHBondContact OE2-OG1 3.46Å; A510-T512 HydrophobicContact CB-CG2 3.85Å; A510-T512 PolarHBondContact O-N 2.86Å; A510-T512 VanDerWaalsContact O-N 3.13Å; T512-P514 WeakPolarHBondContact O-CD 3.47Å; T512-Q517 VanDerWaalsContact CB-NE2 3.31Å; T512-Q517 PolarHBondContact OG1-NE2 3.39Å
513	N	82.1	Confident	83.3	Confident	99 Å²	99	48.2 Å²	48.2	53%	0.529	24%	0.238	S	C	.	.			trans	-84	103.4	172	-176.1	-40.4	0	0	0	109.3	S515 K516 Q517	N513-S515 VanDerWaalsContact C-N 3.33Å; N513-S515 PolarHBondContact O-N 2.65Å; N513-S515 PolarHBondContact OD1-N 2.86Å; N513-K516 HydrophobicContact CB-CB 4.14Å; N513-K516 PolarHBondContact O-N 2.8Å; N513-K516 PolarHBondContact OD1-N 3.23Å; N513-K516 VanDerWaalsContact OD1-N 3.11Å; N513-Q517 PolarHBondContact O-N 3.22Å
514	P	82.8	Confident	82.9	Confident	17 Å²	17	53.8 Å²	53.8	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-34.1	-169.6	-18.5	34.8	0	0	0	111.5	L448 W503 L504 E507 T512 K516 Q517 L518	L448-P514 HydrophobicContact CD1-CG 4.28Å; W503-P514 HydrophobicContact CH2-CB 4.38Å; W503-P514 WeakPolarHBondContact CH2-O 3.38Å; L504-P514 HydrophobicContact CD1-CB 3.75Å; L504-P514 HydrophobicContact CD1-CG 4.11Å; E507-P514 HydrophobicContact CB-CB 4.28Å; E507-P514 HydrophobicContact CB-CG 4.27Å; T512-P514 WeakPolarHBondContact O-CD 3.47Å; P514-K516 PolarHBondContact O-N 3.02Å; P514-Q517 PolarHBondContact O-N 3.43Å; P514-L518 VanDerWaalsContact O-CB 3.25Å; P514-L518 WeakPolarHBondContact O-CB 3.47Å; P514-L518 PolarHBondContact O-N 3.33Å
515	S	80.4	Confident	82.5	Confident	50 Å²	50	54.3 Å²	54.3	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-42.2	178.2	-58.2	0	0	0	0	112.2	L448 N513 Y519	L448-S515 WeakPolarHBondContact CD2-OG 3.31Å; N513-S515 VanDerWaalsContact C-N 3.33Å; N513-S515 PolarHBondContact O-N 2.65Å; N513-S515 PolarHBondContact OD1-N 2.86Å; S515-Y519 PolarHBondContact O-N 3.11Å; S515-Y519 VanDerWaalsContact O-N 3.17Å
516	K	81.9	Confident	82	Confident	133 Å²	133	56.3 Å²	56.3	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-65.7	-46.2	178.3	-175.5	-177.5	178	-176.1	0	111.2	N513 P514 Y519 Q520	N513-K516 HydrophobicContact CB-CB 4.14Å; N513-K516 PolarHBondContact O-N 2.8Å; N513-K516 PolarHBondContact OD1-N 3.23Å; N513-K516 VanDerWaalsContact OD1-N 3.11Å; P514-K516 PolarHBondContact O-N 3.02Å; K516-Y519 PolarHBondContact O-N 3.25Å; K516-Q520 WeakPolarHBondContact O-CG 3.4Å; K516-Q520 PolarHBondContact O-N 2.78Å
