A0A3Q0KK89_SCHMA Loading...

Nad dependent epimerase/dehydratase

AlphaFold DB , UniProt , Accession A0A3Q0KK89, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 355 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	34.6	Very low	31.7	Very low	235 Å²	235	156 Å²	156	100%	1.158	80%	0.801	S	S	*	*				0	87.3	0	-155.3	168.1	160.4	0	0	106.3	V3	M1-V3 PolarHBondContact O-N 3.31Å
2	N	29.3	Very low	31.8	Very low	170 Å²	170	152 Å²	152	91%	0.909	78%	0.776	S	S	*	*			trans	-79	114.4	-169.6	-83.7	-12.6	0	0	0	110.5
3	V	32	Very low	32.3	Very low	134 Å²	134	148 Å²	148	81%	0.812	76%	0.756	S	S	*	*			trans	-131.6	61.5	163.5	-171	0	0	0	0	107.9	M1	M1-V3 PolarHBondContact O-N 3.31Å
4	L	28.6	Very low	32.6	Very low	169 Å²	169	147.1 Å²	147.1	89%	0.885	75%	0.747	S	S	*	*			trans	-146.1	77.4	168.2	-77.8	179.5	0	0	0	109.4
5	Q	27.9	Very low	33.4	Very low	157 Å²	157	142.8 Å²	142.8	73%	0.734	73%	0.731	S	S	*	*			trans	-173.8	140.4	151.6	-109.3	174.7	-38.1	0	0	107.7
6	P	36.6	Very low	34.1	Very low	116 Å²	116	139.6 Å²	139.6	75%	0.753	72%	0.716	S	S	*	*			cis	-125.6	120.1	37.4	32.3	-13.9	0	0	0	114.5
7	L	29.5	Very low	35.1	Very low	179 Å²	179	135.1 Å²	135.1	94%	0.937	69%	0.693	S	S	*	*			trans	-92.1	29.1	156.9	-108.2	162.6	0	0	0	110.7
8	M	26.8	Very low	35.8	Very low	129 Å²	129	135.1 Å²	135.1	64%	0.635	69%	0.69	S	S	*	*			trans	-107.2	124	175.9	-72.8	-176.3	64.6	0	0	108.8
9	N	31.8	Very low	36.6	Very low	72 Å²	72	132.3 Å²	132.3	39%	0.385	68%	0.677	S	S	.	*			trans	107.7	16.5	157.1	-61.8	13	0	0	0	120.4	K11 E12 I13	N9-K11 VanDerWaalsContact C-N 3.3Å; N9-K11 PolarHBondContact O-N 3.48Å; N9-E12 HydrophobicContact CB-CB 4.31Å; N9-E12 PolarHBondContact ND2-OE2 2.78Å; N9-E12 PolarHBondContact OD1-OE2 3.03Å; N9-I13 WeakPolarHBondContact O-CD1 3.32Å; N9-I13 VanDerWaalsContact O-CG1 3.23Å; N9-I13 WeakPolarHBondContact O-CG1 3.36Å; N9-I13 PolarHBondContact O-N 3.33Å
10	E	37.1	Very low	37.4	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	66%	0.663	S	S	*	*	H	α-helix	trans	-69.2	-27.3	167.1	-81.7	-169.5	163.9	0	0	113.4
11	K	34.8	Very low	38.2	Very low	185 Å²	185	129 Å²	129	80%	0.804	66%	0.657	S	S	*	*	H	α-helix	trans	-78.1	-30.5	174.8	-83	-173	174.9	-177.5	0	114	N9 T15	N9-K11 VanDerWaalsContact C-N 3.3Å; N9-K11 PolarHBondContact O-N 3.48Å; K11-T15 PolarHBondContact O-OG1 3.16Å
12	E	32.7	Very low	39.4	Very low	108 Å²	108	121.7 Å²	121.7	51%	0.505	62%	0.623	S	S	.	*	H	α-helix	trans	-76	-35.1	178.5	-81.5	-176.8	163.3	0	0	112.2	N9 Q14 T15 D16	N9-E12 HydrophobicContact CB-CB 4.31Å; N9-E12 PolarHBondContact ND2-OE2 2.78Å; N9-E12 PolarHBondContact OD1-OE2 3.03Å; E12-Q14 PolarHBondContact O-N 2.98Å; E12-T15 PolarHBondContact O-N 3.27Å; E12-T15 PolarHBondContact O-OG1 3.11Å; E12-D16 PolarHBondContact O-N 3.36Å; E12-D16 VanDerWaalsContact O-N 3.07Å
13	I	37.8	Very low	40.8	Very low	100 Å²	100	118.6 Å²	118.6	51%	0.513	60%	0.603	S	S	.	*	H	α-helix	trans	-66.6	-37.9	-179.8	-65.5	165.6	0	0	0	111.5	N9 D17	N9-I13 WeakPolarHBondContact O-CD1 3.32Å; N9-I13 VanDerWaalsContact O-CG1 3.23Å; N9-I13 WeakPolarHBondContact O-CG1 3.36Å; N9-I13 PolarHBondContact O-N 3.33Å; I13-D17 PolarHBondContact O-N 3.43Å; I13-D17 VanDerWaalsContact O-N 3.17Å
14	Q	37.3	Very low	41.7	Very low	135 Å²	135	114.9 Å²	114.9	63%	0.631	58%	0.578	S	S	*	*	H	α-helix	trans	-67.4	-38.9	177.6	-103.5	-176.4	-27.4	0	0	112.9	E12 E18	E12-Q14 PolarHBondContact O-N 2.98Å; Q14-E18 PolarHBondContact O-N 2.83Å
15	T	44	Very low	43.2	Very low	83 Å²	83	109.5 Å²	109.5	51%	0.509	55%	0.552	S	S	.	*	H	α-helix	trans	-73.1	-33.7	179.6	44.4	0	0	0	0	112.8	K11 E12 N19	K11-T15 PolarHBondContact O-OG1 3.16Å; E12-T15 PolarHBondContact O-N 3.27Å; E12-T15 PolarHBondContact O-OG1 3.11Å; T15-N19 VanDerWaalsContact O-CB 3.24Å; T15-N19 WeakPolarHBondContact O-CB 3.4Å; T15-N19 PolarHBondContact O-N 2.91Å; T15-N19 VanDerWaalsContact O-N 3.13Å
16	D	45.2	Very low	44.8	Very low	92 Å²	92	107.1 Å²	107.1	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-73.1	-40.2	178.4	-77.9	-16.6	0	0	0	112	E12 E18 N19 I20	E12-D16 PolarHBondContact O-N 3.36Å; E12-D16 VanDerWaalsContact O-N 3.07Å; D16-E18 PolarHBondContact O-N 3.33Å; D16-N19 PolarHBondContact O-N 2.83Å; D16-I20 VanDerWaalsContact O-CB 3.31Å; D16-I20 WeakPolarHBondContact O-CB 3.4Å; D16-I20 WeakPolarHBondContact O-CD1 3.43Å; D16-I20 WeakPolarHBondContact O-CG1 3.45Å; D16-I20 PolarHBondContact O-N 3.06Å
17	D	50.8	Low	45.8	Very low	62 Å²	62	104.1 Å²	104.1	33%	0.332	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-40.1	178.1	-83.6	-20.4	0	0	0	112.1	I13 H21	I13-D17 PolarHBondContact O-N 3.43Å; I13-D17 VanDerWaalsContact O-N 3.17Å; D17-H21 VanDerWaalsContact O-CB 3.22Å; D17-H21 WeakPolarHBondContact O-CB 3.5Å; D17-H21 PolarHBondContact O-N 3.07Å
18	E	47.1	Very low	47	Very low	135 Å²	135	98.1 Å²	98.1	63%	0.631	49%	0.49	S	S	*	.	H	α-helix	trans	-69.6	-39.7	177.2	-129.2	176.3	-160.8	0	0	111.8	Q14 D16 H21 N22	Q14-E18 PolarHBondContact O-N 2.83Å; D16-E18 PolarHBondContact O-N 3.33Å; E18-H21 PolarHBondContact O-N 3.24Å; E18-N22 WeakPolarHBondContact O-CB 3.3Å; E18-N22 PolarHBondContact O-N 2.62Å; E18-N22 PolarHBondContact O-ND2 2.87Å; E18-N22 VanDerWaalsContact O-ND2 3.11Å
19	N	50.7	Low	48.5	Very low	82 Å²	82	95.5 Å²	95.5	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-68.2	-42	177.7	-166.6	5.2	0	0	0	111.6	T15 D16 N22 Q23	T15-N19 VanDerWaalsContact O-CB 3.24Å; T15-N19 WeakPolarHBondContact O-CB 3.4Å; T15-N19 PolarHBondContact O-N 2.91Å; T15-N19 VanDerWaalsContact O-N 3.13Å; D16-N19 PolarHBondContact O-N 2.83Å; N19-N22 PolarHBondContact O-N 3.34Å; N19-Q23 WeakPolarHBondContact O-CB 3.48Å; N19-Q23 VanDerWaalsContact O-CG 3.25Å; N19-Q23 WeakPolarHBondContact O-CG 3.4Å; N19-Q23 PolarHBondContact O-N 2.99Å; N19-Q23 PolarHBondContact OD1-NE2 2.89Å; N19-Q23 VanDerWaalsContact OD1-NE2 3.11Å
20	I	54.1	Low	49.6	Very low	79 Å²	79	94.1 Å²	94.1	41%	0.405	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-41.5	175.2	-68.6	166.3	0	0	0	110.7	D16 Q23 L24	D16-I20 VanDerWaalsContact O-CB 3.31Å; D16-I20 WeakPolarHBondContact O-CB 3.4Å; D16-I20 WeakPolarHBondContact O-CD1 3.43Å; D16-I20 WeakPolarHBondContact O-CG1 3.45Å; D16-I20 PolarHBondContact O-N 3.06Å; I20-Q23 PolarHBondContact O-N 2.64Å; I20-L24 HydrophobicContact CG2-CD1 4.01Å; I20-L24 WeakPolarHBondContact O-CB 3.33Å; I20-L24 WeakPolarHBondContact O-CG 3.23Å; I20-L24 PolarHBondContact O-N 2.83Å
21	H	53.9	Low	50.3	Low	116 Å²	116	89.5 Å²	89.5	54%	0.537	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-47	174.9	-173.8	73.9	0	0	0	111.7	D17 E18 Q23 L24 V25	D17-H21 VanDerWaalsContact O-CB 3.22Å; D17-H21 WeakPolarHBondContact O-CB 3.5Å; D17-H21 PolarHBondContact O-N 3.07Å; E18-H21 PolarHBondContact O-N 3.24Å; H21-Q23 PolarHBondContact O-N 2.9Å; H21-L24 PolarHBondContact O-N 2.94Å; H21-V25 WeakPolarHBondContact O-CG2 3.11Å; H21-V25 PolarHBondContact O-N 2.89Å
22	N	58.9	Low	51	Low	83 Å²	83	86.8 Å²	86.8	44%	0.444	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-38.4	177.9	-73.2	-29.9	0	0	0	112.5	E18 N19 V25 N26	E18-N22 WeakPolarHBondContact O-CB 3.3Å; E18-N22 PolarHBondContact O-N 2.62Å; E18-N22 PolarHBondContact O-ND2 2.87Å; E18-N22 VanDerWaalsContact O-ND2 3.11Å; N19-N22 PolarHBondContact O-N 3.34Å; N22-V25 PolarHBondContact O-N 3.34Å; N22-N26 VanDerWaalsContact O-CB 3.32Å; N22-N26 WeakPolarHBondContact O-CB 3.07Å; N22-N26 VanDerWaalsContact O-CG 3.23Å; N22-N26 PolarHBondContact O-N 3.34Å; N22-N26 PolarHBondContact O-ND2 3.19Å
23	Q	59.5	Low	51.9	Low	105 Å²	105	89.9 Å²	89.9	49%	0.491	46%	0.46	S	S	.	.	H	α-helix	trans	-65	-40.1	174.5	-74.6	177.9	20.7	0	0	112.1	N19 I20 H21 L27	N19-Q23 WeakPolarHBondContact O-CB 3.48Å; N19-Q23 VanDerWaalsContact O-CG 3.25Å; N19-Q23 WeakPolarHBondContact O-CG 3.4Å; N19-Q23 PolarHBondContact O-N 2.99Å; N19-Q23 PolarHBondContact OD1-NE2 2.89Å; N19-Q23 VanDerWaalsContact OD1-NE2 3.11Å; I20-Q23 PolarHBondContact O-N 2.64Å; H21-Q23 PolarHBondContact O-N 2.9Å; Q23-L27 WeakPolarHBondContact O-CB 3.15Å; Q23-L27 PolarHBondContact O-N 2.89Å
24	L	50.6	Low	52.4	Low	55 Å²	55	89.4 Å²	89.4	29%	0.288	46%	0.458	S	S	.	.	H	α-helix	trans	-65.6	-45.1	175.6	-80.3	165.3	0	0	0	112	I20 H21 L27 I28 F339	I20-L24 HydrophobicContact CG2-CD1 4.01Å; I20-L24 WeakPolarHBondContact O-CB 3.33Å; I20-L24 WeakPolarHBondContact O-CG 3.23Å; I20-L24 PolarHBondContact O-N 2.83Å; H21-L24 PolarHBondContact O-N 2.94Å; L24-L27 PolarHBondContact O-N 3.39Å; L24-I28 WeakPolarHBondContact O-CD1 3.33Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 3.04Å; L24-F339 HydrophobicContact CD2-CZ 3.91Å
25	V	60.2	Low	53	Low	56 Å²	56	91.2 Å²	91.2	34%	0.339	47%	0.467	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.9	170.9	0	0	0	0	111	H21 N22 L27 I28 N29	H21-V25 WeakPolarHBondContact O-CG2 3.11Å; H21-V25 PolarHBondContact O-N 2.89Å; N22-V25 PolarHBondContact O-N 3.34Å; V25-L27 PolarHBondContact O-N 3.3Å; V25-I28 PolarHBondContact O-N 3.35Å; V25-N29 WeakPolarHBondContact O-CB 3.23Å; V25-N29 VanDerWaalsContact O-CG 3.31Å; V25-N29 PolarHBondContact O-N 3.2Å; V25-N29 PolarHBondContact O-ND2 3.33Å
26	N	62.2	Low	53.3	Low	107 Å²	107	98.1 Å²	98.1	57%	0.572	48%	0.484	S	S	*	.	H	α-helix	trans	-64.9	-38.9	177.3	-75.5	-25	0	0	0	112.7	N22 N29 S30	N22-N26 VanDerWaalsContact O-CB 3.32Å; N22-N26 WeakPolarHBondContact O-CB 3.07Å; N22-N26 VanDerWaalsContact O-CG 3.23Å; N22-N26 PolarHBondContact O-N 3.34Å; N22-N26 PolarHBondContact O-ND2 3.19Å; N26-N29 PolarHBondContact O-N 2.71Å; N26-S30 WeakPolarHBondContact O-CB 3.29Å; N26-S30 PolarHBondContact O-N 3.46Å
27	L	58	Low	53.6	Low	53 Å²	53	98.4 Å²	98.4	28%	0.277	48%	0.478	S	S	.	.	H	α-helix	trans	-64.1	-43.3	175.9	-164.2	81.3	0	0	0	111	Q23 L24 V25 S30 M31	Q23-L27 WeakPolarHBondContact O-CB 3.15Å; Q23-L27 PolarHBondContact O-N 2.89Å; L24-L27 PolarHBondContact O-N 3.39Å; V25-L27 PolarHBondContact O-N 3.3Å; L27-S30 PolarHBondContact O-N 3.16Å; L27-S30 PolarHBondContact O-OG 3.48Å; L27-M31 HydrophobicContact CB-CE 4.49Å; L27-M31 HydrophobicContact CD2-CE 3.76Å; L27-M31 HydrophobicContact CG-CE 3.76Å; L27-M31 WeakPolarHBondContact O-CG 3.49Å; L27-M31 PolarHBondContact O-N 2.89Å
28	I	54.2	Low	53.5	Low	54 Å²	54	98.2 Å²	98.2	28%	0.277	48%	0.476	S	S	.	.	H	α-helix	trans	-63	-46	176.6	-68.5	164.2	0	0	0	111	L24 V25 S30 M31 L32 F339	L24-I28 WeakPolarHBondContact O-CD1 3.33Å; L24-I28 VanDerWaalsContact O-CG1 3.24Å; L24-I28 WeakPolarHBondContact O-CG1 3.48Å; L24-I28 PolarHBondContact O-N 3.04Å; V25-I28 PolarHBondContact O-N 3.35Å; I28-S30 VanDerWaalsContact C-N 3.3Å; I28-S30 PolarHBondContact O-N 3.45Å; I28-M31 PolarHBondContact O-N 3.44Å; I28-M31 VanDerWaalsContact O-N 3.13Å; I28-L32 HydrophobicContact CG2-CD1 3.71Å; I28-L32 HydrophobicContact CG2-CG 4.36Å; I28-L32 WeakPolarHBondContact O-CG 3.49Å; I28-L32 PolarHBondContact O-N 3.45Å; I28-F339 HydrophobicContact CD1-CE2 4.17Å
29	N	57.1	Low	53.9	Low	73 Å²	73	98.3 Å²	98.3	39%	0.39	48%	0.482	S	S	.	.	H	α-helix	trans	-60.9	-39.3	176.5	-73	-24.9	0	0	0	111.8	V25 N26 M31 L32 F33	V25-N29 WeakPolarHBondContact O-CB 3.23Å; V25-N29 VanDerWaalsContact O-CG 3.31Å; V25-N29 PolarHBondContact O-N 3.2Å; V25-N29 PolarHBondContact O-ND2 3.33Å; N26-N29 PolarHBondContact O-N 2.71Å; N29-M31 VanDerWaalsContact C-N 3.32Å; N29-M31 PolarHBondContact O-N 3.03Å; N29-L32 PolarHBondContact O-N 3.21Å; N29-F33 WeakPolarHBondContact O-CD2 3.22Å; N29-F33 PolarHBondContact O-N 2.72Å
30	S	55.3	Low	54.2	Low	43 Å²	43	103.2 Å²	103.2	30%	0.301	50%	0.499	S	S	.	.	H	α-helix	trans	-67.1	-31	176.2	76.7	0	0	0	0	113.5	N26 L27 I28	N26-S30 WeakPolarHBondContact O-CB 3.29Å; N26-S30 PolarHBondContact O-N 3.46Å; L27-S30 PolarHBondContact O-N 3.16Å; L27-S30 PolarHBondContact O-OG 3.48Å; I28-S30 VanDerWaalsContact C-N 3.3Å; I28-S30 PolarHBondContact O-N 3.45Å
31	M	51.5	Low	54.2	Low	73 Å²	73	102 Å²	102	36%	0.36	49%	0.493	S	S	.	.	H	α-helix	trans	-77.2	-34.6	176.9	-75.4	-169.1	-92.7	0	0	112.5	L27 I28 N29	L27-M31 HydrophobicContact CB-CE 4.49Å; L27-M31 HydrophobicContact CD2-CE 3.76Å; L27-M31 HydrophobicContact CG-CE 3.76Å; L27-M31 WeakPolarHBondContact O-CG 3.49Å; L27-M31 PolarHBondContact O-N 2.89Å; I28-M31 PolarHBondContact O-N 3.44Å; I28-M31 VanDerWaalsContact O-N 3.13Å; N29-M31 VanDerWaalsContact C-N 3.32Å; N29-M31 PolarHBondContact O-N 3.03Å
32	L	50.1	Low	54.1	Low	128 Å²	128	103.9 Å²	103.9	67%	0.67	50%	0.496	S	S	*	.	H	α-helix	trans	-76.5	-28.4	-177.4	-72.3	169.9	0	0	0	113.5	I28 N29	I28-L32 HydrophobicContact CG2-CD1 3.71Å; I28-L32 HydrophobicContact CG2-CG 4.36Å; I28-L32 WeakPolarHBondContact O-CG 3.49Å; I28-L32 PolarHBondContact O-N 3.45Å; N29-L32 PolarHBondContact O-N 3.21Å
33	F	51.7	Low	53.7	Low	173 Å²	173	108.5 Å²	108.5	76%	0.759	51%	0.512	S	S	*	.	S	Bend	trans	-103.6	-2.3	-168.9	-82.7	-80.7	0	0	0	116.7	N29	N29-F33 WeakPolarHBondContact O-CD2 3.22Å; N29-F33 PolarHBondContact O-N 2.72Å
34	N	48.5	Very low	53.5	Low	90 Å²	90	107.7 Å²	107.7	48%	0.481	51%	0.514	S	S	.	.			trans	-146.7	85.9	-174.2	-141.9	-25.2	0	0	0	115.4	R36 W37 L38	N34-R36 PolarHBondContact O-N 3.36Å; N34-W37 HydrophobicContact CB-CB 4.06Å; N34-W37 PolarHBondContact O-N 3.02Å; N34-L38 PolarHBondContact O-N 2.97Å
35	Q	49.7	Very low	53.8	Low	174 Å²	174	107 Å²	107	81%	0.813	51%	0.509	S	S	*	.	H	α-helix	trans	-56.3	-31.7	176.3	-85.4	-173.6	-15.7	0	0	114	W37	Q35-W37 VanDerWaalsContact C-N 3.32Å; Q35-W37 PolarHBondContact O-N 2.95Å
36	R	51.2	Low	53.5	Low	228 Å²	228	107.7 Å²	107.7	86%	0.86	51%	0.513	S	S	*	.	H	α-helix	trans	-72	-24.5	177.8	-95.9	-178.9	170.6	176.5	-2.2	113.4	N34	N34-R36 PolarHBondContact O-N 3.36Å
37	W	50.6	Low	53.2	Low	97 Å²	97	106.7 Å²	106.7	37%	0.367	51%	0.508	S	S	.	.	H	α-helix	trans	-79.6	-35.6	178.8	-172.8	79.5	0	0	0	112.2	N34 Q35 N39 K40 N41 Q45	N34-W37 HydrophobicContact CB-CB 4.06Å; N34-W37 PolarHBondContact O-N 3.02Å; Q35-W37 VanDerWaalsContact C-N 3.32Å; Q35-W37 PolarHBondContact O-N 2.95Å; W37-N39 VanDerWaalsContact C-N 3.29Å; W37-N39 PolarHBondContact O-N 3.34Å; W37-K40 PolarHBondContact O-N 3.24Å; W37-N41 PolarHBondContact NE1-ND2 2.92Å; W37-N41 VanDerWaalsContact NE1-ND2 3.17Å; W37-Q45 VanDerWaalsContact CE3-NE2 3.31Å; W37-Q45 HydrophobicContact CH2-CG 4.32Å; W37-Q45 VanDerWaalsContact CH2-NE2 3.31Å
38	L	47.7	Very low	53.4	Low	58 Å²	58	107.3 Å²	107.3	30%	0.304	51%	0.514	S	S	.	.	H	α-helix	trans	-58.3	-35.4	178.5	-80.3	160.8	0	0	0	113.5	N34	N34-L38 PolarHBondContact O-N 2.97Å
39	N	56.9	Low	53.2	Low	138 Å²	138	109 Å²	109	74%	0.738	52%	0.523	S	S	*	.	H	α-helix	trans	-76.5	-26.8	-179.4	-82.3	-14.5	0	0	0	114	W37	W37-N39 VanDerWaalsContact C-N 3.29Å; W37-N39 PolarHBondContact O-N 3.34Å
40	K	55.7	Low	52.9	Low	184 Å²	184	112.2 Å²	112.2	80%	0.8	53%	0.53	S	S	*	.	H	α-helix	trans	-88.9	-22.7	-172.3	-149	174.5	-177.3	-178.5	0	113.7	W37	W37-K40 PolarHBondContact O-N 3.24Å
41	N	54.1	Low	52.9	Low	55 Å²	55	114.5 Å²	114.5	29%	0.294	54%	0.539	S	S	.	.			trans	-122.9	20.3	-169	-72.7	-36.3	0	0	0	115.4	W37 K43 V44 Q45	W37-N41 PolarHBondContact NE1-ND2 2.92Å; W37-N41 VanDerWaalsContact NE1-ND2 3.17Å; N41-K43 VanDerWaalsContact C-N 3.28Å; N41-K43 PolarHBondContact O-N 3.27Å; N41-K43 VanDerWaalsContact O-N 3.11Å; N41-V44 PolarHBondContact O-N 3.45Å; N41-Q45 PolarHBondContact O-N 3.28Å; N41-Q45 VanDerWaalsContact O-N 3.12Å
42	R	52	Low	52.9	Low	154 Å²	154	114.3 Å²	114.3	58%	0.581	54%	0.539	S	S	*	.	H	α-helix	trans	-49.7	-40.7	-175	-132.3	-179.1	-166.6	-167.2	4.7	114.3	V46	R42-V46 VanDerWaalsContact O-CG2 3.3Å; R42-V46 WeakPolarHBondContact O-CG2 3.38Å; R42-V46 PolarHBondContact O-N 3.07Å
43	K	51.2	Low	52.8	Low	180 Å²	180	113.4 Å²	113.4	78%	0.783	53%	0.534	S	S	*	.	H	α-helix	trans	-73.2	-36.4	179	-84.2	-176.6	176.7	177.9	0	113.7	N41 N47	N41-K43 VanDerWaalsContact C-N 3.28Å; N41-K43 PolarHBondContact O-N 3.27Å; N41-K43 VanDerWaalsContact O-N 3.11Å; K43-N47 PolarHBondContact O-N 3.39Å
44	V	55.8	Low	52.6	Low	89 Å²	89	112.8 Å²	112.8	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-68.4	-43.2	179.4	178.5	0	0	0	0	109.5	N41 V46 N47 T48	N41-V44 PolarHBondContact O-N 3.45Å; V44-V46 PolarHBondContact O-N 3.42Å; V44-N47 PolarHBondContact O-N 3.25Å; V44-T48 PolarHBondContact O-N 2.85Å; V44-T48 PolarHBondContact O-OG1 3.01Å
45	Q	56.3	Low	52.4	Low	41 Å²	41	115 Å²	115	19%	0.192	54%	0.543	C	S	.	.	H	α-helix	trans	-63.3	-42.8	177.6	-69.5	179	-14.1	0	0	113.1	W37 N41 N47 T48 L49	W37-Q45 VanDerWaalsContact CE3-NE2 3.31Å; W37-Q45 HydrophobicContact CH2-CG 4.32Å; W37-Q45 VanDerWaalsContact CH2-NE2 3.31Å; N41-Q45 PolarHBondContact O-N 3.28Å; N41-Q45 VanDerWaalsContact O-N 3.12Å; Q45-N47 VanDerWaalsContact C-N 3.29Å; Q45-N47 PolarHBondContact O-N 2.9Å; Q45-T48 PolarHBondContact O-N 3.36Å; Q45-L49 WeakPolarHBondContact O-CB 3.48Å; Q45-L49 PolarHBondContact O-N 2.81Å
46	V	54.4	Low	52.3	Low	70 Å²	70	108.9 Å²	108.9	42%	0.424	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-36	177.3	171.6	0	0	0	0	111.4	R42 V44 R50	R42-V46 VanDerWaalsContact O-CG2 3.3Å; R42-V46 WeakPolarHBondContact O-CG2 3.38Å; R42-V46 PolarHBondContact O-N 3.07Å; V44-V46 PolarHBondContact O-N 3.42Å; V46-R50 VanDerWaalsContact O-CB 3.23Å; V46-R50 WeakPolarHBondContact O-CB 3.38Å; V46-R50 WeakPolarHBondContact O-CG 3.41Å; V46-R50 PolarHBondContact O-N 2.99Å
47	N	56.1	Low	52	Low	86 Å²	86	102.9 Å²	102.9	46%	0.46	51%	0.51	S	S	.	.	H	α-helix	trans	-75.4	-36.7	176.4	-78.5	-11.6	0	0	0	112.8	K43 V44 Q45 R50 N51	K43-N47 PolarHBondContact O-N 3.39Å; V44-N47 PolarHBondContact O-N 3.25Å; Q45-N47 VanDerWaalsContact C-N 3.29Å; Q45-N47 PolarHBondContact O-N 2.9Å; N47-R50 PolarHBondContact O-N 2.7Å; N47-N51 VanDerWaalsContact O-CB 3.29Å; N47-N51 WeakPolarHBondContact O-CB 3.36Å; N47-N51 PolarHBondContact O-N 2.69Å
48	T	61.1	Low	51.8	Low	66 Å²	66	102.9 Å²	102.9	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-67	-42.8	172.9	-53.3	0	0	0	0	111.1	V44 Q45 N51 L52	V44-T48 PolarHBondContact O-N 2.85Å; V44-T48 PolarHBondContact O-OG1 3.01Å; Q45-T48 PolarHBondContact O-N 3.36Å; T48-N51 PolarHBondContact O-N 2.78Å; T48-L52 HydrophobicContact CG2-CD1 4.15Å; T48-L52 WeakPolarHBondContact O-CB 3.36Å; T48-L52 WeakPolarHBondContact O-CG 3.49Å; T48-L52 PolarHBondContact O-N 3.47Å
49	L	50.5	Low	51.6	Low	88 Å²	88	106 Å²	106	46%	0.461	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-40.5	174.5	-157.3	82.9	0	0	0	111.2	Q45 L52 L53	Q45-L49 WeakPolarHBondContact O-CB 3.48Å; Q45-L49 PolarHBondContact O-N 2.81Å; L49-L52 PolarHBondContact O-N 3.39Å; L49-L53 HydrophobicContact CG-CD1 4.34Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.32Å; L49-L53 WeakPolarHBondContact O-CD1 3.48Å; L49-L53 WeakPolarHBondContact O-CG 3.46Å; L49-L53 PolarHBondContact O-N 2.9Å
50	R	50.9	Low	50.9	Low	141 Å²	141	101.9 Å²	101.9	53%	0.532	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-40.1	171.5	-95.7	-172.8	-170.7	129.2	2.3	112.9	V46 N47 L53 K54	V46-R50 VanDerWaalsContact O-CB 3.23Å; V46-R50 WeakPolarHBondContact O-CB 3.38Å; V46-R50 WeakPolarHBondContact O-CG 3.41Å; V46-R50 PolarHBondContact O-N 2.99Å; N47-R50 PolarHBondContact O-N 2.7Å; R50-L53 CarbonylContact O-C 3.53Å; R50-L53 PolarHBondContact O-N 3.18Å; R50-K54 VanDerWaalsContact O-CB 3.26Å; R50-K54 WeakPolarHBondContact O-CB 3.44Å; R50-K54 WeakPolarHBondContact O-CG 3.46Å; R50-K54 PolarHBondContact O-N 3.35Å
51	N	55.9	Low	50.4	Low	91 Å²	91	97.7 Å²	97.7	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-72.5	-35.9	179.4	-80.6	-8.5	0	0	0	111.2	N47 T48 K54 N55	N47-N51 VanDerWaalsContact O-CB 3.29Å; N47-N51 WeakPolarHBondContact O-CB 3.36Å; N47-N51 PolarHBondContact O-N 2.69Å; T48-N51 PolarHBondContact O-N 2.78Å; N51-K54 PolarHBondContact O-N 3.44Å; N51-N55 VanDerWaalsContact O-CB 3.22Å; N51-N55 WeakPolarHBondContact O-CB 3.39Å; N51-N55 VanDerWaalsContact O-CG 3.28Å; N51-N55 PolarHBondContact O-N 3Å
52	L	50.6	Low	49.9	Very low	69 Å²	69	99.7 Å²	99.7	36%	0.361	50%	0.499	S	S	.	.	H	α-helix	trans	-61.9	-45.2	168.2	-76.9	161.9	0	0	0	110.8	T48 L49 K54 C56	T48-L52 HydrophobicContact CG2-CD1 4.15Å; T48-L52 WeakPolarHBondContact O-CB 3.36Å; T48-L52 WeakPolarHBondContact O-CG 3.49Å; T48-L52 PolarHBondContact O-N 3.47Å; L49-L52 PolarHBondContact O-N 3.39Å; L52-K54 PolarHBondContact O-N 3.39Å; L52-C56 WeakPolarHBondContact O-CB 3.18Å; L52-C56 PolarHBondContact O-N 3.39Å; L52-C56 PolarHBondContact O-SG 3.13Å
53	L	47.7	Very low	49.4	Very low	109 Å²	109	96.7 Å²	96.7	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-69.3	-26.4	175.8	-72.6	166.3	0	0	0	114	L49 R50 C56	L49-L53 HydrophobicContact CG-CD1 4.34Å; L49-L53 VanDerWaalsContact O-CB 3.29Å; L49-L53 WeakPolarHBondContact O-CB 3.32Å; L49-L53 WeakPolarHBondContact O-CD1 3.48Å; L49-L53 WeakPolarHBondContact O-CG 3.46Å; L49-L53 PolarHBondContact O-N 2.9Å; R50-L53 CarbonylContact O-C 3.53Å; R50-L53 PolarHBondContact O-N 3.18Å; L53-C56 WeakPolarHBondContact O-CB 3.43Å
54	K	47.4	Very low	49.1	Very low	161 Å²	161	96.1 Å²	96.1	70%	0.7	49%	0.488	S	S	*	.	H	α-helix	trans	-82.2	-37.9	174.6	-84	-177.3	172.6	-173.8	0	112.5	R50 N51 L52 C56	R50-K54 VanDerWaalsContact O-CB 3.26Å; R50-K54 WeakPolarHBondContact O-CB 3.44Å; R50-K54 WeakPolarHBondContact O-CG 3.46Å; R50-K54 PolarHBondContact O-N 3.35Å; N51-K54 PolarHBondContact O-N 3.44Å; L52-K54 PolarHBondContact O-N 3.39Å; K54-C56 PolarHBondContact O-N 2.71Å
55	N	45.7	Very low	48.8	Very low	136 Å²	136	94 Å²	94	73%	0.727	47%	0.473	S	S	*	.	H	α-helix	trans	-74.9	-11.3	173.4	-71.7	-9	0	0	0	111.9	N51 C57	N51-N55 VanDerWaalsContact O-CB 3.22Å; N51-N55 WeakPolarHBondContact O-CB 3.39Å; N51-N55 VanDerWaalsContact O-CG 3.28Å; N51-N55 PolarHBondContact O-N 3Å; N55-C57 PolarHBondContact O-N 2.89Å
56	C	46.4	Very low	48.3	Very low	46 Å²	46	95.1 Å²	95.1	31%	0.311	48%	0.48	S	S	.	.			trans	-66.3	83.4	162.8	-82.9	0	0	0	0	111.1	L52 L53 K54 Y58	L52-C56 WeakPolarHBondContact O-CB 3.18Å; L52-C56 PolarHBondContact O-N 3.39Å; L52-C56 PolarHBondContact O-SG 3.13Å; L53-C56 WeakPolarHBondContact O-CB 3.43Å; K54-C56 PolarHBondContact O-N 2.71Å; C56-Y58 HydrophobicContact CB-CD2 3.81Å; C56-Y58 HydrophobicContact CB-CG 4.37Å; C56-Y58 PolarHBondContact O-N 3.26Å; C56-Y58 VanDerWaalsContact SG-CD2 3.51Å
57	C	44.2	Very low	48.1	Very low	101 Å²	101	96.2 Å²	96.2	68%	0.682	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-4.3	150.4	-87.7	0	0	0	0	113.9	N55 I59 S60 M61	N55-C57 PolarHBondContact O-N 2.89Å; C57-I59 PolarHBondContact O-N 3.49Å; C57-S60 PolarHBondContact O-N 3.11Å; C57-M61 PolarHBondContact O-N 2.89Å
58	Y	46.8	Very low	47.9	Very low	98 Å²	98	94.9 Å²	94.9	38%	0.384	48%	0.478	S	S	.	.	H	α-helix	trans	-60.2	-25.6	175.6	-75.3	-89.1	0	0	0	115.8	C56 M61 F62 F336	C56-Y58 HydrophobicContact CB-CD2 3.81Å; C56-Y58 HydrophobicContact CB-CG 4.37Å; C56-Y58 PolarHBondContact O-N 3.26Å; C56-Y58 VanDerWaalsContact SG-CD2 3.51Å; Y58-M61 HydrophobicContact CD1-CE 4.37Å; Y58-M61 HydrophobicContact CE1-CE 4.15Å; Y58-M61 CarbonylContact O-C 3.53Å; Y58-M61 PolarHBondContact O-N 3.36Å; Y58-F62 WeakPolarHBondContact O-CA 3.44Å; Y58-F62 WeakPolarHBondContact O-CB 3.45Å; Y58-F62 PolarHBondContact O-N 3.02Å; Y58-F336 HydrophobicContact CD1-CE2 4.3Å
59	I	43	Very low	47.2	Very low	124 Å²	124	95.9 Å²	95.9	64%	0.636	48%	0.48	S	S	*	.	H	α-helix	trans	-72.1	-38.9	175.2	-62.5	176.2	0	0	0	110.6	C57 M61 F62 N63	C57-I59 PolarHBondContact O-N 3.49Å; I59-M61 VanDerWaalsContact C-N 3.34Å; I59-F62 PolarHBondContact O-N 3.3Å; I59-N63 PolarHBondContact O-N 3.35Å
60	S	43.1	Very low	47.3	Very low	51 Å²	51	95.9 Å²	95.9	36%	0.357	48%	0.479	S	S	.	.	H	α-helix	trans	-68.3	-36.3	171.7	125.4	0	0	0	0	111.2	C57 R64	C57-S60 PolarHBondContact O-N 3.11Å; S60-R64 WeakPolarHBondContact O-CB 3.31Å; S60-R64 WeakPolarHBondContact O-CG 3.39Å; S60-R64 PolarHBondContact O-N 3.17Å; S60-R64 PolarHBondContact OG-NE 2.91Å; S60-R64 PolarHBondContact OG-NH2 2.92Å
61	M	45.6	Very low	47.1	Very low	96 Å²	96	94.4 Å²	94.4	47%	0.473	48%	0.478	S	S	.	.	H	α-helix	trans	-67.7	-40.6	174.3	-118.3	176.8	80	0	0	111.6	C57 Y58 I59 R64 L65	C57-M61 PolarHBondContact O-N 2.89Å; Y58-M61 HydrophobicContact CD1-CE 4.37Å; Y58-M61 HydrophobicContact CE1-CE 4.15Å; Y58-M61 CarbonylContact O-C 3.53Å; Y58-M61 PolarHBondContact O-N 3.36Å; I59-M61 VanDerWaalsContact C-N 3.34Å; M61-R64 CarbonylContact O-C 3.27Å; M61-R64 PolarHBondContact O-N 3.28Å; M61-L65 WeakPolarHBondContact O-CA 3.36Å; M61-L65 WeakPolarHBondContact O-CB 3.49Å; M61-L65 PolarHBondContact O-N 2.78Å
62	F	42.4	Very low	46.8	Very low	96 Å²	96	98.4 Å²	98.4	42%	0.421	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-44.8	177.3	-176.3	-101.3	0	0	0	111.1	Y58 I59 L65 L66	Y58-F62 WeakPolarHBondContact O-CA 3.44Å; Y58-F62 WeakPolarHBondContact O-CB 3.45Å; Y58-F62 PolarHBondContact O-N 3.02Å; I59-F62 PolarHBondContact O-N 3.3Å; F62-L65 PolarHBondContact O-N 2.91Å; F62-L66 HydrophobicContact CD1-CD1 3.65Å; F62-L66 HydrophobicContact CD2-CD1 3.88Å; F62-L66 HydrophobicContact CE1-CD1 3.29Å; F62-L66 HydrophobicContact CE2-CD1 3.53Å; F62-L66 HydrophobicContact CG-CD1 3.94Å; F62-L66 HydrophobicContact CZ-CD1 3.22Å; F62-L66 WeakPolarHBondContact O-CB 3.45Å; F62-L66 PolarHBondContact O-N 3.37Å
63	N	41.7	Very low	46.6	Very low	91 Å²	91	98.6 Å²	98.6	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-43.6	173.8	-75.4	-17.9	0	0	0	111.7	I59 L65 L67	I59-N63 PolarHBondContact O-N 3.35Å; N63-L65 PolarHBondContact O-N 2.88Å; N63-L67 WeakPolarHBondContact O-CB 3.45Å; N63-L67 WeakPolarHBondContact O-CD1 3.17Å; N63-L67 WeakPolarHBondContact O-CG 3.45Å; N63-L67 PolarHBondContact O-N 2.67Å
64	R	46.6	Very low	46.4	Very low	169 Å²	169	101.7 Å²	101.7	64%	0.638	50%	0.496	S	S	*	.	H	α-helix	trans	-67.6	-32.6	175	-74.2	-178.7	-124.4	-120.1	2.3	113.3	S60 M61 T68	S60-R64 WeakPolarHBondContact O-CB 3.31Å; S60-R64 WeakPolarHBondContact O-CG 3.39Å; S60-R64 PolarHBondContact O-N 3.17Å; S60-R64 PolarHBondContact OG-NE 2.91Å; S60-R64 PolarHBondContact OG-NH2 2.92Å; M61-R64 CarbonylContact O-C 3.27Å; M61-R64 PolarHBondContact O-N 3.28Å; R64-T68 WeakPolarHBondContact O-CB 3.18Å; R64-T68 VanDerWaalsContact O-CG2 3.29Å; R64-T68 WeakPolarHBondContact O-CG2 3.46Å; R64-T68 PolarHBondContact O-N 2.58Å; R64-T68 PolarHBondContact O-OG1 3.45Å
65	L	48	Very low	46.4	Very low	45 Å²	45	97.3 Å²	97.3	24%	0.236	48%	0.483	C	S	.	.	H	α-helix	trans	-75.7	-42.4	179.3	-147.8	80.9	0	0	0	111.1	M61 F62 N63 T68 M69 L333	M61-L65 WeakPolarHBondContact O-CA 3.36Å; M61-L65 WeakPolarHBondContact O-CB 3.49Å; M61-L65 PolarHBondContact O-N 2.78Å; F62-L65 PolarHBondContact O-N 2.91Å; N63-L65 PolarHBondContact O-N 2.88Å; L65-T68 WeakPolarHBondContact CA-OG1 3.35Å; L65-T68 PolarHBondContact O-N 2.74Å; L65-T68 PolarHBondContact O-OG1 3.29Å; L65-T68 VanDerWaalsContact O-OG1 3.06Å; L65-M69 WeakPolarHBondContact O-CB 3.32Å; L65-M69 VanDerWaalsContact O-CG 3.28Å; L65-M69 WeakPolarHBondContact O-CG 3.39Å; L65-M69 PolarHBondContact O-N 3Å; L65-L333 HydrophobicContact CD2-CD1 4.3Å
66	L	47.4	Very low	46.4	Very low	63 Å²	63	96.2 Å²	96.2	33%	0.33	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-45.7	171.4	-104.8	112.2	0	0	0	110.8	F62 T68 M69 I70	F62-L66 HydrophobicContact CD1-CD1 3.65Å; F62-L66 HydrophobicContact CD2-CD1 3.88Å; F62-L66 HydrophobicContact CE1-CD1 3.29Å; F62-L66 HydrophobicContact CE2-CD1 3.53Å; F62-L66 HydrophobicContact CG-CD1 3.94Å; F62-L66 HydrophobicContact CZ-CD1 3.22Å; F62-L66 WeakPolarHBondContact O-CB 3.45Å; F62-L66 PolarHBondContact O-N 3.37Å; L66-T68 VanDerWaalsContact C-N 3.35Å; L66-T68 PolarHBondContact O-N 3.37Å; L66-M69 PolarHBondContact O-N 3.47Å; L66-I70 HydrophobicContact CB-CD1 4.49Å; L66-I70 HydrophobicContact CD2-CD1 3.98Å; L66-I70 WeakPolarHBondContact O-CB 3.36Å; L66-I70 VanDerWaalsContact O-CG1 3.24Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 2.94Å
67	L	48.9	Very low	46.2	Very low	93 Å²	93	99 Å²	99	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-58.9	-45.3	175.8	-74.6	166	0	0	0	110.9	N63 M69 I70 E71	N63-L67 WeakPolarHBondContact O-CB 3.45Å; N63-L67 WeakPolarHBondContact O-CD1 3.17Å; N63-L67 WeakPolarHBondContact O-CG 3.45Å; N63-L67 PolarHBondContact O-N 2.67Å; L67-M69 PolarHBondContact O-N 3.2Å; L67-I70 PolarHBondContact O-N 3.21Å; L67-E71 WeakPolarHBondContact O-CB 3.41Å; L67-E71 VanDerWaalsContact O-CG 3.27Å; L67-E71 WeakPolarHBondContact O-CG 3.45Å; L67-E71 PolarHBondContact O-N 3.07Å
68	T	52.3	Low	46.2	Very low	59 Å²	59	99.8 Å²	99.8	36%	0.362	48%	0.484	S	S	.	.	H	α-helix	trans	-69.8	-26.6	177	50.2	0	0	0	0	114.4	R64 L65 L66 R72	R64-T68 WeakPolarHBondContact O-CB 3.18Å; R64-T68 VanDerWaalsContact O-CG2 3.29Å; R64-T68 WeakPolarHBondContact O-CG2 3.46Å; R64-T68 PolarHBondContact O-N 2.58Å; R64-T68 PolarHBondContact O-OG1 3.45Å; L65-T68 WeakPolarHBondContact CA-OG1 3.35Å; L65-T68 PolarHBondContact O-N 2.74Å; L65-T68 PolarHBondContact O-OG1 3.29Å; L65-T68 VanDerWaalsContact O-OG1 3.06Å; L66-T68 VanDerWaalsContact C-N 3.35Å; L66-T68 PolarHBondContact O-N 3.37Å; T68-R72 WeakPolarHBondContact O-CB 3.33Å; T68-R72 WeakPolarHBondContact O-CG 3.41Å; T68-R72 PolarHBondContact O-N 3.24Å
69	M	45.8	Very low	46.1	Very low	87 Å²	87	100.6 Å²	100.6	43%	0.429	49%	0.492	S	S	.	.	H	α-helix	trans	-78.8	-30.3	173.3	-73.4	-164.1	-59.2	0	0	112.9	L65 L66 L67 P73 L333	L65-M69 WeakPolarHBondContact O-CB 3.32Å; L65-M69 VanDerWaalsContact O-CG 3.28Å; L65-M69 WeakPolarHBondContact O-CG 3.39Å; L65-M69 PolarHBondContact O-N 3Å; L66-M69 PolarHBondContact O-N 3.47Å; L67-M69 PolarHBondContact O-N 3.2Å; M69-P73 WeakPolarHBondContact O-CD 3.43Å; M69-L333 HydrophobicContact CE-CD2 4.28Å; M69-L333 HydrophobicContact SD-CD2 4.21Å
70	I	52.7	Low	46.1	Very low	88 Å²	88	97 Å²	97	45%	0.451	48%	0.477	S	S	.	.	H	α-helix	trans	-84.2	-34.9	177.1	-67.1	167.5	0	0	0	111.5	L66 L67 P73	L66-I70 HydrophobicContact CB-CD1 4.49Å; L66-I70 HydrophobicContact CD2-CD1 3.98Å; L66-I70 WeakPolarHBondContact O-CB 3.36Å; L66-I70 VanDerWaalsContact O-CG1 3.24Å; L66-I70 WeakPolarHBondContact O-CG1 3.46Å; L66-I70 PolarHBondContact O-N 2.94Å; L67-I70 PolarHBondContact O-N 3.21Å; I70-P73 WeakPolarHBondContact O-CD 3.28Å
71	E	46.8	Very low	46.1	Very low	110 Å²	110	101.4 Å²	101.4	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-81.1	-28.9	-177	-74.4	-172.7	168.2	0	0	113.7	L67 R74 T75	L67-E71 WeakPolarHBondContact O-CB 3.41Å; L67-E71 VanDerWaalsContact O-CG 3.27Å; L67-E71 WeakPolarHBondContact O-CG 3.45Å; L67-E71 PolarHBondContact O-N 3.07Å; E71-R74 PolarHBondContact O-N 2.86Å; E71-R74 VanDerWaalsContact O-N 3.17Å; E71-T75 PolarHBondContact O-N 3.29Å; E71-T75 PolarHBondContact O-OG1 3.39Å
72	R	49.3	Very low	46.1	Very low	174 Å²	174	100.9 Å²	100.9	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-65.6	-39.2	-179.8	-87.9	-173.9	171.3	179.2	-1.4	114.9	T68 R74 T75 L76	T68-R72 WeakPolarHBondContact O-CB 3.33Å; T68-R72 WeakPolarHBondContact O-CG 3.41Å; T68-R72 PolarHBondContact O-N 3.24Å; R72-R74 VanDerWaalsContact C-N 3.3Å; R72-R74 PolarHBondContact O-N 2.95Å; R72-T75 WeakPolarHBondContact CA-OG1 3.39Å; R72-L76 WeakPolarHBondContact O-CB 3.44Å; R72-L76 WeakPolarHBondContact O-CG 3.32Å; R72-L76 PolarHBondContact O-N 3Å
73	P	46.3	Very low	46.1	Very low	74 Å²	74	101.9 Å²	101.9	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-38	169.7	-21.2	30.9	0	0	0	112.2	M69 I70 L77	M69-P73 WeakPolarHBondContact O-CD 3.43Å; I70-P73 WeakPolarHBondContact O-CD 3.28Å; P73-L77 WeakPolarHBondContact O-CB 3.38Å; P73-L77 WeakPolarHBondContact O-CD1 3.23Å; P73-L77 WeakPolarHBondContact O-CG 3.34Å; P73-L77 PolarHBondContact O-N 3.47Å; P73-L77 VanDerWaalsContact O-N 3.11Å
74	R	44.4	Very low	46	Very low	173 Å²	173	103.6 Å²	103.6	65%	0.653	51%	0.51	S	S	*	.	H	α-helix	trans	-71.5	-40.4	-180	-84.3	-178.1	165.9	165.4	-3.2	113.3	E71 R72 L78	E71-R74 PolarHBondContact O-N 2.86Å; E71-R74 VanDerWaalsContact O-N 3.17Å; R72-R74 VanDerWaalsContact C-N 3.3Å; R72-R74 PolarHBondContact O-N 2.95Å; R74-L78 WeakPolarHBondContact O-CB 3.38Å; R74-L78 WeakPolarHBondContact O-CD1 3.31Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.49Å
75	T	47.6	Very low	45.7	Very low	69 Å²	69	99.6 Å²	99.6	42%	0.423	51%	0.508	S	S	.	.	H	α-helix	trans	-73.3	-34.8	179.7	31.4	0	0	0	0	112.6	E71 R72 L78 Q79	E71-T75 PolarHBondContact O-N 3.29Å; E71-T75 PolarHBondContact O-OG1 3.39Å; R72-T75 WeakPolarHBondContact CA-OG1 3.39Å; T75-L78 PolarHBondContact O-N 3.35Å; T75-Q79 WeakPolarHBondContact O-CB 3.33Å; T75-Q79 VanDerWaalsContact O-CG 3.28Å; T75-Q79 WeakPolarHBondContact O-CG 3.28Å; T75-Q79 PolarHBondContact O-N 3.36Å
76	L	44.2	Very low	45.2	Very low	114 Å²	114	101.4 Å²	101.4	60%	0.597	53%	0.525	S	S	*	.	H	α-helix	trans	-72.1	-34.7	173.7	-72.8	169	0	0	0	112.5	R72 S80	R72-L76 WeakPolarHBondContact O-CB 3.44Å; R72-L76 WeakPolarHBondContact O-CG 3.32Å; R72-L76 PolarHBondContact O-N 3Å; L76-S80 WeakPolarHBondContact O-CB 3.3Å; L76-S80 PolarHBondContact O-N 2.96Å; L76-S80 PolarHBondContact O-OG 2.98Å
77	L	43.3	Very low	44.9	Very low	104 Å²	104	102.9 Å²	102.9	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-39	170.8	-81.6	165.1	0	0	0	112	P73 S80 F81	P73-L77 WeakPolarHBondContact O-CB 3.38Å; P73-L77 WeakPolarHBondContact O-CD1 3.23Å; P73-L77 WeakPolarHBondContact O-CG 3.34Å; P73-L77 PolarHBondContact O-N 3.47Å; P73-L77 VanDerWaalsContact O-N 3.11Å; L77-S80 WeakPolarHBondContact CA-OG 3.42Å; L77-S80 PolarHBondContact O-OG 3.3Å; L77-F81 WeakPolarHBondContact O-CB 3.48Å; L77-F81 VanDerWaalsContact O-CD2 3.3Å; L77-F81 WeakPolarHBondContact O-CD2 3.5Å; L77-F81 PolarHBondContact O-N 2.81Å
78	L	43.2	Very low	44.1	Very low	117 Å²	117	103.2 Å²	103.2	61%	0.613	55%	0.551	S	S	*	*	H	α-helix	trans	-73.3	-35.2	177.9	-74.8	164.6	0	0	0	112.6	R74 T75 F81 T82	R74-L78 WeakPolarHBondContact O-CB 3.38Å; R74-L78 WeakPolarHBondContact O-CD1 3.31Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.49Å; T75-L78 PolarHBondContact O-N 3.35Å; L78-F81 PolarHBondContact O-N 3.1Å; L78-T82 PolarHBondContact O-N 3.44Å; L78-T82 PolarHBondContact O-OG1 2.78Å; L78-T82 VanDerWaalsContact O-OG1 3.06Å
79	Q	45.7	Very low	43.1	Very low	116 Å²	116	105.7 Å²	105.7	54%	0.542	57%	0.57	S	S	.	*	H	α-helix	trans	-71.7	-34.2	175.4	-76.2	178	-10.8	0	0	112.9	T75 T82 L83	T75-Q79 WeakPolarHBondContact O-CB 3.33Å; T75-Q79 VanDerWaalsContact O-CG 3.28Å; T75-Q79 WeakPolarHBondContact O-CG 3.28Å; T75-Q79 PolarHBondContact O-N 3.36Å; Q79-T82 WeakPolarHBondContact CA-OG1 3.39Å; Q79-T82 PolarHBondContact O-OG1 3.2Å; Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 WeakPolarHBondContact O-CD1 3.45Å; Q79-L83 WeakPolarHBondContact O-CG 3.43Å; Q79-L83 PolarHBondContact O-N 3.21Å; Q79-L83 VanDerWaalsContact O-N 3.13Å
80	S	43.9	Very low	42.5	Very low	47 Å²	47	105.6 Å²	105.6	33%	0.329	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-38.8	171.2	59.9	0	0	0	0	111.3	L76 L77 L83 L84	L76-S80 WeakPolarHBondContact O-CB 3.3Å; L76-S80 PolarHBondContact O-N 2.96Å; L76-S80 PolarHBondContact O-OG 2.98Å; L77-S80 WeakPolarHBondContact CA-OG 3.42Å; L77-S80 PolarHBondContact O-OG 3.3Å; S80-L83 PolarHBondContact O-N 3.38Å; S80-L84 WeakPolarHBondContact O-CB 3.48Å; S80-L84 WeakPolarHBondContact O-CD1 3.45Å; S80-L84 PolarHBondContact O-N 2.78Å
81	F	42.7	Very low	41.5	Very low	144 Å²	144	108.8 Å²	108.8	63%	0.632	60%	0.6	S	S	*	*	H	α-helix	trans	-67	-34.8	174.8	-97.7	-85	0	0	0	113.8	L77 L78 S85	L77-F81 WeakPolarHBondContact O-CB 3.48Å; L77-F81 VanDerWaalsContact O-CD2 3.3Å; L77-F81 WeakPolarHBondContact O-CD2 3.5Å; L77-F81 PolarHBondContact O-N 2.81Å; L78-F81 PolarHBondContact O-N 3.1Å; F81-S85 WeakPolarHBondContact O-CB 3.48Å; F81-S85 PolarHBondContact O-N 3.26Å; F81-S85 PolarHBondContact O-OG 3.45Å
82	T	45.3	Very low	40.7	Very low	85 Å²	85	109.7 Å²	109.7	52%	0.521	62%	0.619	S	S	.	*	H	α-helix	trans	-73.6	-34.7	174.8	47.5	0	0	0	0	112.8	L78 Q79 S85 S86	L78-T82 PolarHBondContact O-N 3.44Å; L78-T82 PolarHBondContact O-OG1 2.78Å; L78-T82 VanDerWaalsContact O-OG1 3.06Å; Q79-T82 WeakPolarHBondContact CA-OG1 3.39Å; Q79-T82 PolarHBondContact O-OG1 3.2Å; T82-S85 WeakPolarHBondContact CA-OG 3.18Å; T82-S85 PolarHBondContact O-N 2.9Å; T82-S85 PolarHBondContact O-OG 3.28Å; T82-S86 WeakPolarHBondContact O-CB 3.42Å; T82-S86 PolarHBondContact O-N 3.27Å; T82-S86 PolarHBondContact O-OG 2.91Å
83	L	41.7	Very low	40.1	Very low	118 Å²	118	105.7 Å²	105.7	62%	0.618	62%	0.617	S	S	*	*	H	α-helix	trans	-68.8	-33.9	172.3	-78.7	162.4	0	0	0	112.5	Q79 S80 S86 S87	Q79-L83 WeakPolarHBondContact O-CB 3.34Å; Q79-L83 WeakPolarHBondContact O-CD1 3.45Å; Q79-L83 WeakPolarHBondContact O-CG 3.43Å; Q79-L83 PolarHBondContact O-N 3.21Å; Q79-L83 VanDerWaalsContact O-N 3.13Å; S80-L83 PolarHBondContact O-N 3.38Å; L83-S86 PolarHBondContact O-OG 3.2Å; L83-S87 PolarHBondContact O-OG 2.84Å
84	L	40.8	Very low	39.5	Very low	127 Å²	127	108.3 Å²	108.3	67%	0.665	64%	0.638	S	S	*	*	H	α-helix	trans	-73.9	-33.3	174.3	-93	119.9	0	0	0	112.8	S80 S88	S80-L84 WeakPolarHBondContact O-CB 3.48Å; S80-L84 WeakPolarHBondContact O-CD1 3.45Å; S80-L84 PolarHBondContact O-N 2.78Å; L84-S88 PolarHBondContact O-OG 3.06Å
85	S	39.7	Very low	39.1	Very low	85 Å²	85	104.8 Å²	104.8	59%	0.594	64%	0.64	S	S	*	*	H	α-helix	trans	-85	-19.7	179	61.6	0	0	0	0	114.5	F81 T82 S87	F81-S85 WeakPolarHBondContact O-CB 3.48Å; F81-S85 PolarHBondContact O-N 3.26Å; F81-S85 PolarHBondContact O-OG 3.45Å; T82-S85 WeakPolarHBondContact CA-OG 3.18Å; T82-S85 PolarHBondContact O-N 2.9Å; T82-S85 PolarHBondContact O-OG 3.28Å; S85-S87 VanDerWaalsContact C-N 3.31Å
86	S	37.9	Very low	38.4	Very low	83 Å²	83	107.9 Å²	107.9	58%	0.58	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-2.6	171.1	59.7	0	0	0	0	114.2	T82 L83	T82-S86 WeakPolarHBondContact O-CB 3.42Å; T82-S86 PolarHBondContact O-N 3.27Å; T82-S86 PolarHBondContact O-OG 2.91Å; L83-S86 PolarHBondContact O-OG 3.2Å
87	S	39.4	Very low	38.1	Very low	93 Å²	93	107.4 Å²	107.4	65%	0.65	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	6.4	-178.7	-53.3	0	0	0	0	113.5	L83 S85	L83-S87 PolarHBondContact O-OG 2.84Å; S85-S87 VanDerWaalsContact C-N 3.31Å
88	S	32.6	Very low	37.5	Very low	101 Å²	101	107.8 Å²	107.8	71%	0.706	68%	0.682	S	S	*	*	S	Bend	trans	-99.7	18.9	-174.3	-49.4	0	0	0	0	115	L84	L84-S88 PolarHBondContact O-OG 3.06Å
89	S	32.1	Very low	37	Very low	111 Å²	111	108 Å²	108	78%	0.776	69%	0.692	S	S	*	*	S	Bend	trans	-140.7	62.9	178.2	64.1	0	0	0	0	112.6
90	A	31.8	Very low	36.6	Very low	85 Å²	85	106.9 Å²	106.9	70%	0.702	70%	0.698	S	S	*	*	S	Bend	trans	-165.6	134.9	158.2	0	0	0	0	0	111
91	L	32.8	Very low	36.5	Very low	155 Å²	155	110.1 Å²	110.1	81%	0.812	72%	0.721	S	S	*	*			trans	79.9	80.4	170.1	-79.4	77.7	0	0	0	117.9
92	S	29.8	Very low	37.2	Very low	129 Å²	129	109.1 Å²	109.1	90%	0.902	72%	0.721	S	S	*	*			trans	-79.8	101.2	135.8	57.5	0	0	0	0	109.2
93	S	37.7	Very low	38.3	Very low	89 Å²	89	107.8 Å²	107.8	62%	0.622	72%	0.715	S	S	*	*			trans	-141.8	110.9	158.6	59.2	0	0	0	0	108.8	S95	S93-S95 PolarHBondContact O-N 2.94Å
94	S	33.4	Very low	40.3	Very low	130 Å²	130	105.8 Å²	105.8	91%	0.909	70%	0.704	S	S	*	*			trans	-61.7	116	175.7	49.9	0	0	0	0	111.1
95	S	36.4	Very low	42.7	Very low	99 Å²	99	101.9 Å²	101.9	69%	0.692	68%	0.684	S	S	*	*			trans	-131.9	107.1	157.3	61.1	0	0	0	0	108.5	S93 S97	S93-S95 PolarHBondContact O-N 2.94Å; S95-S97 PolarHBondContact O-N 3.13Å
96	S	32.8	Very low	45.4	Very low	134 Å²	134	98 Å²	98	94%	0.937	66%	0.657	S	S	*	*			trans	-58.7	99.1	167	50.4	0	0	0	0	109.1
97	S	36.9	Very low	48.2	Very low	104 Å²	104	96.9 Å²	96.9	73%	0.727	64%	0.642	S	S	*	*			trans	-107.1	124.8	166.5	56.5	0	0	0	0	108.3	S95 S99	S95-S97 PolarHBondContact O-N 3.13Å; S97-S99 PolarHBondContact O-N 3.44Å
98	S	31.1	Very low	51	Low	112 Å²	112	92.4 Å²	92.4	78%	0.783	61%	0.611	S	S	*	*			trans	-46.2	122.5	173.9	48.3	0	0	0	0	110.7	S100	S98-S100 PolarHBondContact O-N 3.44Å
99	S	31.4	Very low	54.1	Low	120 Å²	120	87.6 Å²	87.6	84%	0.839	58%	0.577	S	S	*	*			trans	-66.7	78.9	173.5	58.5	0	0	0	0	110.3	S97 S101	S97-S99 PolarHBondContact O-N 3.44Å; S99-S101 PolarHBondContact O-N 2.96Å
100	S	38.5	Very low	57.3	Low	94 Å²	94	82.4 Å²	82.4	66%	0.657	54%	0.541	S	S	*	.			trans	-66.1	112.8	153.1	59.4	0	0	0	0	105.7	S98 I102	S98-S100 PolarHBondContact O-N 3.44Å; S100-I102 PolarHBondContact O-N 3.04Å
101	S	42.3	Very low	60.5	Low	115 Å²	115	78.4 Å²	78.4	80%	0.804	51%	0.508	S	S	*	.			trans	-50.7	104.5	176.2	55.2	0	0	0	0	108.9	S99 S103	S99-S101 PolarHBondContact O-N 2.96Å; S101-S103 PolarHBondContact O-N 2.93Å
102	I	56.4	Low	63.6	Low	123 Å²	123	71 Å²	71	63%	0.631	47%	0.469	S	S	*	.			trans	-61.2	111.4	177.3	-65.6	171.8	0	0	0	105.5	S100 N104	S100-I102 PolarHBondContact O-N 3.04Å; I102-N104 PolarHBondContact O-N 2.99Å
103	S	69.7	Low	66.7	Low	57 Å²	57	64.9 Å²	64.9	40%	0.399	43%	0.426	S	S	.	.			trans	-60.2	126.6	-179.6	173.2	0	0	0	0	109.4	S101 D105 R177	S101-S103 PolarHBondContact O-N 2.93Å; S103-D105 PolarHBondContact O-N 3.28Å; S103-D105 VanDerWaalsContact O-N 3.07Å; S103-D105 WeakPolarHBondContact OG-CB 3.44Å; S103-D105 PolarHBondContact OG-N 3.13Å; S103-D105 PolarHBondContact OG-OD2 3.43Å; S103-R177 PolarHBondContact O-NE 2.87Å
104	N	81.7	Confident	69.4	Low	75 Å²	75	61.3 Å²	61.3	40%	0.401	40%	0.4	S	S	.	.			trans	-74.1	16.8	172.4	-70.4	-10.5	0	0	0	112.4	I102	I102-N104 PolarHBondContact O-N 2.99Å
105	D	93.2	Very high	72.3	Confident	45 Å²	45	56 Å²	56	24%	0.241	36%	0.36	C	S	.	.			trans	-77.1	137.9	-179.4	-72.6	-2.9	0	0	0	111.4	S103 F107 K166 R177 Y195	S103-D105 PolarHBondContact O-N 3.28Å; S103-D105 VanDerWaalsContact O-N 3.07Å; S103-D105 WeakPolarHBondContact OG-CB 3.44Å; S103-D105 PolarHBondContact OG-N 3.13Å; S103-D105 PolarHBondContact OG-OD2 3.43Å; D105-F107 PolarHBondContact O-N 2.88Å; D105-K166 WeakPolarHBondContact OD1-CE 3.29Å; D105-K166 IonicContact OD1-NZ 2.69Å; D105-K166 PolarHBondContact OD1-NZ 2.91Å; D105-K166 IonicContact OD2-NZ 3.73Å; D105-K166 PolarHBondContact OD2-NZ 2.92Å; D105-R177 PolarHBondContact O-NE 2.66Å; D105-Y195 HydrophobicContact CB-CD1 3.75Å; D105-Y195 HydrophobicContact CB-CE1 4.09Å
106	L	96	Very high	75.2	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.026	33%	0.328	C	S	.	.			trans	-59.4	128	170.2	-72.7	-177.3	0	0	0	109.7	I109 F173 C176 A179 L191 Y195 A198	L106-I109 HydrophobicContact CD1-CG1 4.4Å; L106-F173 HydrophobicContact CD1-CD2 3.68Å; L106-F173 HydrophobicContact CD1-CE2 3.61Å; L106-F173 HydrophobicContact CD1-CG 4.18Å; L106-F173 HydrophobicContact CD1-CZ 4.05Å; L106-F173 HydrophobicContact CD2-CB 4.37Å; L106-F173 HydrophobicContact CD2-CD2 4.43Å; L106-F173 HydrophobicContact CD2-CG 4.21Å; L106-F173 HydrophobicContact CG-CD2 4.09Å; L106-F173 HydrophobicContact CG-CG 4.37Å; L106-C176 WeakPolarHBondContact CD2-O 3.31Å; L106-A179 HydrophobicContact CD1-CB 3.87Å; L106-A179 HydrophobicContact CD2-CB 3.9Å; L106-L191 HydrophobicContact CD1-CD2 4.44Å; L106-Y195 HydrophobicContact CB-CD1 4.28Å; L106-Y195 HydrophobicContact CB-CD2 3.92Å; L106-Y195 HydrophobicContact CB-CE2 4.19Å; L106-Y195 HydrophobicContact CB-CG 3.96Å; L106-Y195 HydrophobicContact CD1-CD2 4.02Å; L106-Y195 HydrophobicContact CD1-CE2 3.82Å; L106-Y195 HydrophobicContact CG-CD2 4.2Å; L106-Y195 HydrophobicContact CG-CE2 3.99Å; L106-A198 WeakPolarHBondContact O-CB 3.41Å
107	F	95.5	Very high	78.1	Confident	58 Å²	58	46.2 Å²	46.2	25%	0.254	30%	0.295	S	S	.	.	S	Bend	trans	-95.4	-33.4	173	178.3	-115.3	0	0	0	111.6	D105 Y129 R177 F178 A198 K199 L304	D105-F107 PolarHBondContact O-N 2.88Å; F107-Y129 HydrophobicContact CE1-CE2 4.43Å; F107-Y129 AromaticContact CE1-CZ 3.89Å; F107-Y129 WeakPolarHBondContact CE1-OH 3.14Å; F107-R177 PolarHBondContact N-O 3.3Å; F107-F178 HydrophobicContact CB-CE1 4.5Å; F107-F178 HydrophobicContact CD1-CD1 4.48Å; F107-F178 AromaticContact CD1-CE1 3.99Å; F107-F178 HydrophobicContact CD1-CE1 3.99Å; F107-A198 CarbonylContact O-C 3.57Å; F107-A198 WeakPolarHBondContact O-CA 3.44Å; F107-K199 HydrophobicContact CZ-CD 4.48Å; F107-K199 PolarHBondContact O-N 3.04Å; F107-L304 HydrophobicContact CE1-CD2 4.07Å
108	I	98.2	Very high	81	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.8	176.4	-57.8	-66.9	0	0	0	111.4	L125 R177 F178 A179 K199 I201 L304	I108-L125 HydrophobicContact CB-CD1 4.45Å; I108-L125 HydrophobicContact CG1-CD2 4.29Å; I108-L125 HydrophobicContact CG2-CD1 4.03Å; I108-R177 PolarHBondContact N-O 2.97Å; I108-F178 HydrophobicContact CB-CB 4.19Å; I108-F178 HydrophobicContact CB-CD1 3.79Å; I108-F178 HydrophobicContact CB-CG 4.44Å; I108-F178 HydrophobicContact CG1-CD1 3.68Å; I108-F178 HydrophobicContact CG1-CE1 4.27Å; I108-F178 WeakPolarHBondContact O-CA 3.49Å; I108-A179 PolarHBondContact O-N 2.99Å; I108-K199 WeakPolarHBondContact CA-O 3.14Å; I108-K199 HydrophobicContact CD1-CB 3.75Å; I108-I201 HydrophobicContact CD1-CD1 4.3Å; I108-I201 HydrophobicContact CG2-CD1 3.74Å; I108-I201 HydrophobicContact CG2-CG1 3.94Å; I108-L304 HydrophobicContact CD1-CD2 3.5Å; I108-L304 VanDerWaalsContact CD1-CD2 3.5Å; I108-L304 HydrophobicContact CG1-CD2 4.24Å
109	I	98.7	Very high	84.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.2	169.7	-59.6	163	0	0	0	108.3	L106 L191 M192 A198 K199 V200 I201	L106-I109 HydrophobicContact CD1-CG1 4.4Å; I109-L191 HydrophobicContact CD1-CB 3.69Å; I109-L191 HydrophobicContact CG1-CB 4.31Å; I109-L191 HydrophobicContact CG2-CD1 4.27Å; I109-M192 HydrophobicContact CD1-CG 4.06Å; I109-A198 HydrophobicContact CD1-CB 3.65Å; I109-A198 HydrophobicContact CG1-CB 3.99Å; I109-K199 PolarHBondContact N-O 3.41Å; I109-V200 CarbonylContact O-C 3.57Å; I109-V200 VanDerWaalsContact O-CA 3.28Å; I109-V200 WeakPolarHBondContact O-CA 3.31Å; I109-I201 PolarHBondContact O-N 3.39Å
110	G	98.6	Very high	87.1	Confident	2 Å²	2	31.2 Å²	31.2	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	114	171.9	0	0	0	0	0	110.5	A179 C185 I201	G110-A179 PolarHBondContact N-O 2.95Å; G110-C185 VanDerWaalsContact O-CA 3.31Å; G110-C185 WeakPolarHBondContact O-CA 3.33Å; G110-C185 VanDerWaalsContact O-CB 3.31Å; G110-C185 WeakPolarHBondContact O-CB 3.47Å; G110-I201 WeakPolarHBondContact CA-O 3.22Å
111	A	98.5	Very high	89.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.158	C	C	.	.			trans	-99.5	-3.6	179.8	0	0	0	0	0	113.1	Y188 V200 I201 W275 I279	A111-Y188 HydrophobicContact CB-CG 4.25Å; A111-V200 HydrophobicContact CB-CG1 3.77Å; A111-I201 PolarHBondContact N-O 2.83Å; A111-W275 PolarHBondContact O-NE1 3.42Å; A111-I279 HydrophobicContact CB-CD1 3.68Å; A111-I279 HydrophobicContact CB-CG1 4.31Å; A111-I279 HydrophobicContact CB-CG2 4.12Å; A111-I279 WeakPolarHBondContact O-CD1 3.31Å
112	G	97.9	Very high	92.6	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.01	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-68.7	142.5	177.3	0	0	0	0	0	113.4	T203	G112-T203 WeakPolarHBondContact CA-OG1 3.49Å
113	Q	96.8	Very high	94.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-64.1	157	176.8	-73.3	-71.9	-22.5	0	0	111.6	T116 Y182 W210 F272 W275	Q113-T116 HydrophobicContact CB-CG2 4.14Å; Q113-T116 WeakPolarHBondContact O-CB 3.43Å; Q113-T116 WeakPolarHBondContact O-CG2 3.35Å; Q113-T116 PolarHBondContact O-N 3.29Å; Q113-T116 PolarHBondContact O-OG1 3.08Å; Q113-Y182 VanDerWaalsContact CD-OH 3.24Å; Q113-Y182 PolarHBondContact NE2-OH 3.16Å; Q113-Y182 VanDerWaalsContact OE1-CZ 3.23Å; Q113-Y182 PolarHBondContact OE1-OH 2.99Å; Q113-W210 HydrophobicContact CB-CZ2 4.17Å; Q113-F272 HydrophobicContact CB-CD2 4.13Å; Q113-F272 HydrophobicContact CB-CE2 3.95Å; Q113-F272 HydrophobicContact CG-CD2 3.93Å; Q113-F272 HydrophobicContact CG-CE2 4.1Å; Q113-W275 HydrophobicContact CG-CD2 4.49Å; Q113-W275 HydrophobicContact CG-CG 4.01Å
114	M	93.6	Very high	95.8	Very high	14 Å²	14	16.6 Å²	16.6	7%	0.069	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	152.6	169.4	61	-176.9	80.8	0	0	110.8	T116 D181 Y182 W210 T218 Y252	M114-T116 PolarHBondContact O-N 3.44Å; M114-D181 WeakPolarHBondContact CA-OD1 3.46Å; M114-Y182 HydrophobicContact CB-CD2 3.99Å; M114-Y182 HydrophobicContact CB-CE2 4.23Å; M114-Y182 HydrophobicContact CE-CD1 4.1Å; M114-Y182 HydrophobicContact CE-CD2 3.21Å; M114-Y182 HydrophobicContact CE-CE1 4.21Å; M114-Y182 HydrophobicContact CE-CE2 3.36Å; M114-Y182 HydrophobicContact CE-CG 3.57Å; M114-Y182 HydrophobicContact CG-CD2 4.23Å; M114-Y182 HydrophobicContact CG-CE2 4.06Å; M114-W210 PolarHBondContact O-NE1 2.82Å; M114-T218 HydrophobicContact CG-CG2 4.38Å; M114-T218 WeakPolarHBondContact SD-CB 3.35Å; M114-T218 HydrophobicContact SD-CG2 3.51Å; M114-T218 VanDerWaalsContact SD-CG2 3.51Å; M114-T218 PolarHBondContact SD-OG1 2.77Å; M114-Y252 HydrophobicContact CE-CD2 4.43Å; M114-Y252 HydrophobicContact CE-CE2 3.45Å; M114-Y252 VanDerWaalsContact CE-CE2 3.45Å; M114-Y252 HydrophobicContact SD-CE2 3.99Å; M114-Y252 PolarHBondContact SD-OH 3.49Å
115	R	94.2	Very high	96.5	Very high	19 Å²	19	13 Å²	13	7%	0.072	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	8.1	-177.9	-43.1	-48.8	-55.9	153.5	3.5	116.1	G117 R205 S213 T217 T218 N318	R115-G117 VanDerWaalsContact C-N 3.35Å; R115-R205 PolarHBondContact O-NH1 3.44Å; R115-S213 PolarHBondContact NE-OG 2.7Å; R115-T217 WeakPolarHBondContact CD-OG1 3.1Å; R115-T217 PolarHBondContact NE-OG1 2.82Å; R115-T218 HydrophobicContact CG-CG2 4.31Å; R115-T218 WeakPolarHBondContact CG-OG1 3.19Å; R115-N318 VanDerWaalsContact NH1-CG 3.32Å; R115-N318 PolarHBondContact NH1-ND2 2.89Å; R115-N318 PolarHBondContact NH1-OD1 3.42Å; R115-N318 PolarHBondContact NH2-O 2.89Å
116	T	96.5	Very high	96.6	Very high	4 Å²	4	13.5 Å²	13.5	3%	0.025	7%	0.069	C	C	.	.	S	Bend	trans	-92.4	9	169.6	62.6	0	0	0	0	113.4	Q113 M114 T203 R205 F272 P293	Q113-T116 HydrophobicContact CB-CG2 4.14Å; Q113-T116 WeakPolarHBondContact O-CB 3.43Å; Q113-T116 WeakPolarHBondContact O-CG2 3.35Å; Q113-T116 PolarHBondContact O-N 3.29Å; Q113-T116 PolarHBondContact O-OG1 3.08Å; M114-T116 PolarHBondContact O-N 3.44Å; T116-T203 VanDerWaalsContact CB-O 3.32Å; T116-T203 WeakPolarHBondContact CB-O 3.44Å; T116-T203 WeakPolarHBondContact CG2-O 3.29Å; T116-T203 WeakPolarHBondContact OG1-CB 3.37Å; T116-T203 PolarHBondContact OG1-O 3.11Å; T116-T203 PolarHBondContact OG1-OG1 2.95Å; T116-R205 HydrophobicContact CG2-CB 4.47Å; T116-F272 HydrophobicContact CG2-CE2 3.75Å; T116-F272 HydrophobicContact CG2-CZ 3.84Å; T116-P293 WeakPolarHBondContact O-CD 3.47Å; T116-P293 WeakPolarHBondContact O-CG 3.09Å
117	G	95.1	Very high	96.6	Very high	23 Å²	23	18 Å²	18	24%	0.237	9%	0.093	C	C	.	.	S	Bend	trans	90.9	23.8	-179.3	0	0	0	0	0	114.6	R115 T119 S120 L121	R115-G117 VanDerWaalsContact C-N 3.35Å; G117-T119 PolarHBondContact O-N 3.41Å; G117-S120 WeakPolarHBondContact O-CB 3.45Å; G117-S120 PolarHBondContact O-N 3.26Å; G117-L121 PolarHBondContact O-N 3.4Å
118	T	96.9	Very high	96.6	Very high	4 Å²	4	16.9 Å²	16.9	3%	0.025	9%	0.09	C	C	.	.	H	α-helix	trans	-53	-34.6	173.8	53.2	0	0	0	0	113.9	L121 K122 H135 D181	T118-L121 PolarHBondContact O-N 2.89Å; T118-K122 PolarHBondContact O-N 3.32Å; T118-H135 PolarHBondContact OG1-NE2 3.11Å; T118-D181 HydrophobicContact CG2-CB 4.18Å; T118-D181 PolarHBondContact OG1-OD1 3.46Å
119	T	95.5	Very high	96.5	Very high	10 Å²	10	19.7 Å²	19.7	6%	0.061	10%	0.101	C	C	.	.	H	α-helix	trans	-67.2	-44.1	175	-49.8	0	0	0	0	111.7	G117 L121 K122 F123 H135 L317 N318	G117-T119 PolarHBondContact O-N 3.41Å; T119-L121 VanDerWaalsContact C-N 3.3Å; T119-L121 PolarHBondContact O-N 3.14Å; T119-K122 WeakPolarHBondContact O-CB 3.31Å; T119-K122 PolarHBondContact O-N 3.35Å; T119-F123 HydrophobicContact CG2-CD2 4.01Å; T119-F123 HydrophobicContact CG2-CE2 3.91Å; T119-F123 VanDerWaalsContact O-CD2 3.31Å; T119-F123 WeakPolarHBondContact O-CD2 3.24Å; T119-F123 PolarHBondContact O-N 3.28Å; T119-F123 VanDerWaalsContact O-N 3.16Å; T119-H135 WeakPolarHBondContact CA-NE2 3.39Å; T119-H135 PolarHBondContact N-NE2 2.92Å; T119-H135 PolarHBondContact OG1-NE2 3.05Å; T119-H135 VanDerWaalsContact OG1-NE2 3.1Å; T119-L317 HydrophobicContact CG2-CB 4.11Å; T119-N318 HydrophobicContact CG2-CB 4.01Å; T119-N318 PolarHBondContact OG1-ND2 3.45Å
120	S	95.8	Very high	96.3	Very high	6 Å²	6	27 Å²	27	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-43.6	174	-77	0	0	0	0	111.4	G117 K122 F123 A124 P315 L317	G117-S120 WeakPolarHBondContact O-CB 3.45Å; G117-S120 PolarHBondContact O-N 3.26Å; S120-K122 PolarHBondContact O-N 3.47Å; S120-F123 PolarHBondContact O-N 3.29Å; S120-A124 WeakPolarHBondContact O-CB 3.45Å; S120-A124 PolarHBondContact O-N 3.29Å; S120-P315 WeakPolarHBondContact CB-O 3.38Å; S120-P315 PolarHBondContact OG-O 2.85Å; S120-L317 PolarHBondContact OG-N 2.92Å
121	L	97.8	Very high	96	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-60.4	-43.7	175.5	179.4	61.9	0	0	0	112.5	G117 T118 T119 F123 A124 L125 V180 I201 T203 F291 L300	G117-L121 PolarHBondContact O-N 3.4Å; T118-L121 PolarHBondContact O-N 2.89Å; T119-L121 VanDerWaalsContact C-N 3.3Å; T119-L121 PolarHBondContact O-N 3.14Å; L121-F123 PolarHBondContact O-N 2.98Å; L121-A124 PolarHBondContact O-N 3.42Å; L121-L125 HydrophobicContact CD1-CD1 4.07Å; L121-L125 HydrophobicContact CD1-CG 4.07Å; L121-L125 HydrophobicContact CG-CD1 4.01Å; L121-L125 HydrophobicContact CG-CG 4.43Å; L121-L125 WeakPolarHBondContact O-CG 3.43Å; L121-L125 PolarHBondContact O-N 3.38Å; L121-V180 HydrophobicContact CD2-CG1 3.96Å; L121-V180 HydrophobicContact CG-CG1 4.33Å; L121-I201 HydrophobicContact CD1-CD1 4.07Å; L121-I201 HydrophobicContact CD1-CG2 4.4Å; L121-I201 HydrophobicContact CD2-CB 4.14Å; L121-I201 HydrophobicContact CD2-CG2 3.72Å; L121-T203 HydrophobicContact CB-CG2 4.34Å; L121-T203 HydrophobicContact CD2-CG2 3.76Å; L121-F291 HydrophobicContact CD1-CD1 4.28Å; L121-F291 HydrophobicContact CD1-CE1 4.14Å; L121-L300 HydrophobicContact CD1-CD1 4.12Å; L121-L300 HydrophobicContact CD1-CD2 4.18Å
122	K	97.3	Very high	95.8	Very high	5 Å²	5	32.9 Å²	32.9	2%	0.022	17%	0.173	C	C	.	.	H	α-helix	trans	-52.7	-55.1	174.6	173.6	-158.8	168.7	74.4	0	110.9	T118 T119 S120 A124 L125 Q126 C133 H135 D138 V180	T118-K122 PolarHBondContact O-N 3.32Å; T119-K122 WeakPolarHBondContact O-CB 3.31Å; T119-K122 PolarHBondContact O-N 3.35Å; S120-K122 PolarHBondContact O-N 3.47Å; K122-A124 VanDerWaalsContact C-N 3.33Å; K122-A124 PolarHBondContact O-N 2.9Å; K122-L125 PolarHBondContact O-N 3.49Å; K122-Q126 VanDerWaalsContact O-CG 3.32Å; K122-Q126 WeakPolarHBondContact O-CG 3.31Å; K122-Q126 PolarHBondContact O-N 3.41Å; K122-C133 HydrophobicContact CB-CB 4.46Å; K122-C133 HydrophobicContact CG-CB 3.76Å; K122-C133 PolarHBondContact NZ-O 2.94Å; K122-H135 HydrophobicContact CD-CB 3.83Å; K122-H135 HydrophobicContact CG-CB 4.39Å; K122-D138 IonicContact NZ-OD1 3.28Å; K122-D138 PolarHBondContact NZ-OD1 3.1Å; K122-D138 IonicContact NZ-OD2 2.72Å; K122-D138 PolarHBondContact NZ-OD2 2.88Å; K122-V180 HydrophobicContact CB-CG2 3.98Å