517	Q	83.6	Confident	81.9	Confident	49 Å²	49	54 Å²	54	23%	0.229	29%	0.289	C	S	.	.	H	α-helix	trans	-65.4	-46.9	179	-71.1	-172.8	-3.1	0	0	111.3	W503 E507 T512 N513 P514 Y519 Q520 E521	W503-Q517 HydrophobicContact CH2-CB 4.41Å; W503-Q517 HydrophobicContact CZ2-CB 4.11Å; E507-Q517 VanDerWaalsContact OE2-CD 3.28Å; E507-Q517 PolarHBondContact OE2-NE2 2.9Å; E507-Q517 PolarHBondContact OE2-OE1 3.14Å; T512-Q517 VanDerWaalsContact CB-NE2 3.31Å; T512-Q517 PolarHBondContact OG1-NE2 3.39Å; N513-Q517 PolarHBondContact O-N 3.22Å; P514-Q517 PolarHBondContact O-N 3.43Å; Q517-Y519 PolarHBondContact O-N 3.5Å; Q517-Q520 PolarHBondContact O-N 3.1Å; Q517-E521 WeakPolarHBondContact O-CG 3.47Å; Q517-E521 PolarHBondContact O-N 3.22Å
518	L	84.9	Confident	81.6	Confident	15 Å²	15	62.1 Å²	62.1	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-54.5	-41.1	178.5	-175	60	0	0	0	111.7	L455 W472 L500 W503 P514 L522 I534	L455-L518 HydrophobicContact CD2-CD1 4.01Å; L455-L518 HydrophobicContact CD2-CD2 4.25Å; L455-L518 HydrophobicContact CD2-CG 4.49Å; W472-L518 HydrophobicContact CH2-CD1 3.92Å; W472-L518 HydrophobicContact CZ2-CD1 3.81Å; L500-L518 HydrophobicContact CD2-CD1 4.06Å; W503-L518 HydrophobicContact CH2-CB 3.74Å; W503-L518 HydrophobicContact CH2-CD1 4.27Å; W503-L518 HydrophobicContact CZ3-CB 4.11Å; W503-L518 HydrophobicContact CZ3-CD1 4.09Å; W503-L518 HydrophobicContact CZ3-CG 4.49Å; P514-L518 VanDerWaalsContact O-CB 3.25Å; P514-L518 WeakPolarHBondContact O-CB 3.47Å; P514-L518 PolarHBondContact O-N 3.33Å; L518-L522 HydrophobicContact CD1-CD1 4.23Å; L518-L522 HydrophobicContact CD1-CG 4.33Å; L518-L522 HydrophobicContact CG-CD1 4.02Å; L518-L522 WeakPolarHBondContact O-CB 3.5Å; L518-L522 WeakPolarHBondContact O-CD1 3.11Å; L518-L522 WeakPolarHBondContact O-CG 3.26Å; L518-L522 PolarHBondContact O-N 3.35Å; L518-I534 HydrophobicContact CD2-CD1 4.33Å
519	Y	83.8	Confident	81.5	Confident	65 Å²	65	69.2 Å²	69.2	26%	0.255	35%	0.35	S	S	.	.	H	α-helix	trans	-61.6	-48.8	175.6	179.7	-99.7	0	0	0	112.7	S515 K516 Q517 E521 L522 I523 A531 R535	S515-Y519 PolarHBondContact O-N 3.11Å; S515-Y519 VanDerWaalsContact O-N 3.17Å; K516-Y519 PolarHBondContact O-N 3.25Å; Q517-Y519 PolarHBondContact O-N 3.5Å; Y519-E521 VanDerWaalsContact C-N 3.35Å; Y519-E521 PolarHBondContact O-N 3Å; Y519-L522 PolarHBondContact O-N 3.3Å; Y519-I523 HydrophobicContact CD1-CD1 3.97Å; Y519-I523 HydrophobicContact CE1-CD1 3.36Å; Y519-I523 HydrophobicContact CE1-CG1 4.49Å; Y519-I523 HydrophobicContact CE2-CD1 4.27Å; Y519-I523 WeakPolarHBondContact O-CG1 3.48Å; Y519-I523 PolarHBondContact O-N 3.36Å; Y519-A531 HydrophobicContact CD2-CB 3.77Å; Y519-A531 WeakPolarHBondContact CD2-O 3.44Å; Y519-A531 HydrophobicContact CE2-CB 3.79Å; Y519-R535 HydrophobicContact CD2-CB 4.05Å; Y519-R535 HydrophobicContact CE2-CB 4.05Å