123	F	96.1	Very high	95.7	Very high	76 Å²	76	33 Å²	33	33%	0.333	17%	0.174	S	C	.	.	H	α-helix	trans	-66.8	-34.9	-177.9	-80.3	-87.4	0	0	0	112.3	T119 S120 L121 Q126 L127 P315 L317	T119-F123 HydrophobicContact CG2-CD2 4.01Å; T119-F123 HydrophobicContact CG2-CE2 3.91Å; T119-F123 VanDerWaalsContact O-CD2 3.31Å; T119-F123 WeakPolarHBondContact O-CD2 3.24Å; T119-F123 PolarHBondContact O-N 3.28Å; T119-F123 VanDerWaalsContact O-N 3.16Å; S120-F123 PolarHBondContact O-N 3.29Å; L121-F123 PolarHBondContact O-N 2.98Å; F123-Q126 PolarHBondContact O-N 2.87Å; F123-L127 WeakPolarHBondContact O-CB 3.22Å; F123-L127 WeakPolarHBondContact O-CG 3.44Å; F123-L127 PolarHBondContact O-N 3.26Å; F123-P315 HydrophobicContact CB-CB 4.05Å; F123-P315 HydrophobicContact CB-CG 4.07Å; F123-L317 HydrophobicContact CB-CD1 3.95Å; F123-L317 HydrophobicContact CD1-CD1 4.05Å; F123-L317 HydrophobicContact CD2-CD1 3.2Å; F123-L317 HydrophobicContact CE1-CD1 4.36Å; F123-L317 HydrophobicContact CE2-CD1 3.59Å; F123-L317 HydrophobicContact CG-CD1 3.46Å; F123-L317 VanDerWaalsContact CG-CD1 3.46Å; F123-L317 HydrophobicContact CZ-CD1 4.15Å
124	A	97.5	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-48.3	174.4	0	0	0	0	0	111.5	S120 L121 K122 Q126 L127 L128 W297 L300 F314 P315	S120-A124 WeakPolarHBondContact O-CB 3.45Å; S120-A124 PolarHBondContact O-N 3.29Å; L121-A124 PolarHBondContact O-N 3.42Å; K122-A124 VanDerWaalsContact C-N 3.33Å; K122-A124 PolarHBondContact O-N 2.9Å; A124-Q126 VanDerWaalsContact C-N 3.34Å; A124-Q126 PolarHBondContact O-N 3.35Å; A124-L127 PolarHBondContact O-N 3.13Å; A124-L128 VanDerWaalsContact O-CG 3.23Å; A124-L128 WeakPolarHBondContact O-CG 3.36Å; A124-L128 PolarHBondContact O-N 2.86Å; A124-W297 HydrophobicContact CB-CH2 3.87Å; A124-W297 HydrophobicContact CB-CZ3 3.67Å; A124-L300 HydrophobicContact CB-CD2 3.92Å; A124-F314 HydrophobicContact CB-CD2 4.33Å; A124-F314 HydrophobicContact CB-CE2 3.58Å; A124-F314 HydrophobicContact CB-CZ 3.96Å; A124-P315 HydrophobicContact CB-CG 4.37Å
125	L	97.5	Very high	95.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-38.9	177.1	-67.7	170.2	0	0	0	112.3	I108 L121 K122 L128 Y129 F178 V180 L304	I108-L125 HydrophobicContact CB-CD1 4.45Å; I108-L125 HydrophobicContact CG1-CD2 4.29Å; I108-L125 HydrophobicContact CG2-CD1 4.03Å; L121-L125 HydrophobicContact CD1-CD1 4.07Å; L121-L125 HydrophobicContact CD1-CG 4.07Å; L121-L125 HydrophobicContact CG-CD1 4.01Å; L121-L125 HydrophobicContact CG-CG 4.43Å; L121-L125 WeakPolarHBondContact O-CG 3.43Å; L121-L125 PolarHBondContact O-N 3.38Å; K122-L125 PolarHBondContact O-N 3.49Å; L125-L128 PolarHBondContact O-N 2.82Å; L125-Y129 HydrophobicContact CD2-CE2 4.42Å; L125-Y129 PolarHBondContact O-N 3.07Å; L125-F178 HydrophobicContact CB-CD2 3.97Å; L125-F178 HydrophobicContact CB-CE2 4.35Å; L125-F178 HydrophobicContact CB-CG 4.12Å; L125-F178 HydrophobicContact CD1-CB 3.9Å; L125-F178 HydrophobicContact CD1-CG 4.12Å; L125-V180 HydrophobicContact CD1-CG1 4.1Å; L125-L304 HydrophobicContact CD2-CD1 4.01Å
126	Q	95.6	Very high	96	Very high	55 Å²	55	32.7 Å²	32.7	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-63.7	-41.4	175	-69.4	-176.7	-66.7	0	0	112	K122 F123 A124 N130 Q131 C133	K122-Q126 VanDerWaalsContact O-CG 3.32Å; K122-Q126 WeakPolarHBondContact O-CG 3.31Å; K122-Q126 PolarHBondContact O-N 3.41Å; F123-Q126 PolarHBondContact O-N 2.87Å; A124-Q126 VanDerWaalsContact C-N 3.34Å; A124-Q126 PolarHBondContact O-N 3.35Å; Q126-N130 WeakPolarHBondContact O-CA 3.5Å; Q126-N130 PolarHBondContact O-N 3.21Å; Q126-Q131 WeakPolarHBondContact CG-O 3.38Å; Q126-C133 HydrophobicContact CG-CB 3.91Å
127	L	95.4	Very high	95.8	Very high	101 Å²	101	36.9 Å²	36.9	53%	0.529	19%	0.189	S	C	.	.	H	α-helix	trans	-65.3	-42.1	176.2	-75.4	168.5	0	0	0	112	F123 A124 W297 V312 P315	F123-L127 WeakPolarHBondContact O-CB 3.22Å; F123-L127 WeakPolarHBondContact O-CG 3.44Å; F123-L127 PolarHBondContact O-N 3.26Å; A124-L127 PolarHBondContact O-N 3.13Å; L127-W297 HydrophobicContact CB-CH2 4.26Å; L127-W297 HydrophobicContact CD1-CH2 4.15Å; L127-W297 HydrophobicContact CD1-CZ2 4.29Å; L127-V312 HydrophobicContact CD1-CG1 4.27Å; L127-P315 HydrophobicContact CD1-CG 3.74Å
128	L	96.2	Very high	95.8	Very high	33 Å²	33	36.5 Å²	36.5	17%	0.173	18%	0.182	C	C	.	.	H	α-helix	trans	-69.8	-37.7	-176.7	-70.4	167	0	0	0	113	A124 L125 W297 L300 L304 I306 P309	A124-L128 VanDerWaalsContact O-CG 3.23Å; A124-L128 WeakPolarHBondContact O-CG 3.36Å; A124-L128 PolarHBondContact O-N 2.86Å; L125-L128 PolarHBondContact O-N 2.82Å; L128-W297 HydrophobicContact CD1-CE3 4.15Å; L128-W297 HydrophobicContact CD1-CZ3 3.61Å; L128-W297 HydrophobicContact CD2-CE3 4.12Å; L128-W297 HydrophobicContact CD2-CH2 4.46Å; L128-W297 HydrophobicContact CD2-CZ3 3.79Å; L128-W297 HydrophobicContact CG-CE3 4.33Å; L128-W297 HydrophobicContact CG-CH2 4.27Å; L128-W297 HydrophobicContact CG-CZ3 3.6Å; L128-L300 HydrophobicContact CD1-CD2 3.91Å; L128-L300 HydrophobicContact CD1-CG 4.22Å; L128-L304 HydrophobicContact CD1-CD1 3.94Å; L128-I306 HydrophobicContact CB-CD1 3.8Å; L128-I306 HydrophobicContact CD1-CD1 3.88Å; L128-I306 HydrophobicContact CD2-CD1 3.68Å; L128-I306 HydrophobicContact CG-CD1 3.97Å; L128-P309 HydrophobicContact CD2-CG 3.48Å; L128-P309 VanDerWaalsContact CD2-CG 3.48Å
129	Y	95	Very high	95.8	Very high	59 Å²	59	36.3 Å²	36.3	23%	0.231	18%	0.181	C	C	.	.	H	α-helix	trans	-113.2	-8.1	-172.4	-70.9	-76.5	0	0	0	115	F107 L125 Q131 F178 L304 I306	F107-Y129 HydrophobicContact CE1-CE2 4.43Å; F107-Y129 AromaticContact CE1-CZ 3.89Å; F107-Y129 WeakPolarHBondContact CE1-OH 3.14Å; L125-Y129 HydrophobicContact CD2-CE2 4.42Å; L125-Y129 PolarHBondContact O-N 3.07Å; Y129-Q131 WeakPolarHBondContact O-CG 3.12Å; Y129-Q131 PolarHBondContact O-N 3.48Å; Y129-F178 VanDerWaalsContact CB-CZ 3.41Å; Y129-F178 HydrophobicContact CD1-CZ 4.32Å; Y129-F178 AromaticContact CD2-CE1 3.64Å; Y129-F178 HydrophobicContact CD2-CE1 3.64Å; Y129-F178 HydrophobicContact CD2-CE2 4.15Å; Y129-F178 AromaticContact CD2-CZ 3.31Å; Y129-F178 HydrophobicContact CD2-CZ 3.31Å; Y129-F178 HydrophobicContact CE2-CE1 4.01Å; Y129-F178 HydrophobicContact CE2-CZ 4.14Å; Y129-F178 HydrophobicContact CG-CE1 4.07Å; Y129-F178 HydrophobicContact CG-CE2 4.3Å; Y129-F178 AromaticContact CG-CZ 3.42Å; Y129-F178 HydrophobicContact CG-CZ 3.42Å; Y129-F178 VanDerWaalsContact CG-CZ 3.42Å; Y129-L304 HydrophobicContact CE2-CD1 3.98Å; Y129-I306 HydrophobicContact CE2-CD1 4.29Å
130	N	93.9	Very high	95.8	Very high	155 Å²	155	37.6 Å²	37.6	83%	0.829	19%	0.187	S	C	*	.	S	Bend	trans	50.6	41.5	-172	-165.9	37	0	0	0	112.6	Q126	Q126-N130 WeakPolarHBondContact O-CA 3.5Å; Q126-N130 PolarHBondContact O-N 3.21Å
131	Q	93.7	Very high	95.6	Very high	66 Å²	66	41.1 Å²	41.1	31%	0.308	20%	0.2	S	C	.	.	S	Bend	trans	-136.1	154.3	-175.3	-79.9	177	-13.6	0	0	111.2	Q126 Y129 F178	Q126-Q131 WeakPolarHBondContact CG-O 3.38Å; Y129-Q131 WeakPolarHBondContact O-CG 3.12Å; Y129-Q131 PolarHBondContact O-N 3.48Å; Q131-F178 HydrophobicContact CB-CE2 3.73Å; Q131-F178 HydrophobicContact CB-CZ 4.16Å
132	S	92.8	Very high	95.4	Very high	59 Å²	59	46.8 Å²	46.8	41%	0.413	23%	0.226	S	C	.	.			trans	-66.7	135.8	-177.2	-65.5	0	0	0	0	112.9	C176 R177 F178	S132-C176 WeakPolarHBondContact O-CA 3.41Å; S132-R177 PolarHBondContact O-N 3.3Å; S132-F178 WeakPolarHBondContact O-CD2 3.04Å
133	C	96.5	Very high	95.3	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124	172.3	177.9	0	0	0	0	109.4	K122 Q126 F178	K122-C133 HydrophobicContact CB-CB 4.46Å; K122-C133 HydrophobicContact CG-CB 3.76Å; K122-C133 PolarHBondContact NZ-O 2.94Å; Q126-C133 HydrophobicContact CG-CB 3.91Å; C133-F178 CarbonylContact C-O 3.53Å; C133-F178 VanDerWaalsContact CA-O 3.3Å; C133-F178 WeakPolarHBondContact CA-O 3.39Å; C133-F178 HydrophobicContact CB-CB 3.97Å; C133-F178 HydrophobicContact CB-CD2 3.94Å; C133-F178 HydrophobicContact CB-CG 4.45Å
134	Y	97.9	Very high	95.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	134.2	179	-161.8	-85.4	0	0	0	111.5	I139 Y143 H147 W151 I172 F173 F178 V180	Y134-I139 HydrophobicContact CE1-CD1 3.85Å; Y134-I139 HydrophobicContact CE1-CG1 3.91Å; Y134-Y143 HydrophobicContact CD2-CE2 4.12Å; Y134-Y143 HydrophobicContact CE2-CD2 4.14Å; Y134-Y143 AromaticContact CE2-CE2 3.71Å; Y134-Y143 HydrophobicContact CE2-CE2 3.71Å; Y134-H147 AromaticContact CE2-CE1 3.94Å; Y134-H147 AromaticContact CE2-ND1 3.54Å; Y134-H147 AromaticContact CZ-ND1 3.69Å; Y134-H147 PolarHBondContact OH-ND1 3.32Å; Y134-W151 AromaticContact CE1-CZ2 3.93Å; Y134-W151 HydrophobicContact CE1-CZ2 3.93Å; Y134-W151 AromaticContact CE1-NE1 3.58Å; Y134-W151 AromaticContact CZ-NE1 3.64Å; Y134-W151 PolarHBondContact OH-NE1 2.81Å; Y134-I172 HydrophobicContact CE1-CG2 4.14Å; Y134-I172 HydrophobicContact CE2-CG2 3.88Å; Y134-I172 VanDerWaalsContact CE2-O 3.23Å; Y134-I172 WeakPolarHBondContact CE2-O 3.29Å; Y134-I172 WeakPolarHBondContact OH-CG2 3.4Å; Y134-F173 HydrophobicContact CD1-CD1 4.23Å; Y134-F173 HydrophobicContact CD1-CE1 4.04Å; Y134-F173 HydrophobicContact CD2-CD1 4.06Å; Y134-F173 HydrophobicContact CE1-CE1 4.5Å; Y134-F173 AromaticContact CG-CD1 3.84Å; Y134-F173 HydrophobicContact CG-CD1 3.84Å; Y134-F173 HydrophobicContact CG-CE1 4.11Å; Y134-F178 PolarHBondContact N-O 2.71Å; Y134-V180 PolarHBondContact O-N 3.13Å; Y134-V180 VanDerWaalsContact O-O 3.08Å
135	H	97.4	Very high	95.2	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.028	25%	0.249	C	C	.	.			trans	-153.2	158	-179.8	-172.5	-55	0	0	0	110.5	T118 T119 K122 Y137 D138 I139 V180 D181	T118-H135 PolarHBondContact OG1-NE2 3.11Å; T119-H135 WeakPolarHBondContact CA-NE2 3.39Å; T119-H135 PolarHBondContact N-NE2 2.92Å; T119-H135 PolarHBondContact OG1-NE2 3.05Å; T119-H135 VanDerWaalsContact OG1-NE2 3.1Å; K122-H135 HydrophobicContact CD-CB 3.83Å; K122-H135 HydrophobicContact CG-CB 4.39Å; H135-Y137 PolarHBondContact ND1-N 3.15Å; H135-Y137 PolarHBondContact O-N 3.44Å; H135-D138 WeakPolarHBondContact CB-OD2 3.35Å; H135-D138 PolarHBondContact N-OD2 3.08Å; H135-D138 WeakPolarHBondContact O-CB 3.46Å; H135-D138 PolarHBondContact O-N 3.13Å; H135-I139 PolarHBondContact O-N 3.04Å; H135-V180 WeakPolarHBondContact CA-O 3.31Å; H135-V180 HydrophobicContact CB-CG2 4.45Å; H135-D181 IonicContact CE1-OD2 2.65Å; H135-D181 PolarHBondContact CE1-OD2 3.32Å; H135-D181 IonicContact ND1-OD2 2.73Å; H135-D181 PolarHBondContact ND1-OD2 3.34Å; H135-D181 VanDerWaalsContact ND1-OD2 3.1Å; H135-D181 IonicContact NE2-OD2 2.99Å
136	M	95.9	Very high	95.2	Very high	22 Å²	22	55.3 Å²	55.3	11%	0.108	27%	0.271	C	S	.	.	H	α-helix	trans	-46.5	-32.3	169.1	-176.5	54.4	67.5	0	0	114.3	D138 I139 I140 D181 Y182 P183 M251	M136-D138 VanDerWaalsContact C-N 3.31Å; M136-D138 PolarHBondContact O-N 3.17Å; M136-I139 HydrophobicContact CE-CD1 4.43Å; M136-I139 PolarHBondContact O-N 3.13Å; M136-I139 HydrophobicContact SD-CB 4.3Å; M136-I139 HydrophobicContact SD-CD1 4.33Å; M136-I140 HydrophobicContact CG-CD1 3.77Å; M136-I140 HydrophobicContact CG-CG1 4.27Å; M136-I140 WeakPolarHBondContact O-CG1 3.38Å; M136-I140 PolarHBondContact O-N 3.36Å; M136-I140 HydrophobicContact SD-CD1 3.95Å; M136-I140 HydrophobicContact SD-CG1 3.96Å; M136-D181 WeakPolarHBondContact CB-OD2 3.35Å; M136-Y182 WeakPolarHBondContact CA-O 3.5Å; M136-Y182 WeakPolarHBondContact CB-O 3.37Å; M136-Y182 PolarHBondContact N-O 3.28Å; M136-Y182 VanDerWaalsContact N-O 3.12Å; M136-P183 HydrophobicContact CE-CG 4.18Å; M136-M251 HydrophobicContact CE-CE 3.45Å; M136-M251 VanDerWaalsContact CE-CE 3.45Å; M136-M251 HydrophobicContact CE-SD 3.29Å; M136-M251 WeakPolarHBondContact CE-SD 3.44Å
137	Y	93	Very high	95.3	Very high	92 Å²	92	53.5 Å²	53.5	36%	0.361	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-44.4	176	-178.6	-86.4	0	0	0	111.2	H135 I139 I140 Y141 H142	H135-Y137 PolarHBondContact ND1-N 3.15Å; H135-Y137 PolarHBondContact O-N 3.44Å; Y137-I139 VanDerWaalsContact C-N 3.32Å; Y137-I139 PolarHBondContact O-N 3.38Å; Y137-I140 PolarHBondContact O-N 2.85Å; Y137-Y141 HydrophobicContact CD1-CD2 4.07Å; Y137-Y141 AromaticContact CD2-CD2 3.38Å; Y137-Y141 HydrophobicContact CD2-CD2 3.38Å; Y137-Y141 AromaticContact CD2-CE2 3.49Å; Y137-Y141 HydrophobicContact CD2-CE2 3.49Å; Y137-Y141 VanDerWaalsContact CD2-CE2 3.49Å; Y137-Y141 AromaticContact CE1-CD2 3.98Å; Y137-Y141 HydrophobicContact CE1-CD2 3.98Å; Y137-Y141 HydrophobicContact CE1-CG 4.43Å; Y137-Y141 AromaticContact CE2-CD2 3.27Å; Y137-Y141 HydrophobicContact CE2-CD2 3.27Å; Y137-Y141 AromaticContact CE2-CE2 3.4Å; Y137-Y141 HydrophobicContact CE2-CE2 3.4Å; Y137-Y141 HydrophobicContact CE2-CG 4.2Å; Y137-Y141 AromaticContact CG-CD2 3.78Å; Y137-Y141 HydrophobicContact CG-CD2 3.78Å; Y137-Y141 HydrophobicContact CG-CE2 4.3Å; Y137-Y141 AromaticContact CZ-CD2 3.59Å; Y137-Y141 WeakPolarHBondContact O-CB 3.41Å; Y137-Y141 VanDerWaalsContact O-CD2 3.27Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.43Å; Y137-Y141 PolarHBondContact O-N 3.01Å; Y137-H142 AromaticContact CE1-NE2 3.78Å
138	D	95.1	Very high	95.4	Very high	15 Å²	15	48.7 Å²	48.7	8%	0.08	24%	0.238	C	C	.	.	H	α-helix	trans	-68.5	-35.4	-179.7	-46.5	-64.8	0	0	0	111.2	K122 H135 M136 H142 Y143	K122-D138 IonicContact NZ-OD1 3.28Å; K122-D138 PolarHBondContact NZ-OD1 3.1Å; K122-D138 IonicContact NZ-OD2 2.72Å; K122-D138 PolarHBondContact NZ-OD2 2.88Å; H135-D138 WeakPolarHBondContact CB-OD2 3.35Å; H135-D138 PolarHBondContact N-OD2 3.08Å; H135-D138 WeakPolarHBondContact O-CB 3.46Å; H135-D138 PolarHBondContact O-N 3.13Å; M136-D138 VanDerWaalsContact C-N 3.31Å; M136-D138 PolarHBondContact O-N 3.17Å; D138-H142 CarbonylContact O-C 3.6Å; D138-H142 WeakPolarHBondContact O-CA 3.21Å; D138-H142 WeakPolarHBondContact O-CB 3.27Å; D138-H142 PolarHBondContact O-N 3.27Å; D138-H142 IonicContact OD1-CD2 2.94Å; D138-Y143 HydrophobicContact CB-CD2 3.85Å; D138-Y143 HydrophobicContact CB-CE2 3.54Å; D138-Y143 WeakPolarHBondContact O-CD2 3.45Å; D138-Y143 PolarHBondContact O-N 2.88Å
139	I	96.8	Very high	95.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-61.5	-48.4	172.9	-56.2	177.4	0	0	0	110.2	Y134 H135 M136 Y137 Q144 H147 I148 P183	Y134-I139 HydrophobicContact CE1-CD1 3.85Å; Y134-I139 HydrophobicContact CE1-CG1 3.91Å; H135-I139 PolarHBondContact O-N 3.04Å; M136-I139 HydrophobicContact CE-CD1 4.43Å; M136-I139 PolarHBondContact O-N 3.13Å; M136-I139 HydrophobicContact SD-CB 4.3Å; M136-I139 HydrophobicContact SD-CD1 4.33Å; Y137-I139 VanDerWaalsContact C-N 3.32Å; Y137-I139 PolarHBondContact O-N 3.38Å; I139-Q144 WeakPolarHBondContact O-CA 3.16Å; I139-Q144 PolarHBondContact O-N 2.76Å; I139-H147 HydrophobicContact CG2-CB 4.47Å; I139-I148 HydrophobicContact CG2-CD1 4.33Å; I139-I148 HydrophobicContact CG2-CG1 3.56Å; I139-P183 HydrophobicContact CD1-CG 4.02Å
140	I	94	Very high	95.7	Very high	37 Å²	37	50 Å²	50	19%	0.19	24%	0.244	C	C	.	.	I	π-helix	trans	-71.2	-38.4	-175	-68	173	0	0	0	112	M136 Y137 L241 L244	M136-I140 HydrophobicContact CG-CD1 3.77Å; M136-I140 HydrophobicContact CG-CG1 4.27Å; M136-I140 WeakPolarHBondContact O-CG1 3.38Å; M136-I140 PolarHBondContact O-N 3.36Å; M136-I140 HydrophobicContact SD-CD1 3.95Å; M136-I140 HydrophobicContact SD-CG1 3.96Å; Y137-I140 PolarHBondContact O-N 2.85Å; I140-L241 HydrophobicContact CG2-CD1 4.14Å; I140-L244 HydrophobicContact CG1-CD2 4.48Å
141	Y	92	Very high	95.9	Very high	80 Å²	80	42.7 Å²	42.7	31%	0.314	21%	0.205	S	C	.	.	I	π-helix	trans	-106.3	-20.8	-167.6	-65.9	-68.9	0	0	0	114.8	Y137 R326	Y137-Y141 HydrophobicContact CD1-CD2 4.07Å; Y137-Y141 AromaticContact CD2-CD2 3.38Å; Y137-Y141 HydrophobicContact CD2-CD2 3.38Å; Y137-Y141 AromaticContact CD2-CE2 3.49Å; Y137-Y141 HydrophobicContact CD2-CE2 3.49Å; Y137-Y141 VanDerWaalsContact CD2-CE2 3.49Å; Y137-Y141 AromaticContact CE1-CD2 3.98Å; Y137-Y141 HydrophobicContact CE1-CD2 3.98Å; Y137-Y141 HydrophobicContact CE1-CG 4.43Å; Y137-Y141 AromaticContact CE2-CD2 3.27Å; Y137-Y141 HydrophobicContact CE2-CD2 3.27Å; Y137-Y141 AromaticContact CE2-CE2 3.4Å; Y137-Y141 HydrophobicContact CE2-CE2 3.4Å; Y137-Y141 HydrophobicContact CE2-CG 4.2Å; Y137-Y141 AromaticContact CG-CD2 3.78Å; Y137-Y141 HydrophobicContact CG-CD2 3.78Å; Y137-Y141 HydrophobicContact CG-CE2 4.3Å; Y137-Y141 AromaticContact CZ-CD2 3.59Å; Y137-Y141 WeakPolarHBondContact O-CB 3.41Å; Y137-Y141 VanDerWaalsContact O-CD2 3.27Å; Y137-Y141 WeakPolarHBondContact O-CD2 3.43Å; Y137-Y141 PolarHBondContact O-N 3.01Å; Y141-R326 PolarHBondContact OH-NH1 3.26Å
142	H	93.3	Very high	96.1	Very high	119 Å²	119	40 Å²	40	55%	0.551	19%	0.193	S	C	*	.	I	π-helix	trans	-119.5	-53	-175.3	-57.7	-48.7	0	0	0	112.6	Y137 D138	Y137-H142 AromaticContact CE1-NE2 3.78Å; D138-H142 CarbonylContact O-C 3.6Å; D138-H142 WeakPolarHBondContact O-CA 3.21Å; D138-H142 WeakPolarHBondContact O-CB 3.27Å; D138-H142 PolarHBondContact O-N 3.27Å; D138-H142 IonicContact OD1-CD2 2.94Å
143	Y	95.4	Very high	96.4	Very high	81 Å²	81	41.2 Å²	41.2	32%	0.318	20%	0.195	S	C	.	.	I	π-helix	trans	-89.6	-32.5	-173.4	-54.9	-57.9	0	0	0	114.4	Y134 D138 S146 H147	Y134-Y143 HydrophobicContact CD2-CE2 4.12Å; Y134-Y143 HydrophobicContact CE2-CD2 4.14Å; Y134-Y143 AromaticContact CE2-CE2 3.71Å; Y134-Y143 HydrophobicContact CE2-CE2 3.71Å; D138-Y143 HydrophobicContact CB-CD2 3.85Å; D138-Y143 HydrophobicContact CB-CE2 3.54Å; D138-Y143 WeakPolarHBondContact O-CD2 3.45Å; D138-Y143 PolarHBondContact O-N 2.88Å; Y143-S146 PolarHBondContact O-OG 3Å; Y143-H147 AromaticContact CD1-CE1 3.54Å; Y143-H147 AromaticContact CD1-ND1 3.81Å; Y143-H147 AromaticContact CD1-NE2 3.82Å; Y143-H147 AromaticContact CD2-CE1 3.65Å; Y143-H147 AromaticContact CD2-CG 3.95Å; Y143-H147 AromaticContact CD2-ND1 3.19Å; Y143-H147 WeakPolarHBondContact CD2-ND1 3.38Å; Y143-H147 AromaticContact CE1-CE1 3.78Å; Y143-H147 AromaticContact CE2-CE1 3.86Å; Y143-H147 AromaticContact CE2-ND1 3.74Å; Y143-H147 HydrophobicContact CG-CB 4.31Å; Y143-H147 AromaticContact CG-CE1 3.48Å; Y143-H147 VanDerWaalsContact CG-CE1 3.48Å; Y143-H147 AromaticContact CG-CG 3.62Å; Y143-H147 AromaticContact CG-ND1 3.23Å; Y143-H147 AromaticContact CG-NE2 3.95Å; Y143-H147 AromaticContact CZ-CE1 3.94Å
144	Q	95.3	Very high	96.5	Very high	79 Å²	79	41.3 Å²	41.3	37%	0.369	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	-140	176.7	-59.1	178.8	-8.6	0	0	112.6	I139 S146 H147 I148 L241	I139-Q144 WeakPolarHBondContact O-CA 3.16Å; I139-Q144 PolarHBondContact O-N 2.76Å; Q144-S146 PolarHBondContact O-N 3.02Å; Q144-H147 PolarHBondContact O-N 3.14Å; Q144-I148 WeakPolarHBondContact O-CG1 3.48Å; Q144-I148 PolarHBondContact O-N 3Å; Q144-I148 VanDerWaalsContact O-N 3.16Å; Q144-L241 HydrophobicContact CB-CD2 4.26Å; Q144-L241 HydrophobicContact CG-CD2 4.43Å
145	E	96.9	Very high	96.5	Very high	33 Å²	33	41.5 Å²	41.5	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-51.2	-34.3	-174.3	-164.9	62.2	-164.1	0	0	113.9	H147 I148 Q149 G240 K242 S243	E145-H147 PolarHBondContact O-N 3.27Å; E145-I148 PolarHBondContact O-N 2.83Å; E145-Q149 HydrophobicContact CG-CG 4.35Å; E145-Q149 WeakPolarHBondContact O-CG 3.17Å; E145-Q149 PolarHBondContact O-N 2.85Å; E145-Q149 PolarHBondContact OE1-NE2 3.01Å; E145-G240 WeakPolarHBondContact CB-O 3.49Å; E145-G240 PolarHBondContact N-O 2.9Å; E145-G240 VanDerWaalsContact N-O 3.11Å; E145-K242 VanDerWaalsContact CD-CG 3.41Å; E145-K242 HydrophobicContact CG-CG 4.36Å; E145-K242 WeakPolarHBondContact OE1-CE 3.29Å; E145-K242 WeakPolarHBondContact OE1-CG 3.43Å; E145-K242 WeakPolarHBondContact OE2-CG 3.41Å; E145-K242 PolarHBondContact OE2-N 3.43Å; E145-S243 VanDerWaalsContact OE1-CB 3.28Å; E145-S243 WeakPolarHBondContact OE1-CB 3.01Å; E145-S243 PolarHBondContact OE1-OG 3.29Å; E145-S243 PolarHBondContact OE2-N 3.28Å
146	S	96.9	Very high	96.5	Very high	68 Å²	68	44.4 Å²	44.4	48%	0.476	21%	0.211	S	C	.	.	H	α-helix	trans	-59.5	-49.1	-177.7	68.6	0	0	0	0	112.2	Y143 Q144 K150	Y143-S146 PolarHBondContact O-OG 3Å; Q144-S146 PolarHBondContact O-N 3.02Å; S146-K150 WeakPolarHBondContact O-CG 3.49Å; S146-K150 PolarHBondContact O-N 2.99Å
147	H	97.8	Very high	96.6	Very high	17 Å²	17	45.6 Å²	45.6	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-78.6	-29.9	178.6	-80	-152.2	0	0	0	111.8	Y134 I139 Y143 Q144 E145 Q149 K150 W151 I172	Y134-H147 AromaticContact CE2-CE1 3.94Å; Y134-H147 AromaticContact CE2-ND1 3.54Å; Y134-H147 AromaticContact CZ-ND1 3.69Å; Y134-H147 PolarHBondContact OH-ND1 3.32Å; I139-H147 HydrophobicContact CG2-CB 4.47Å; Y143-H147 AromaticContact CD1-CE1 3.54Å; Y143-H147 AromaticContact CD1-ND1 3.81Å; Y143-H147 AromaticContact CD1-NE2 3.82Å; Y143-H147 AromaticContact CD2-CE1 3.65Å; Y143-H147 AromaticContact CD2-CG 3.95Å; Y143-H147 AromaticContact CD2-ND1 3.19Å; Y143-H147 WeakPolarHBondContact CD2-ND1 3.38Å; Y143-H147 AromaticContact CE1-CE1 3.78Å; Y143-H147 AromaticContact CE2-CE1 3.86Å; Y143-H147 AromaticContact CE2-ND1 3.74Å; Y143-H147 HydrophobicContact CG-CB 4.31Å; Y143-H147 AromaticContact CG-CE1 3.48Å; Y143-H147 VanDerWaalsContact CG-CE1 3.48Å; Y143-H147 AromaticContact CG-CG 3.62Å; Y143-H147 AromaticContact CG-ND1 3.23Å; Y143-H147 AromaticContact CG-NE2 3.95Å; Y143-H147 AromaticContact CZ-CE1 3.94Å; Q144-H147 PolarHBondContact O-N 3.14Å; E145-H147 PolarHBondContact O-N 3.27Å; H147-Q149 VanDerWaalsContact C-N 3.3Å; H147-Q149 PolarHBondContact O-N 3.04Å; H147-K150 PolarHBondContact O-N 2.92Å; H147-W151 PolarHBondContact O-N 3.07Å; H147-I172 PolarHBondContact CE1-O 3.11Å
148	I	98.4	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-46	173.5	-68.4	171.5	0	0	0	110.5	I139 Q144 E145 W151 I152 L241 L244 L247	I139-I148 HydrophobicContact CG2-CD1 4.33Å; I139-I148 HydrophobicContact CG2-CG1 3.56Å; Q144-I148 WeakPolarHBondContact O-CG1 3.48Å; Q144-I148 PolarHBondContact O-N 3Å; Q144-I148 VanDerWaalsContact O-N 3.16Å; E145-I148 PolarHBondContact O-N 2.83Å; I148-W151 PolarHBondContact O-N 2.78Å; I148-I152 HydrophobicContact CG2-CD1 3.88Å; I148-I152 WeakPolarHBondContact O-CG1 3.33Å; I148-I152 PolarHBondContact O-N 3.28Å; I148-L241 HydrophobicContact CD1-CD2 3.57Å; I148-L244 HydrophobicContact CD1-CB 4.11Å; I148-L244 HydrophobicContact CD1-CD1 4.26Å; I148-L247 HydrophobicContact CB-CD2 4.3Å; I148-L247 HydrophobicContact CG1-CD2 3.99Å; I148-L247 HydrophobicContact CG2-CB 4.07Å; I148-L247 HydrophobicContact CG2-CD2 4.14Å
149	Q	98.3	Very high	96.7	Very high	66 Å²	66	47.5 Å²	47.5	31%	0.308	23%	0.229	S	C	.	.	H	α-helix	trans	-66.2	-41.3	178	-67.7	-61	-31.2	0	0	112.5	E145 H147 W151 I152 N153 S243	E145-Q149 HydrophobicContact CG-CG 4.35Å; E145-Q149 WeakPolarHBondContact O-CG 3.17Å; E145-Q149 PolarHBondContact O-N 2.85Å; E145-Q149 PolarHBondContact OE1-NE2 3.01Å; H147-Q149 VanDerWaalsContact C-N 3.3Å; H147-Q149 PolarHBondContact O-N 3.04Å; Q149-W151 VanDerWaalsContact C-N 3.32Å; Q149-W151 PolarHBondContact O-N 3.07Å; Q149-I152 PolarHBondContact O-N 3.46Å; Q149-N153 VanDerWaalsContact O-CG 3.3Å; Q149-N153 PolarHBondContact O-N 2.65Å; Q149-N153 PolarHBondContact O-ND2 3.43Å; Q149-S243 PolarHBondContact NE2-OG 3.42Å
150	K	98.2	Very high	96.7	Very high	54 Å²	54	54.8 Å²	54.8	24%	0.235	26%	0.261	C	S	.	.	H	α-helix	trans	-56.2	-46.8	173.9	-70.4	177.3	176.6	-169.8	0	111.4	S146 H147 N153 L154 D171 I172	S146-K150 WeakPolarHBondContact O-CG 3.49Å; S146-K150 PolarHBondContact O-N 2.99Å; H147-K150 PolarHBondContact O-N 2.92Å; K150-N153 WeakPolarHBondContact O-CB 3.49Å; K150-N153 PolarHBondContact O-N 2.73Å; K150-L154 PolarHBondContact O-N 2.66Å; K150-L154 VanDerWaalsContact O-N 3.07Å; K150-D171 WeakPolarHBondContact CD-OD2 3.41Å; K150-D171 WeakPolarHBondContact CE-OD1 3.26Å; K150-D171 WeakPolarHBondContact CE-OD2 3.34Å; K150-D171 PolarHBondContact NZ-O 2.92Å; K150-D171 IonicContact NZ-OD1 3.1Å; K150-D171 PolarHBondContact NZ-OD1 2.53Å; K150-D171 IonicContact NZ-OD2 3.13Å; K150-D171 PolarHBondContact NZ-OD2 3.23Å; K150-D171 VanDerWaalsContact NZ-OD2 3.1Å; K150-I172 HydrophobicContact CB-CD1 4.15Å; K150-I172 HydrophobicContact CB-CG1 4.02Å; K150-I172 HydrophobicContact CD-CG1 4.25Å
151	W	98.5	Very high	96.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-44.2	176.9	-80.4	112.8	0	0	0	112.9	Y134 H147 I148 Q149 N153 L154 F155 W169 I172 F173 P183 F187 L247	Y134-W151 AromaticContact CE1-CZ2 3.93Å; Y134-W151 HydrophobicContact CE1-CZ2 3.93Å; Y134-W151 AromaticContact CE1-NE1 3.58Å; Y134-W151 AromaticContact CZ-NE1 3.64Å; Y134-W151 PolarHBondContact OH-NE1 2.81Å; H147-W151 PolarHBondContact O-N 3.07Å; I148-W151 PolarHBondContact O-N 2.78Å; Q149-W151 VanDerWaalsContact C-N 3.32Å; Q149-W151 PolarHBondContact O-N 3.07Å; W151-N153 PolarHBondContact O-N 2.93Å; W151-L154 HydrophobicContact CE3-CD1 4.07Å; W151-L154 HydrophobicContact CZ3-CD1 4.09Å; W151-L154 WeakPolarHBondContact O-CB 3.34Å; W151-L154 PolarHBondContact O-N 3.25Å; W151-F155 WeakPolarHBondContact O-CD2 3.38Å; W151-F155 PolarHBondContact O-N 3.29Å; W151-W169 HydrophobicContact CH2-CZ3 4.16Å; W151-W169 AromaticContact CZ3-CZ3 3.92Å; W151-W169 HydrophobicContact CZ3-CZ3 3.92Å; W151-I172 HydrophobicContact CD2-CD1 3.81Å; W151-I172 HydrophobicContact CE3-CD1 4.11Å; W151-I172 HydrophobicContact CG-CD1 4.22Å; W151-I172 HydrophobicContact CH2-CD1 4.48Å; W151-I172 HydrophobicContact CH2-CG2 4.49Å; W151-I172 HydrophobicContact CZ2-CD1 4.21Å; W151-I172 HydrophobicContact CZ2-CG2 3.64Å; W151-I172 HydrophobicContact CZ3-CD1 4.43Å; W151-F173 HydrophobicContact CH2-CE1 4.38Å; W151-F173 HydrophobicContact CH2-CZ 4.04Å; W151-F173 HydrophobicContact CZ2-CE1 4.1Å; W151-F173 HydrophobicContact CZ2-CZ 4.21Å; W151-P183 HydrophobicContact CB-CG 4.27Å; W151-P183 HydrophobicContact CD2-CB 3.72Å; W151-P183 HydrophobicContact CD2-CG 3.59Å; W151-P183 HydrophobicContact CE3-CB 3.67Å; W151-P183 HydrophobicContact CE3-CG 4.09Å; W151-P183 HydrophobicContact CG-CB 4.26Å; W151-P183 HydrophobicContact CG-CG 3.68Å; W151-P183 HydrophobicContact CH2-CB 4.23Å; W151-P183 HydrophobicContact CZ2-CB 4.27Å; W151-P183 HydrophobicContact CZ2-CG 4.35Å; W151-P183 HydrophobicContact CZ3-CB 3.94Å; W151-F187 HydrophobicContact CE3-CD2 4.4Å; W151-F187 HydrophobicContact CE3-CE2 4.18Å; W151-F187 AromaticContact CZ3-CD2 3.69Å; W151-F187 HydrophobicContact CZ3-CD2 3.69Å; W151-F187 AromaticContact CZ3-CE2 3.92Å; W151-F187 HydrophobicContact CZ3-CE2 3.92Å; W151-L247 HydrophobicContact CB-CD1 3.61Å; W151-L247 HydrophobicContact CB-CD2 4.42Å; W151-L247 HydrophobicContact CG-CD1 4.49Å
152	I	98.3	Very high	96.7	Very high	11 Å²	11	62.9 Å²	62.9	6%	0.056	30%	0.299	C	S	.	.	H	α-helix	trans	-56.7	-41.3	175.3	-71.8	169	0	0	0	110.7	I148 Q149 L154 F155 N156 I246 L247	I148-I152 HydrophobicContact CG2-CD1 3.88Å; I148-I152 WeakPolarHBondContact O-CG1 3.33Å; I148-I152 PolarHBondContact O-N 3.28Å; Q149-I152 PolarHBondContact O-N 3.46Å; I152-L154 PolarHBondContact O-N 3.39Å; I152-F155 PolarHBondContact O-N 2.95Å; I152-N156 WeakPolarHBondContact O-CB 3.42Å; I152-N156 PolarHBondContact O-N 3.04Å; I152-N156 PolarHBondContact O-ND2 2.91Å; I152-I246 HydrophobicContact CD1-CB 4.07Å; I152-I246 HydrophobicContact CD1-CG2 3.94Å; I152-I246 HydrophobicContact CG1-CG2 4.29Å; I152-L247 HydrophobicContact CD1-CB 4.43Å; I152-L247 HydrophobicContact CG1-CB 4.22Å; I152-L247 HydrophobicContact CG1-CD1 4.45Å