520	Q	83.7	Confident	81.7	Confident	95 Å²	95	68.3 Å²	68.3	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-44.4	-180	-70.8	178.1	-27.7	0	0	111.4	K516 Q517 I523 L524	K516-Q520 WeakPolarHBondContact O-CG 3.4Å; K516-Q520 PolarHBondContact O-N 2.78Å; Q517-Q520 PolarHBondContact O-N 3.1Å; Q520-I523 WeakPolarHBondContact O-CB 3.2Å; Q520-I523 PolarHBondContact O-N 3.32Å; Q520-L524 WeakPolarHBondContact O-CG 3.44Å; Q520-L524 PolarHBondContact O-N 2.91Å; Q520-L524 VanDerWaalsContact O-N 3.11Å
521	E	82.9	Confident	81.9	Confident	46 Å²	46	67.1 Å²	67.1	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-71.7	-32.1	-177.7	-58.9	-54.7	161	0	0	113	N471 W472 Q517 Y519 I523 L524 T525	N471-E521 PolarHBondContact ND2-OE2 2.9Å; W472-E521 HydrophobicContact CZ2-CB 4.46Å; Q517-E521 WeakPolarHBondContact O-CG 3.47Å; Q517-E521 PolarHBondContact O-N 3.22Å; Y519-E521 VanDerWaalsContact C-N 3.35Å; Y519-E521 PolarHBondContact O-N 3Å; E521-I523 VanDerWaalsContact C-N 3.3Å; E521-I523 PolarHBondContact O-N 3.36Å; E521-L524 PolarHBondContact O-N 3.07Å; E521-L524 WeakPolarHBondContact OE2-CD1 3.37Å; E521-T525 WeakPolarHBondContact O-CG2 3.38Å; E521-T525 PolarHBondContact O-N 3.23Å; E521-T525 PolarHBondContact O-OG1 3Å
522	L	84.9	Confident	82.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-33.5	171.9	-74.8	168.9	0	0	0	112.1	L455 L468 L518 Y519 T525 G526 N527 A531 I534	L455-L522 HydrophobicContact CD1-CD1 4.3Å; L455-L522 HydrophobicContact CD1-CD2 4.04Å; L455-L522 HydrophobicContact CD2-CD1 4.16Å; L455-L522 HydrophobicContact CD2-CD2 4.21Å; L468-L522 HydrophobicContact CD1-CD2 4.22Å; L468-L522 HydrophobicContact CD2-CD2 4.09Å; L518-L522 HydrophobicContact CD1-CD1 4.23Å; L518-L522 HydrophobicContact CD1-CG 4.33Å; L518-L522 HydrophobicContact CG-CD1 4.02Å; L518-L522 WeakPolarHBondContact O-CB 3.5Å; L518-L522 WeakPolarHBondContact O-CD1 3.11Å; L518-L522 WeakPolarHBondContact O-CG 3.26Å; L518-L522 PolarHBondContact O-N 3.35Å; Y519-L522 PolarHBondContact O-N 3.3Å; L522-T525 PolarHBondContact O-OG1 3.35Å; L522-G526 PolarHBondContact O-N 3.24Å; L522-N527 HydrophobicContact CB-CB 4.3Å; L522-N527 HydrophobicContact CD2-CB 3.81Å; L522-N527 CarbonylContact O-C 3.56Å; L522-N527 VanDerWaalsContact O-CA 3.31Å; L522-N527 WeakPolarHBondContact O-CA 3.44Å; L522-N527 WeakPolarHBondContact O-CB 3.48Å; L522-N527 PolarHBondContact O-N 3.22Å; L522-A531 HydrophobicContact CB-CB 3.73Å; L522-A531 HydrophobicContact CD1-CB 4.42Å; L522-I534 HydrophobicContact CD1-CD1 3.57Å
523	I	84.9	Confident	82.5	Confident	61 Å²	61	66.2 Å²	66.2	31%	0.313	33%	0.33	S	S	.	.	H	α-helix	trans	-67.4	-46.1	173.5	-68.2	173.7	0	0	0	110.5	Y519 Q520 E521 T525 G526 A531	Y519-I523 HydrophobicContact CD1-CD1 3.97Å; Y519-I523 HydrophobicContact CE1-CD1 3.36Å; Y519-I523 HydrophobicContact CE1-CG1 4.49Å; Y519-I523 HydrophobicContact CE2-CD1 4.27Å; Y519-I523 WeakPolarHBondContact O-CG1 3.48Å; Y519-I523 PolarHBondContact O-N 3.36Å; Q520-I523 WeakPolarHBondContact O-CB 3.2Å; Q520-I523 PolarHBondContact O-N 3.32Å; E521-I523 VanDerWaalsContact C-N 3.3Å; E521-I523 PolarHBondContact O-N 3.36Å; I523-T525 VanDerWaalsContact C-N 3.3Å; I523-T525 PolarHBondContact O-N 2.91Å; I523-G526 PolarHBondContact O-N 3.31Å; I523-G526 VanDerWaalsContact O-N 3.09Å; I523-A531 HydrophobicContact CG1-CB 4.02Å
524	L	84.1	Confident	82.2	Confident	127 Å²	127	62.3 Å²	62.3	67%	0.665	31%	0.308	S	S	*	.	H	α-helix	trans	-62.2	-37	-178.8	-71.4	171.8	0	0	0	112.3	Q520 E521 G526	Q520-L524 WeakPolarHBondContact O-CG 3.44Å; Q520-L524 PolarHBondContact O-N 2.91Å; Q520-L524 VanDerWaalsContact O-N 3.11Å; E521-L524 PolarHBondContact O-N 3.07Å; E521-L524 WeakPolarHBondContact OE2-CD1 3.37Å; L524-G526 PolarHBondContact O-N 3.11Å
525	T	83	Confident	82	Confident	20 Å²	20	66.2 Å²	66.2	12%	0.123	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	3.8	176.8	55.5	0	0	0	0	114.6	L468 N471 E521 L522 I523 N527	L468-T525 HydrophobicContact CD2-CG2 3.76Å; L468-T525 WeakPolarHBondContact CD2-OG1 3.45Å; L468-T525 HydrophobicContact CG-CG2 4.32Å; N471-T525 HydrophobicContact CB-CG2 4.03Å; E521-T525 WeakPolarHBondContact O-CG2 3.38Å; E521-T525 PolarHBondContact O-N 3.23Å; E521-T525 PolarHBondContact O-OG1 3Å; L522-T525 PolarHBondContact O-OG1 3.35Å; I523-T525 VanDerWaalsContact C-N 3.3Å; I523-T525 PolarHBondContact O-N 2.91Å; T525-N527 PolarHBondContact OG1-ND2 3.45Å; T525-N527 VanDerWaalsContact OG1-ND2 3.1Å
526	G	81.1	Confident	81.6	Confident	59 Å²	59	66.3 Å²	66.3	61%	0.608	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	8.6	177.4	0	0	0	0	0	114.9	L522 I523 L524 R528	L522-G526 PolarHBondContact O-N 3.24Å; I523-G526 PolarHBondContact O-N 3.31Å; I523-G526 VanDerWaalsContact O-N 3.09Å; L524-G526 PolarHBondContact O-N 3.11Å; G526-R528 VanDerWaalsContact C-N 3.3Å; G526-R528 PolarHBondContact O-N 3.37Å