153	N	98.1	Very high	96.7	Very high	84 Å²	84	63.6 Å²	63.6	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-61.8	-43	175.2	-70.2	-20.5	0	0	0	112	Q149 K150 W151 N156 M157	Q149-N153 VanDerWaalsContact O-CG 3.3Å; Q149-N153 PolarHBondContact O-N 2.65Å; Q149-N153 PolarHBondContact O-ND2 3.43Å; K150-N153 WeakPolarHBondContact O-CB 3.49Å; K150-N153 PolarHBondContact O-N 2.73Å; W151-N153 PolarHBondContact O-N 2.93Å; N153-N156 WeakPolarHBondContact O-CB 3.5Å; N153-N156 PolarHBondContact O-N 3.42Å; N153-M157 WeakPolarHBondContact O-CG 3.24Å; N153-M157 PolarHBondContact O-N 3.41Å
154	L	98.2	Very high	96.7	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-42.1	175.1	-69.4	-165.4	0	0	0	113	K150 W151 I152 N156 M157 N158 I164 H168 W169 I172	K150-L154 PolarHBondContact O-N 2.66Å; K150-L154 VanDerWaalsContact O-N 3.07Å; W151-L154 HydrophobicContact CE3-CD1 4.07Å; W151-L154 HydrophobicContact CZ3-CD1 4.09Å; W151-L154 WeakPolarHBondContact O-CB 3.34Å; W151-L154 PolarHBondContact O-N 3.25Å; I152-L154 PolarHBondContact O-N 3.39Å; L154-N156 VanDerWaalsContact C-N 3.3Å; L154-N156 PolarHBondContact O-N 3.23Å; L154-M157 HydrophobicContact CD2-SD 4.05Å; L154-M157 PolarHBondContact O-N 2.81Å; L154-N158 VanDerWaalsContact O-CB 3.31Å; L154-N158 WeakPolarHBondContact O-CB 3.44Å; L154-N158 PolarHBondContact O-N 2.85Å; L154-I164 HydrophobicContact CB-CD1 4.41Å; L154-I164 HydrophobicContact CD2-CD1 4.27Å; L154-I164 HydrophobicContact CD2-CG1 4.46Å; L154-I164 HydrophobicContact CD2-CG2 3.45Å; L154-I164 VanDerWaalsContact CD2-CG2 3.45Å; L154-H168 HydrophobicContact CD2-CB 3.79Å; L154-W169 HydrophobicContact CD1-CD2 4.43Å; L154-W169 HydrophobicContact CD1-CE3 3.72Å; L154-W169 HydrophobicContact CD1-CH2 3.84Å; L154-W169 HydrophobicContact CD1-CZ3 3.4Å; L154-I172 HydrophobicContact CD1-CD1 3.31Å; L154-I172 HydrophobicContact CG-CD1 4.03Å
155	F	98.1	Very high	96.7	Very high	3 Å²	3	62.3 Å²	62.3	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-41.1	173.1	-81.4	-77	0	0	0	111.7	W151 I152 N158 K159 P183 V186 F187 L247 N250 M251 K254	W151-F155 WeakPolarHBondContact O-CD2 3.38Å; W151-F155 PolarHBondContact O-N 3.29Å; I152-F155 PolarHBondContact O-N 2.95Å; F155-N158 PolarHBondContact O-N 3.06Å; F155-K159 WeakPolarHBondContact O-CB 3.43Å; F155-K159 VanDerWaalsContact O-CG 3.27Å; F155-K159 WeakPolarHBondContact O-CG 3.29Å; F155-K159 PolarHBondContact O-N 2.82Å; F155-P183 HydrophobicContact CE2-CB 3.94Å; F155-P183 HydrophobicContact CZ-CB 4.16Å; F155-V186 HydrophobicContact CE1-CG2 4.04Å; F155-V186 HydrophobicContact CZ-CG2 3.81Å; F155-F187 HydrophobicContact CD1-CE2 4.03Å; F155-F187 AromaticContact CD1-CZ 3.86Å; F155-F187 HydrophobicContact CD1-CZ 3.86Å; F155-F187 HydrophobicContact CD2-CE2 4.26Å; F155-F187 HydrophobicContact CD2-CZ 4.49Å; F155-F187 AromaticContact CE1-CE2 3.7Å; F155-F187 HydrophobicContact CE1-CE2 3.7Å; F155-F187 AromaticContact CE1-CZ 3.97Å; F155-F187 HydrophobicContact CE1-CZ 3.97Å; F155-F187 AromaticContact CE2-CE2 3.91Å; F155-F187 HydrophobicContact CE2-CE2 3.91Å; F155-F187 HydrophobicContact CG-CE2 4.29Å; F155-F187 HydrophobicContact CG-CZ 4.13Å; F155-F187 AromaticContact CZ-CE2 3.61Å; F155-F187 HydrophobicContact CZ-CE2 3.61Å; F155-F187 HydrophobicContact CZ-CZ 4.29Å; F155-L247 HydrophobicContact CD2-CD1 4Å; F155-L247 HydrophobicContact CE2-CD1 3.68Å; F155-N250 HydrophobicContact CB-CB 4.09Å; F155-N250 HydrophobicContact CD1-CB 3.82Å; F155-N250 HydrophobicContact CD2-CB 3.82Å; F155-N250 HydrophobicContact CE1-CB 4.13Å; F155-N250 WeakPolarHBondContact CE1-O 3.48Å; F155-N250 HydrophobicContact CE2-CB 4.18Å; F155-N250 HydrophobicContact CG-CB 3.66Å; F155-N250 HydrophobicContact CZ-CB 4.33Å; F155-M251 HydrophobicContact CE2-CG 3.97Å; F155-M251 HydrophobicContact CZ-CB 4.36Å; F155-M251 HydrophobicContact CZ-CG 3.7Å; F155-K254 HydrophobicContact CD1-CD 4.11Å; F155-K254 HydrophobicContact CE1-CB 3.89Å; F155-K254 HydrophobicContact CE1-CD 3.62Å; F155-K254 HydrophobicContact CE1-CG 4.39Å
156	N	97.8	Very high	96.6	Very high	67 Å²	67	64.3 Å²	64.3	36%	0.358	31%	0.313	S	S	.	.	H	α-helix	trans	-66	-40.3	177.1	-70.8	-24.9	0	0	0	112.4	I152 N153 L154 K160	I152-N156 WeakPolarHBondContact O-CB 3.42Å; I152-N156 PolarHBondContact O-N 3.04Å; I152-N156 PolarHBondContact O-ND2 2.91Å; N153-N156 WeakPolarHBondContact O-CB 3.5Å; N153-N156 PolarHBondContact O-N 3.42Å; L154-N156 VanDerWaalsContact C-N 3.3Å; L154-N156 PolarHBondContact O-N 3.23Å; N156-K160 WeakPolarHBondContact O-CG 3.3Å; N156-K160 PolarHBondContact O-N 3.18Å
157	M	97.6	Very high	96.5	Very high	48 Å²	48	66.4 Å²	66.4	24%	0.236	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-47.3	173.5	-71.7	171.9	178.9	0	0	111	N153 L154 K159 K160 F161 I162 I164	N153-M157 WeakPolarHBondContact O-CG 3.24Å; N153-M157 PolarHBondContact O-N 3.41Å; L154-M157 HydrophobicContact CD2-SD 4.05Å; L154-M157 PolarHBondContact O-N 2.81Å; M157-K159 PolarHBondContact O-N 2.72Å; M157-K160 CarbonylContact O-C 3.48Å; M157-K160 PolarHBondContact O-N 3.11Å; M157-K160 VanDerWaalsContact O-N 3.08Å; M157-F161 PolarHBondContact O-N 3.03Å; M157-I162 HydrophobicContact CB-CB 4.14Å; M157-I162 HydrophobicContact CB-CG2 4.46Å; M157-I162 WeakPolarHBondContact O-CB 3.45Å; M157-I162 PolarHBondContact O-N 3.17Å; M157-I164 HydrophobicContact CB-CD1 4.47Å; M157-I164 HydrophobicContact CB-CG1 4.08Å
158	N	96.2	Very high	96.5	Very high	39 Å²	39	69 Å²	69	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-44.5	178.9	-168.9	-109.9	0	0	0	112.3	L154 F155 K160 F161 I164 F187 E190 K254	L154-N158 VanDerWaalsContact O-CB 3.31Å; L154-N158 WeakPolarHBondContact O-CB 3.44Å; L154-N158 PolarHBondContact O-N 2.85Å; F155-N158 PolarHBondContact O-N 3.06Å; N158-K160 PolarHBondContact O-N 3.49Å; N158-F161 PolarHBondContact O-N 3.03Å; N158-I164 HydrophobicContact CB-CD1 4.18Å; N158-F187 HydrophobicContact CB-CE1 3.82Å; N158-F187 HydrophobicContact CB-CZ 4.26Å; N158-E190 PolarHBondContact ND2-OE1 3.34Å; N158-K254 PolarHBondContact OD1-NZ 3.31Å
159	K	95.4	Very high	96.4	Very high	107 Å²	107	69 Å²	69	47%	0.465	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-29.5	174.9	-76.7	173.7	175.1	-178.3	0	112.9	F155 M157 F161 N250	F155-K159 WeakPolarHBondContact O-CB 3.43Å; F155-K159 VanDerWaalsContact O-CG 3.27Å; F155-K159 WeakPolarHBondContact O-CG 3.29Å; F155-K159 PolarHBondContact O-N 2.82Å; M157-K159 PolarHBondContact O-N 2.72Å; K159-F161 VanDerWaalsContact C-N 3.33Å; K159-N250 PolarHBondContact NZ-OD1 3.38Å
160	K	96.2	Very high	96.2	Very high	154 Å²	154	68.3 Å²	68.3	67%	0.67	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	8.1	176.9	-68.6	178	-179.4	-177.3	0	113.3	N156 M157 N158 I162	N156-K160 WeakPolarHBondContact O-CG 3.3Å; N156-K160 PolarHBondContact O-N 3.18Å; M157-K160 CarbonylContact O-C 3.48Å; M157-K160 PolarHBondContact O-N 3.11Å; M157-K160 VanDerWaalsContact O-N 3.08Å; N158-K160 PolarHBondContact O-N 3.49Å; K160-I162 HydrophobicContact CB-CD1 3.9Å; K160-I162 HydrophobicContact CB-CG1 3.88Å; K160-I162 HydrophobicContact CD-CD1 4.2Å; K160-I162 PolarHBondContact O-N 2.94Å; K160-I162 VanDerWaalsContact O-N 3.14Å
161	F	93.1	Very high	96	Very high	199 Å²	199	69.8 Å²	69.8	87%	0.873	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	27.2	-175	-53.7	-80.9	0	0	0	113.8	M157 N158 K159	M157-F161 PolarHBondContact O-N 3.03Å; N158-F161 PolarHBondContact O-N 3.03Å; K159-F161 VanDerWaalsContact C-N 3.33Å
162	I	93	Very high	96	Very high	87 Å²	87	69.9 Å²	69.9	45%	0.446	34%	0.339	S	S	.	.			trans	-76.2	132.2	174.6	-62.5	173.5	0	0	0	108	M157 K160 I164	M157-I162 HydrophobicContact CB-CB 4.14Å; M157-I162 HydrophobicContact CB-CG2 4.46Å; M157-I162 WeakPolarHBondContact O-CB 3.45Å; M157-I162 PolarHBondContact O-N 3.17Å; K160-I162 HydrophobicContact CB-CD1 3.9Å; K160-I162 HydrophobicContact CB-CG1 3.88Å; K160-I162 HydrophobicContact CD-CD1 4.2Å; K160-I162 PolarHBondContact O-N 2.94Å; K160-I162 VanDerWaalsContact O-N 3.14Å; I162-I164 PolarHBondContact O-N 2.98Å
163	N	92.6	Very high	95.9	Very high	135 Å²	135	69.5 Å²	69.5	72%	0.722	34%	0.337	S	S	*	.			trans	-65.8	119.2	174.1	-172	32.1	0	0	0	109.9	E165	N163-E165 PolarHBondContact O-N 3.18Å
164	I	96	Very high	95.5	Very high	9 Å²	9	69.9 Å²	69.9	5%	0.046	34%	0.339	C	S	.	.			trans	-87.1	105.1	-178.6	-55.5	169.5	0	0	0	108.9	L154 M157 N158 I162 H168 W169 F187	L154-I164 HydrophobicContact CB-CD1 4.41Å; L154-I164 HydrophobicContact CD2-CD1 4.27Å; L154-I164 HydrophobicContact CD2-CG1 4.46Å; L154-I164 HydrophobicContact CD2-CG2 3.45Å; L154-I164 VanDerWaalsContact CD2-CG2 3.45Å; M157-I164 HydrophobicContact CB-CD1 4.47Å; M157-I164 HydrophobicContact CB-CG1 4.08Å; N158-I164 HydrophobicContact CB-CD1 4.18Å; I162-I164 PolarHBondContact O-N 2.98Å; I164-H168 HydrophobicContact CG2-CB 3.94Å; I164-W169 HydrophobicContact CB-CZ2 3.84Å; I164-W169 HydrophobicContact CD1-CH2 4.2Å; I164-W169 HydrophobicContact CD1-CZ2 3.84Å; I164-W169 HydrophobicContact CG1-CZ2 4.46Å; I164-W169 HydrophobicContact CG2-CD2 4.28Å; I164-W169 VanDerWaalsContact CG2-CE2 3.48Å; I164-W169 HydrophobicContact CG2-CH2 4.44Å; I164-W169 HydrophobicContact CG2-CZ2 3.59Å; I164-W169 PolarHBondContact O-NE1 2.94Å; I164-W169 VanDerWaalsContact O-NE1 3.13Å; I164-F187 HydrophobicContact CD1-CE1 4.13Å
165	E	95.1	Very high	95.2	Very high	124 Å²	124	76.1 Å²	76.1	58%	0.579	37%	0.368	S	S	*	.			trans	-67.3	155.4	-179	-64.5	-177.1	-162.6	0	0	113.7	N163 I167 H168 W169	N163-E165 PolarHBondContact O-N 3.18Å; E165-I167 HydrophobicContact CB-CG2 4.1Å; E165-I167 PolarHBondContact O-N 3.43Å; E165-I167 VanDerWaalsContact O-N 3.09Å; E165-H168 PolarHBondContact O-N 3.42Å; E165-W169 VanDerWaalsContact O-CD1 3.29Å
166	K	95.2	Very high	95	Very high	74 Å²	74	76.1 Å²	76.1	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-52.2	-32.8	179.3	-169.2	166.9	-175.8	175.8	0	113.4	D105 H168 W169 N170 I194	D105-K166 WeakPolarHBondContact OD1-CE 3.29Å; D105-K166 IonicContact OD1-NZ 2.69Å; D105-K166 PolarHBondContact OD1-NZ 2.91Å; D105-K166 IonicContact OD2-NZ 3.73Å; D105-K166 PolarHBondContact OD2-NZ 2.92Å; K166-H168 VanDerWaalsContact C-N 3.3Å; K166-H168 PolarHBondContact O-N 2.84Å; K166-W169 PolarHBondContact O-N 3.17Å; K166-N170 VanDerWaalsContact O-CG 3.31Å; K166-N170 PolarHBondContact O-N 3.48Å; K166-N170 PolarHBondContact O-OD1 2.73Å; K166-I194 HydrophobicContact CB-CG2 3.97Å; K166-I194 HydrophobicContact CD-CG2 4.07Å; K166-I194 HydrophobicContact CG-CG2 3.7Å
167	I	95	Very high	94.9	Very high	113 Å²	113	75.3 Å²	75.3	58%	0.579	36%	0.36	S	S	*	.	H	α-helix	trans	-60.3	-37.5	179.2	-167.3	166.5	0	0	0	112.7	E165 N170 D171	E165-I167 HydrophobicContact CB-CG2 4.1Å; E165-I167 PolarHBondContact O-N 3.43Å; E165-I167 VanDerWaalsContact O-N 3.09Å; I167-N170 PolarHBondContact O-N 2.97Å; I167-D171 PolarHBondContact O-N 2.63Å
168	H	96.3	Very high	94.9	Very high	70 Å²	70	73 Å²	73	32%	0.324	35%	0.349	S	S	.	.	H	α-helix	trans	-71.1	-35.1	178.3	-63.7	-64.7	0	0	0	112.2	L154 I164 E165 K166 D171 I172	L154-H168 HydrophobicContact CD2-CB 3.79Å; I164-H168 HydrophobicContact CG2-CB 3.94Å; E165-H168 PolarHBondContact O-N 3.42Å; K166-H168 VanDerWaalsContact C-N 3.3Å; K166-H168 PolarHBondContact O-N 2.84Å; H168-D171 PolarHBondContact O-N 3.45Å; H168-I172 PolarHBondContact O-N 3.38Å
169	W	96.3	Very high	95	Very high	1 Å²	1	71.2 Å²	71.2	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-68.4	-42.3	174.6	-57.4	111.6	0	0	0	111.3	W151 L154 I164 E165 K166 D171 I172 F173 F187 E190 L191 Y195	W151-W169 HydrophobicContact CH2-CZ3 4.16Å; W151-W169 AromaticContact CZ3-CZ3 3.92Å; W151-W169 HydrophobicContact CZ3-CZ3 3.92Å; L154-W169 HydrophobicContact CD1-CD2 4.43Å; L154-W169 HydrophobicContact CD1-CE3 3.72Å; L154-W169 HydrophobicContact CD1-CH2 3.84Å; L154-W169 HydrophobicContact CD1-CZ3 3.4Å; I164-W169 HydrophobicContact CB-CZ2 3.84Å; I164-W169 HydrophobicContact CD1-CH2 4.2Å; I164-W169 HydrophobicContact CD1-CZ2 3.84Å; I164-W169 HydrophobicContact CG1-CZ2 4.46Å; I164-W169 HydrophobicContact CG2-CD2 4.28Å; I164-W169 VanDerWaalsContact CG2-CE2 3.48Å; I164-W169 HydrophobicContact CG2-CH2 4.44Å; I164-W169 HydrophobicContact CG2-CZ2 3.59Å; I164-W169 PolarHBondContact O-NE1 2.94Å; I164-W169 VanDerWaalsContact O-NE1 3.13Å; E165-W169 VanDerWaalsContact O-CD1 3.29Å; K166-W169 PolarHBondContact O-N 3.17Å; W169-D171 VanDerWaalsContact C-N 3.31Å; W169-D171 PolarHBondContact O-N 3.35Å; W169-I172 PolarHBondContact O-N 3.41Å; W169-I172 VanDerWaalsContact O-N 3.12Å; W169-F173 HydrophobicContact CB-CD2 4.21Å; W169-F173 HydrophobicContact CB-CE2 4.2Å; W169-F173 AromaticContact CE3-CE2 3.88Å; W169-F173 HydrophobicContact CE3-CE2 3.88Å; W169-F173 HydrophobicContact CE3-CZ 4.34Å; W169-F173 WeakPolarHBondContact O-CD2 3.35Å; W169-F173 PolarHBondContact O-N 2.72Å; W169-F187 HydrophobicContact CH2-CB 3.84Å; W169-F187 AromaticContact CH2-CD1 3.66Å; W169-F187 HydrophobicContact CH2-CD1 3.66Å; W169-F187 HydrophobicContact CH2-CD2 4.39Å; W169-F187 HydrophobicContact CH2-CE1 4.24Å; W169-F187 AromaticContact CH2-CG 3.72Å; W169-F187 HydrophobicContact CH2-CG 3.72Å; W169-F187 HydrophobicContact CZ2-CD1 4.41Å; W169-F187 HydrophobicContact CZ3-CB 4.27Å; W169-F187 HydrophobicContact CZ3-CG 4.31Å; W169-E190 HydrophobicContact CZ2-CB 4.14Å; W169-L191 HydrophobicContact CD2-CD2 3.66Å; W169-L191 HydrophobicContact CE3-CD2 3.5Å; W169-L191 VanDerWaalsContact CE3-CD2 3.5Å; W169-L191 HydrophobicContact CG-CD2 4.2Å; W169-L191 HydrophobicContact CH2-CD2 4.3Å; W169-L191 HydrophobicContact CZ2-CD2 4.46Å; W169-L191 HydrophobicContact CZ3-CD2 3.82Å; W169-L191 HydrophobicContact CZ3-CG 4.4Å; W169-Y195 HydrophobicContact CB-CE2 4.26Å; W169-Y195 WeakPolarHBondContact CB-OH 3.48Å
170	N	94.3	Very high	95.1	Very high	52 Å²	52	66.1 Å²	66.1	28%	0.278	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-34.9	175.8	-70	-1.9	0	0	0	112.2	K166 I167 I172 N174 Y195	K166-N170 VanDerWaalsContact O-CG 3.31Å; K166-N170 PolarHBondContact O-N 3.48Å; K166-N170 PolarHBondContact O-OD1 2.73Å; I167-N170 PolarHBondContact O-N 2.97Å; N170-I172 VanDerWaalsContact C-N 3.27Å; N170-I172 PolarHBondContact O-N 3.19Å; N170-N174 WeakPolarHBondContact O-CA 3.4Å; N170-N174 PolarHBondContact O-N 3.44Å; N170-Y195 PolarHBondContact OD1-OH 3.23Å; N170-Y195 VanDerWaalsContact OD1-OH 3.06Å
171	D	95.1	Very high	95.2	Very high	84 Å²	84	59.2 Å²	59.2	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-68.1	-23.8	174.7	-179.3	46	0	0	0	113.3	K150 I167 H168 W169	K150-D171 WeakPolarHBondContact CD-OD2 3.41Å; K150-D171 WeakPolarHBondContact CE-OD1 3.26Å; K150-D171 WeakPolarHBondContact CE-OD2 3.34Å; K150-D171 PolarHBondContact NZ-O 2.92Å; K150-D171 IonicContact NZ-OD1 3.1Å; K150-D171 PolarHBondContact NZ-OD1 2.53Å; K150-D171 IonicContact NZ-OD2 3.13Å; K150-D171 PolarHBondContact NZ-OD2 3.23Å; K150-D171 VanDerWaalsContact NZ-OD2 3.1Å; I167-D171 PolarHBondContact O-N 2.63Å; H168-D171 PolarHBondContact O-N 3.45Å; W169-D171 VanDerWaalsContact C-N 3.31Å; W169-D171 PolarHBondContact O-N 3.35Å
172	I	97.1	Very high	95.4	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-87.6	-51.1	175.3	-70	-174.6	0	0	0	111.5	Y134 H147 K150 W151 L154 H168 W169 N170	Y134-I172 HydrophobicContact CE1-CG2 4.14Å; Y134-I172 HydrophobicContact CE2-CG2 3.88Å; Y134-I172 VanDerWaalsContact CE2-O 3.23Å; Y134-I172 WeakPolarHBondContact CE2-O 3.29Å; Y134-I172 WeakPolarHBondContact OH-CG2 3.4Å; H147-I172 PolarHBondContact CE1-O 3.11Å; K150-I172 HydrophobicContact CB-CD1 4.15Å; K150-I172 HydrophobicContact CB-CG1 4.02Å; K150-I172 HydrophobicContact CD-CG1 4.25Å; W151-I172 HydrophobicContact CD2-CD1 3.81Å; W151-I172 HydrophobicContact CE3-CD1 4.11Å; W151-I172 HydrophobicContact CG-CD1 4.22Å; W151-I172 HydrophobicContact CH2-CD1 4.48Å; W151-I172 HydrophobicContact CH2-CG2 4.49Å; W151-I172 HydrophobicContact CZ2-CD1 4.21Å; W151-I172 HydrophobicContact CZ2-CG2 3.64Å; W151-I172 HydrophobicContact CZ3-CD1 4.43Å; L154-I172 HydrophobicContact CD1-CD1 3.31Å; L154-I172 HydrophobicContact CG-CD1 4.03Å; H168-I172 PolarHBondContact O-N 3.38Å; W169-I172 PolarHBondContact O-N 3.41Å; W169-I172 VanDerWaalsContact O-N 3.12Å; N170-I172 VanDerWaalsContact C-N 3.27Å; N170-I172 PolarHBondContact O-N 3.19Å
173	F	96.3	Very high	95.7	Very high	3 Å²	3	45.6 Å²	45.6	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-82.6	-28.4	-172.7	-59.6	-51.1	0	0	0	112.3	L106 Y134 W151 W169 E175 C176 A179 T184 L191	L106-F173 HydrophobicContact CD1-CD2 3.68Å; L106-F173 HydrophobicContact CD1-CE2 3.61Å; L106-F173 HydrophobicContact CD1-CG 4.18Å; L106-F173 HydrophobicContact CD1-CZ 4.05Å; L106-F173 HydrophobicContact CD2-CB 4.37Å; L106-F173 HydrophobicContact CD2-CD2 4.43Å; L106-F173 HydrophobicContact CD2-CG 4.21Å; L106-F173 HydrophobicContact CG-CD2 4.09Å; L106-F173 HydrophobicContact CG-CG 4.37Å; Y134-F173 HydrophobicContact CD1-CD1 4.23Å; Y134-F173 HydrophobicContact CD1-CE1 4.04Å; Y134-F173 HydrophobicContact CD2-CD1 4.06Å; Y134-F173 HydrophobicContact CE1-CE1 4.5Å; Y134-F173 AromaticContact CG-CD1 3.84Å; Y134-F173 HydrophobicContact CG-CD1 3.84Å; Y134-F173 HydrophobicContact CG-CE1 4.11Å; W151-F173 HydrophobicContact CH2-CE1 4.38Å; W151-F173 HydrophobicContact CH2-CZ 4.04Å; W151-F173 HydrophobicContact CZ2-CE1 4.1Å; W151-F173 HydrophobicContact CZ2-CZ 4.21Å; W169-F173 HydrophobicContact CB-CD2 4.21Å; W169-F173 HydrophobicContact CB-CE2 4.2Å; W169-F173 AromaticContact CE3-CE2 3.88Å; W169-F173 HydrophobicContact CE3-CE2 3.88Å; W169-F173 HydrophobicContact CE3-CZ 4.34Å; W169-F173 WeakPolarHBondContact O-CD2 3.35Å; W169-F173 PolarHBondContact O-N 2.72Å; F173-E175 PolarHBondContact O-N 2.92Å; F173-C176 HydrophobicContact CB-CB 4.28Å; F173-C176 WeakPolarHBondContact O-CB 3.46Å; F173-C176 PolarHBondContact O-N 2.81Å; F173-C176 PolarHBondContact O-SG 3.3Å; F173-A179 HydrophobicContact CD1-CB 3.84Å; F173-A179 HydrophobicContact CE1-CB 3.5Å; F173-A179 VanDerWaalsContact CE1-CB 3.5Å; F173-A179 HydrophobicContact CZ-CB 4.07Å; F173-T184 HydrophobicContact CE1-CG2 4.42Å; F173-T184 HydrophobicContact CZ-CG2 4.19Å; F173-L191 HydrophobicContact CE2-CD2 3.64Å; F173-L191 HydrophobicContact CZ-CD1 4.31Å; F173-L191 HydrophobicContact CZ-CD2 4.13Å
174	N	90.9	Very high	95.9	Very high	92 Å²	92	39.2 Å²	39.2	49%	0.492	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	-107.2	-178.5	-171.1	37.9	0	0	0	111.8	N170	N170-N174 WeakPolarHBondContact O-CA 3.4Å; N170-N174 PolarHBondContact O-N 3.44Å
175	E	90.5	Very high	96	Very high	135 Å²	135	38.8 Å²	38.8	63%	0.631	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.3	-179.8	-65.8	172.5	-173.2	0	0	113.4	F173 R177	F173-E175 PolarHBondContact O-N 2.92Å; E175-R177 PolarHBondContact O-N 3.42Å
176	C	95.3	Very high	96.2	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.027	16%	0.162	C	C	.	.			trans	-67.4	130	178.7	-62.9	0	0	0	0	110.2	L106 S132 F173	L106-C176 WeakPolarHBondContact CD2-O 3.31Å; S132-C176 WeakPolarHBondContact O-CA 3.41Å; F173-C176 HydrophobicContact CB-CB 4.28Å; F173-C176 WeakPolarHBondContact O-CB 3.46Å; F173-C176 PolarHBondContact O-N 2.81Å; F173-C176 PolarHBondContact O-SG 3.3Å
177	R	94.8	Very high	96.3	Very high	49 Å²	49	29.6 Å²	29.6	19%	0.185	15%	0.147	C	C	.	.	S	Bend	trans	-98	-11.9	175.5	-61.7	-61.4	-56.6	-69.9	-2.1	112.6	S103 D105 F107 I108 S132 E175	S103-R177 PolarHBondContact O-NE 2.87Å; D105-R177 PolarHBondContact O-NE 2.66Å; F107-R177 PolarHBondContact N-O 3.3Å; I108-R177 PolarHBondContact N-O 2.97Å; S132-R177 PolarHBondContact O-N 3.3Å; E175-R177 PolarHBondContact O-N 3.42Å
178	F	97.7	Very high	96.5	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.1	178.6	-32.7	-68.5	0	0	0	108.5	F107 I108 L125 Y129 Q131 S132 C133 Y134	F107-F178 HydrophobicContact CB-CE1 4.5Å; F107-F178 HydrophobicContact CD1-CD1 4.48Å; F107-F178 AromaticContact CD1-CE1 3.99Å; F107-F178 HydrophobicContact CD1-CE1 3.99Å; I108-F178 HydrophobicContact CB-CB 4.19Å; I108-F178 HydrophobicContact CB-CD1 3.79Å; I108-F178 HydrophobicContact CB-CG 4.44Å; I108-F178 HydrophobicContact CG1-CD1 3.68Å; I108-F178 HydrophobicContact CG1-CE1 4.27Å; I108-F178 WeakPolarHBondContact O-CA 3.49Å; L125-F178 HydrophobicContact CB-CD2 3.97Å; L125-F178 HydrophobicContact CB-CE2 4.35Å; L125-F178 HydrophobicContact CB-CG 4.12Å; L125-F178 HydrophobicContact CD1-CB 3.9Å; L125-F178 HydrophobicContact CD1-CG 4.12Å; Y129-F178 VanDerWaalsContact CB-CZ 3.41Å; Y129-F178 HydrophobicContact CD1-CZ 4.32Å; Y129-F178 AromaticContact CD2-CE1 3.64Å; Y129-F178 HydrophobicContact CD2-CE1 3.64Å; Y129-F178 HydrophobicContact CD2-CE2 4.15Å; Y129-F178 AromaticContact CD2-CZ 3.31Å; Y129-F178 HydrophobicContact CD2-CZ 3.31Å; Y129-F178 HydrophobicContact CE2-CE1 4.01Å; Y129-F178 HydrophobicContact CE2-CZ 4.14Å; Y129-F178 HydrophobicContact CG-CE1 4.07Å; Y129-F178 HydrophobicContact CG-CE2 4.3Å; Y129-F178 AromaticContact CG-CZ 3.42Å; Y129-F178 HydrophobicContact CG-CZ 3.42Å; Y129-F178 VanDerWaalsContact CG-CZ 3.42Å; Q131-F178 HydrophobicContact CB-CE2 3.73Å; Q131-F178 HydrophobicContact CB-CZ 4.16Å; S132-F178 WeakPolarHBondContact O-CD2 3.04Å; C133-F178 CarbonylContact C-O 3.53Å; C133-F178 VanDerWaalsContact CA-O 3.3Å; C133-F178 WeakPolarHBondContact CA-O 3.39Å; C133-F178 HydrophobicContact CB-CB 3.97Å; C133-F178 HydrophobicContact CB-CD2 3.94Å; C133-F178 HydrophobicContact CB-CG 4.45Å; Y134-F178 PolarHBondContact N-O 2.71Å
179	A	98.2	Very high	96.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	119.1	173.6	0	0	0	0	0	108.8	L106 I108 G110 F173 T184	L106-A179 HydrophobicContact CD1-CB 3.87Å; L106-A179 HydrophobicContact CD2-CB 3.9Å; I108-A179 PolarHBondContact O-N 2.99Å; G110-A179 PolarHBondContact N-O 2.95Å; F173-A179 HydrophobicContact CD1-CB 3.84Å; F173-A179 HydrophobicContact CE1-CB 3.5Å; F173-A179 VanDerWaalsContact CE1-CB 3.5Å; F173-A179 HydrophobicContact CZ-CB 4.07Å; A179-T184 HydrophobicContact CB-CG2 3.5Å; A179-T184 VanDerWaalsContact CB-CG2 3.5Å
180	V	98.3	Very high	96.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.			trans	-131.4	170.1	-175.7	-53.3	0	0	0	0	109.9	L121 K122 L125 Y134 H135	L121-V180 HydrophobicContact CD2-CG1 3.96Å; L121-V180 HydrophobicContact CG-CG1 4.33Å; K122-V180 HydrophobicContact CB-CG2 3.98Å; L125-V180 HydrophobicContact CD1-CG1 4.1Å; Y134-V180 PolarHBondContact O-N 3.13Å; Y134-V180 VanDerWaalsContact O-O 3.08Å; H135-V180 WeakPolarHBondContact CA-O 3.31Å; H135-V180 HydrophobicContact CB-CG2 4.45Å
181	D	97.8	Very high	96.7	Very high	9 Å²	9	23.5 Å²	23.5	5%	0.048	11%	0.113	C	C	.	.	S	Bend	trans	61.8	-168.8	-177.2	-156.4	47.4	0	0	0	112.5	M114 T118 H135 M136 T184 C185	M114-D181 WeakPolarHBondContact CA-OD1 3.46Å; T118-D181 HydrophobicContact CG2-CB 4.18Å; T118-D181 PolarHBondContact OG1-OD1 3.46Å; H135-D181 IonicContact CE1-OD2 2.65Å; H135-D181 PolarHBondContact CE1-OD2 3.32Å; H135-D181 IonicContact ND1-OD2 2.73Å; H135-D181 PolarHBondContact ND1-OD2 3.34Å; H135-D181 VanDerWaalsContact ND1-OD2 3.1Å; H135-D181 IonicContact NE2-OD2 2.99Å; M136-D181 WeakPolarHBondContact CB-OD2 3.35Å; D181-T184 WeakPolarHBondContact O-CB 3.04Å; D181-T184 PolarHBondContact O-N 3.29Å; D181-C185 PolarHBondContact O-N 2.93Å
182	Y	97.7	Very high	96.8	Very high	1 Å²	1	20.1 Å²	20.1	0%	0.004	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	153.6	174.8	-84.9	-95.1	0	0	0	112.5	Q113 M114 M136 T184 C185 V186 M251 A255	Q113-Y182 VanDerWaalsContact CD-OH 3.24Å; Q113-Y182 PolarHBondContact NE2-OH 3.16Å; Q113-Y182 VanDerWaalsContact OE1-CZ 3.23Å; Q113-Y182 PolarHBondContact OE1-OH 2.99Å; M114-Y182 HydrophobicContact CB-CD2 3.99Å; M114-Y182 HydrophobicContact CB-CE2 4.23Å; M114-Y182 HydrophobicContact CE-CD1 4.1Å; M114-Y182 HydrophobicContact CE-CD2 3.21Å; M114-Y182 HydrophobicContact CE-CE1 4.21Å; M114-Y182 HydrophobicContact CE-CE2 3.36Å; M114-Y182 HydrophobicContact CE-CG 3.57Å; M114-Y182 HydrophobicContact CG-CD2 4.23Å; M114-Y182 HydrophobicContact CG-CE2 4.06Å; M136-Y182 WeakPolarHBondContact CA-O 3.5Å; M136-Y182 WeakPolarHBondContact CB-O 3.37Å; M136-Y182 PolarHBondContact N-O 3.28Å; M136-Y182 VanDerWaalsContact N-O 3.12Å; Y182-T184 VanDerWaalsContact C-N 3.32Å; Y182-C185 WeakPolarHBondContact CD2-SG 3.38Å; Y182-C185 WeakPolarHBondContact CE2-SG 3.35Å; Y182-V186 HydrophobicContact CD1-CG1 4.17Å; Y182-V186 HydrophobicContact CE1-CG1 3.4Å; Y182-V186 VanDerWaalsContact CE1-CG1 3.4Å; Y182-V186 HydrophobicContact CE1-CG2 4.47Å; Y182-M251 HydrophobicContact CD1-CB 3.58Å; Y182-M251 HydrophobicContact CD1-CG 3.7Å; Y182-M251 HydrophobicContact CD1-SD 3.62Å; Y182-M251 HydrophobicContact CE1-CB 3.75Å; Y182-M251 HydrophobicContact CE1-CG 4.34Å; Y182-M251 HydrophobicContact CG-SD 4.04Å; Y182-A255 HydrophobicContact CE1-CB 4.38Å; Y182-A255 WeakPolarHBondContact OH-CB 3.49Å
183	P	98.1	Very high	96.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	cis	-78.8	-5.8	-7.3	-14.5	30.3	0	0	0	114.4	M136 I139 W151 F155 C185 V186 L247 M251	M136-P183 HydrophobicContact CE-CG 4.18Å; I139-P183 HydrophobicContact CD1-CG 4.02Å; W151-P183 HydrophobicContact CB-CG 4.27Å; W151-P183 HydrophobicContact CD2-CB 3.72Å; W151-P183 HydrophobicContact CD2-CG 3.59Å; W151-P183 HydrophobicContact CE3-CB 3.67Å; W151-P183 HydrophobicContact CE3-CG 4.09Å; W151-P183 HydrophobicContact CG-CB 4.26Å; W151-P183 HydrophobicContact CG-CG 3.68Å; W151-P183 HydrophobicContact CH2-CB 4.23Å; W151-P183 HydrophobicContact CZ2-CB 4.27Å; W151-P183 HydrophobicContact CZ2-CG 4.35Å; W151-P183 HydrophobicContact CZ3-CB 3.94Å; F155-P183 HydrophobicContact CE2-CB 3.94Å; F155-P183 HydrophobicContact CZ-CB 4.16Å; P183-C185 VanDerWaalsContact C-N 3.35Å; P183-C185 PolarHBondContact O-N 3.17Å; P183-V186 WeakPolarHBondContact O-CG2 3.18Å; P183-V186 PolarHBondContact O-N 3.47Å; P183-L247 HydrophobicContact CG-CD1 4.05Å; P183-L247 HydrophobicContact CG-CD2 4.27Å; P183-L247 HydrophobicContact CG-CG 4.5Å; P183-M251 HydrophobicContact CB-CG 3.97Å; P183-M251 HydrophobicContact CB-SD 3.85Å; P183-M251 HydrophobicContact CG-CG 4.25Å; P183-M251 HydrophobicContact CG-SD 3.61Å
184	T	98.2	Very high	96.8	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-53.4	-46.9	-174.4	-55.8	0	0	0	0	113.5	F173 A179 D181 Y182 V186 F187 L191	F173-T184 HydrophobicContact CE1-CG2 4.42Å; F173-T184 HydrophobicContact CZ-CG2 4.19Å; A179-T184 HydrophobicContact CB-CG2 3.5Å; A179-T184 VanDerWaalsContact CB-CG2 3.5Å; D181-T184 WeakPolarHBondContact O-CB 3.04Å; D181-T184 PolarHBondContact O-N 3.29Å; Y182-T184 VanDerWaalsContact C-N 3.32Å; T184-V186 PolarHBondContact O-N 3.48Å; T184-V186 VanDerWaalsContact O-N 3.13Å; T184-F187 PolarHBondContact O-N 2.89Å; T184-L191 HydrophobicContact CG2-CD1 3.47Å; T184-L191 VanDerWaalsContact CG2-CD1 3.47Å
185	C	98.2	Very high	97.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-56.2	-34.9	-173.2	60.2	0	0	0	0	113.2	G110 D181 Y182 P183 F187 Y188	G110-C185 VanDerWaalsContact O-CA 3.31Å; G110-C185 WeakPolarHBondContact O-CA 3.33Å; G110-C185 VanDerWaalsContact O-CB 3.31Å; G110-C185 WeakPolarHBondContact O-CB 3.47Å; D181-C185 PolarHBondContact O-N 2.93Å; Y182-C185 WeakPolarHBondContact CD2-SG 3.38Å; Y182-C185 WeakPolarHBondContact CE2-SG 3.35Å; P183-C185 VanDerWaalsContact C-N 3.35Å; P183-C185 PolarHBondContact O-N 3.17Å; C185-F187 PolarHBondContact O-N 3.15Å; C185-Y188 VanDerWaalsContact O-CD1 3.31Å; C185-Y188 WeakPolarHBondContact O-CD1 3.45Å; C185-Y188 PolarHBondContact O-N 2.87Å
186	V	98.1	Very high	97.3	Very high	5 Å²	5	22 Å²	22	3%	0.03	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-73.1	-14.6	-179.7	-65.9	0	0	0	0	113.7	F155 Y182 P183 T184 K254 A255 W275	F155-V186 HydrophobicContact CE1-CG2 4.04Å; F155-V186 HydrophobicContact CZ-CG2 3.81Å; Y182-V186 HydrophobicContact CD1-CG1 4.17Å; Y182-V186 HydrophobicContact CE1-CG1 3.4Å; Y182-V186 VanDerWaalsContact CE1-CG1 3.4Å; Y182-V186 HydrophobicContact CE1-CG2 4.47Å; P183-V186 WeakPolarHBondContact O-CG2 3.18Å; P183-V186 PolarHBondContact O-N 3.47Å; T184-V186 PolarHBondContact O-N 3.48Å; T184-V186 VanDerWaalsContact O-N 3.13Å; V186-K254 HydrophobicContact CB-CB 4.44Å; V186-K254 HydrophobicContact CB-CD 3.93Å; V186-K254 HydrophobicContact CB-CG 4.09Å; V186-K254 HydrophobicContact CG2-CD 3.85Å; V186-K254 HydrophobicContact CG2-CG 4.39Å; V186-K254 WeakPolarHBondContact O-CE 3.22Å; V186-A255 HydrophobicContact CG1-CB 3.82Å; V186-W275 HydrophobicContact CB-CH2 4.19Å; V186-W275 HydrophobicContact CG1-CH2 3.84Å; V186-W275 HydrophobicContact CG1-CZ2 4.36Å; V186-W275 HydrophobicContact CG1-CZ3 4.41Å
187	F	98.1	Very high	97.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-103.2	17.9	177	-72.9	-81.2	0	0	0	113.2	W151 F155 N158 I164 W169 T184 C185 K189 E190 L191 K254	W151-F187 HydrophobicContact CE3-CD2 4.4Å; W151-F187 HydrophobicContact CE3-CE2 4.18Å; W151-F187 AromaticContact CZ3-CD2 3.69Å; W151-F187 HydrophobicContact CZ3-CD2 3.69Å; W151-F187 AromaticContact CZ3-CE2 3.92Å; W151-F187 HydrophobicContact CZ3-CE2 3.92Å; F155-F187 HydrophobicContact CD1-CE2 4.03Å; F155-F187 AromaticContact CD1-CZ 3.86Å; F155-F187 HydrophobicContact CD1-CZ 3.86Å; F155-F187 HydrophobicContact CD2-CE2 4.26Å; F155-F187 HydrophobicContact CD2-CZ 4.49Å; F155-F187 AromaticContact CE1-CE2 3.7Å; F155-F187 HydrophobicContact CE1-CE2 3.7Å; F155-F187 AromaticContact CE1-CZ 3.97Å; F155-F187 HydrophobicContact CE1-CZ 3.97Å; F155-F187 AromaticContact CE2-CE2 3.91Å; F155-F187 HydrophobicContact CE2-CE2 3.91Å; F155-F187 HydrophobicContact CG-CE2 4.29Å; F155-F187 HydrophobicContact CG-CZ 4.13Å; F155-F187 AromaticContact CZ-CE2 3.61Å; F155-F187 HydrophobicContact CZ-CE2 3.61Å; F155-F187 HydrophobicContact CZ-CZ 4.29Å; N158-F187 HydrophobicContact CB-CE1 3.82Å; N158-F187 HydrophobicContact CB-CZ 4.26Å; I164-F187 HydrophobicContact CD1-CE1 4.13Å; W169-F187 HydrophobicContact CH2-CB 3.84Å; W169-F187 AromaticContact CH2-CD1 3.66Å; W169-F187 HydrophobicContact CH2-CD1 3.66Å; W169-F187 HydrophobicContact CH2-CD2 4.39Å; W169-F187 HydrophobicContact CH2-CE1 4.24Å; W169-F187 AromaticContact CH2-CG 3.72Å; W169-F187 HydrophobicContact CH2-CG 3.72Å; W169-F187 HydrophobicContact CZ2-CD1 4.41Å; W169-F187 HydrophobicContact CZ3-CB 4.27Å; W169-F187 HydrophobicContact CZ3-CG 4.31Å; T184-F187 PolarHBondContact O-N 2.89Å; C185-F187 PolarHBondContact O-N 3.15Å; F187-K189 VanDerWaalsContact C-N 3.26Å; F187-K189 PolarHBondContact O-N 3.22Å; F187-E190 WeakPolarHBondContact CA-OE2 3.33Å; F187-E190 HydrophobicContact CD1-CB 4.43Å; F187-E190 HydrophobicContact CD1-CG 4.24Å; F187-E190 PolarHBondContact O-N 2.89Å; F187-E190 VanDerWaalsContact O-N 3.15Å; F187-L191 HydrophobicContact CB-CD1 4.2Å; F187-L191 HydrophobicContact CB-CG 4.25Å; F187-L191 WeakPolarHBondContact O-CB 2.89Å; F187-L191 VanDerWaalsContact O-CG 3.27Å; F187-L191 WeakPolarHBondContact O-CG 3.27Å; F187-L191 PolarHBondContact O-N 3.46Å; F187-K254 HydrophobicContact CE1-CD 4.34Å; F187-K254 HydrophobicContact CE2-CD 4.3Å; F187-K254 HydrophobicContact CZ-CD 4.12Å
188	Y	98.1	Very high	97.5	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-54.6	-39.3	-174.4	75.1	-81.7	0	0	0	113.2	A111 C185 L191 M192 W275 E278 I279 Y282 V283	A111-Y188 HydrophobicContact CB-CG 4.25Å; C185-Y188 VanDerWaalsContact O-CD1 3.31Å; C185-Y188 WeakPolarHBondContact O-CD1 3.45Å; C185-Y188 PolarHBondContact O-N 2.87Å; Y188-L191 PolarHBondContact O-N 3.11Å; Y188-M192 HydrophobicContact CD2-SD 4.31Å; Y188-M192 WeakPolarHBondContact O-CB 3.38Å; Y188-M192 VanDerWaalsContact O-CG 3.22Å; Y188-M192 WeakPolarHBondContact O-CG 3.41Å; Y188-M192 PolarHBondContact O-N 2.9Å; Y188-W275 HydrophobicContact CD1-CH2 4.36Å; Y188-W275 HydrophobicContact CD1-CZ2 4.25Å; Y188-W275 HydrophobicContact CE1-CH2 4.14Å; Y188-W275 HydrophobicContact CE1-CZ2 4.22Å; Y188-E278 PolarHBondContact OH-OE1 3.07Å; Y188-I279 HydrophobicContact CD1-CG1 4.42Å; Y188-I279 HydrophobicContact CD2-CG1 4.37Å; Y188-I279 HydrophobicContact CE1-CD1 4.46Å; Y188-I279 HydrophobicContact CE1-CG1 3.89Å; Y188-I279 HydrophobicContact CE2-CG1 3.84Å; Y188-Y282 HydrophobicContact CD2-CD1 4.4Å; Y188-Y282 AromaticContact CE2-CD1 3.71Å; Y188-Y282 HydrophobicContact CE2-CD1 3.71Å; Y188-Y282 HydrophobicContact CE2-CE1 4.37Å; Y188-Y282 HydrophobicContact CE2-CG 4.28Å; Y188-V283 HydrophobicContact CD2-CG2 4.38Å; Y188-V283 HydrophobicContact CE2-CG2 4.35Å
189	K	97.3	Very high	97.5	Very high	59 Å²	59	28.7 Å²	28.7	26%	0.257	14%	0.142	S	C	.	.	H	α-helix	trans	-65	-48.1	178.3	-65.7	-178.4	155.7	152.6	0	111.8	F187 L191 M192 K193 E278 Y282	F187-K189 VanDerWaalsContact C-N 3.26Å; F187-K189 PolarHBondContact O-N 3.22Å; K189-L191 VanDerWaalsContact C-N 3.35Å; K189-M192 PolarHBondContact O-N 3.39Å; K189-K193 WeakPolarHBondContact O-CG 3.36Å; K189-K193 PolarHBondContact O-N 3.22Å; K189-E278 IonicContact NZ-OE1 2.7Å; K189-E278 PolarHBondContact NZ-OE1 3.36Å; K189-Y282 HydrophobicContact CB-CE1 4.13Å; K189-Y282 HydrophobicContact CD-CD2 4.38Å; K189-Y282 HydrophobicContact CD-CE1 4.36Å; K189-Y282 HydrophobicContact CD-CE2 4.17Å; K189-Y282 HydrophobicContact CG-CD1 3.95Å; K189-Y282 HydrophobicContact CG-CE1 3.62Å; K189-Y282 HydrophobicContact CG-CE2 4.29Å; K189-Y282 HydrophobicContact CG-CG 4.42Å
190	E	97.3	Very high	97.6	Very high	45 Å²	45	28.7 Å²	28.7	21%	0.21	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-45.5	177.1	-64.3	90.7	150.9	0	0	110.4	N158 W169 F187 M192 K193 I194 K254	N158-E190 PolarHBondContact ND2-OE1 3.34Å; W169-E190 HydrophobicContact CZ2-CB 4.14Å; F187-E190 WeakPolarHBondContact CA-OE2 3.33Å; F187-E190 HydrophobicContact CD1-CB 4.43Å; F187-E190 HydrophobicContact CD1-CG 4.24Å; F187-E190 PolarHBondContact O-N 2.89Å; F187-E190 VanDerWaalsContact O-N 3.15Å; E190-M192 PolarHBondContact O-N 3.49Å; E190-K193 WeakPolarHBondContact O-CB 3.27Å; E190-K193 PolarHBondContact O-N 3.37Å; E190-I194 WeakPolarHBondContact O-CG1 3.42Å; E190-I194 PolarHBondContact O-N 3.17Å; E190-K254 IonicContact OE1-NZ 3.32Å; E190-K254 PolarHBondContact OE1-NZ 3.07Å
191	L	97.9	Very high	97.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-38.2	179.5	-68.1	171.3	0	0	0	112.8	L106 I109 W169 F173 T184 F187 Y188 K189 K193 I194 Y195	L106-L191 HydrophobicContact CD1-CD2 4.44Å; I109-L191 HydrophobicContact CD1-CB 3.69Å; I109-L191 HydrophobicContact CG1-CB 4.31Å; I109-L191 HydrophobicContact CG2-CD1 4.27Å; W169-L191 HydrophobicContact CD2-CD2 3.66Å; W169-L191 HydrophobicContact CE3-CD2 3.5Å; W169-L191 VanDerWaalsContact CE3-CD2 3.5Å; W169-L191 HydrophobicContact CG-CD2 4.2Å; W169-L191 HydrophobicContact CH2-CD2 4.3Å; W169-L191 HydrophobicContact CZ2-CD2 4.46Å; W169-L191 HydrophobicContact CZ3-CD2 3.82Å; W169-L191 HydrophobicContact CZ3-CG 4.4Å; F173-L191 HydrophobicContact CE2-CD2 3.64Å; F173-L191 HydrophobicContact CZ-CD1 4.31Å; F173-L191 HydrophobicContact CZ-CD2 4.13Å; T184-L191 HydrophobicContact CG2-CD1 3.47Å; T184-L191 VanDerWaalsContact CG2-CD1 3.47Å; F187-L191 HydrophobicContact CB-CD1 4.2Å; F187-L191 HydrophobicContact CB-CG 4.25Å; F187-L191 WeakPolarHBondContact O-CB 2.89Å; F187-L191 VanDerWaalsContact O-CG 3.27Å; F187-L191 WeakPolarHBondContact O-CG 3.27Å; F187-L191 PolarHBondContact O-N 3.46Å; Y188-L191 PolarHBondContact O-N 3.11Å; K189-L191 VanDerWaalsContact C-N 3.35Å; L191-K193 VanDerWaalsContact C-N 3.25Å; L191-K193 PolarHBondContact O-N 2.94Å; L191-I194 PolarHBondContact O-N 3.12Å; L191-Y195 HydrophobicContact CB-CD2 4.48Å; L191-Y195 HydrophobicContact CD2-CD2 4.25Å; L191-Y195 HydrophobicContact CD2-CE2 3.91Å; L191-Y195 WeakPolarHBondContact O-CD2 3.41Å; L191-Y195 PolarHBondContact O-N 2.87Å
192	M	97.7	Very high	97.6	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.069	14%	0.14	C	C	.	.	H	α-helix	trans	-63.6	-30.5	176	-78.4	176.3	72.1	0	0	113.2	I109 Y188 K189 E190 Y195 P196 V200 Y282 V283	I109-M192 HydrophobicContact CD1-CG 4.06Å; Y188-M192 HydrophobicContact CD2-SD 4.31Å; Y188-M192 WeakPolarHBondContact O-CB 3.38Å; Y188-M192 VanDerWaalsContact O-CG 3.22Å; Y188-M192 WeakPolarHBondContact O-CG 3.41Å; Y188-M192 PolarHBondContact O-N 2.9Å; K189-M192 PolarHBondContact O-N 3.39Å; E190-M192 PolarHBondContact O-N 3.49Å; M192-Y195 CarbonylContact O-C 3.59Å; M192-P196 WeakPolarHBondContact O-CA 3.49Å; M192-V200 HydrophobicContact CE-CG2 4.28Å; M192-V200 HydrophobicContact CG-CG2 3.93Å; M192-V200 HydrophobicContact SD-CG2 3.73Å; M192-Y282 HydrophobicContact CE-CE1 4.46Å; M192-Y282 HydrophobicContact SD-CD1 4.3Å; M192-Y282 HydrophobicContact SD-CE1 4.07Å; M192-V283 HydrophobicContact CE-CB 4.36Å; M192-V283 HydrophobicContact CE-CG1 3.86Å; M192-V283 HydrophobicContact CE-CG2 4.18Å; M192-V283 HydrophobicContact SD-CG1 4.36Å; M192-V283 HydrophobicContact SD-CG2 3.8Å
193	K	96.5	Very high	97.7	Very high	157 Å²	157	28.2 Å²	28.2	68%	0.683	14%	0.14	S	C	*	.	H	α-helix	trans	-71.9	-38.5	174.1	-66.5	174	-177.3	179.8	0	111.4	K189 E190 L191	K189-K193 WeakPolarHBondContact O-CG 3.36Å; K189-K193 PolarHBondContact O-N 3.22Å; E190-K193 WeakPolarHBondContact O-CB 3.27Å; E190-K193 PolarHBondContact O-N 3.37Å; L191-K193 VanDerWaalsContact C-N 3.25Å; L191-K193 PolarHBondContact O-N 2.94Å
194	I	96.4	Very high	97.7	Very high	37 Å²	37	29.7 Å²	29.7	19%	0.19	15%	0.149	C	C	.	.	H	α-helix	trans	-75.3	-36.5	-179.9	-62.2	-64.5	0	0	0	112	K166 E190 L191 P196	K166-I194 HydrophobicContact CB-CG2 3.97Å; K166-I194 HydrophobicContact CD-CG2 4.07Å; K166-I194 HydrophobicContact CG-CG2 3.7Å; E190-I194 WeakPolarHBondContact O-CG1 3.42Å; E190-I194 PolarHBondContact O-N 3.17Å; L191-I194 PolarHBondContact O-N 3.12Å; I194-P196 WeakPolarHBondContact O-CD 3.25Å
195	Y	96.3	Very high	97.6	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.008	17%	0.166	C	C	.	.			trans	-119	76.4	-179.4	-53.9	-72.1	0	0	0	109.6	D105 L106 W169 N170 L191 M192 N197 A198	D105-Y195 HydrophobicContact CB-CD1 3.75Å; D105-Y195 HydrophobicContact CB-CE1 4.09Å; L106-Y195 HydrophobicContact CB-CD1 4.28Å; L106-Y195 HydrophobicContact CB-CD2 3.92Å; L106-Y195 HydrophobicContact CB-CE2 4.19Å; L106-Y195 HydrophobicContact CB-CG 3.96Å; L106-Y195 HydrophobicContact CD1-CD2 4.02Å; L106-Y195 HydrophobicContact CD1-CE2 3.82Å; L106-Y195 HydrophobicContact CG-CD2 4.2Å; L106-Y195 HydrophobicContact CG-CE2 3.99Å; W169-Y195 HydrophobicContact CB-CE2 4.26Å; W169-Y195 WeakPolarHBondContact CB-OH 3.48Å; N170-Y195 PolarHBondContact OD1-OH 3.23Å; N170-Y195 VanDerWaalsContact OD1-OH 3.06Å; L191-Y195 HydrophobicContact CB-CD2 4.48Å; L191-Y195 HydrophobicContact CD2-CD2 4.25Å; L191-Y195 HydrophobicContact CD2-CE2 3.91Å; L191-Y195 WeakPolarHBondContact O-CD2 3.41Å; L191-Y195 PolarHBondContact O-N 2.87Å; M192-Y195 CarbonylContact O-C 3.59Å; Y195-N197 PolarHBondContact O-N 2.8Å; Y195-N197 VanDerWaalsContact O-N 3.14Å; Y195-A198 VanDerWaalsContact O-CB 3.29Å; Y195-A198 WeakPolarHBondContact O-CB 3.41Å; Y195-A198 PolarHBondContact O-N 3.29Å
196	P	96.3	Very high	97.5	Very high	76 Å²	76	38.2 Å²	38.2	49%	0.494	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22	-171.7	25.5	-35.4	0	0	0	113.8	M192 I194 R287	M192-P196 WeakPolarHBondContact O-CA 3.49Å; I194-P196 WeakPolarHBondContact O-CD 3.25Å; P196-R287 PolarHBondContact O-NH1 3.3Å; P196-R287 PolarHBondContact O-NH2 3.4Å; P196-R287 VanDerWaalsContact O-NH2 3.13Å
197	N	95.8	Very high	97.5	Very high	143 Å²	143	38.7 Å²	38.7	77%	0.765	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-3.5	178.4	-60.4	-30	0	0	0	113.2	Y195	Y195-N197 PolarHBondContact O-N 2.8Å; Y195-N197 VanDerWaalsContact O-N 3.14Å
198	A	97.5	Very high	97.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.			trans	-68.4	135.2	179.9	0	0	0	0	0	110.7	L106 F107 I109 Y195 R287	L106-A198 WeakPolarHBondContact O-CB 3.41Å; F107-A198 CarbonylContact O-C 3.57Å; F107-A198 WeakPolarHBondContact O-CA 3.44Å; I109-A198 HydrophobicContact CD1-CB 3.65Å; I109-A198 HydrophobicContact CG1-CB 3.99Å; Y195-A198 VanDerWaalsContact O-CB 3.29Å; Y195-A198 WeakPolarHBondContact O-CB 3.41Å; Y195-A198 PolarHBondContact O-N 3.29Å; A198-R287 VanDerWaalsContact O-CZ 3.27Å; A198-R287 PolarHBondContact O-NE 3.12Å; A198-R287 PolarHBondContact O-NH2 3.23Å
199	K	98.4	Very high	97.2	Very high	50 Å²	50	44.6 Å²	44.6	22%	0.217	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	153.5	166.2	-73.8	177.2	177.7	-175.8	0	109.6	F107 I108 I109 F303	F107-K199 HydrophobicContact CZ-CD 4.48Å; F107-K199 PolarHBondContact O-N 3.04Å; I108-K199 WeakPolarHBondContact CA-O 3.14Å; I108-K199 HydrophobicContact CD1-CB 3.75Å; I109-K199 PolarHBondContact N-O 3.41Å; K199-F303 HydrophobicContact CB-CE1 3.75Å; K199-F303 HydrophobicContact CB-CZ 3.67Å; K199-F303 HydrophobicContact CD-CD1 4.39Å; K199-F303 HydrophobicContact CD-CE1 3.81Å; K199-F303 HydrophobicContact CD-CE2 4.29Å; K199-F303 HydrophobicContact CD-CZ 3.76Å; K199-F303 HydrophobicContact CG-CE1 4.22Å; K199-F303 HydrophobicContact CG-CZ 3.9Å; K199-F303 PolarHBondContact NZ-O 2.87Å
200	V	98.8	Very high	97.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.4	-180	-176.3	0	0	0	0	109.5	I109 A111 M192 V283 R287 L288 L289	I109-V200 CarbonylContact O-C 3.57Å; I109-V200 VanDerWaalsContact O-CA 3.28Å; I109-V200 WeakPolarHBondContact O-CA 3.31Å; A111-V200 HydrophobicContact CB-CG1 3.77Å; M192-V200 HydrophobicContact CE-CG2 4.28Å; M192-V200 HydrophobicContact CG-CG2 3.93Å; M192-V200 HydrophobicContact SD-CG2 3.73Å; V200-V283 HydrophobicContact CB-CG1 3.94Å; V200-V283 HydrophobicContact CB-CG2 4.49Å; V200-V283 HydrophobicContact CG1-CG2 4.3Å; V200-V283 HydrophobicContact CG2-CG1 3.85Å; V200-V283 HydrophobicContact CG2-CG2 4.35Å; V200-R287 PolarHBondContact N-O 2.63Å; V200-L288 HydrophobicContact CB-CD1 4.23Å; V200-L288 HydrophobicContact CG1-CD1 4.08Å; V200-L288 WeakPolarHBondContact O-CA 3.41Å; V200-L289 PolarHBondContact O-N 3.45Å
201	I	98.8	Very high	97.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.8	172.4	-57.4	-179.7	0	0	0	108.5	I108 I109 G110 A111 L121 T203 L289 F291 L300 F303	I108-I201 HydrophobicContact CD1-CD1 4.3Å; I108-I201 HydrophobicContact CG2-CD1 3.74Å; I108-I201 HydrophobicContact CG2-CG1 3.94Å; I109-I201 PolarHBondContact O-N 3.39Å; G110-I201 WeakPolarHBondContact CA-O 3.22Å; A111-I201 PolarHBondContact N-O 2.83Å; L121-I201 HydrophobicContact CD1-CD1 4.07Å; L121-I201 HydrophobicContact CD1-CG2 4.4Å; L121-I201 HydrophobicContact CD2-CB 4.14Å; L121-I201 HydrophobicContact CD2-CG2 3.72Å; I201-T203 HydrophobicContact CG2-CG2 4.45Å; I201-L289 WeakPolarHBondContact CA-O 3.2Å; I201-L289 HydrophobicContact CD1-CD2 4.45Å; I201-L289 HydrophobicContact CG1-CB 4.31Å; I201-L289 HydrophobicContact CG1-CD2 4.41Å; I201-L289 HydrophobicContact CG2-CD2 4.33Å; I201-F291 HydrophobicContact CG2-CB 3.95Å; I201-F291 HydrophobicContact CG2-CD1 4.29Å; I201-F291 HydrophobicContact CG2-CG 4.5Å; I201-L300 HydrophobicContact CD1-CD1 3.6Å; I201-F303 HydrophobicContact CG1-CD1 4.42Å; I201-F303 HydrophobicContact CG1-CE1 3.98Å
202	L	98.9	Very high	97	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	101.9	172.2	174.4	56.5	0	0	0	108.7	V204 N276 I279 I280 L288 L289 F291	L202-V204 HydrophobicContact CD2-CG1 4.23Å; L202-V204 HydrophobicContact CG-CG1 3.88Å; L202-V204 PolarHBondContact O-N 3.28Å; L202-N276 HydrophobicContact CD2-CB 4.26Å; L202-I279 HydrophobicContact CB-CG2 4.26Å; L202-I279 HydrophobicContact CD1-CD1 3.82Å; L202-I279 HydrophobicContact CD1-CG2 4.5Å; L202-I279 HydrophobicContact CD2-CB 4.11Å; L202-I279 HydrophobicContact CD2-CG2 3.98Å; L202-I279 HydrophobicContact CG-CG2 4.47Å; L202-I280 HydrophobicContact CD2-CD1 4.22Å; L202-I280 HydrophobicContact CD2-CG1 3.81Å; L202-L288 HydrophobicContact CB-CD1 4.06Å; L202-L289 PolarHBondContact N-O 3.38Å; L202-F291 PolarHBondContact O-N 2.83Å
203	T	98.5	Very high	96.7	Very high	1 Å²	1	42 Å²	42	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.1	171.5	44.6	0	0	0	0	110.6	G112 T116 L121 I201 F291 P293	G112-T203 WeakPolarHBondContact CA-OG1 3.49Å; T116-T203 VanDerWaalsContact CB-O 3.32Å; T116-T203 WeakPolarHBondContact CB-O 3.44Å; T116-T203 WeakPolarHBondContact CG2-O 3.29Å; T116-T203 WeakPolarHBondContact OG1-CB 3.37Å; T116-T203 PolarHBondContact OG1-O 3.11Å; T116-T203 PolarHBondContact OG1-OG1 2.95Å; L121-T203 HydrophobicContact CB-CG2 4.34Å; L121-T203 HydrophobicContact CD2-CG2 3.76Å; I201-T203 HydrophobicContact CG2-CG2 4.45Å; T203-F291 CarbonylContact C-O 3.57Å; T203-F291 WeakPolarHBondContact CA-O 3.47Å; T203-F291 HydrophobicContact CG2-CD1 3.94Å; T203-P293 HydrophobicContact CG2-CG 4.18Å
204	V	97.8	Very high	96.5	Very high	31 Å²	31	34.6 Å²	34.6	19%	0.188	19%	0.19	C	C	.	.			trans	-115.1	163.1	-177.3	-63.8	0	0	0	0	111.8	L202 I290 F291 D292	L202-V204 HydrophobicContact CD2-CG1 4.23Å; L202-V204 HydrophobicContact CG-CG1 3.88Å; L202-V204 PolarHBondContact O-N 3.28Å; V204-I290 HydrophobicContact CB-CG2 4.47Å; V204-I290 HydrophobicContact CG1-CG2 3.76Å; V204-I290 HydrophobicContact CG2-CG2 3.85Å; V204-F291 PolarHBondContact N-O 3.12Å; V204-D292 HydrophobicContact CG2-CB 4.43Å
205	R	96	Very high	96.3	Very high	95 Å²	95	36 Å²	36	36%	0.358	19%	0.193	S	C	.	.			trans	-156.6	155.2	176.9	-170.9	178	-175.6	133.3	8.9	108.5	R115 T116 A207 W210 F272	R115-R205 PolarHBondContact O-NH1 3.44Å; T116-R205 HydrophobicContact CG2-CB 4.47Å; R205-A207 PolarHBondContact O-N 2.92Å; R205-W210 HydrophobicContact CB-CB 4.39Å; R205-W210 HydrophobicContact CG-CB 4.45Å; R205-F272 WeakPolarHBondContact O-CE1 3.41Å
206	D	97.1	Very high	95.8	Very high	84 Å²	84	36.7 Å²	36.7	45%	0.449	20%	0.2	S	C	.	.			trans	-47.1	130.6	161.6	168.9	-114.2	0	0	0	111.3	S209 W210	D206-S209 PolarHBondContact O-N 2.87Å; D206-S209 WeakPolarHBondContact OD1-CB 3.09Å; D206-S209 PolarHBondContact OD1-N 3.38Å; D206-S209 PolarHBondContact OD1-OG 2.88Å; D206-W210 WeakPolarHBondContact O-CB 3.32Å; D206-W210 PolarHBondContact O-N 2.96Å
207	A	97.4	Very high	95.4	Very high	14 Å²	14	33.1 Å²	33.1	12%	0.116	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-42.1	-167.8	0	0	0	0	0	111.9	R205 W210 V211 R269 F272 I273	R205-A207 PolarHBondContact O-N 2.92Å; A207-W210 WeakPolarHBondContact O-CB 3.42Å; A207-W210 PolarHBondContact O-N 2.97Å; A207-V211 WeakPolarHBondContact O-CG2 3.5Å; A207-V211 PolarHBondContact O-N 3.06Å; A207-R269 HydrophobicContact CB-CG 3.58Å; A207-F272 HydrophobicContact CB-CD1 4.05Å; A207-F272 HydrophobicContact CB-CE1 4.4Å; A207-I273 HydrophobicContact CB-CD1 4.19Å; A207-I273 HydrophobicContact CB-CG1 4.09Å
208	D	96.5	Very high	94.9	Very high	79 Å²	79	27.5 Å²	27.5	42%	0.422	15%	0.147	S	C	.	.	H	α-helix	trans	-64	-44.2	176.6	-74.2	-51.9	0	0	0	112.1	W210 V211 S212 R269	D208-W210 VanDerWaalsContact C-N 3.26Å; D208-W210 PolarHBondContact O-N 3.45Å; D208-V211 PolarHBondContact O-N 2.67Å; D208-S212 WeakPolarHBondContact O-CB 3.09Å; D208-S212 PolarHBondContact O-N 2.98Å; D208-S212 PolarHBondContact O-OG 3.41Å; D208-S212 VanDerWaalsContact O-OG 3.13Å; D208-R269 IonicContact OD1-CZ 3.7Å; D208-R269 IonicContact OD1-NE 3.1Å; D208-R269 PolarHBondContact OD1-NE 2.84Å; D208-R269 IonicContact OD1-NH2 2.88Å; D208-R269 PolarHBondContact OD1-NH2 2.72Å; D208-R269 IonicContact OD2-NE 2.66Å
209	S	95.2	Very high	94.2	Very high	49 Å²	49	27.5 Å²	27.5	34%	0.343	15%	0.148	S	C	.	.	H	α-helix	trans	-62.2	-35.5	174.1	-65.5	0	0	0	0	112.2	D206 S213	D206-S209 PolarHBondContact O-N 2.87Å; D206-S209 WeakPolarHBondContact OD1-CB 3.09Å; D206-S209 PolarHBondContact OD1-N 3.38Å; D206-S209 PolarHBondContact OD1-OG 2.88Å; S209-S213 WeakPolarHBondContact O-CB 3.41Å; S209-S213 PolarHBondContact O-N 3.39Å; S209-S213 VanDerWaalsContact O-N 3.11Å
210	W	96.3	Very high	93.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-68.3	-49.2	176.2	177.4	85.6	0	0	0	111.3	Q113 M114 R205 D206 A207 D208 S212 S213 C214 F256 L268 F272	Q113-W210 HydrophobicContact CB-CZ2 4.17Å; M114-W210 PolarHBondContact O-NE1 2.82Å; R205-W210 HydrophobicContact CB-CB 4.39Å; R205-W210 HydrophobicContact CG-CB 4.45Å; D206-W210 WeakPolarHBondContact O-CB 3.32Å; D206-W210 PolarHBondContact O-N 2.96Å; A207-W210 WeakPolarHBondContact O-CB 3.42Å; A207-W210 PolarHBondContact O-N 2.97Å; D208-W210 VanDerWaalsContact C-N 3.26Å; D208-W210 PolarHBondContact O-N 3.45Å; W210-S212 VanDerWaalsContact C-N 3.33Å; W210-S212 PolarHBondContact O-N 3.01Å; W210-S213 WeakPolarHBondContact O-CA 3.5Å; W210-S213 WeakPolarHBondContact O-CB 3.49Å; W210-S213 PolarHBondContact O-N 3.03Å; W210-C214 WeakPolarHBondContact CZ2-SG 3.02Å; W210-C214 PolarHBondContact O-N 3.32Å; W210-C214 PolarHBondContact O-SG 2.88Å; W210-F256 HydrophobicContact CH2-CE1 4.38Å; W210-F256 AromaticContact CH2-CZ 3.84Å; W210-F256 HydrophobicContact CH2-CZ 3.84Å; W210-F256 HydrophobicContact CZ2-CZ 4.11Å; W210-L268 HydrophobicContact CH2-CD1 3.86Å; W210-L268 HydrophobicContact CH2-CG 4.12Å; W210-L268 HydrophobicContact CZ3-CD1 4.02Å; W210-L268 HydrophobicContact CZ3-CD2 4.45Å; W210-L268 HydrophobicContact CZ3-CG 3.78Å; W210-F272 HydrophobicContact CB-CD1 4.36Å; W210-F272 HydrophobicContact CB-CE1 4.04Å; W210-F272 HydrophobicContact CB-CZ 4.35Å; W210-F272 HydrophobicContact CD2-CB 4.21Å; W210-F272 AromaticContact CD2-CD1 3.96Å; W210-F272 HydrophobicContact CD2-CD1 3.96Å; W210-F272 AromaticContact CD2-CD2 3.74Å; W210-F272 HydrophobicContact CD2-CD2 3.74Å; W210-F272 HydrophobicContact CD2-CE1 4.24Å; W210-F272 HydrophobicContact CD2-CE2 4.06Å; W210-F272 AromaticContact CD2-CG 3.69Å; W210-F272 HydrophobicContact CD2-CG 3.69Å; W210-F272 HydrophobicContact CD2-CZ 4.28Å; W210-F272 AromaticContact CE2-CD2 3.63Å; W210-F272 AromaticContact CE2-CE2 3.94Å; W210-F272 HydrophobicContact CE3-CB 3.59Å; W210-F272 AromaticContact CE3-CD1 3.86Å; W210-F272 HydrophobicContact CE3-CD1 3.86Å; W210-F272 HydrophobicContact CE3-CD2 4.02Å; W210-F272 AromaticContact CE3-CG 3.54Å; W210-F272 HydrophobicContact CE3-CG 3.54Å; W210-F272 HydrophobicContact CG-CD1 4.18Å; W210-F272 HydrophobicContact CG-CD2 4.28Å; W210-F272 HydrophobicContact CG-CE1 4Å; W210-F272 HydrophobicContact CG-CE2 4.12Å; W210-F272 HydrophobicContact CG-CG 4.31Å; W210-F272 AromaticContact CG-CZ 3.97Å; W210-F272 HydrophobicContact CG-CZ 3.97Å; W210-F272 HydrophobicContact CH2-CB 3.77Å; W210-F272 HydrophobicContact CH2-CD2 4.14Å; W210-F272 HydrophobicContact CH2-CG 4.15Å; W210-F272 HydrophobicContact CZ2-CB 4.36Å; W210-F272 AromaticContact CZ2-CD2 3.86Å; W210-F272 HydrophobicContact CZ2-CD2 3.86Å; W210-F272 HydrophobicContact CZ2-CG 4.28Å; W210-F272 HydrophobicContact CZ3-CB 3.34Å; W210-F272 HydrophobicContact CZ3-CD1 4.5Å; W210-F272 HydrophobicContact CZ3-CD2 4.21Å; W210-F272 AromaticContact CZ3-CG 3.79Å; W210-F272 HydrophobicContact CZ3-CG 3.79Å; W210-F272 AromaticContact NE1-CE2 3.91Å
211	V	96.3	Very high	92.5	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-55.3	-50	176.3	170.7	0	0	0	0	110.5	A207 D208 S213 C214 R215 D265 L268 R269	A207-V211 WeakPolarHBondContact O-CG2 3.5Å; A207-V211 PolarHBondContact O-N 3.06Å; D208-V211 PolarHBondContact O-N 2.67Å; V211-S213 VanDerWaalsContact C-N 3.27Å; V211-S213 PolarHBondContact O-N 3.4Å; V211-C214 PolarHBondContact O-N 2.71Å; V211-C214 VanDerWaalsContact O-N 3.13Å; V211-R215 HydrophobicContact CG1-CG 4.3Å; V211-R215 WeakPolarHBondContact O-CG 3.21Å; V211-R215 PolarHBondContact O-N 3.43Å; V211-D265 HydrophobicContact CG1-CB 3.92Å; V211-L268 HydrophobicContact CG1-CD2 4.46Å; V211-L268 HydrophobicContact CG2-CG 4.43Å; V211-R269 HydrophobicContact CG2-CB 3.85Å; V211-R269 HydrophobicContact CG2-CG 4.4Å
212	S	93.8	Very high	91.3	Very high	55 Å²	55	32.8 Å²	32.8	39%	0.385	18%	0.179	S	C	.	.	H	α-helix	trans	-53.9	-44.4	175.7	-70.9	0	0	0	0	112.2	D208 W210 A216 R320	D208-S212 WeakPolarHBondContact O-CB 3.09Å; D208-S212 PolarHBondContact O-N 2.98Å; D208-S212 PolarHBondContact O-OG 3.41Å; D208-S212 VanDerWaalsContact O-OG 3.13Å; W210-S212 VanDerWaalsContact C-N 3.33Å; W210-S212 PolarHBondContact O-N 3.01Å; S212-A216 PolarHBondContact O-N 3.5Å; S212-R320 PolarHBondContact O-NE 2.8Å; S212-R320 PolarHBondContact O-NH2 3.21Å
213	S	92.7	Very high	90.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-44.4	178.5	-170.1	0	0	0	0	112	R115 S209 W210 V211 A216 T217	R115-S213 PolarHBondContact NE-OG 2.7Å; S209-S213 WeakPolarHBondContact O-CB 3.41Å; S209-S213 PolarHBondContact O-N 3.39Å; S209-S213 VanDerWaalsContact O-N 3.11Å; W210-S213 WeakPolarHBondContact O-CA 3.5Å; W210-S213 WeakPolarHBondContact O-CB 3.49Å; W210-S213 PolarHBondContact O-N 3.03Å; V211-S213 VanDerWaalsContact C-N 3.27Å; V211-S213 PolarHBondContact O-N 3.4Å; S213-A216 PolarHBondContact O-N 2.93Å; S213-T217 PolarHBondContact O-N 3Å; S213-T217 PolarHBondContact O-OG1 3.4Å
214	C	92.6	Very high	89.6	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-52.6	177.4	-74.2	0	0	0	0	111.2	W210 V211 A216 T217 T218 A219	W210-C214 WeakPolarHBondContact CZ2-SG 3.02Å; W210-C214 PolarHBondContact O-N 3.32Å; W210-C214 PolarHBondContact O-SG 2.88Å; V211-C214 PolarHBondContact O-N 2.71Å; V211-C214 VanDerWaalsContact O-N 3.13Å; C214-A216 VanDerWaalsContact C-N 3.25Å; C214-A216 PolarHBondContact O-N 3.44Å; C214-T217 CarbonylContact O-C 3.56Å; C214-T217 VanDerWaalsContact O-C 3.27Å; C214-T217 PolarHBondContact O-N 3.04Å; C214-T218 PolarHBondContact O-N 3.49Å; C214-T218 VanDerWaalsContact O-N 3.08Å; C214-A219 HydrophobicContact CB-CB 3.89Å; C214-A219 CarbonylContact O-C 3.54Å; C214-A219 WeakPolarHBondContact O-CA 3.33Å; C214-A219 PolarHBondContact O-N 3.32Å
215	R	90.7	Very high	88.6	Confident	66 Å²	66	35.7 Å²	35.7	25%	0.249	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-34.4	179.8	-69.8	-59.3	-168.6	-167.7	-1.3	114.1	V211 T217 S220 M263 T264 D265	V211-R215 HydrophobicContact CG1-CG 4.3Å; V211-R215 WeakPolarHBondContact O-CG 3.21Å; V211-R215 PolarHBondContact O-N 3.43Å; R215-T217 VanDerWaalsContact C-N 3.26Å; R215-T217 PolarHBondContact O-N 2.89Å; R215-S220 WeakPolarHBondContact O-CA 3.2Å; R215-S220 WeakPolarHBondContact O-CB 3.13Å; R215-M263 PolarHBondContact NH2-O 3.3Å; R215-T264 PolarHBondContact NH2-O 3.15Å; R215-D265 IonicContact CZ-OD1 2.67Å; R215-D265 VanDerWaalsContact CZ-OD1 3.28Å; R215-D265 IonicContact NE-OD1 2.63Å; R215-D265 PolarHBondContact NE-OD1 2.81Å; R215-D265 IonicContact NH2-OD1 3Å; R215-D265 PolarHBondContact NH2-OD1 2.93Å