527	N	83.9	Confident	80.9	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.102	30%	0.301	C	S	.	.			trans	-89.9	44.5	-178.3	-68.6	-59.7	0	0	0	113	D464 L522 T525 K529 A530 A531	D464-N527 PolarHBondContact OD2-OD1 3.11Å; L522-N527 HydrophobicContact CB-CB 4.3Å; L522-N527 HydrophobicContact CD2-CB 3.81Å; L522-N527 CarbonylContact O-C 3.56Å; L522-N527 VanDerWaalsContact O-CA 3.31Å; L522-N527 WeakPolarHBondContact O-CA 3.44Å; L522-N527 WeakPolarHBondContact O-CB 3.48Å; L522-N527 PolarHBondContact O-N 3.22Å; T525-N527 PolarHBondContact OG1-ND2 3.45Å; T525-N527 VanDerWaalsContact OG1-ND2 3.1Å; N527-K529 VanDerWaalsContact C-N 3.33Å; N527-K529 PolarHBondContact O-N 3.45Å; N527-A530 HydrophobicContact CB-CB 4.27Å; N527-A530 WeakPolarHBondContact O-CB 3.49Å; N527-A530 PolarHBondContact O-N 3.4Å; N527-A531 PolarHBondContact O-N 3.17Å
528	R	80.9	Confident	80	Confident	176 Å²	176	61.7 Å²	61.7	66%	0.664	31%	0.31	S	S	*	.	H	α-helix	trans	-55.1	-42.1	-174.1	-66.5	-175.1	-178.5	-178.9	-0.2	113.9	G526 A530 A531 D532	G526-R528 VanDerWaalsContact C-N 3.3Å; G526-R528 PolarHBondContact O-N 3.37Å; R528-A530 VanDerWaalsContact C-N 3.29Å; R528-A530 PolarHBondContact O-N 3.43Å; R528-A531 WeakPolarHBondContact O-CB 3.42Å; R528-A531 PolarHBondContact O-N 3.3Å; R528-D532 PolarHBondContact O-N 3.07Å
529	K	79.7	Confident	78.9	Confident	191 Å²	191	65.7 Å²	65.7	83%	0.83	33%	0.328	S	S	*	.	H	α-helix	trans	-62.4	-35.4	177.7	-68	-173.5	178.3	-174.7	0	112.7	N527 K533	N527-K529 VanDerWaalsContact C-N 3.33Å; N527-K529 PolarHBondContact O-N 3.45Å; K529-K533 WeakPolarHBondContact O-CB 3.34Å; K529-K533 PolarHBondContact O-N 3.03Å
530	A	81.4	Confident	77.6	Confident	5 Å²	5	67.3 Å²	67.3	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-74.5	-40.2	176.8	0	0	0	0	0	111	L455 L459 N527 R528 K533 I534	L455-A530 HydrophobicContact CD1-CB 3.88Å; L459-A530 HydrophobicContact CB-CB 3.86Å; L459-A530 HydrophobicContact CD1-CB 4.15Å; N527-A530 HydrophobicContact CB-CB 4.27Å; N527-A530 WeakPolarHBondContact O-CB 3.49Å; N527-A530 PolarHBondContact O-N 3.4Å; R528-A530 VanDerWaalsContact C-N 3.29Å; R528-A530 PolarHBondContact O-N 3.43Å; A530-K533 PolarHBondContact O-N 3.37Å; A530-I534 WeakPolarHBondContact O-CG1 3.14Å; A530-I534 PolarHBondContact O-N 3.12Å