216	A	87.6	Confident	87.8	Confident	18 Å²	18	35 Å²	35	15%	0.149	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.1	175.9	0	0	0	0	0	114.4	S212 S213 C214 R320	S212-A216 PolarHBondContact O-N 3.5Å; S213-A216 PolarHBondContact O-N 2.93Å; C214-A216 VanDerWaalsContact C-N 3.25Å; C214-A216 PolarHBondContact O-N 3.44Å; A216-R320 HydrophobicContact CB-CG 4.13Å
217	T	86.7	Confident	86.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.1	-93.6	-171.7	59.6	0	0	0	0	112.1	R115 S213 C214 R215 A219 S220 R320 L323 R324 L327	R115-T217 WeakPolarHBondContact CD-OG1 3.1Å; R115-T217 PolarHBondContact NE-OG1 2.82Å; S213-T217 PolarHBondContact O-N 3Å; S213-T217 PolarHBondContact O-OG1 3.4Å; C214-T217 CarbonylContact O-C 3.56Å; C214-T217 VanDerWaalsContact O-C 3.27Å; C214-T217 PolarHBondContact O-N 3.04Å; R215-T217 VanDerWaalsContact C-N 3.26Å; R215-T217 PolarHBondContact O-N 2.89Å; T217-A219 VanDerWaalsContact C-N 3.34Å; T217-A219 PolarHBondContact O-N 3.31Å; T217-S220 WeakPolarHBondContact O-CB 3.49Å; T217-S220 PolarHBondContact O-N 2.84Å; T217-S220 PolarHBondContact O-OG 3.39Å; T217-R320 HydrophobicContact CG2-CG 4.24Å; T217-L323 HydrophobicContact CG2-CB 3.91Å; T217-L323 HydrophobicContact CG2-CD2 3.93Å; T217-L323 HydrophobicContact CG2-CG 3.88Å; T217-R324 HydrophobicContact CG2-CB 4.32Å; T217-L327 WeakPolarHBondContact O-CD1 3.22Å
218	T	84.8	Confident	86.2	Confident	25 Å²	25	39.5 Å²	39.5	15%	0.153	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-17.3	-166.1	52	0	0	0	0	114.8	M114 R115 C214 V223 H248 Y252 L323	M114-T218 HydrophobicContact CG-CG2 4.38Å; M114-T218 WeakPolarHBondContact SD-CB 3.35Å; M114-T218 HydrophobicContact SD-CG2 3.51Å; M114-T218 VanDerWaalsContact SD-CG2 3.51Å; M114-T218 PolarHBondContact SD-OG1 2.77Å; R115-T218 HydrophobicContact CG-CG2 4.31Å; R115-T218 WeakPolarHBondContact CG-OG1 3.19Å; C214-T218 PolarHBondContact O-N 3.49Å; C214-T218 VanDerWaalsContact O-N 3.08Å; T218-V223 WeakPolarHBondContact O-CG1 3.4Å; T218-H248 PolarHBondContact O-NE2 3.19Å; T218-Y252 VanDerWaalsContact C-OH 3.28Å; T218-Y252 WeakPolarHBondContact CB-OH 3.37Å; T218-Y252 PolarHBondContact O-OH 3.44Å; T218-L323 HydrophobicContact CG2-CD2 4.25Å
219	A	84.4	Confident	85.7	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	32.3	171.8	0	0	0	0	0	111.4	C214 T217 M224 Y252	C214-A219 HydrophobicContact CB-CB 3.89Å; C214-A219 CarbonylContact O-C 3.54Å; C214-A219 WeakPolarHBondContact O-CA 3.33Å; C214-A219 PolarHBondContact O-N 3.32Å; T217-A219 VanDerWaalsContact C-N 3.34Å; T217-A219 PolarHBondContact O-N 3.31Å; A219-M224 VanDerWaalsContact CA-CG 3.43Å; A219-M224 VanDerWaalsContact CA-SD 3.57Å; A219-M224 HydrophobicContact CB-CG 4.01Å; A219-M224 HydrophobicContact CB-SD 3.7Å; A219-M224 WeakPolarHBondContact O-CG 3.23Å; A219-Y252 HydrophobicContact CB-CE1 4.35Å
220	S	83.3	Confident	85.2	Confident	21 Å²	21	42.8 Å²	42.8	15%	0.147	22%	0.224	C	C	.	.	S	Bend	trans	-75.8	156.5	170.6	61	0	0	0	0	110.9	R215 T217 M222 V223 M224	R215-S220 WeakPolarHBondContact O-CA 3.2Å; R215-S220 WeakPolarHBondContact O-CB 3.13Å; T217-S220 WeakPolarHBondContact O-CB 3.49Å; T217-S220 PolarHBondContact O-N 2.84Å; T217-S220 PolarHBondContact O-OG 3.39Å; S220-M222 PolarHBondContact O-N 2.82Å; S220-M222 VanDerWaalsContact O-N 3.09Å; S220-V223 CarbonylContact O-C 3.49Å; S220-V223 WeakPolarHBondContact O-CA 3.17Å; S220-V223 PolarHBondContact O-N 3.19Å; S220-V223 WeakPolarHBondContact OG-CG2 3.4Å; S220-M224 WeakPolarHBondContact O-CB 3.5Å; S220-M224 WeakPolarHBondContact O-CG 3.28Å; S220-M224 PolarHBondContact O-N 2.75Å
221	D	76.4	Confident	84.6	Confident	118 Å²	118	42.8 Å²	42.8	63%	0.631	22%	0.224	S	C	*	.	H	α-helix	trans	-51.4	-39.6	-177.8	-52	-21.3	0	0	0	113.7	V223 M224 T225	D221-V223 PolarHBondContact O-N 3.04Å; D221-M224 PolarHBondContact O-N 3.44Å; D221-T225 WeakPolarHBondContact O-CB 3.32Å; D221-T225 PolarHBondContact O-N 2.92Å
222	M	75.1	Confident	84.2	Confident	21 Å²	21	43.9 Å²	43.9	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-31.7	178.3	-176.3	-171.1	71.5	0	0	112.2	S220 T225 L327 R331	S220-M222 PolarHBondContact O-N 2.82Å; S220-M222 VanDerWaalsContact O-N 3.09Å; M222-T225 WeakPolarHBondContact O-CG2 3.1Å; M222-L327 HydrophobicContact CE-CB 3.74Å; M222-L327 HydrophobicContact CE-CD2 3.54Å; M222-L327 HydrophobicContact CE-CG 4.18Å; M222-R331 HydrophobicContact SD-CB 3.65Å; M222-R331 HydrophobicContact SD-CG 4.33Å
223	V	80.2	Confident	83.9	Confident	24 Å²	24	44 Å²	44	15%	0.145	23%	0.225	C	C	.	.	H	α-helix	trans	-93.2	-31.6	-176.7	176.5	0	0	0	0	111	T218 S220 D221 H248 L327	T218-V223 WeakPolarHBondContact O-CG1 3.4Å; S220-V223 CarbonylContact O-C 3.49Å; S220-V223 WeakPolarHBondContact O-CA 3.17Å; S220-V223 PolarHBondContact O-N 3.19Å; S220-V223 WeakPolarHBondContact OG-CG2 3.4Å; D221-V223 PolarHBondContact O-N 3.04Å; V223-H248 WeakPolarHBondContact CG1-NE2 3.11Å; V223-H248 PolarHBondContact O-CE1 3.07Å; V223-H248 PolarHBondContact O-ND1 3.36Å; V223-L327 HydrophobicContact CG2-CD1 4.43Å; V223-L327 HydrophobicContact CG2-CD2 4.17Å
224	M	80.2	Confident	83.8	Confident	12 Å²	12	46.5 Å²	46.5	6%	0.059	24%	0.238	C	C	.	.	H	α-helix	trans	-83.7	-15.2	-178.7	-67	-67.9	-61.6	0	0	113.8	A219 S220 D221 K226 Y252 Y260 D261	A219-M224 VanDerWaalsContact CA-CG 3.43Å; A219-M224 VanDerWaalsContact CA-SD 3.57Å; A219-M224 HydrophobicContact CB-CG 4.01Å; A219-M224 HydrophobicContact CB-SD 3.7Å; A219-M224 WeakPolarHBondContact O-CG 3.23Å; S220-M224 WeakPolarHBondContact O-CB 3.5Å; S220-M224 WeakPolarHBondContact O-CG 3.28Å; S220-M224 PolarHBondContact O-N 2.75Å; D221-M224 PolarHBondContact O-N 3.44Å; M224-K226 PolarHBondContact O-N 2.94Å; M224-Y252 HydrophobicContact CE-CD1 4.48Å; M224-Y252 HydrophobicContact SD-CD1 3.99Å; M224-Y252 HydrophobicContact SD-CE1 3.79Å; M224-Y260 HydrophobicContact CE-CD2 3.18Å; M224-Y260 HydrophobicContact CE-CE2 3.56Å; M224-Y260 HydrophobicContact CE-CG 4.28Å; M224-Y260 WeakPolarHBondContact CE-O 3.47Å; M224-Y260 HydrophobicContact SD-CD2 3.91Å; M224-Y260 HydrophobicContact SD-CE2 3.91Å; M224-D261 HydrophobicContact CE-CB 4.34Å; M224-D261 WeakPolarHBondContact O-CB 3.25Å
225	T	76.8	Confident	83.6	Confident	57 Å²	57	47 Å²	47	35%	0.35	24%	0.24	S	C	.	.			trans	-65.5	123	176.1	-178	0	0	0	0	110.9	D221 M222 H227	D221-T225 WeakPolarHBondContact O-CB 3.32Å; D221-T225 PolarHBondContact O-N 2.92Å; M222-T225 WeakPolarHBondContact O-CG2 3.1Å; T225-H227 WeakPolarHBondContact CG2-O 3.2Å; T225-H227 PolarHBondContact O-N 3.38Å; T225-H227 PolarHBondContact OG1-N 2.87Å; T225-H227 PolarHBondContact OG1-O 3.22Å
226	K	79.6	Confident	83.6	Confident	80 Å²	80	45.5 Å²	45.5	35%	0.348	24%	0.235	S	C	.	.	S	Bend	trans	-67.1	-19.9	171.7	-72.3	176.1	173.1	152.8	0	112.8	M224 D249 P258 D261	M224-K226 PolarHBondContact O-N 2.94Å; K226-D249 WeakPolarHBondContact CE-OD1 3.37Å; K226-P258 PolarHBondContact NZ-O 2.82Å; K226-D261 WeakPolarHBondContact CD-OD2 3.41Å; K226-D261 WeakPolarHBondContact CE-OD1 3.44Å; K226-D261 VanDerWaalsContact NZ-CG 3.25Å; K226-D261 IonicContact NZ-OD1 2.72Å; K226-D261 PolarHBondContact NZ-OD1 3.25Å; K226-D261 IonicContact NZ-OD2 3.26Å; K226-D261 PolarHBondContact NZ-OD2 2.73Å
227	H	78.6	Confident	83.9	Confident	158 Å²	158	52.9 Å²	52.9	73%	0.731	26%	0.259	S	S	*	.	S	Bend	trans	-113.2	114.8	-179.2	-60.5	-61.4	0	0	0	110.3	T225	T225-H227 WeakPolarHBondContact CG2-O 3.2Å; T225-H227 PolarHBondContact O-N 3.38Å; T225-H227 PolarHBondContact OG1-N 2.87Å; T225-H227 PolarHBondContact OG1-O 3.22Å
228	T	82.6	Confident	84	Confident	36 Å²	36	59.7 Å²	59.7	22%	0.221	29%	0.294	C	S	.	.			trans	-83.7	138.6	170.2	47.3	0	0	0	0	110.7	E232 N233 Y236 P245	T228-E232 HydrophobicContact CG2-CB 4.49Å; T228-N233 WeakPolarHBondContact CB-OD1 3.27Å; T228-N233 PolarHBondContact O-ND2 3.49Å; T228-N233 PolarHBondContact OG1-ND2 3.39Å; T228-N233 PolarHBondContact OG1-OD1 3.31Å; T228-Y236 HydrophobicContact CG2-CD2 4.36Å; T228-Y236 HydrophobicContact CG2-CE2 3.92Å; T228-P245 HydrophobicContact CG2-CB 3.88Å; T228-P245 HydrophobicContact CG2-CG 3.65Å
229	T	85.4	Confident	84.3	Confident	57 Å²	57	61.7 Å²	61.7	35%	0.35	30%	0.299	S	S	.	.			trans	-66.1	162.4	169.7	63.4	0	0	0	0	111	T231 E232 N233	T229-T231 VanDerWaalsContact C-N 3.27Å; T229-T231 PolarHBondContact O-N 3.04Å; T229-T231 PolarHBondContact OG1-OG1 2.83Å; T229-E232 WeakPolarHBondContact CB-OE2 3.09Å; T229-E232 WeakPolarHBondContact CG2-OE2 3.13Å; T229-E232 PolarHBondContact N-OE2 3.46Å; T229-E232 PolarHBondContact O-N 3.3Å; T229-E232 WeakPolarHBondContact OG1-CB 3.24Å; T229-E232 WeakPolarHBondContact OG1-CG 3.35Å; T229-E232 PolarHBondContact OG1-N 2.82Å; T229-E232 PolarHBondContact OG1-OE2 2.96Å; T229-N233 PolarHBondContact O-N 3Å; T229-N233 PolarHBondContact O-ND2 3.47Å
230	F	85.4	Confident	84.7	Confident	140 Å²	140	62.8 Å²	62.8	61%	0.614	31%	0.311	S	S	*	.	H	α-helix	trans	-54.7	-42.2	177	174.8	-107.5	0	0	0	112.8	N233 I234 L341	F230-N233 WeakPolarHBondContact O-CB 3.48Å; F230-N233 PolarHBondContact O-N 2.77Å; F230-I234 HydrophobicContact CD1-CD1 3.91Å; F230-I234 HydrophobicContact CE1-CD1 3.36Å; F230-I234 HydrophobicContact CE1-CG1 4.44Å; F230-I234 HydrophobicContact CE2-CD1 4.3Å; F230-I234 HydrophobicContact CZ-CD1 3.59Å; F230-I234 HydrophobicContact CZ-CG1 4.38Å; F230-I234 WeakPolarHBondContact O-CG1 3.47Å; F230-I234 PolarHBondContact O-N 3.09Å; F230-I234 VanDerWaalsContact O-N 3.07Å; F230-L341 HydrophobicContact CD1-CD1 3.93Å; F230-L341 HydrophobicContact CE1-CD1 3.9Å
231	T	84.3	Confident	85.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-76.1	-34.5	-179.5	52	0	0	0	0	113.3	T229 N233 I234 I235 A334 L337 N338 L341	T229-T231 VanDerWaalsContact C-N 3.27Å; T229-T231 PolarHBondContact O-N 3.04Å; T229-T231 PolarHBondContact OG1-OG1 2.83Å; T231-N233 VanDerWaalsContact C-N 3.28Å; T231-N233 PolarHBondContact O-N 2.86Å; T231-I234 WeakPolarHBondContact O-CB 3.42Å; T231-I234 PolarHBondContact O-N 3.46Å; T231-I234 VanDerWaalsContact O-N 3.17Å; T231-I235 WeakPolarHBondContact O-CG1 3.44Å; T231-I235 PolarHBondContact O-N 2.95Å; T231-A334 PolarHBondContact OG1-O 2.92Å; T231-L337 HydrophobicContact CG2-CB 3.65Å; T231-N338 VanDerWaalsContact CB-OD1 3.32Å; T231-N338 WeakPolarHBondContact CB-OD1 3.14Å; T231-N338 HydrophobicContact CG2-CB 4.46Å; T231-N338 WeakPolarHBondContact CG2-OD1 2.94Å; T231-N338 PolarHBondContact OG1-ND2 3.07Å; T231-N338 PolarHBondContact OG1-OD1 3.21Å; T231-L341 HydrophobicContact CG2-CD1 3.61Å
232	E	86.8	Confident	86.1	Confident	28 Å²	28	61.6 Å²	61.6	13%	0.131	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-44	169.6	-74.9	163.6	158.4	0	0	110.3	T228 T229 I234 I235 Y236 A334	T228-E232 HydrophobicContact CG2-CB 4.49Å; T229-E232 WeakPolarHBondContact CB-OE2 3.09Å; T229-E232 WeakPolarHBondContact CG2-OE2 3.13Å; T229-E232 PolarHBondContact N-OE2 3.46Å; T229-E232 PolarHBondContact O-N 3.3Å; T229-E232 WeakPolarHBondContact OG1-CB 3.24Å; T229-E232 WeakPolarHBondContact OG1-CG 3.35Å; T229-E232 PolarHBondContact OG1-N 2.82Å; T229-E232 PolarHBondContact OG1-OE2 2.96Å; E232-I234 VanDerWaalsContact C-N 3.31Å; E232-I234 PolarHBondContact O-N 3.38Å; E232-I235 PolarHBondContact O-N 2.99Å; E232-I235 VanDerWaalsContact O-N 3.12Å; E232-Y236 HydrophobicContact CB-CD2 4.43Å; E232-Y236 HydrophobicContact CB-CE2 4.3Å; E232-Y236 WeakPolarHBondContact O-CD2 3.43Å; E232-Y236 PolarHBondContact O-N 3.16Å; E232-A334 HydrophobicContact CG-CB 3.84Å
233	N	88.3	Confident	87.1	Confident	58 Å²	58	61.3 Å²	61.3	31%	0.31	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-38.3	174.7	-76.1	-38.2	0	0	0	112.9	T228 T229 F230 T231 R237	T228-N233 WeakPolarHBondContact CB-OD1 3.27Å; T228-N233 PolarHBondContact O-ND2 3.49Å; T228-N233 PolarHBondContact OG1-ND2 3.39Å; T228-N233 PolarHBondContact OG1-OD1 3.31Å; T229-N233 PolarHBondContact O-N 3Å; T229-N233 PolarHBondContact O-ND2 3.47Å; F230-N233 WeakPolarHBondContact O-CB 3.48Å; F230-N233 PolarHBondContact O-N 2.77Å; T231-N233 VanDerWaalsContact C-N 3.28Å; T231-N233 PolarHBondContact O-N 2.86Å; N233-R237 VanDerWaalsContact O-CB 3.32Å; N233-R237 WeakPolarHBondContact O-CB 3.41Å; N233-R237 PolarHBondContact O-N 2.97Å
234	I	89.4	Confident	87.8	Confident	53 Å²	53	61.2 Å²	61.2	27%	0.272	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-47.9	172.1	-70.3	170.6	0	0	0	110.5	F230 T231 E232 Y236 R237 L238	F230-I234 HydrophobicContact CD1-CD1 3.91Å; F230-I234 HydrophobicContact CE1-CD1 3.36Å; F230-I234 HydrophobicContact CE1-CG1 4.44Å; F230-I234 HydrophobicContact CE2-CD1 4.3Å; F230-I234 HydrophobicContact CZ-CD1 3.59Å; F230-I234 HydrophobicContact CZ-CG1 4.38Å; F230-I234 WeakPolarHBondContact O-CG1 3.47Å; F230-I234 PolarHBondContact O-N 3.09Å; F230-I234 VanDerWaalsContact O-N 3.07Å; T231-I234 WeakPolarHBondContact O-CB 3.42Å; T231-I234 PolarHBondContact O-N 3.46Å; T231-I234 VanDerWaalsContact O-N 3.17Å; E232-I234 VanDerWaalsContact C-N 3.31Å; E232-I234 PolarHBondContact O-N 3.38Å; I234-Y236 PolarHBondContact O-N 3.13Å; I234-R237 PolarHBondContact O-N 3.38Å; I234-L238 HydrophobicContact CG2-CD1 3.76Å; I234-L238 HydrophobicContact CG2-CG 4.14Å; I234-L238 WeakPolarHBondContact O-CB 3.32Å; I234-L238 WeakPolarHBondContact O-CG 3.49Å; I234-L238 PolarHBondContact O-N 3.26Å
235	I	88.7	Confident	88.4	Confident	14 Å²	14	62 Å²	62	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-45	-179.7	-70.1	165.2	0	0	0	110.8	T231 E232 R237 L238 R239 L333 A334 L337	T231-I235 WeakPolarHBondContact O-CG1 3.44Å; T231-I235 PolarHBondContact O-N 2.95Å; E232-I235 PolarHBondContact O-N 2.99Å; E232-I235 VanDerWaalsContact O-N 3.12Å; I235-R237 PolarHBondContact O-N 2.94Å; I235-L238 PolarHBondContact O-N 3.29Å; I235-R239 WeakPolarHBondContact O-CB 3.35Å; I235-R239 VanDerWaalsContact O-CG 3.25Å; I235-R239 WeakPolarHBondContact O-CG 3.24Å; I235-R239 PolarHBondContact O-N 2.87Å; I235-R239 VanDerWaalsContact O-N 3.09Å; I235-L333 HydrophobicContact CD1-CB 4.33Å; I235-L333 HydrophobicContact CD1-CD2 4.26Å; I235-L333 HydrophobicContact CD1-CG 4.07Å; I235-L333 HydrophobicContact CG1-CD2 4.43Å; I235-A334 HydrophobicContact CD1-CB 3.63Å; I235-L337 HydrophobicContact CD1-CD1 4.22Å; I235-L337 HydrophobicContact CG1-CD1 4.19Å
236	Y	91	Very high	89.3	Confident	34 Å²	34	63.6 Å²	63.6	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-45.3	175.5	-78.3	-60.2	0	0	0	111.5	T228 E232 I234 R239 G240 L241 K242 L244 P245	T228-Y236 HydrophobicContact CG2-CD2 4.36Å; T228-Y236 HydrophobicContact CG2-CE2 3.92Å; E232-Y236 HydrophobicContact CB-CD2 4.43Å; E232-Y236 HydrophobicContact CB-CE2 4.3Å; E232-Y236 WeakPolarHBondContact O-CD2 3.43Å; E232-Y236 PolarHBondContact O-N 3.16Å; I234-Y236 PolarHBondContact O-N 3.13Å; Y236-R239 PolarHBondContact O-N 2.86Å; Y236-G240 PolarHBondContact O-N 3.45Å; Y236-L241 WeakPolarHBondContact CB-O 3.34Å; Y236-L241 HydrophobicContact CD1-CB 4.22Å; Y236-L241 CarbonylContact O-C 3.46Å; Y236-L241 WeakPolarHBondContact O-CA 3.48Å; Y236-L241 PolarHBondContact O-N 3.44Å; Y236-K242 PolarHBondContact O-N 3.45Å; Y236-L244 HydrophobicContact CD1-CB 4.34Å; Y236-L244 HydrophobicContact CD1-CD2 4.46Å; Y236-L244 HydrophobicContact CE1-CB 4.37Å; Y236-L244 HydrophobicContact CE1-CD2 4.04Å; Y236-L244 HydrophobicContact CE1-CG 4.49Å; Y236-P245 HydrophobicContact CD2-CG 3.77Å; Y236-P245 HydrophobicContact CE1-CG 4.46Å; Y236-P245 HydrophobicContact CE2-CG 3.63Å; Y236-P245 HydrophobicContact CG-CG 4.28Å
237	R	93	Very high	90	Very high	172 Å²	172	59.8 Å²	59.8	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-62.8	-45.5	177.8	-177.2	175.1	-81.2	135.5	-5.7	112.3	N233 I234 I235 R239 G240 K242	N233-R237 VanDerWaalsContact O-CB 3.32Å; N233-R237 WeakPolarHBondContact O-CB 3.41Å; N233-R237 PolarHBondContact O-N 2.97Å; I234-R237 PolarHBondContact O-N 3.38Å; I235-R237 PolarHBondContact O-N 2.94Å; R237-R239 PolarHBondContact O-N 2.89Å; R237-G240 PolarHBondContact O-N 3.23Å; R237-K242 HydrophobicContact CB-CB 4.35Å
238	L	90.6	Very high	90.8	Very high	143 Å²	143	53.4 Å²	53.4	75%	0.749	26%	0.261	S	S	*	.	H	α-helix	trans	-64.1	-24	178	-70.6	177.1	0	0	0	113	I234 I235	I234-L238 HydrophobicContact CG2-CD1 3.76Å; I234-L238 HydrophobicContact CG2-CG 4.14Å; I234-L238 WeakPolarHBondContact O-CB 3.32Å; I234-L238 WeakPolarHBondContact O-CG 3.49Å; I234-L238 PolarHBondContact O-N 3.26Å; I235-L238 PolarHBondContact O-N 3.29Å
239	R	90.8	Very high	91.3	Very high	68 Å²	68	53.8 Å²	53.8	26%	0.257	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.4	175.9	-69.4	176.6	62.3	-161.1	-5.8	113.9	I235 Y236 R237 L241 Y330	I235-R239 WeakPolarHBondContact O-CB 3.35Å; I235-R239 VanDerWaalsContact O-CG 3.25Å; I235-R239 WeakPolarHBondContact O-CG 3.24Å; I235-R239 PolarHBondContact O-N 2.87Å; I235-R239 VanDerWaalsContact O-N 3.09Å; Y236-R239 PolarHBondContact O-N 2.86Å; R237-R239 PolarHBondContact O-N 2.89Å; R239-L241 VanDerWaalsContact C-N 3.32Å; R239-L241 HydrophobicContact CB-CB 4.48Å; R239-L241 HydrophobicContact CB-CD1 4.02Å; R239-L241 HydrophobicContact CB-CG 4.23Å; R239-Y330 VanDerWaalsContact NH1-CE2 3.33Å
240	G	92.5	Very high	91.8	Very high	24 Å²	24	51.3 Å²	51.3	25%	0.247	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	28.1	-173.8	0	0	0	0	0	113.4	E145 Y236 R237	E145-G240 WeakPolarHBondContact CB-O 3.49Å; E145-G240 PolarHBondContact N-O 2.9Å; E145-G240 VanDerWaalsContact N-O 3.11Å; Y236-G240 PolarHBondContact O-N 3.45Å; R237-G240 PolarHBondContact O-N 3.23Å
241	L	94.7	Very high	92.3	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	22%	0.218	C	C	.	.			trans	-129.8	32.8	-172.8	-61.4	172.1	0	0	0	111.5	I140 Q144 I148 Y236 R239 S243 L244	I140-L241 HydrophobicContact CG2-CD1 4.14Å; Q144-L241 HydrophobicContact CB-CD2 4.26Å; Q144-L241 HydrophobicContact CG-CD2 4.43Å; I148-L241 HydrophobicContact CD1-CD2 3.57Å; Y236-L241 WeakPolarHBondContact CB-O 3.34Å; Y236-L241 HydrophobicContact CD1-CB 4.22Å; Y236-L241 CarbonylContact O-C 3.46Å; Y236-L241 WeakPolarHBondContact O-CA 3.48Å; Y236-L241 PolarHBondContact O-N 3.44Å; R239-L241 VanDerWaalsContact C-N 3.32Å; R239-L241 HydrophobicContact CB-CB 4.48Å; R239-L241 HydrophobicContact CB-CD1 4.02Å; R239-L241 HydrophobicContact CB-CG 4.23Å; L241-S243 PolarHBondContact O-N 2.96Å; L241-S243 VanDerWaalsContact O-N 3.14Å; L241-L244 HydrophobicContact CB-CB 4.05Å; L241-L244 HydrophobicContact CB-CD2 4.27Å; L241-L244 HydrophobicContact CD1-CD2 4.13Å; L241-L244 VanDerWaalsContact O-CB 3.27Å; L241-L244 WeakPolarHBondContact O-CB 3.45Å; L241-L244 PolarHBondContact O-N 3.36Å
242	K	94.7	Very high	92.8	Very high	111 Å²	111	44.9 Å²	44.9	48%	0.483	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.9	-171.6	62.5	173.3	-176.8	-178.3	0	112.7	E145 Y236 R237	E145-K242 VanDerWaalsContact CD-CG 3.41Å; E145-K242 HydrophobicContact CG-CG 4.36Å; E145-K242 WeakPolarHBondContact OE1-CE 3.29Å; E145-K242 WeakPolarHBondContact OE1-CG 3.43Å; E145-K242 WeakPolarHBondContact OE2-CG 3.41Å; E145-K242 PolarHBondContact OE2-N 3.43Å; Y236-K242 PolarHBondContact O-N 3.45Å; R237-K242 HydrophobicContact CB-CB 4.35Å
243	S	95.8	Very high	93.2	Very high	16 Å²	16	45.1 Å²	45.1	11%	0.112	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	8.2	-179.1	-68.9	0	0	0	0	113.9	E145 Q149 L241 P245 I246 L247	E145-S243 VanDerWaalsContact OE1-CB 3.28Å; E145-S243 WeakPolarHBondContact OE1-CB 3.01Å; E145-S243 PolarHBondContact OE1-OG 3.29Å; E145-S243 PolarHBondContact OE2-N 3.28Å; Q149-S243 PolarHBondContact NE2-OG 3.42Å; L241-S243 PolarHBondContact O-N 2.96Å; L241-S243 VanDerWaalsContact O-N 3.14Å; S243-P245 VanDerWaalsContact C-CD 3.49Å; S243-I246 PolarHBondContact O-N 3.49Å; S243-L247 PolarHBondContact O-N 3.44Å
244	L	94.5	Very high	93.5	Very high	22 Å²	22	45.2 Å²	45.2	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-39.1	175.8	-175.7	59.5	0	0	0	113.5	I140 I148 Y236 L241 I246 L247 H248	I140-L244 HydrophobicContact CG1-CD2 4.48Å; I148-L244 HydrophobicContact CD1-CB 4.11Å; I148-L244 HydrophobicContact CD1-CD1 4.26Å; Y236-L244 HydrophobicContact CD1-CB 4.34Å; Y236-L244 HydrophobicContact CD1-CD2 4.46Å; Y236-L244 HydrophobicContact CE1-CB 4.37Å; Y236-L244 HydrophobicContact CE1-CD2 4.04Å; Y236-L244 HydrophobicContact CE1-CG 4.49Å; L241-L244 HydrophobicContact CB-CB 4.05Å; L241-L244 HydrophobicContact CB-CD2 4.27Å; L241-L244 HydrophobicContact CD1-CD2 4.13Å; L241-L244 VanDerWaalsContact O-CB 3.27Å; L241-L244 WeakPolarHBondContact O-CB 3.45Å; L241-L244 PolarHBondContact O-N 3.36Å; L244-I246 VanDerWaalsContact C-N 3.33Å; L244-I246 PolarHBondContact O-N 2.92Å; L244-L247 HydrophobicContact CD1-CD2 4.49Å; L244-L247 PolarHBondContact O-N 3.42Å; L244-H248 WeakPolarHBondContact O-CB 3.44Å; L244-H248 PolarHBondContact O-N 3.12Å
245	P	92.8	Very high	93.8	Very high	28 Å²	28	43.4 Å²	43.4	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-40.5	175	-25	35.2	0	0	0	113.2	T228 Y236 S243 H248 D249	T228-P245 HydrophobicContact CG2-CB 3.88Å; T228-P245 HydrophobicContact CG2-CG 3.65Å; Y236-P245 HydrophobicContact CD2-CG 3.77Å; Y236-P245 HydrophobicContact CE1-CG 4.46Å; Y236-P245 HydrophobicContact CE2-CG 3.63Å; Y236-P245 HydrophobicContact CG-CG 4.28Å; S243-P245 VanDerWaalsContact C-CD 3.49Å; P245-H248 PolarHBondContact O-N 2.89Å; P245-D249 PolarHBondContact O-N 3.09Å
246	I	94.8	Very high	94.1	Very high	91 Å²	91	43.8 Å²	43.8	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-66.4	-42.3	177.9	-59.2	172.5	0	0	0	110.5	I152 S243 L244 H248 D249 N250	I152-I246 HydrophobicContact CD1-CB 4.07Å; I152-I246 HydrophobicContact CD1-CG2 3.94Å; I152-I246 HydrophobicContact CG1-CG2 4.29Å; S243-I246 PolarHBondContact O-N 3.49Å; L244-I246 VanDerWaalsContact C-N 3.33Å; L244-I246 PolarHBondContact O-N 2.92Å; I246-H248 VanDerWaalsContact C-N 3.32Å; I246-D249 PolarHBondContact O-N 3.28Å; I246-N250 WeakPolarHBondContact O-CB 3.33Å; I246-N250 PolarHBondContact O-N 2.8Å; I246-N250 PolarHBondContact O-ND2 2.86Å
247	L	96.2	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-41.2	175.3	178.4	60.6	0	0	0	111.2	I148 W151 I152 F155 P183 S243 L244 N250 M251	I148-L247 HydrophobicContact CB-CD2 4.3Å; I148-L247 HydrophobicContact CG1-CD2 3.99Å; I148-L247 HydrophobicContact CG2-CB 4.07Å; I148-L247 HydrophobicContact CG2-CD2 4.14Å; W151-L247 HydrophobicContact CB-CD1 3.61Å; W151-L247 HydrophobicContact CB-CD2 4.42Å; W151-L247 HydrophobicContact CG-CD1 4.49Å; I152-L247 HydrophobicContact CD1-CB 4.43Å; I152-L247 HydrophobicContact CG1-CB 4.22Å; I152-L247 HydrophobicContact CG1-CD1 4.45Å; F155-L247 HydrophobicContact CD2-CD1 4Å; F155-L247 HydrophobicContact CE2-CD1 3.68Å; P183-L247 HydrophobicContact CG-CD1 4.05Å; P183-L247 HydrophobicContact CG-CD2 4.27Å; P183-L247 HydrophobicContact CG-CG 4.5Å; S243-L247 PolarHBondContact O-N 3.44Å; L244-L247 HydrophobicContact CD1-CD2 4.49Å; L244-L247 PolarHBondContact O-N 3.42Å; L247-N250 PolarHBondContact O-N 2.83Å; L247-M251 HydrophobicContact CD1-CG 4.2Å; L247-M251 HydrophobicContact CD1-SD 4.37Å; L247-M251 HydrophobicContact CG-CE 4.08Å; L247-M251 HydrophobicContact CG-CG 4.4Å; L247-M251 HydrophobicContact CG-SD 4.12Å; L247-M251 WeakPolarHBondContact O-CB 3.34Å; L247-M251 WeakPolarHBondContact O-CG 3.45Å; L247-M251 PolarHBondContact O-N 3.46Å
248	H	94	Very high	94.2	Very high	23 Å²	23	38.8 Å²	38.8	11%	0.106	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-49	176.6	-174	-79.5	0	0	0	112.3	T218 V223 L244 P245 I246 N250 M251 Y252	T218-H248 PolarHBondContact O-NE2 3.19Å; V223-H248 WeakPolarHBondContact CG1-NE2 3.11Å; V223-H248 PolarHBondContact O-CE1 3.07Å; V223-H248 PolarHBondContact O-ND1 3.36Å; L244-H248 WeakPolarHBondContact O-CB 3.44Å; L244-H248 PolarHBondContact O-N 3.12Å; P245-H248 PolarHBondContact O-N 2.89Å; I246-H248 VanDerWaalsContact C-N 3.32Å; H248-N250 VanDerWaalsContact C-N 3.33Å; H248-N250 PolarHBondContact O-N 3.19Å; H248-M251 VanDerWaalsContact CA-CE 3.47Å; H248-M251 HydrophobicContact CB-CE 4.2Å; H248-M251 WeakPolarHBondContact O-CB 2.91Å; H248-M251 PolarHBondContact O-N 3.35Å; H248-M251 VanDerWaalsContact O-N 3.16Å; H248-Y252 AromaticContact CD2-CD2 3.9Å; H248-Y252 AromaticContact CD2-CE2 3.62Å; H248-Y252 AromaticContact CE1-CD2 3.24Å; H248-Y252 WeakPolarHBondContact CE1-CD2 3.31Å; H248-Y252 AromaticContact CE1-CE2 3.27Å; H248-Y252 WeakPolarHBondContact CE1-CE2 3.42Å; H248-Y252 AromaticContact CE1-CG 3.87Å; H248-Y252 AromaticContact CE1-CZ 3.88Å; H248-Y252 AromaticContact ND1-CD2 3.71Å; H248-Y252 AromaticContact NE2-CD2 3.35Å; H248-Y252 VanDerWaalsContact NE2-CD2 3.35Å; H248-Y252 WeakPolarHBondContact NE2-CD2 3.44Å; H248-Y252 AromaticContact NE2-CE2 2.89Å; H248-Y252 WeakPolarHBondContact NE2-CE2 3.19Å; H248-Y252 AromaticContact NE2-CZ 3.57Å; H248-Y252 WeakPolarHBondContact O-CD2 3.43Å; H248-Y252 PolarHBondContact O-N 3.05Å
249	D	94.1	Very high	94.4	Very high	44 Å²	44	36.7 Å²	36.7	24%	0.235	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-43.5	176.2	-177.2	68.4	0	0	0	112.5	K226 P245 I246 M251 T253 Y260	K226-D249 WeakPolarHBondContact CE-OD1 3.37Å; P245-D249 PolarHBondContact O-N 3.09Å; I246-D249 PolarHBondContact O-N 3.28Å; D249-M251 PolarHBondContact O-N 3.17Å; D249-T253 WeakPolarHBondContact O-CB 3.34Å; D249-T253 PolarHBondContact O-N 3.35Å; D249-T253 PolarHBondContact O-OG1 2.8Å; D249-Y260 WeakPolarHBondContact CA-OH 3.49Å; D249-Y260 WeakPolarHBondContact OD1-CE1 3.3Å; D249-Y260 PolarHBondContact OD1-OH 3.05Å
250	N	96.1	Very high	94.4	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.032	19%	0.19	C	C	.	.	H	α-helix	trans	-60.6	-43.9	175.8	-79.3	-28.2	0	0	0	112.7	F155 K159 I246 L247 H248 K254	F155-N250 HydrophobicContact CB-CB 4.09Å; F155-N250 HydrophobicContact CD1-CB 3.82Å; F155-N250 HydrophobicContact CD2-CB 3.82Å; F155-N250 HydrophobicContact CE1-CB 4.13Å; F155-N250 WeakPolarHBondContact CE1-O 3.48Å; F155-N250 HydrophobicContact CE2-CB 4.18Å; F155-N250 HydrophobicContact CG-CB 3.66Å; F155-N250 HydrophobicContact CZ-CB 4.33Å; K159-N250 PolarHBondContact NZ-OD1 3.38Å; I246-N250 WeakPolarHBondContact O-CB 3.33Å; I246-N250 PolarHBondContact O-N 2.8Å; I246-N250 PolarHBondContact O-ND2 2.86Å; L247-N250 PolarHBondContact O-N 2.83Å; H248-N250 VanDerWaalsContact C-N 3.33Å; H248-N250 PolarHBondContact O-N 3.19Å; N250-K254 WeakPolarHBondContact O-CB 3.44Å; N250-K254 PolarHBondContact O-N 2.95Å; N250-K254 VanDerWaalsContact O-N 3.07Å
251	M	96.1	Very high	94.4	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-50.9	-179.9	-76.5	-176.3	-52.3	0	0	111.7	M136 F155 Y182 P183 L247 H248 D249 K254 A255	M136-M251 HydrophobicContact CE-CE 3.45Å; M136-M251 VanDerWaalsContact CE-CE 3.45Å; M136-M251 HydrophobicContact CE-SD 3.29Å; M136-M251 WeakPolarHBondContact CE-SD 3.44Å; F155-M251 HydrophobicContact CE2-CG 3.97Å; F155-M251 HydrophobicContact CZ-CB 4.36Å; F155-M251 HydrophobicContact CZ-CG 3.7Å; Y182-M251 HydrophobicContact CD1-CB 3.58Å; Y182-M251 HydrophobicContact CD1-CG 3.7Å; Y182-M251 HydrophobicContact CD1-SD 3.62Å; Y182-M251 HydrophobicContact CE1-CB 3.75Å; Y182-M251 HydrophobicContact CE1-CG 4.34Å; Y182-M251 HydrophobicContact CG-SD 4.04Å; P183-M251 HydrophobicContact CB-CG 3.97Å; P183-M251 HydrophobicContact CB-SD 3.85Å; P183-M251 HydrophobicContact CG-CG 4.25Å; P183-M251 HydrophobicContact CG-SD 3.61Å; L247-M251 HydrophobicContact CD1-CG 4.2Å; L247-M251 HydrophobicContact CD1-SD 4.37Å; L247-M251 HydrophobicContact CG-CE 4.08Å; L247-M251 HydrophobicContact CG-CG 4.4Å; L247-M251 HydrophobicContact CG-SD 4.12Å; L247-M251 WeakPolarHBondContact O-CB 3.34Å; L247-M251 WeakPolarHBondContact O-CG 3.45Å; L247-M251 PolarHBondContact O-N 3.46Å; H248-M251 VanDerWaalsContact CA-CE 3.47Å; H248-M251 HydrophobicContact CB-CE 4.2Å; H248-M251 WeakPolarHBondContact O-CB 2.91Å; H248-M251 PolarHBondContact O-N 3.35Å; H248-M251 VanDerWaalsContact O-N 3.16Å; D249-M251 PolarHBondContact O-N 3.17Å; M251-K254 PolarHBondContact O-N 3.11Å; M251-A255 WeakPolarHBondContact O-CB 3.27Å; M251-A255 PolarHBondContact O-N 3.24Å
252	Y	94.2	Very high	94.2	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-71.1	-38.5	-178.4	-86.5	-104.6	0	0	0	112.3	M114 T218 A219 M224 H248 K254 A255 F256 Y260	M114-Y252 HydrophobicContact CE-CD2 4.43Å; M114-Y252 HydrophobicContact CE-CE2 3.45Å; M114-Y252 VanDerWaalsContact CE-CE2 3.45Å; M114-Y252 HydrophobicContact SD-CE2 3.99Å; M114-Y252 PolarHBondContact SD-OH 3.49Å; T218-Y252 VanDerWaalsContact C-OH 3.28Å; T218-Y252 WeakPolarHBondContact CB-OH 3.37Å; T218-Y252 PolarHBondContact O-OH 3.44Å; A219-Y252 HydrophobicContact CB-CE1 4.35Å; M224-Y252 HydrophobicContact CE-CD1 4.48Å; M224-Y252 HydrophobicContact SD-CD1 3.99Å; M224-Y252 HydrophobicContact SD-CE1 3.79Å; H248-Y252 AromaticContact CD2-CD2 3.9Å; H248-Y252 AromaticContact CD2-CE2 3.62Å; H248-Y252 AromaticContact CE1-CD2 3.24Å; H248-Y252 WeakPolarHBondContact CE1-CD2 3.31Å; H248-Y252 AromaticContact CE1-CE2 3.27Å; H248-Y252 WeakPolarHBondContact CE1-CE2 3.42Å; H248-Y252 AromaticContact CE1-CG 3.87Å; H248-Y252 AromaticContact CE1-CZ 3.88Å; H248-Y252 AromaticContact ND1-CD2 3.71Å; H248-Y252 AromaticContact NE2-CD2 3.35Å; H248-Y252 VanDerWaalsContact NE2-CD2 3.35Å; H248-Y252 WeakPolarHBondContact NE2-CD2 3.44Å; H248-Y252 AromaticContact NE2-CE2 2.89Å; H248-Y252 WeakPolarHBondContact NE2-CE2 3.19Å; H248-Y252 AromaticContact NE2-CZ 3.57Å; H248-Y252 WeakPolarHBondContact O-CD2 3.43Å; H248-Y252 PolarHBondContact O-N 3.05Å; Y252-K254 VanDerWaalsContact C-N 3.27Å; Y252-K254 PolarHBondContact O-N 3.16Å; Y252-A255 PolarHBondContact O-N 3.46Å; Y252-F256 AromaticContact CD1-CD2 3.65Å; Y252-F256 HydrophobicContact CD1-CD2 3.65Å; Y252-F256 AromaticContact CD1-CE2 3.78Å; Y252-F256 HydrophobicContact CD1-CE2 3.78Å; Y252-F256 HydrophobicContact CE1-CD2 4.18Å; Y252-F256 AromaticContact CE1-CE2 3.87Å; Y252-F256 HydrophobicContact CE1-CE2 3.87Å; Y252-F256 HydrophobicContact CG-CD2 4.41Å; Y252-F256 PolarHBondContact O-N 3.4Å; Y252-Y260 VanDerWaalsContact CB-CE2 3.45Å; Y252-Y260 AromaticContact CD1-CD2 3.54Å; Y252-Y260 HydrophobicContact CD1-CD2 3.54Å; Y252-Y260 HydrophobicContact CD1-CE2 4.07Å; Y252-Y260 HydrophobicContact CD1-CG 4.29Å; Y252-Y260 AromaticContact CG-CD2 3.7Å; Y252-Y260 HydrophobicContact CG-CD2 3.7Å; Y252-Y260 AromaticContact CG-CE2 3.87Å; Y252-Y260 HydrophobicContact CG-CE2 3.87Å; Y252-Y260 HydrophobicContact CG-CG 4.38Å
253	T	95.2	Very high	94.1	Very high	33 Å²	33	37.9 Å²	37.9	20%	0.202	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-40.2	174	-64.9	0	0	0	0	111.4	D249 G257 P258	D249-T253 WeakPolarHBondContact O-CB 3.34Å; D249-T253 PolarHBondContact O-N 3.35Å; D249-T253 PolarHBondContact O-OG1 2.8Å; T253-G257 WeakPolarHBondContact CA-O 3.29Å; T253-G257 CarbonylContact O-C 3.43Å; T253-G257 WeakPolarHBondContact O-CA 3.37Å; T253-G257 PolarHBondContact O-N 2.7Å; T253-P258 HydrophobicContact CG2-CB 4.42Å
254	K	95.4	Very high	94.1	Very high	60 Å²	60	40.7 Å²	40.7	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-71.1	-35.2	177.2	-171.5	173	167.8	80.7	0	112.3	F155 N158 V186 F187 E190 N250 M251 Y252	F155-K254 HydrophobicContact CD1-CD 4.11Å; F155-K254 HydrophobicContact CE1-CB 3.89Å; F155-K254 HydrophobicContact CE1-CD 3.62Å; F155-K254 HydrophobicContact CE1-CG 4.39Å; N158-K254 PolarHBondContact OD1-NZ 3.31Å; V186-K254 HydrophobicContact CB-CB 4.44Å; V186-K254 HydrophobicContact CB-CD 3.93Å; V186-K254 HydrophobicContact CB-CG 4.09Å; V186-K254 HydrophobicContact CG2-CD 3.85Å; V186-K254 HydrophobicContact CG2-CG 4.39Å; V186-K254 WeakPolarHBondContact O-CE 3.22Å; F187-K254 HydrophobicContact CE1-CD 4.34Å; F187-K254 HydrophobicContact CE2-CD 4.3Å; F187-K254 HydrophobicContact CZ-CD 4.12Å; E190-K254 IonicContact OE1-NZ 3.32Å; E190-K254 PolarHBondContact OE1-NZ 3.07Å; N250-K254 WeakPolarHBondContact O-CB 3.44Å; N250-K254 PolarHBondContact O-N 2.95Å; N250-K254 VanDerWaalsContact O-N 3.07Å; M251-K254 PolarHBondContact O-N 3.11Å; Y252-K254 VanDerWaalsContact C-N 3.27Å; Y252-K254 PolarHBondContact O-N 3.16Å
255	A	95	Very high	94.1	Very high	15 Å²	15	43.4 Å²	43.4	12%	0.124	24%	0.238	C	C	.	.	H	α-helix	trans	-77	-43.8	-178.9	0	0	0	0	0	113.8	Y182 V186 M251 Y252 W275	Y182-A255 HydrophobicContact CE1-CB 4.38Å; Y182-A255 WeakPolarHBondContact OH-CB 3.49Å; V186-A255 HydrophobicContact CG1-CB 3.82Å; M251-A255 WeakPolarHBondContact O-CB 3.27Å; M251-A255 PolarHBondContact O-N 3.24Å; Y252-A255 PolarHBondContact O-N 3.46Å; A255-W275 HydrophobicContact CB-CZ3 4.34Å
256	F	94.1	Very high	94.3	Very high	21 Å²	21	46.5 Å²	46.5	9%	0.092	25%	0.253	C	S	.	.	H	α-helix	trans	-125.5	-2.9	-166.8	-53	-53.6	0	0	0	113.4	W210 Y252 M263 L268 A271	W210-F256 HydrophobicContact CH2-CE1 4.38Å; W210-F256 AromaticContact CH2-CZ 3.84Å; W210-F256 HydrophobicContact CH2-CZ 3.84Å; W210-F256 HydrophobicContact CZ2-CZ 4.11Å; Y252-F256 AromaticContact CD1-CD2 3.65Å; Y252-F256 HydrophobicContact CD1-CD2 3.65Å; Y252-F256 AromaticContact CD1-CE2 3.78Å; Y252-F256 HydrophobicContact CD1-CE2 3.78Å; Y252-F256 HydrophobicContact CE1-CD2 4.18Å; Y252-F256 AromaticContact CE1-CE2 3.87Å; Y252-F256 HydrophobicContact CE1-CE2 3.87Å; Y252-F256 HydrophobicContact CG-CD2 4.41Å; Y252-F256 PolarHBondContact O-N 3.4Å; F256-M263 HydrophobicContact CB-CE 3.96Å; F256-M263 HydrophobicContact CB-SD 4.13Å; F256-M263 WeakPolarHBondContact O-CE 3.34Å; F256-L268 HydrophobicContact CE2-CD1 4.48Å; F256-A271 HydrophobicContact CD1-CB 3.8Å; F256-A271 HydrophobicContact CE1-CB 4.39Å
257	G	93.8	Very high	94.4	Very high	21 Å²	21	46.9 Å²	46.9	22%	0.216	25%	0.252	C	S	.	.			trans	91.1	172.4	-178.3	0	0	0	0	0	113.7	T253 N259 Y260	T253-G257 WeakPolarHBondContact CA-O 3.29Å; T253-G257 CarbonylContact O-C 3.43Å; T253-G257 WeakPolarHBondContact O-CA 3.37Å; T253-G257 PolarHBondContact O-N 2.7Å; G257-N259 PolarHBondContact O-N 3.1Å; G257-N259 VanDerWaalsContact O-N 3.15Å; G257-Y260 WeakPolarHBondContact O-CB 3.38Å; G257-Y260 WeakPolarHBondContact O-CD1 3.4Å; G257-Y260 PolarHBondContact O-N 2.75Å
258	P	93.5	Very high	94.3	Very high	80 Å²	80	47.1 Å²	47.1	52%	0.519	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.3	-167.8	27.3	-36.1	0	0	0	114.8	K226 T253	K226-P258 PolarHBondContact NZ-O 2.82Å; T253-P258 HydrophobicContact CG2-CB 4.42Å
259	N	93.1	Very high	94.5	Very high	100 Å²	100	48.7 Å²	48.7	54%	0.535	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	20.3	-178.3	-58.5	-24.4	0	0	0	112.3	G257 D261 Q262 M263	G257-N259 PolarHBondContact O-N 3.1Å; G257-N259 VanDerWaalsContact O-N 3.15Å; N259-D261 PolarHBondContact O-N 3Å; N259-D261 VanDerWaalsContact O-N 3.11Å; N259-Q262 PolarHBondContact O-N 3.39Å; N259-M263 PolarHBondContact O-N 3.26Å
260	Y	92.4	Very high	94.6	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.016	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-54.2	-30.7	-179.6	73.6	-86.8	0	0	0	113	M224 D249 Y252 G257 Q262	M224-Y260 HydrophobicContact CE-CD2 3.18Å; M224-Y260 HydrophobicContact CE-CE2 3.56Å; M224-Y260 HydrophobicContact CE-CG 4.28Å; M224-Y260 WeakPolarHBondContact CE-O 3.47Å; M224-Y260 HydrophobicContact SD-CD2 3.91Å; M224-Y260 HydrophobicContact SD-CE2 3.91Å; D249-Y260 WeakPolarHBondContact CA-OH 3.49Å; D249-Y260 WeakPolarHBondContact OD1-CE1 3.3Å; D249-Y260 PolarHBondContact OD1-OH 3.05Å; Y252-Y260 VanDerWaalsContact CB-CE2 3.45Å; Y252-Y260 AromaticContact CD1-CD2 3.54Å; Y252-Y260 HydrophobicContact CD1-CD2 3.54Å; Y252-Y260 HydrophobicContact CD1-CE2 4.07Å; Y252-Y260 HydrophobicContact CD1-CG 4.29Å; Y252-Y260 AromaticContact CG-CD2 3.7Å; Y252-Y260 HydrophobicContact CG-CD2 3.7Å; Y252-Y260 AromaticContact CG-CE2 3.87Å; Y252-Y260 HydrophobicContact CG-CE2 3.87Å; Y252-Y260 HydrophobicContact CG-CG 4.38Å; G257-Y260 WeakPolarHBondContact O-CB 3.38Å; G257-Y260 WeakPolarHBondContact O-CD1 3.4Å; G257-Y260 PolarHBondContact O-N 2.75Å; Y260-Q262 PolarHBondContact O-N 2.98Å
261	D	90.9	Very high	94.7	Very high	48 Å²	48	52 Å²	52	26%	0.257	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-71.4	-14.5	178.7	61	-44.7	0	0	0	114.5	M224 K226 N259	M224-D261 HydrophobicContact CE-CB 4.34Å; M224-D261 WeakPolarHBondContact O-CB 3.25Å; K226-D261 WeakPolarHBondContact CD-OD2 3.41Å; K226-D261 WeakPolarHBondContact CE-OD1 3.44Å; K226-D261 VanDerWaalsContact NZ-CG 3.25Å; K226-D261 IonicContact NZ-OD1 2.72Å; K226-D261 PolarHBondContact NZ-OD1 3.25Å; K226-D261 IonicContact NZ-OD2 3.26Å; K226-D261 PolarHBondContact NZ-OD2 2.73Å; N259-D261 PolarHBondContact O-N 3Å; N259-D261 VanDerWaalsContact O-N 3.11Å
262	Q	91.5	Very high	94.7	Very high	143 Å²	143	51.9 Å²	51.9	67%	0.668	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-111.3	-2.9	-178.8	-61.1	178.1	-6.3	0	0	112.9	N259 Y260 T264	N259-Q262 PolarHBondContact O-N 3.39Å; Y260-Q262 PolarHBondContact O-N 2.98Å; Q262-T264 PolarHBondContact O-N 3.11Å
263	M	92.9	Very high	94.9	Very high	35 Å²	35	55.8 Å²	55.8	17%	0.172	30%	0.299	C	S	.	.			trans	-61.1	132.7	-179.7	-72.5	-178.2	168.5	0	0	111	R215 F256 N259 E267 L268 A271	R215-M263 PolarHBondContact NH2-O 3.3Å; F256-M263 HydrophobicContact CB-CE 3.96Å; F256-M263 HydrophobicContact CB-SD 4.13Å; F256-M263 WeakPolarHBondContact O-CE 3.34Å; N259-M263 PolarHBondContact O-N 3.26Å; M263-E267 WeakPolarHBondContact CA-OE2 3.38Å; M263-E267 HydrophobicContact CB-CB 4.06Å; M263-E267 HydrophobicContact CG-CB 4.17Å; M263-L268 HydrophobicContact CB-CB 4.42Å; M263-L268 HydrophobicContact SD-CD1 4.43Å; M263-A271 HydrophobicContact CE-CB 4.38Å; M263-A271 HydrophobicContact SD-CB 4.36Å
264	T	94.6	Very high	95	Very high	74 Å²	74	61.4 Å²	61.4	45%	0.454	32%	0.32	S	S	.	.			trans	-64	168.1	162.8	60.9	0	0	0	0	110.8	R215 Q262 D266 E267 L268	R215-T264 PolarHBondContact NH2-O 3.15Å; Q262-T264 PolarHBondContact O-N 3.11Å; T264-D266 PolarHBondContact O-N 3.44Å; T264-E267 WeakPolarHBondContact CB-OE2 3.49Å; T264-E267 WeakPolarHBondContact CG2-OE2 3.33Å; T264-E267 PolarHBondContact N-OE2 2.81Å; T264-E267 PolarHBondContact O-N 3.31Å; T264-E267 WeakPolarHBondContact OG1-CB 3.11Å; T264-E267 VanDerWaalsContact OG1-CG 3.24Å; T264-E267 WeakPolarHBondContact OG1-CG 3.26Å; T264-E267 PolarHBondContact OG1-N 3.48Å; T264-E267 PolarHBondContact OG1-OE2 2.72Å; T264-L268 WeakPolarHBondContact O-CB 3.5Å; T264-L268 PolarHBondContact O-N 3.26Å
265	D	95.3	Very high	95.2	Very high	79 Å²	79	59.2 Å²	59.2	42%	0.422	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-34.5	176	-77.4	1.3	0	0	0	112.2	V211 R215 R269	V211-D265 HydrophobicContact CG1-CB 3.92Å; R215-D265 IonicContact CZ-OD1 2.67Å; R215-D265 VanDerWaalsContact CZ-OD1 3.28Å; R215-D265 IonicContact NE-OD1 2.63Å; R215-D265 PolarHBondContact NE-OD1 2.81Å; R215-D265 IonicContact NH2-OD1 3Å; R215-D265 PolarHBondContact NH2-OD1 2.93Å; D265-R269 WeakPolarHBondContact O-CB 3.22Å; D265-R269 PolarHBondContact O-N 2.75Å
266	D	96.9	Very high	95.3	Very high	93 Å²	93	59.3 Å²	59.3	50%	0.497	31%	0.309	S	S	.	.	H	α-helix	trans	-69.8	-45.7	176.7	-63.6	-26.9	0	0	0	111.6	T264 L268 R269 D270	T264-D266 PolarHBondContact O-N 3.44Å; D266-L268 VanDerWaalsContact C-N 3.3Å; D266-L268 PolarHBondContact O-N 3.34Å; D266-R269 WeakPolarHBondContact O-CB 3.43Å; D266-R269 PolarHBondContact O-N 2.91Å; D266-R269 VanDerWaalsContact O-N 3.17Å; D266-R269 IonicContact OD1-CZ 3.99Å; D266-R269 IonicContact OD1-NH1 2.81Å; D266-R269 PolarHBondContact OD1-NH1 3.33Å; D266-R269 IonicContact OD1-NH2 3.13Å; D266-R269 PolarHBondContact OD1-NH2 2.7Å; D266-R269 VanDerWaalsContact OD1-NH2 3.13Å; D266-D270 PolarHBondContact O-N 2.96Å
267	E	96.5	Very high	95.5	Very high	99 Å²	99	62.7 Å²	62.7	46%	0.463	33%	0.325	S	S	.	.	H	α-helix	trans	-62.4	-38.2	175.7	-71.8	165.5	138.3	0	0	112.1	M263 T264 D270 A271	M263-E267 WeakPolarHBondContact CA-OE2 3.38Å; M263-E267 HydrophobicContact CB-CB 4.06Å; M263-E267 HydrophobicContact CG-CB 4.17Å; T264-E267 WeakPolarHBondContact CB-OE2 3.49Å; T264-E267 WeakPolarHBondContact CG2-OE2 3.33Å; T264-E267 PolarHBondContact N-OE2 2.81Å; T264-E267 PolarHBondContact O-N 3.31Å; T264-E267 WeakPolarHBondContact OG1-CB 3.11Å; T264-E267 VanDerWaalsContact OG1-CG 3.24Å; T264-E267 WeakPolarHBondContact OG1-CG 3.26Å; T264-E267 PolarHBondContact OG1-N 3.48Å; T264-E267 PolarHBondContact OG1-OE2 2.72Å; E267-D270 PolarHBondContact O-N 3.48Å; E267-A271 VanDerWaalsContact O-CB 3.29Å; E267-A271 WeakPolarHBondContact O-CB 3.45Å; E267-A271 PolarHBondContact O-N 3.37Å
268	L	95.1	Very high	95.7	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-38	176.5	-175.3	58.7	0	0	0	111.4	W210 V211 F256 M263 T264 D266 F272	W210-L268 HydrophobicContact CH2-CD1 3.86Å; W210-L268 HydrophobicContact CH2-CG 4.12Å; W210-L268 HydrophobicContact CZ3-CD1 4.02Å; W210-L268 HydrophobicContact CZ3-CD2 4.45Å; W210-L268 HydrophobicContact CZ3-CG 3.78Å; V211-L268 HydrophobicContact CG1-CD2 4.46Å; V211-L268 HydrophobicContact CG2-CG 4.43Å; F256-L268 HydrophobicContact CE2-CD1 4.48Å; M263-L268 HydrophobicContact CB-CB 4.42Å; M263-L268 HydrophobicContact SD-CD1 4.43Å; T264-L268 WeakPolarHBondContact O-CB 3.5Å; T264-L268 PolarHBondContact O-N 3.26Å; D266-L268 VanDerWaalsContact C-N 3.3Å; D266-L268 PolarHBondContact O-N 3.34Å; L268-F272 PolarHBondContact O-N 3.39Å; L268-F272 VanDerWaalsContact O-N 3.11Å
269	R	97	Very high	96	Very high	56 Å²	56	61.3 Å²	61.3	21%	0.211	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-50.1	172.8	-168.9	-165.2	-62.2	106.5	4.2	110.9	A207 D208 V211 D265 D266 A271 F272 I273	A207-R269 HydrophobicContact CB-CG 3.58Å; D208-R269 IonicContact OD1-CZ 3.7Å; D208-R269 IonicContact OD1-NE 3.1Å; D208-R269 PolarHBondContact OD1-NE 2.84Å; D208-R269 IonicContact OD1-NH2 2.88Å; D208-R269 PolarHBondContact OD1-NH2 2.72Å; D208-R269 IonicContact OD2-NE 2.66Å; V211-R269 HydrophobicContact CG2-CB 3.85Å; V211-R269 HydrophobicContact CG2-CG 4.4Å; D265-R269 WeakPolarHBondContact O-CB 3.22Å; D265-R269 PolarHBondContact O-N 2.75Å; D266-R269 WeakPolarHBondContact O-CB 3.43Å; D266-R269 PolarHBondContact O-N 2.91Å; D266-R269 VanDerWaalsContact O-N 3.17Å; D266-R269 IonicContact OD1-CZ 3.99Å; D266-R269 IonicContact OD1-NH1 2.81Å; D266-R269 PolarHBondContact OD1-NH1 3.33Å; D266-R269 IonicContact OD1-NH2 3.13Å; D266-R269 PolarHBondContact OD1-NH2 2.7Å; D266-R269 VanDerWaalsContact OD1-NH2 3.13Å; R269-A271 VanDerWaalsContact C-N 3.33Å; R269-A271 PolarHBondContact O-N 2.9Å; R269-F272 WeakPolarHBondContact O-CB 3.48Å; R269-F272 PolarHBondContact O-N 3.25Å; R269-F272 VanDerWaalsContact O-N 3.16Å; R269-I273 HydrophobicContact CG-CD1 4.13Å; R269-I273 WeakPolarHBondContact O-CG1 3.13Å; R269-I273 PolarHBondContact O-N 3.28Å
270	D	97.6	Very high	96.2	Very high	98 Å²	98	59.3 Å²	59.3	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-39.8	-178.1	-71	-10.4	0	0	0	111.4	D266 E267 F272 I273 K274	D266-D270 PolarHBondContact O-N 2.96Å; E267-D270 PolarHBondContact O-N 3.48Å; D270-F272 VanDerWaalsContact C-N 3.31Å; D270-F272 PolarHBondContact O-N 2.7Å; D270-I273 PolarHBondContact O-N 3.04Å; D270-K274 VanDerWaalsContact O-CB 3.26Å; D270-K274 WeakPolarHBondContact O-CB 3.42Å; D270-K274 PolarHBondContact O-N 2.83Å
271	A	96.8	Very high	96.5	Very high	20 Å²	20	64.7 Å²	64.7	17%	0.165	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-38.1	174.7	0	0	0	0	0	112.3	F256 M263 E267 R269 W275	F256-A271 HydrophobicContact CD1-CB 3.8Å; F256-A271 HydrophobicContact CE1-CB 4.39Å; M263-A271 HydrophobicContact CE-CB 4.38Å; M263-A271 HydrophobicContact SD-CB 4.36Å; E267-A271 VanDerWaalsContact O-CB 3.29Å; E267-A271 WeakPolarHBondContact O-CB 3.45Å; E267-A271 PolarHBondContact O-N 3.37Å; R269-A271 VanDerWaalsContact C-N 3.33Å; R269-A271 PolarHBondContact O-N 2.9Å; A271-W275 WeakPolarHBondContact O-CB 3.47Å; A271-W275 PolarHBondContact O-N 3.28Å
272	F	97.4	Very high	96.9	Very high	2 Å²	2	67 Å²	67	1%	0.009	33%	0.329	C	S	.	.	H	α-helix	trans	-69	-43.5	175.3	174.3	-113.4	0	0	0	113.1	Q113 T116 R205 A207 W210 L268 R269 D270 K274 W275 N276	Q113-F272 HydrophobicContact CB-CD2 4.13Å; Q113-F272 HydrophobicContact CB-CE2 3.95Å; Q113-F272 HydrophobicContact CG-CD2 3.93Å; Q113-F272 HydrophobicContact CG-CE2 4.1Å; T116-F272 HydrophobicContact CG2-CE2 3.75Å; T116-F272 HydrophobicContact CG2-CZ 3.84Å; R205-F272 WeakPolarHBondContact O-CE1 3.41Å; A207-F272 HydrophobicContact CB-CD1 4.05Å; A207-F272 HydrophobicContact CB-CE1 4.4Å; W210-F272 HydrophobicContact CB-CD1 4.36Å; W210-F272 HydrophobicContact CB-CE1 4.04Å; W210-F272 HydrophobicContact CB-CZ 4.35Å; W210-F272 HydrophobicContact CD2-CB 4.21Å; W210-F272 AromaticContact CD2-CD1 3.96Å; W210-F272 HydrophobicContact CD2-CD1 3.96Å; W210-F272 AromaticContact CD2-CD2 3.74Å; W210-F272 HydrophobicContact CD2-CD2 3.74Å; W210-F272 HydrophobicContact CD2-CE1 4.24Å; W210-F272 HydrophobicContact CD2-CE2 4.06Å; W210-F272 AromaticContact CD2-CG 3.69Å; W210-F272 HydrophobicContact CD2-CG 3.69Å; W210-F272 HydrophobicContact CD2-CZ 4.28Å; W210-F272 AromaticContact CE2-CD2 3.63Å; W210-F272 AromaticContact CE2-CE2 3.94Å; W210-F272 HydrophobicContact CE3-CB 3.59Å; W210-F272 AromaticContact CE3-CD1 3.86Å; W210-F272 HydrophobicContact CE3-CD1 3.86Å; W210-F272 HydrophobicContact CE3-CD2 4.02Å; W210-F272 AromaticContact CE3-CG 3.54Å; W210-F272 HydrophobicContact CE3-CG 3.54Å; W210-F272 HydrophobicContact CG-CD1 4.18Å; W210-F272 HydrophobicContact CG-CD2 4.28Å; W210-F272 HydrophobicContact CG-CE1 4Å; W210-F272 HydrophobicContact CG-CE2 4.12Å; W210-F272 HydrophobicContact CG-CG 4.31Å; W210-F272 AromaticContact CG-CZ 3.97Å; W210-F272 HydrophobicContact CG-CZ 3.97Å; W210-F272 HydrophobicContact CH2-CB 3.77Å; W210-F272 HydrophobicContact CH2-CD2 4.14Å; W210-F272 HydrophobicContact CH2-CG 4.15Å; W210-F272 HydrophobicContact CZ2-CB 4.36Å; W210-F272 AromaticContact CZ2-CD2 3.86Å; W210-F272 HydrophobicContact CZ2-CD2 3.86Å; W210-F272 HydrophobicContact CZ2-CG 4.28Å; W210-F272 HydrophobicContact CZ3-CB 3.34Å; W210-F272 HydrophobicContact CZ3-CD1 4.5Å; W210-F272 HydrophobicContact CZ3-CD2 4.21Å; W210-F272 AromaticContact CZ3-CG 3.79Å; W210-F272 HydrophobicContact CZ3-CG 3.79Å; W210-F272 AromaticContact NE1-CE2 3.91Å; L268-F272 PolarHBondContact O-N 3.39Å; L268-F272 VanDerWaalsContact O-N 3.11Å; R269-F272 WeakPolarHBondContact O-CB 3.48Å; R269-F272 PolarHBondContact O-N 3.25Å; R269-F272 VanDerWaalsContact O-N 3.16Å; D270-F272 VanDerWaalsContact C-N 3.31Å; D270-F272 PolarHBondContact O-N 2.7Å; F272-K274 VanDerWaalsContact C-N 3.33Å; F272-W275 WeakPolarHBondContact O-CB 3.39Å; F272-W275 PolarHBondContact O-N 2.88Å; F272-N276 WeakPolarHBondContact CE1-ND2 3.43Å; F272-N276 WeakPolarHBondContact CE2-ND2 3.46Å; F272-N276 WeakPolarHBondContact CZ-ND2 3.41Å; F272-N276 PolarHBondContact O-N 3.27Å; F272-N276 VanDerWaalsContact O-N 3.08Å
273	I	98.2	Very high	97.2	Very high	85 Å²	85	60.4 Å²	60.4	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-47.7	175.4	-67.9	167.3	0	0	0	109.6	A207 R269 D270 W275 N276 Q277	A207-I273 HydrophobicContact CB-CD1 4.19Å; A207-I273 HydrophobicContact CB-CG1 4.09Å; R269-I273 HydrophobicContact CG-CD1 4.13Å; R269-I273 WeakPolarHBondContact O-CG1 3.13Å; R269-I273 PolarHBondContact O-N 3.28Å; D270-I273 PolarHBondContact O-N 3.04Å; I273-W275 PolarHBondContact O-N 3Å; I273-N276 PolarHBondContact O-N 3.34Å; I273-Q277 PolarHBondContact O-N 2.74Å
274	K	97.9	Very high	97.5	Very high	150 Å²	150	61.4 Å²	61.4	65%	0.652	31%	0.308	S	S	*	.	H	α-helix	trans	-59	-44.5	176.9	-177.4	-179.6	176.9	-178.1	0	112.1	D270 F272 N276 Q277 E278	D270-K274 VanDerWaalsContact O-CB 3.26Å; D270-K274 WeakPolarHBondContact O-CB 3.42Å; D270-K274 PolarHBondContact O-N 2.83Å; F272-K274 VanDerWaalsContact C-N 3.33Å; K274-N276 PolarHBondContact O-N 3.2Å; K274-Q277 PolarHBondContact O-N 3.32Å; K274-E278 WeakPolarHBondContact O-CB 3.33Å; K274-E278 PolarHBondContact O-N 3.06Å
275	W	97.9	Very high	97.6	Very high	15 Å²	15	67 Å²	67	6%	0.057	33%	0.326	C	S	.	.	H	α-helix	trans	-56.6	-48.8	176.8	177.9	-89	0	0	0	112	A111 Q113 V186 Y188 A255 A271 F272 I273 E278 I279	A111-W275 PolarHBondContact O-NE1 3.42Å; Q113-W275 HydrophobicContact CG-CD2 4.49Å; Q113-W275 HydrophobicContact CG-CG 4.01Å; V186-W275 HydrophobicContact CB-CH2 4.19Å; V186-W275 HydrophobicContact CG1-CH2 3.84Å; V186-W275 HydrophobicContact CG1-CZ2 4.36Å; V186-W275 HydrophobicContact CG1-CZ3 4.41Å; Y188-W275 HydrophobicContact CD1-CH2 4.36Å; Y188-W275 HydrophobicContact CD1-CZ2 4.25Å; Y188-W275 HydrophobicContact CE1-CH2 4.14Å; Y188-W275 HydrophobicContact CE1-CZ2 4.22Å; A255-W275 HydrophobicContact CB-CZ3 4.34Å; A271-W275 WeakPolarHBondContact O-CB 3.47Å; A271-W275 PolarHBondContact O-N 3.28Å; F272-W275 WeakPolarHBondContact O-CB 3.39Å; F272-W275 PolarHBondContact O-N 2.88Å; I273-W275 PolarHBondContact O-N 3Å; W275-E278 PolarHBondContact O-N 3.32Å; W275-I279 HydrophobicContact CD2-CD1 4.47Å; W275-I279 HydrophobicContact CG-CD1 4.43Å; W275-I279 HydrophobicContact CZ2-CD1 4.16Å; W275-I279 PolarHBondContact O-N 3.06Å
276	N	98.4	Very high	97.7	Very high	17 Å²	17	69.4 Å²	69.4	9%	0.091	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-44.5	-179.7	-66.5	-18.3	0	0	0	111.1	L202 F272 I273 K274 E278 I279 I280	L202-N276 HydrophobicContact CD2-CB 4.26Å; F272-N276 WeakPolarHBondContact CE1-ND2 3.43Å; F272-N276 WeakPolarHBondContact CE2-ND2 3.46Å; F272-N276 WeakPolarHBondContact CZ-ND2 3.41Å; F272-N276 PolarHBondContact O-N 3.27Å; F272-N276 VanDerWaalsContact O-N 3.08Å; I273-N276 PolarHBondContact O-N 3.34Å; K274-N276 PolarHBondContact O-N 3.2Å; N276-E278 VanDerWaalsContact C-N 3.34Å; N276-E278 PolarHBondContact O-N 3.45Å; N276-I279 PolarHBondContact O-N 3.34Å; N276-I280 VanDerWaalsContact O-CG1 3.31Å; N276-I280 WeakPolarHBondContact O-CG1 3.44Å; N276-I280 PolarHBondContact O-N 2.91Å
277	Q	98.5	Very high	97.8	Very high	92 Å²	92	67.2 Å²	67.2	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-62.6	-41.6	179.2	-169.1	59.7	49.8	0	0	111.7	I273 K274 I279 I280 D281	I273-Q277 PolarHBondContact O-N 2.74Å; K274-Q277 PolarHBondContact O-N 3.32Å; Q277-I279 VanDerWaalsContact C-N 3.27Å; Q277-I279 PolarHBondContact O-N 2.97Å; Q277-I280 PolarHBondContact O-N 3.4Å; Q277-I280 VanDerWaalsContact O-N 3.14Å; Q277-D281 PolarHBondContact NE2-OD1 3.31Å; Q277-D281 WeakPolarHBondContact O-CB 3.24Å; Q277-D281 VanDerWaalsContact O-CG 3.22Å; Q277-D281 PolarHBondContact O-N 3.34Å
278	E	98.3	Very high	97.9	Very high	72 Å²	72	63.6 Å²	63.6	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-57.8	-40	177.2	-172.3	-171.2	130.8	0	0	112.2	Y188 K189 K274 W275 N276 Y282	Y188-E278 PolarHBondContact OH-OE1 3.07Å; K189-E278 IonicContact NZ-OE1 2.7Å; K189-E278 PolarHBondContact NZ-OE1 3.36Å; K274-E278 WeakPolarHBondContact O-CB 3.33Å; K274-E278 PolarHBondContact O-N 3.06Å; W275-E278 PolarHBondContact O-N 3.32Å; N276-E278 VanDerWaalsContact C-N 3.34Å; N276-E278 PolarHBondContact O-N 3.45Å; E278-Y282 WeakPolarHBondContact O-CB 3.46Å; E278-Y282 PolarHBondContact O-N 3.5Å
279	I	98.5	Very high	98.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.9	-43.1	177.5	-67.6	161.9	0	0	0	110.8	A111 Y188 L202 W275 N276 Q277 D281 Y282 V283 L288	A111-I279 HydrophobicContact CB-CD1 3.68Å; A111-I279 HydrophobicContact CB-CG1 4.31Å; A111-I279 HydrophobicContact CB-CG2 4.12Å; A111-I279 WeakPolarHBondContact O-CD1 3.31Å; Y188-I279 HydrophobicContact CD1-CG1 4.42Å; Y188-I279 HydrophobicContact CD2-CG1 4.37Å; Y188-I279 HydrophobicContact CE1-CD1 4.46Å; Y188-I279 HydrophobicContact CE1-CG1 3.89Å; Y188-I279 HydrophobicContact CE2-CG1 3.84Å; L202-I279 HydrophobicContact CB-CG2 4.26Å; L202-I279 HydrophobicContact CD1-CD1 3.82Å; L202-I279 HydrophobicContact CD1-CG2 4.5Å; L202-I279 HydrophobicContact CD2-CB 4.11Å; L202-I279 HydrophobicContact CD2-CG2 3.98Å; L202-I279 HydrophobicContact CG-CG2 4.47Å; W275-I279 HydrophobicContact CD2-CD1 4.47Å; W275-I279 HydrophobicContact CG-CD1 4.43Å; W275-I279 HydrophobicContact CZ2-CD1 4.16Å; W275-I279 PolarHBondContact O-N 3.06Å; N276-I279 PolarHBondContact O-N 3.34Å; Q277-I279 VanDerWaalsContact C-N 3.27Å; Q277-I279 PolarHBondContact O-N 2.97Å; I279-D281 VanDerWaalsContact C-N 3.26Å; I279-D281 PolarHBondContact O-N 2.86Å; I279-Y282 PolarHBondContact O-N 2.92Å; I279-V283 HydrophobicContact CG2-CG2 3.86Å; I279-V283 WeakPolarHBondContact O-CB 3.27Å; I279-V283 VanDerWaalsContact O-CG2 3.31Å; I279-V283 WeakPolarHBondContact O-CG2 3.4Å; I279-V283 PolarHBondContact O-N 3.5Å; I279-L288 HydrophobicContact CG2-CD1 4.21Å
280	I	98.6	Very high	98.1	Very high	57 Å²	57	65.5 Å²	65.5	29%	0.292	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-40.3	177.7	-68	167.2	0	0	0	110.8	L202 N276 Q277 L288 I290	L202-I280 HydrophobicContact CD2-CD1 4.22Å; L202-I280 HydrophobicContact CD2-CG1 3.81Å; N276-I280 VanDerWaalsContact O-CG1 3.31Å; N276-I280 WeakPolarHBondContact O-CG1 3.44Å; N276-I280 PolarHBondContact O-N 2.91Å; Q277-I280 PolarHBondContact O-N 3.4Å; Q277-I280 VanDerWaalsContact O-N 3.14Å; I280-L288 HydrophobicContact CG1-CD2 4.32Å; I280-I290 HydrophobicContact CD1-CD1 3.82Å; I280-I290 HydrophobicContact CG1-CD1 3.85Å; I280-I290 HydrophobicContact CG1-CG1 4.29Å
281	D	98.5	Very high	98.2	Very high	118 Å²	118	60.9 Å²	60.9	63%	0.631	30%	0.296	S	S	*	.	H	α-helix	trans	-75.3	-33	179.9	-64.9	-19.6	0	0	0	112.4	Q277 I279	Q277-D281 PolarHBondContact NE2-OD1 3.31Å; Q277-D281 WeakPolarHBondContact O-CB 3.24Å; Q277-D281 VanDerWaalsContact O-CG 3.22Å; Q277-D281 PolarHBondContact O-N 3.34Å; I279-D281 VanDerWaalsContact C-N 3.26Å; I279-D281 PolarHBondContact O-N 2.86Å
282	Y	98.4	Very high	98.2	Very high	95 Å²	95	61.6 Å²	61.6	37%	0.373	30%	0.297	S	S	.	.	H	α-helix	trans	-83.9	-39.6	-175.4	-176	-95.2	0	0	0	113.9	Y188 K189 M192 E278 I279	Y188-Y282 HydrophobicContact CD2-CD1 4.4Å; Y188-Y282 AromaticContact CE2-CD1 3.71Å; Y188-Y282 HydrophobicContact CE2-CD1 3.71Å; Y188-Y282 HydrophobicContact CE2-CE1 4.37Å; Y188-Y282 HydrophobicContact CE2-CG 4.28Å; K189-Y282 HydrophobicContact CB-CE1 4.13Å; K189-Y282 HydrophobicContact CD-CD2 4.38Å; K189-Y282 HydrophobicContact CD-CE1 4.36Å; K189-Y282 HydrophobicContact CD-CE2 4.17Å; K189-Y282 HydrophobicContact CG-CD1 3.95Å; K189-Y282 HydrophobicContact CG-CE1 3.62Å; K189-Y282 HydrophobicContact CG-CE2 4.29Å; K189-Y282 HydrophobicContact CG-CG 4.42Å; M192-Y282 HydrophobicContact CE-CE1 4.46Å; M192-Y282 HydrophobicContact SD-CD1 4.3Å; M192-Y282 HydrophobicContact SD-CE1 4.07Å; E278-Y282 WeakPolarHBondContact O-CB 3.46Å; E278-Y282 PolarHBondContact O-N 3.5Å; I279-Y282 PolarHBondContact O-N 2.92Å