531	A	81.7	Confident	76.1	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-49.3	176.1	0	0	0	0	0	111.8	Y519 L522 I523 N527 R528 K533 I534 R535	Y519-A531 HydrophobicContact CD2-CB 3.77Å; Y519-A531 WeakPolarHBondContact CD2-O 3.44Å; Y519-A531 HydrophobicContact CE2-CB 3.79Å; L522-A531 HydrophobicContact CB-CB 3.73Å; L522-A531 HydrophobicContact CD1-CB 4.42Å; I523-A531 HydrophobicContact CG1-CB 4.02Å; N527-A531 PolarHBondContact O-N 3.17Å; R528-A531 WeakPolarHBondContact O-CB 3.42Å; R528-A531 PolarHBondContact O-N 3.3Å; A531-K533 VanDerWaalsContact C-N 3.34Å; A531-K533 PolarHBondContact O-N 2.97Å; A531-I534 PolarHBondContact O-N 3.23Å; A531-R535 PolarHBondContact O-N 3.38Å
532	D	80.3	Confident	74.4	Confident	73 Å²	73	65.8 Å²	65.8	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-39.6	-179.6	-69.9	-32.5	0	0	0	112.2	R528 R535 T536	R528-D532 PolarHBondContact O-N 3.07Å; D532-R535 PolarHBondContact O-N 3.46Å; D532-T536 WeakPolarHBondContact O-CG2 3.45Å; D532-T536 PolarHBondContact O-N 3.31Å; D532-T536 PolarHBondContact O-OG1 3.15Å
533	K	79.8	Confident	72.3	Confident	91 Å²	91	73 Å²	73	40%	0.396	38%	0.382	S	S	.	.	H	α-helix	trans	-68.4	-39.5	179.6	-160.2	178.3	179.2	-167.3	0	112.4	E458 L459 K529 A530 A531 T536 D537	E458-K533 IonicContact OE2-NZ 3.99Å; L459-K533 HydrophobicContact CD1-CB 4.37Å; L459-K533 HydrophobicContact CD1-CD 4.18Å; L459-K533 HydrophobicContact CD2-CD 3.6Å; K529-K533 WeakPolarHBondContact O-CB 3.34Å; K529-K533 PolarHBondContact O-N 3.03Å; A530-K533 PolarHBondContact O-N 3.37Å; A531-K533 VanDerWaalsContact C-N 3.34Å; A531-K533 PolarHBondContact O-N 2.97Å; K533-T536 WeakPolarHBondContact CA-OG1 3.48Å; K533-T536 PolarHBondContact O-N 3.37Å; K533-T536 PolarHBondContact O-OG1 3.06Å; K533-D537 WeakPolarHBondContact O-CB 3.48Å; K533-D537 PolarHBondContact O-N 3.36Å; K533-D537 VanDerWaalsContact O-N 3.12Å
534	I	77.3	Confident	69.9	Low	16 Å²	16	74.2 Å²	74.2	8%	0.082	40%	0.396	C	S	.	.	H	α-helix	trans	-65.8	-39.9	175	-72.8	166.3	0	0	0	111.2	L455 L459 L518 L522 A530 A531 D537 A538	L455-I534 HydrophobicContact CB-CD1 4.05Å; L455-I534 HydrophobicContact CD1-CD1 3.81Å; L455-I534 HydrophobicContact CD2-CD1 3.85Å; L455-I534 HydrophobicContact CG-CD1 4.1Å; L459-I534 HydrophobicContact CD1-CG1 4.37Å; L518-I534 HydrophobicContact CD2-CD1 4.33Å; L522-I534 HydrophobicContact CD1-CD1 3.57Å; A530-I534 WeakPolarHBondContact O-CG1 3.14Å; A530-I534 PolarHBondContact O-N 3.12Å; A531-I534 PolarHBondContact O-N 3.23Å; I534-D537 PolarHBondContact O-N 2.85Å; I534-A538 PolarHBondContact O-N 3.49Å
535	R	77.2	Confident	67.5	Low	100 Å²	100	73.2 Å²	73.2	38%	0.377	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-47.1	176.7	-174	-178.6	64.7	79.1	0.5	111.7	Y519 A531 D532 D537 A538 E539	Y519-R535 HydrophobicContact CD2-CB 4.05Å; Y519-R535 HydrophobicContact CE2-CB 4.05Å; A531-R535 PolarHBondContact O-N 3.38Å; D532-R535 PolarHBondContact O-N 3.46Å; R535-D537 VanDerWaalsContact C-N 3.26Å; R535-D537 PolarHBondContact O-N 2.65Å; R535-A538 PolarHBondContact O-N 3.07Å; R535-E539 WeakPolarHBondContact CG-OE1 3.42Å; R535-E539 IonicContact CZ-OE1 3.81Å; R535-E539 VanDerWaalsContact NH1-CD 3.33Å; R535-E539 IonicContact NH1-OE1 3.24Å; R535-E539 PolarHBondContact NH1-OE1 2.7Å; R535-E539 IonicContact NH1-OE2 3.78Å; R535-E539 PolarHBondContact NH1-OE2 3.43Å; R535-E539 WeakPolarHBondContact O-CG 3.48Å; R535-E539 PolarHBondContact O-N 2.75Å; R535-E539 VanDerWaalsContact O-N 3.07Å
536	T	72.4	Confident	64.9	Low	52 Å²	52	77.6 Å²	77.6	32%	0.319	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-34.6	178.2	49.3	0	0	0	0	112.5	D532 K533 E539 N540	D532-T536 WeakPolarHBondContact O-CG2 3.45Å; D532-T536 PolarHBondContact O-N 3.31Å; D532-T536 PolarHBondContact O-OG1 3.15Å; K533-T536 WeakPolarHBondContact CA-OG1 3.48Å; K533-T536 PolarHBondContact O-N 3.37Å; K533-T536 PolarHBondContact O-OG1 3.06Å; T536-E539 PolarHBondContact O-N 3.18Å; T536-N540 WeakPolarHBondContact O-CB 3.47Å; T536-N540 VanDerWaalsContact O-CG 3.26Å; T536-N540 PolarHBondContact O-N 3.35Å; T536-N540 PolarHBondContact O-ND2 3.31Å
537	D	67.9	Low	62.6	Low	35 Å²	35	81.4 Å²	81.4	19%	0.187	43%	0.433	C	S	.	.	H	α-helix	trans	-73.6	-34.8	179.6	-67.7	-19.8	0	0	0	112.6	R454 K533 I534 R535 T541	R454-D537 IonicContact CZ-OD2 3.78Å; R454-D537 VanDerWaalsContact NH1-CG 3.29Å; R454-D537 IonicContact NH1-OD1 3.86Å; R454-D537 IonicContact NH1-OD2 2.7Å; R454-D537 PolarHBondContact NH1-OD2 3.04Å; R454-D537 IonicContact NH2-OD2 2.61Å; R454-D537 PolarHBondContact NH2-OD2 2.9Å; K533-D537 WeakPolarHBondContact O-CB 3.48Å; K533-D537 PolarHBondContact O-N 3.36Å; K533-D537 VanDerWaalsContact O-N 3.12Å; I534-D537 PolarHBondContact O-N 2.85Å; R535-D537 VanDerWaalsContact C-N 3.26Å; R535-D537 PolarHBondContact O-N 2.65Å; D537-T541 PolarHBondContact O-N 3.19Å; D537-T541 PolarHBondContact O-OG1 3.24Å
538	A	64	Low	60	Low	50 Å²	50	89.8 Å²	89.8	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-38.2	171.6	0	0	0	0	0	112	I534 R535 T541 G542	I534-A538 PolarHBondContact O-N 3.49Å; R535-A538 PolarHBondContact O-N 3.07Å; A538-T541 PolarHBondContact O-OG1 3.03Å; A538-G542 PolarHBondContact O-N 3.2Å
539	E	61.3	Low	59	Low	98 Å²	98	85.5 Å²	85.5	46%	0.458	49%	0.485	S	S	.	.	H	α-helix	trans	-70.2	-34.3	177.1	-72.6	170.9	-171	0	0	113	R535 T536	R535-E539 WeakPolarHBondContact CG-OE1 3.42Å; R535-E539 IonicContact CZ-OE1 3.81Å; R535-E539 VanDerWaalsContact NH1-CD 3.33Å; R535-E539 IonicContact NH1-OE1 3.24Å; R535-E539 PolarHBondContact NH1-OE1 2.7Å; R535-E539 IonicContact NH1-OE2 3.78Å; R535-E539 PolarHBondContact NH1-OE2 3.43Å; R535-E539 WeakPolarHBondContact O-CG 3.48Å; R535-E539 PolarHBondContact O-N 2.75Å; R535-E539 VanDerWaalsContact O-N 3.07Å; T536-E539 PolarHBondContact O-N 3.18Å
540	N	56.9	Low	57.9	Low	100 Å²	100	79.9 Å²	79.9	54%	0.535	47%	0.467	S	S	.	.	H	α-helix	trans	-77	-31.4	179.2	-74.3	-26.7	0	0	0	113.3	T536	T536-N540 WeakPolarHBondContact O-CB 3.47Å; T536-N540 VanDerWaalsContact O-CG 3.26Å; T536-N540 PolarHBondContact O-N 3.35Å; T536-N540 PolarHBondContact O-ND2 3.31Å
541	T	53.4	Low	56.6	Low	62 Å²	62	84.1 Å²	84.1	38%	0.38	49%	0.49	S	S	.	.	H	α-helix	trans	-76.1	-34.1	177.3	40.8	0	0	0	0	112.6	D537 A538 K543 S544	D537-T541 PolarHBondContact O-N 3.19Å; D537-T541 PolarHBondContact O-OG1 3.24Å; A538-T541 PolarHBondContact O-OG1 3.03Å; T541-K543 PolarHBondContact O-N 3.3Å; T541-S544 PolarHBondContact O-N 3.13Å; T541-S544 VanDerWaalsContact O-N 3.13Å
542	G	46	Very low	55.1	Low	46 Å²	46	89 Å²	89	47%	0.474	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-28.5	172	0	0	0	0	0	114	A538	A538-G542 PolarHBondContact O-N 3.2Å
543	K	40.6	Very low	53.5	Low	151 Å²	151	90 Å²	90	66%	0.657	53%	0.527	S	S	*	.	H	α-helix	trans	-77.9	-21	175.7	-70.7	177.5	-178.6	173.6	0	113.8	T541	T541-K543 PolarHBondContact O-N 3.3Å
544	S	35.8	Very low	51.8	Low	88 Å²	88	89.9 Å²	89.9	62%	0.615	54%	0.536	S	S	*	.	H	α-helix	trans	-82.7	-19.8	178.8	-174.8	0	0	0	0	113.5	T541	T541-S544 PolarHBondContact O-N 3.13Å; T541-S544 VanDerWaalsContact O-N 3.13Å
545	C	32.3	Very low	50	Low	105 Å²	105	95.2 Å²	95.2	71%	0.709	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-6.5	176.1	-83.4	0	0	0	0	114
546	C	28.7	Very low	47.9	Very low	113 Å²	113	94.8 Å²	94.8	76%	0.764	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	4.5	175.9	-65.5	0	0	0	0	113.5
547	I	34.1	Very low	45.8	Very low	138 Å²	138	98.4 Å²	98.4	71%	0.708	61%	0.605	S	S	*	*			trans	-135.7	84	175.4	-51.8	176.6	0	0	0	108.1
548	S	28.9	Very low	43.8	Very low	195 Å²	195	104.2 Å²	104.2	100%	1.364	64%	0.643	S	S	*	*			trans	-176.2	0	146	-75.2	0	0	0	0	109.4

Retrieved 548 of 548 residues in 195.6 ms (Link to these results)

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