283	V	98.6	Very high	98	Very high	5 Å²	5	62 Å²	62	3%	0.03	30%	0.3	C	S	.	.	S	Bend	trans	-86.9	130	-171	-175.9	0	0	0	0	110.5	Y188 M192 V200 I279 K285 R287 L288	Y188-V283 HydrophobicContact CD2-CG2 4.38Å; Y188-V283 HydrophobicContact CE2-CG2 4.35Å; M192-V283 HydrophobicContact CE-CB 4.36Å; M192-V283 HydrophobicContact CE-CG1 3.86Å; M192-V283 HydrophobicContact CE-CG2 4.18Å; M192-V283 HydrophobicContact SD-CG1 4.36Å; M192-V283 HydrophobicContact SD-CG2 3.8Å; V200-V283 HydrophobicContact CB-CG1 3.94Å; V200-V283 HydrophobicContact CB-CG2 4.49Å; V200-V283 HydrophobicContact CG1-CG2 4.3Å; V200-V283 HydrophobicContact CG2-CG1 3.85Å; V200-V283 HydrophobicContact CG2-CG2 4.35Å; I279-V283 HydrophobicContact CG2-CG2 3.86Å; I279-V283 WeakPolarHBondContact O-CB 3.27Å; I279-V283 VanDerWaalsContact O-CG2 3.31Å; I279-V283 WeakPolarHBondContact O-CG2 3.4Å; I279-V283 PolarHBondContact O-N 3.5Å; V283-K285 PolarHBondContact O-N 3.37Å; V283-R287 HydrophobicContact CG1-CB 4.33Å; V283-L288 HydrophobicContact CB-CB 4.22Å; V283-L288 HydrophobicContact CB-CD1 4.27Å; V283-L288 HydrophobicContact CB-CD2 4.32Å; V283-L288 HydrophobicContact CG1-CB 3.78Å; V283-L288 HydrophobicContact CG1-CD1 4.22Å; V283-L288 HydrophobicContact CG1-CG 4.45Å
284	P	98.2	Very high	97.8	Very high	56 Å²	56	65 Å²	65	36%	0.364	31%	0.31	S	S	.	.			trans	-54.1	134.3	173.6	-26.5	35.3	0	0	0	112.1	D286 R287 L288	P284-D286 WeakPolarHBondContact CB-OD1 3.45Å; P284-D286 PolarHBondContact O-N 3.46Å; P284-R287 CarbonylContact O-C 3.57Å; P284-R287 WeakPolarHBondContact O-CA 3.43Å; P284-R287 PolarHBondContact O-N 3.26Å; P284-L288 PolarHBondContact O-N 3Å
285	K	97.6	Very high	97.7	Very high	193 Å²	193	62.3 Å²	62.3	84%	0.839	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-57.8	-35.4	-172.9	-68.5	-174.1	178.9	-177.7	0	113.4	V283 R287 L288	V283-K285 PolarHBondContact O-N 3.37Å; K285-R287 PolarHBondContact O-N 3.26Å; K285-L288 PolarHBondContact O-N 2.99Å
286	D	97.2	Very high	97.6	Very high	128 Å²	128	62.2 Å²	62.2	68%	0.684	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-68.6	-19	177.1	62.6	-57.5	0	0	0	113.4	P284	P284-D286 WeakPolarHBondContact CB-OD1 3.45Å; P284-D286 PolarHBondContact O-N 3.46Å
287	R	98	Very high	97.6	Very high	47 Å²	47	62.3 Å²	62.3	18%	0.177	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-103.7	-2.9	176.3	-68.9	179	61.3	-175.4	1	113.4	P196 A198 V200 V283 P284 K285 F303	P196-R287 PolarHBondContact O-NH1 3.3Å; P196-R287 PolarHBondContact O-NH2 3.4Å; P196-R287 VanDerWaalsContact O-NH2 3.13Å; A198-R287 VanDerWaalsContact O-CZ 3.27Å; A198-R287 PolarHBondContact O-NE 3.12Å; A198-R287 PolarHBondContact O-NH2 3.23Å; V200-R287 PolarHBondContact N-O 2.63Å; V283-R287 HydrophobicContact CG1-CB 4.33Å; P284-R287 CarbonylContact O-C 3.57Å; P284-R287 WeakPolarHBondContact O-CA 3.43Å; P284-R287 PolarHBondContact O-N 3.26Å; K285-R287 PolarHBondContact O-N 3.26Å; R287-F303 WeakPolarHBondContact O-CZ 3.32Å
288	L	98.8	Very high	97.6	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.12	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.5	-173.9	-177.6	62.9	0	0	0	111.8	V200 L202 I279 I280 V283 P284 K285 I290	V200-L288 HydrophobicContact CB-CD1 4.23Å; V200-L288 HydrophobicContact CG1-CD1 4.08Å; V200-L288 WeakPolarHBondContact O-CA 3.41Å; L202-L288 HydrophobicContact CB-CD1 4.06Å; I279-L288 HydrophobicContact CG2-CD1 4.21Å; I280-L288 HydrophobicContact CG1-CD2 4.32Å; V283-L288 HydrophobicContact CB-CB 4.22Å; V283-L288 HydrophobicContact CB-CD1 4.27Å; V283-L288 HydrophobicContact CB-CD2 4.32Å; V283-L288 HydrophobicContact CG1-CB 3.78Å; V283-L288 HydrophobicContact CG1-CD1 4.22Å; V283-L288 HydrophobicContact CG1-CG 4.45Å; P284-L288 PolarHBondContact O-N 3Å; K285-L288 PolarHBondContact O-N 2.99Å; L288-I290 HydrophobicContact CD2-CG1 4.2Å; L288-I290 HydrophobicContact CG-CG1 4.36Å
289	L	98.8	Very high	97.6	Very high	19 Å²	19	59.3 Å²	59.3	10%	0.099	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.1	160.5	177	66	0	0	0	109.7	V200 I201 L202 F291 P299 L300 F303	V200-L289 PolarHBondContact O-N 3.45Å; I201-L289 WeakPolarHBondContact CA-O 3.2Å; I201-L289 HydrophobicContact CD1-CD2 4.45Å; I201-L289 HydrophobicContact CG1-CB 4.31Å; I201-L289 HydrophobicContact CG1-CD2 4.41Å; I201-L289 HydrophobicContact CG2-CD2 4.33Å; L202-L289 PolarHBondContact N-O 3.38Å; L289-F291 HydrophobicContact CD2-CB 4.08Å; L289-F291 HydrophobicContact CD2-CD2 4.4Å; L289-F291 HydrophobicContact CD2-CG 4.28Å; L289-F291 HydrophobicContact CG-CB 4.05Å; L289-P299 HydrophobicContact CD1-CB 4.4Å; L289-L300 HydrophobicContact CD2-CD1 4.07Å; L289-F303 HydrophobicContact CB-CB 4.27Å; L289-F303 HydrophobicContact CB-CD1 3.53Å; L289-F303 HydrophobicContact CB-CD2 3.86Å; L289-F303 HydrophobicContact CB-CE1 3.63Å; L289-F303 HydrophobicContact CB-CE2 3.97Å; L289-F303 HydrophobicContact CB-CG 3.63Å; L289-F303 HydrophobicContact CB-CZ 3.84Å; L289-F303 HydrophobicContact CD1-CB 4.1Å; L289-F303 HydrophobicContact CD1-CG 4.33Å; L289-F303 HydrophobicContact CD2-CB 3.91Å; L289-F303 HydrophobicContact CD2-CD1 3.83Å; L289-F303 HydrophobicContact CD2-CG 4.02Å; L289-F303 HydrophobicContact CG-CB 4.3Å; L289-F303 HydrophobicContact CG-CD1 4.23Å; L289-F303 HydrophobicContact CG-CG 4.19Å
290	I	98.7	Very high	97.6	Very high	84 Å²	84	59.3 Å²	59.3	43%	0.431	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.1	164.3	-56.4	171.4	0	0	0	106.6	V204 I280 L288	V204-I290 HydrophobicContact CB-CG2 4.47Å; V204-I290 HydrophobicContact CG1-CG2 3.76Å; V204-I290 HydrophobicContact CG2-CG2 3.85Å; I280-I290 HydrophobicContact CD1-CD1 3.82Å; I280-I290 HydrophobicContact CG1-CD1 3.85Å; I280-I290 HydrophobicContact CG1-CG1 4.29Å; L288-I290 HydrophobicContact CD2-CG1 4.2Å; L288-I290 HydrophobicContact CG-CG1 4.36Å
291	F	98.6	Very high	97.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	119.7	-167	-175.7	-132	0	0	0	112.1	L121 I201 L202 T203 V204 L289 P293 D295 G296 P299 L300 F314	L121-F291 HydrophobicContact CD1-CD1 4.28Å; L121-F291 HydrophobicContact CD1-CE1 4.14Å; I201-F291 HydrophobicContact CG2-CB 3.95Å; I201-F291 HydrophobicContact CG2-CD1 4.29Å; I201-F291 HydrophobicContact CG2-CG 4.5Å; L202-F291 PolarHBondContact O-N 2.83Å; T203-F291 CarbonylContact C-O 3.57Å; T203-F291 WeakPolarHBondContact CA-O 3.47Å; T203-F291 HydrophobicContact CG2-CD1 3.94Å; V204-F291 PolarHBondContact N-O 3.12Å; L289-F291 HydrophobicContact CD2-CB 4.08Å; L289-F291 HydrophobicContact CD2-CD2 4.4Å; L289-F291 HydrophobicContact CD2-CG 4.28Å; L289-F291 HydrophobicContact CG-CB 4.05Å; F291-P293 HydrophobicContact CD1-CG 4.32Å; F291-P293 HydrophobicContact CE1-CB 4.37Å; F291-P293 HydrophobicContact CE1-CG 4.15Å; F291-D295 HydrophobicContact CE2-CB 4.48Å; F291-G296 WeakPolarHBondContact CE2-O 3.28Å; F291-G296 WeakPolarHBondContact CZ-O 3.33Å; F291-P299 HydrophobicContact CD2-CG 3.96Å; F291-P299 HydrophobicContact CE2-CG 3.83Å; F291-L300 HydrophobicContact CE2-CB 4.23Å; F291-L300 HydrophobicContact CZ-CB 4.23Å; F291-L300 HydrophobicContact CZ-CD2 4.49Å; F291-F314 HydrophobicContact CE1-CE2 4.27Å; F291-F314 AromaticContact CE1-CZ 3.81Å; F291-F314 HydrophobicContact CE1-CZ 3.81Å; F291-F314 HydrophobicContact CZ-CE1 4.48Å; F291-F314 AromaticContact CZ-CE2 3.78Å; F291-F314 HydrophobicContact CZ-CE2 3.78Å; F291-F314 AromaticContact CZ-CZ 3.62Å; F291-F314 HydrophobicContact CZ-CZ 3.62Å
292	D	97	Very high	97.5	Very high	35 Å²	35	57.6 Å²	57.6	19%	0.187	29%	0.286	C	S	.	.			trans	-91.6	120.5	159.8	-170.7	-29.7	0	0	0	107.8	V204 K294 D295	V204-D292 HydrophobicContact CG2-CB 4.43Å; D292-K294 PolarHBondContact O-N 3.05Å; D292-K294 WeakPolarHBondContact OD1-CB 3.48Å; D292-K294 VanDerWaalsContact OD1-CG 3.29Å; D292-K294 WeakPolarHBondContact OD1-CG 3.32Å; D292-K294 PolarHBondContact OD1-N 3.29Å; D292-D295 VanDerWaalsContact O-CB 3.3Å; D292-D295 WeakPolarHBondContact O-CB 3.39Å; D292-D295 PolarHBondContact O-N 3.14Å
293	P	94.3	Very high	97.5	Very high	10 Å²	10	54.7 Å²	54.7	7%	0.065	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-56.7	-11.6	175.9	-30.1	40.2	0	0	0	115.3	T116 T203 F291 D295 F314	T116-P293 WeakPolarHBondContact O-CD 3.47Å; T116-P293 WeakPolarHBondContact O-CG 3.09Å; T203-P293 HydrophobicContact CG2-CG 4.18Å; F291-P293 HydrophobicContact CD1-CG 4.32Å; F291-P293 HydrophobicContact CE1-CB 4.37Å; F291-P293 HydrophobicContact CE1-CG 4.15Å; P293-D295 VanDerWaalsContact C-N 3.3Å; P293-F314 HydrophobicContact CB-CE1 3.94Å; P293-F314 HydrophobicContact CB-CZ 4.41Å; P293-F314 WeakPolarHBondContact O-CD1 3.21Å; P293-F314 WeakPolarHBondContact O-CE1 3.44Å
294	K	93.6	Very high	97.4	Very high	149 Å²	149	54.8 Å²	54.8	65%	0.648	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-70.5	-23	168.8	-66.9	174.2	-174.8	170.7	0	113.6	D292 G296	D292-K294 PolarHBondContact O-N 3.05Å; D292-K294 WeakPolarHBondContact OD1-CB 3.48Å; D292-K294 VanDerWaalsContact OD1-CG 3.29Å; D292-K294 WeakPolarHBondContact OD1-CG 3.32Å; D292-K294 PolarHBondContact OD1-N 3.29Å; K294-G296 PolarHBondContact O-N 3.23Å
295	D	95.4	Very high	97.4	Very high	94 Å²	94	59.1 Å²	59.1	50%	0.503	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-73.7	-12.6	179.6	-57.6	-29.4	0	0	0	112.2	F291 D292 P293 P299	F291-D295 HydrophobicContact CE2-CB 4.48Å; D292-D295 VanDerWaalsContact O-CB 3.3Å; D292-D295 WeakPolarHBondContact O-CB 3.39Å; D292-D295 PolarHBondContact O-N 3.14Å; P293-D295 VanDerWaalsContact C-N 3.3Å; D295-P299 HydrophobicContact CB-CG 3.72Å
296	G	96.2	Very high	97.3	Very high	12 Å²	12	52 Å²	52	12%	0.124	27%	0.266	C	S	.	.			trans	73.3	-145.1	173.3	0	0	0	0	0	113.6	F291 K294	F291-G296 WeakPolarHBondContact CE2-O 3.28Å; F291-G296 WeakPolarHBondContact CZ-O 3.33Å; K294-G296 PolarHBondContact O-N 3.23Å
297	W	98.1	Very high	97.3	Very high	20 Å²	20	51.4 Å²	51.4	8%	0.076	27%	0.27	C	S	.	.	H	α-helix	trans	-74.3	-36.4	-171.7	-70.3	121.2	0	0	0	114.3	A124 L127 L128 L300 C301 I308 P309 V312 F314	A124-W297 HydrophobicContact CB-CH2 3.87Å; A124-W297 HydrophobicContact CB-CZ3 3.67Å; L127-W297 HydrophobicContact CB-CH2 4.26Å; L127-W297 HydrophobicContact CD1-CH2 4.15Å; L127-W297 HydrophobicContact CD1-CZ2 4.29Å; L128-W297 HydrophobicContact CD1-CE3 4.15Å; L128-W297 HydrophobicContact CD1-CZ3 3.61Å; L128-W297 HydrophobicContact CD2-CE3 4.12Å; L128-W297 HydrophobicContact CD2-CH2 4.46Å; L128-W297 HydrophobicContact CD2-CZ3 3.79Å; L128-W297 HydrophobicContact CG-CE3 4.33Å; L128-W297 HydrophobicContact CG-CH2 4.27Å; L128-W297 HydrophobicContact CG-CZ3 3.6Å; W297-L300 HydrophobicContact CE3-CD2 4.39Å; W297-L300 HydrophobicContact CZ3-CD2 4.36Å; W297-L300 PolarHBondContact O-N 2.94Å; W297-L300 VanDerWaalsContact O-N 3.16Å; W297-C301 WeakPolarHBondContact O-CB 3.19Å; W297-C301 PolarHBondContact O-N 3.41Å; W297-I308 HydrophobicContact CB-CG1 4.37Å; W297-I308 HydrophobicContact CB-CG2 3.78Å; W297-I308 HydrophobicContact CG-CG2 4.19Å; W297-P309 HydrophobicContact CD2-CG 4.35Å; W297-P309 HydrophobicContact CE3-CG 4.45Å; W297-P309 HydrophobicContact CH2-CG 4.38Å; W297-P309 HydrophobicContact CZ2-CG 4.27Å; W297-P309 HydrophobicContact CZ3-CG 4.47Å; W297-V312 HydrophobicContact CZ2-CG1 4.27Å; W297-V312 PolarHBondContact NE1-O 3.19Å; W297-F314 HydrophobicContact CD2-CB 4.47Å; W297-F314 AromaticContact CD2-CD2 3.76Å; W297-F314 HydrophobicContact CD2-CD2 3.76Å; W297-F314 AromaticContact CE3-CD2 3.82Å; W297-F314 HydrophobicContact CE3-CD2 3.82Å; W297-F314 HydrophobicContact CE3-CE2 4.25Å; W297-F314 HydrophobicContact CG-CB 4.49Å; W297-F314 HydrophobicContact CG-CD2 4.25Å; W297-F314 HydrophobicContact CH2-CD2 4.41Å; W297-F314 HydrophobicContact CZ2-CD2 4.35Å; W297-F314 HydrophobicContact CZ3-CD2 4.14Å; W297-F314 HydrophobicContact CZ3-CE2 4.36Å
298	T	97.8	Very high	97.3	Very high	67 Å²	67	53.1 Å²	53.1	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-53	-60.6	-165.8	-55.5	0	0	0	0	113.6	L300 C301 E302	T298-L300 VanDerWaalsContact C-N 3.26Å; T298-L300 PolarHBondContact O-N 2.97Å; T298-C301 PolarHBondContact O-N 2.95Å; T298-E302 HydrophobicContact CG2-CG 4.5Å; T298-E302 WeakPolarHBondContact CG2-OE1 3.34Å; T298-E302 WeakPolarHBondContact O-CB 3.46Å; T298-E302 VanDerWaalsContact O-CG 3.32Å; T298-E302 WeakPolarHBondContact O-CG 3.29Å; T298-E302 PolarHBondContact O-N 3.37Å
299	P	98.2	Very high	97.1	Very high	33 Å²	33	53.7 Å²	53.7	21%	0.214	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-30.2	-177.2	27.7	-36.5	0	0	0	112.6	L289 F291 D295 F303	L289-P299 HydrophobicContact CD1-CB 4.4Å; F291-P299 HydrophobicContact CD2-CG 3.96Å; F291-P299 HydrophobicContact CE2-CG 3.83Å; D295-P299 HydrophobicContact CB-CG 3.72Å; P299-F303 VanDerWaalsContact O-CB 3.23Å; P299-F303 WeakPolarHBondContact O-CB 3.5Å; P299-F303 PolarHBondContact O-N 3.3Å; P299-F303 VanDerWaalsContact O-N 3.11Å
300	L	98.3	Very high	96.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-69.1	-50.5	177.9	-179.2	61	0	0	0	111.3	L121 A124 L128 I201 L289 F291 W297 T298 F303 L304 F314	L121-L300 HydrophobicContact CD1-CD1 4.12Å; L121-L300 HydrophobicContact CD1-CD2 4.18Å; A124-L300 HydrophobicContact CB-CD2 3.92Å; L128-L300 HydrophobicContact CD1-CD2 3.91Å; L128-L300 HydrophobicContact CD1-CG 4.22Å; I201-L300 HydrophobicContact CD1-CD1 3.6Å; L289-L300 HydrophobicContact CD2-CD1 4.07Å; F291-L300 HydrophobicContact CE2-CB 4.23Å; F291-L300 HydrophobicContact CZ-CB 4.23Å; F291-L300 HydrophobicContact CZ-CD2 4.49Å; W297-L300 HydrophobicContact CE3-CD2 4.39Å; W297-L300 HydrophobicContact CZ3-CD2 4.36Å; W297-L300 PolarHBondContact O-N 2.94Å; W297-L300 VanDerWaalsContact O-N 3.16Å; T298-L300 VanDerWaalsContact C-N 3.26Å; T298-L300 PolarHBondContact O-N 2.97Å; L300-F303 PolarHBondContact O-N 3.49Å; L300-L304 HydrophobicContact CD1-CD1 3.68Å; L300-L304 HydrophobicContact CD1-CG 4.19Å; L300-L304 HydrophobicContact CG-CD1 3.86Å; L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 WeakPolarHBondContact O-CG 3.21Å; L300-L304 PolarHBondContact O-N 3.27Å; L300-F314 HydrophobicContact CD2-CE2 4.07Å
301	C	98.2	Very high	96.6	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.014	34%	0.34	C	S	.	.	H	α-helix	trans	-66.4	-39.9	-179.4	-73.9	0	0	0	0	112	W297 T298 L304 N305 I306 I308	W297-C301 WeakPolarHBondContact O-CB 3.19Å; W297-C301 PolarHBondContact O-N 3.41Å; T298-C301 PolarHBondContact O-N 2.95Å; C301-L304 CarbonylContact O-C 3.57Å; C301-L304 PolarHBondContact O-N 3.26Å; C301-N305 WeakPolarHBondContact O-CA 3.42Å; C301-N305 PolarHBondContact O-N 2.81Å; C301-I306 HydrophobicContact CB-CG1 4.32Å; C301-I306 WeakPolarHBondContact CB-O 3.45Å; C301-I306 PolarHBondContact O-N 3.35Å; C301-I308 HydrophobicContact CB-CG1 3.71Å
302	E	97.9	Very high	96.4	Very high	138 Å²	138	67.6 Å²	67.6	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-60.1	-49.8	173.7	-75.5	175.7	-179.9	0	0	111.5	T298 L304 N305	T298-E302 HydrophobicContact CG2-CG 4.5Å; T298-E302 WeakPolarHBondContact CG2-OE1 3.34Å; T298-E302 WeakPolarHBondContact O-CB 3.46Å; T298-E302 VanDerWaalsContact O-CG 3.32Å; T298-E302 WeakPolarHBondContact O-CG 3.29Å; T298-E302 PolarHBondContact O-N 3.37Å; E302-L304 VanDerWaalsContact C-N 3.27Å; E302-L304 PolarHBondContact O-N 3.32Å; E302-N305 PolarHBondContact O-N 3.45Å; E302-N305 VanDerWaalsContact O-N 3.07Å
303	F	98.2	Very high	96.3	Very high	33 Å²	33	71 Å²	71	15%	0.145	38%	0.383	C	S	.	.	H	α-helix	trans	-61.7	-36.4	178.2	176.5	-113.3	0	0	0	112.9	K199 I201 R287 L289 P299 L300 N305	K199-F303 HydrophobicContact CB-CE1 3.75Å; K199-F303 HydrophobicContact CB-CZ 3.67Å; K199-F303 HydrophobicContact CD-CD1 4.39Å; K199-F303 HydrophobicContact CD-CE1 3.81Å; K199-F303 HydrophobicContact CD-CE2 4.29Å; K199-F303 HydrophobicContact CD-CZ 3.76Å; K199-F303 HydrophobicContact CG-CE1 4.22Å; K199-F303 HydrophobicContact CG-CZ 3.9Å; K199-F303 PolarHBondContact NZ-O 2.87Å; I201-F303 HydrophobicContact CG1-CD1 4.42Å; I201-F303 HydrophobicContact CG1-CE1 3.98Å; R287-F303 WeakPolarHBondContact O-CZ 3.32Å; L289-F303 HydrophobicContact CB-CB 4.27Å; L289-F303 HydrophobicContact CB-CD1 3.53Å; L289-F303 HydrophobicContact CB-CD2 3.86Å; L289-F303 HydrophobicContact CB-CE1 3.63Å; L289-F303 HydrophobicContact CB-CE2 3.97Å; L289-F303 HydrophobicContact CB-CG 3.63Å; L289-F303 HydrophobicContact CB-CZ 3.84Å; L289-F303 HydrophobicContact CD1-CB 4.1Å; L289-F303 HydrophobicContact CD1-CG 4.33Å; L289-F303 HydrophobicContact CD2-CB 3.91Å; L289-F303 HydrophobicContact CD2-CD1 3.83Å; L289-F303 HydrophobicContact CD2-CG 4.02Å; L289-F303 HydrophobicContact CG-CB 4.3Å; L289-F303 HydrophobicContact CG-CD1 4.23Å; L289-F303 HydrophobicContact CG-CG 4.19Å; P299-F303 VanDerWaalsContact O-CB 3.23Å; P299-F303 WeakPolarHBondContact O-CB 3.5Å; P299-F303 PolarHBondContact O-N 3.3Å; P299-F303 VanDerWaalsContact O-N 3.11Å; L300-F303 PolarHBondContact O-N 3.49Å; F303-N305 VanDerWaalsContact C-N 3.3Å
304	L	97.1	Very high	96.4	Very high	8 Å²	8	71.2 Å²	71.2	4%	0.042	38%	0.383	C	S	.	.	H	α-helix	trans	-81.3	-10.7	178.3	-66.7	175.4	0	0	0	113.2	F107 I108 L125 L128 Y129 L300 C301 E302 I306	F107-L304 HydrophobicContact CE1-CD2 4.07Å; I108-L304 HydrophobicContact CD1-CD2 3.5Å; I108-L304 VanDerWaalsContact CD1-CD2 3.5Å; I108-L304 HydrophobicContact CG1-CD2 4.24Å; L125-L304 HydrophobicContact CD2-CD1 4.01Å; L128-L304 HydrophobicContact CD1-CD1 3.94Å; Y129-L304 HydrophobicContact CE2-CD1 3.98Å; L300-L304 HydrophobicContact CD1-CD1 3.68Å; L300-L304 HydrophobicContact CD1-CG 4.19Å; L300-L304 HydrophobicContact CG-CD1 3.86Å; L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 WeakPolarHBondContact O-CG 3.21Å; L300-L304 PolarHBondContact O-N 3.27Å; C301-L304 CarbonylContact O-C 3.57Å; C301-L304 PolarHBondContact O-N 3.26Å; E302-L304 VanDerWaalsContact C-N 3.27Å; E302-L304 PolarHBondContact O-N 3.32Å; L304-I306 HydrophobicContact CB-CD1 3.98Å; L304-I306 HydrophobicContact CB-CG1 3.92Å; L304-I306 HydrophobicContact CD1-CD1 4.05Å
305	N	96.7	Very high	96.4	Very high	147 Å²	147	64.9 Å²	64.9	79%	0.786	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	50.2	-174.4	-167	37.6	0	0	0	112.6	C301 E302 F303	C301-N305 WeakPolarHBondContact O-CA 3.42Å; C301-N305 PolarHBondContact O-N 2.81Å; E302-N305 PolarHBondContact O-N 3.45Å; E302-N305 VanDerWaalsContact O-N 3.07Å; F303-N305 VanDerWaalsContact C-N 3.3Å
306	I	96.4	Very high	96.1	Very high	43 Å²	43	66.6 Å²	66.6	22%	0.221	36%	0.361	C	S	.	.			trans	-131.6	156	177.7	62.4	-178.7	0	0	0	110.5	L128 Y129 C301 L304	L128-I306 HydrophobicContact CB-CD1 3.8Å; L128-I306 HydrophobicContact CD1-CD1 3.88Å; L128-I306 HydrophobicContact CD2-CD1 3.68Å; L128-I306 HydrophobicContact CG-CD1 3.97Å; Y129-I306 HydrophobicContact CE2-CD1 4.29Å; C301-I306 HydrophobicContact CB-CG1 4.32Å; C301-I306 WeakPolarHBondContact CB-O 3.45Å; C301-I306 PolarHBondContact O-N 3.35Å; L304-I306 HydrophobicContact CB-CD1 3.98Å; L304-I306 HydrophobicContact CB-CG1 3.92Å; L304-I306 HydrophobicContact CD1-CD1 4.05Å
307	P	97.2	Very high	95.5	Very high	116 Å²	116	69.9 Å²	69.9	75%	0.753	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-60.5	147.3	175.3	-22.6	33.8	0	0	0	112.6
308	I	97.2	Very high	94.6	Very high	82 Å²	82	71.1 Å²	71.1	42%	0.421	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-69.3	130.8	168.7	-65.2	172.6	0	0	0	108.4	W297 C301 E310	W297-I308 HydrophobicContact CB-CG1 4.37Å; W297-I308 HydrophobicContact CB-CG2 3.78Å; W297-I308 HydrophobicContact CG-CG2 4.19Å; C301-I308 HydrophobicContact CB-CG1 3.71Å; I308-E310 PolarHBondContact O-N 3.44Å
309	P	96.1	Very high	93.6	Very high	35 Å²	35	74.9 Å²	74.9	23%	0.227	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-59.3	125.7	175.3	-25.7	35.4	0	0	0	112.2	L128 W297 V312	L128-P309 HydrophobicContact CD2-CG 3.48Å; L128-P309 VanDerWaalsContact CD2-CG 3.48Å; W297-P309 HydrophobicContact CD2-CG 4.35Å; W297-P309 HydrophobicContact CE3-CG 4.45Å; W297-P309 HydrophobicContact CH2-CG 4.38Å; W297-P309 HydrophobicContact CZ2-CG 4.27Å; W297-P309 HydrophobicContact CZ3-CG 4.47Å; P309-V312 HydrophobicContact CB-CB 4.06Å; P309-V312 HydrophobicContact CB-CG2 4.38Å
310	E	94.4	Very high	92.5	Very high	169 Å²	169	78.4 Å²	78.4	79%	0.79	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	136.3	175.5	-65.2	-175.7	-178.8	0	0	111.1	I308 V312	I308-E310 PolarHBondContact O-N 3.44Å; E310-V312 PolarHBondContact O-N 3.41Å
311	N	92.5	Very high	91.4	Very high	164 Å²	164	82.8 Å²	82.8	88%	0.877	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	15	174.1	-55.3	-52.9	0	0	0	116.2
312	V	94.3	Very high	90.5	Very high	62 Å²	62	86.8 Å²	86.8	38%	0.376	45%	0.451	S	S	.	.			trans	-110.9	115	175.4	-179	0	0	0	0	108.9	L127 W297 P309 E310	L127-V312 HydrophobicContact CD1-CG1 4.27Å; W297-V312 HydrophobicContact CZ2-CG1 4.27Å; W297-V312 PolarHBondContact NE1-O 3.19Å; P309-V312 HydrophobicContact CB-CB 4.06Å; P309-V312 HydrophobicContact CB-CG2 4.38Å; E310-V312 PolarHBondContact O-N 3.41Å
313	P	94.8	Very high	89.5	Confident	108 Å²	108	81.5 Å²	81.5	70%	0.701	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-68.2	150.4	175.8	29.1	-34.2	0	0	0	110.8
314	F	96.3	Very high	88.6	Confident	14 Å²	14	85.5 Å²	85.5	6%	0.061	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-60.9	135.4	174.7	-173.3	-91.7	0	0	0	110.2	A124 F291 P293 W297 L300 H316	A124-F314 HydrophobicContact CB-CD2 4.33Å; A124-F314 HydrophobicContact CB-CE2 3.58Å; A124-F314 HydrophobicContact CB-CZ 3.96Å; F291-F314 HydrophobicContact CE1-CE2 4.27Å; F291-F314 AromaticContact CE1-CZ 3.81Å; F291-F314 HydrophobicContact CE1-CZ 3.81Å; F291-F314 HydrophobicContact CZ-CE1 4.48Å; F291-F314 AromaticContact CZ-CE2 3.78Å; F291-F314 HydrophobicContact CZ-CE2 3.78Å; F291-F314 AromaticContact CZ-CZ 3.62Å; F291-F314 HydrophobicContact CZ-CZ 3.62Å; P293-F314 HydrophobicContact CB-CE1 3.94Å; P293-F314 HydrophobicContact CB-CZ 4.41Å; P293-F314 WeakPolarHBondContact O-CD1 3.21Å; P293-F314 WeakPolarHBondContact O-CE1 3.44Å; W297-F314 HydrophobicContact CD2-CB 4.47Å; W297-F314 AromaticContact CD2-CD2 3.76Å; W297-F314 HydrophobicContact CD2-CD2 3.76Å; W297-F314 AromaticContact CE3-CD2 3.82Å; W297-F314 HydrophobicContact CE3-CD2 3.82Å; W297-F314 HydrophobicContact CE3-CE2 4.25Å; W297-F314 HydrophobicContact CG-CB 4.49Å; W297-F314 HydrophobicContact CG-CD2 4.25Å; W297-F314 HydrophobicContact CH2-CD2 4.41Å; W297-F314 HydrophobicContact CZ2-CD2 4.35Å; W297-F314 HydrophobicContact CZ3-CD2 4.14Å; W297-F314 HydrophobicContact CZ3-CE2 4.36Å; L300-F314 HydrophobicContact CD2-CE2 4.07Å; F314-H316 PolarHBondContact O-CD2 3.33Å; F314-H316 VanDerWaalsContact O-CD2 3.24Å; F314-H316 PolarHBondContact O-N 2.79Å
315	P	94	Very high	88	Confident	15 Å²	15	89.2 Å²	89.2	10%	0.097	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-62.5	129.3	-177	-24.5	34.7	0	0	0	112.6	S120 F123 A124 L127 L317	S120-P315 WeakPolarHBondContact CB-O 3.38Å; S120-P315 PolarHBondContact OG-O 2.85Å; F123-P315 HydrophobicContact CB-CB 4.05Å; F123-P315 HydrophobicContact CB-CG 4.07Å; A124-P315 HydrophobicContact CB-CG 4.37Å; L127-P315 HydrophobicContact CD1-CG 3.74Å; P315-L317 HydrophobicContact CB-CD1 4.3Å; P315-L317 HydrophobicContact CB-CG 4.46Å
316	H	88.5	Confident	87.3	Confident	130 Å²	130	85.9 Å²	85.9	60%	0.602	44%	0.438	S	S	*	.			trans	-118.6	90.1	171.7	-69.4	-67	0	0	0	110.6	F314	F314-H316 PolarHBondContact O-CD2 3.33Å; F314-H316 VanDerWaalsContact O-CD2 3.24Å; F314-H316 PolarHBondContact O-N 2.79Å
317	L	84.1	Confident	86.6	Confident	81 Å²	81	85.4 Å²	85.4	42%	0.424	44%	0.435	S	S	.	.			trans	-119.9	170.8	-170.7	-64.2	173.4	0	0	0	112.5	T119 S120 F123 P315	T119-L317 HydrophobicContact CG2-CB 4.11Å; S120-L317 PolarHBondContact OG-N 2.92Å; F123-L317 HydrophobicContact CB-CD1 3.95Å; F123-L317 HydrophobicContact CD1-CD1 4.05Å; F123-L317 HydrophobicContact CD2-CD1 3.2Å; F123-L317 HydrophobicContact CE1-CD1 4.36Å; F123-L317 HydrophobicContact CE2-CD1 3.59Å; F123-L317 HydrophobicContact CG-CD1 3.46Å; F123-L317 VanDerWaalsContact CG-CD1 3.46Å; F123-L317 HydrophobicContact CZ-CD1 4.15Å; P315-L317 HydrophobicContact CB-CD1 4.3Å; P315-L317 HydrophobicContact CB-CG 4.46Å
318	N	78.6	Confident	86	Confident	47 Å²	47	82.8 Å²	82.8	25%	0.251	41%	0.414	S	S	.	.			trans	61.7	50.7	174.6	-161.3	9.3	0	0	0	114.5	R115 T119 R320	R115-N318 VanDerWaalsContact NH1-CG 3.32Å; R115-N318 PolarHBondContact NH1-ND2 2.89Å; R115-N318 PolarHBondContact NH1-OD1 3.42Å; R115-N318 PolarHBondContact NH2-O 2.89Å; T119-N318 HydrophobicContact CG2-CB 4.01Å; T119-N318 PolarHBondContact OG1-ND2 3.45Å; N318-R320 PolarHBondContact O-N 3.49Å
319	K	76.6	Confident	85.5	Confident	145 Å²	145	83 Å²	83	63%	0.63	41%	0.412	S	S	*	.			trans	-55.4	138.3	176.7	-62.3	-178.4	-179.5	179.1	0	110.6	V321 D322 L323	K319-V321 PolarHBondContact O-N 2.97Å; K319-D322 PolarHBondContact O-N 3.49Å; K319-L323 PolarHBondContact O-N 3.09Å
320	R	75.6	Confident	84.9	Confident	108 Å²	108	84 Å²	84	41%	0.408	41%	0.412	S	S	.	.	H	α-helix	trans	-52.4	-42.6	-179.2	-179.3	-178	176.8	-171.4	-1.6	111.9	S212 A216 T217 N318 L323 R324	S212-R320 PolarHBondContact O-NE 2.8Å; S212-R320 PolarHBondContact O-NH2 3.21Å; A216-R320 HydrophobicContact CB-CG 4.13Å; T217-R320 HydrophobicContact CG2-CG 4.24Å; N318-R320 PolarHBondContact O-N 3.49Å; R320-L323 PolarHBondContact O-N 2.88Å; R320-R324 WeakPolarHBondContact O-CB 3.33Å; R320-R324 PolarHBondContact O-N 2.85Å
321	V	74.5	Confident	84.3	Confident	91 Å²	91	80.5 Å²	80.5	55%	0.552	39%	0.391	S	S	*	.	H	α-helix	trans	-62.4	-45.9	-178.3	-178.8	0	0	0	0	111.4	K319 L323 R324 N325	K319-V321 PolarHBondContact O-N 2.97Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.17Å; V321-R324 PolarHBondContact O-N 3.3Å; V321-N325 WeakPolarHBondContact O-CB 3.48Å; V321-N325 PolarHBondContact O-N 3.23Å; V321-N325 PolarHBondContact O-OD1 3Å
322	D	79.5	Confident	84	Confident	86 Å²	86	77.8 Å²	77.8	46%	0.46	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-37.6	-177.8	-57.7	-25.6	0	0	0	112.5	K319 R326	K319-D322 PolarHBondContact O-N 3.49Å; D322-R326 WeakPolarHBondContact O-CG 3.45Å; D322-R326 PolarHBondContact O-N 3.25Å; D322-R326 PolarHBondContact O-NE 2.83Å
323	L	77.7	Confident	83.5	Confident	28 Å²	28	76.3 Å²	76.3	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-72.2	-43.8	175.6	-176.3	57.2	0	0	0	111.3	T217 T218 K319 R320 V321 N325 R326 L327	T217-L323 HydrophobicContact CG2-CB 3.91Å; T217-L323 HydrophobicContact CG2-CD2 3.93Å; T217-L323 HydrophobicContact CG2-CG 3.88Å; T218-L323 HydrophobicContact CG2-CD2 4.25Å; K319-L323 PolarHBondContact O-N 3.09Å; R320-L323 PolarHBondContact O-N 2.88Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.17Å; L323-N325 VanDerWaalsContact C-N 3.35Å; L323-N325 PolarHBondContact O-N 3.42Å; L323-R326 PolarHBondContact O-N 3.04Å; L323-L327 HydrophobicContact CD1-CD1 4.38Å; L323-L327 HydrophobicContact CD1-CG 4.37Å; L323-L327 HydrophobicContact CG-CD1 4.14Å; L323-L327 WeakPolarHBondContact O-CG 3.32Å; L323-L327 PolarHBondContact O-N 2.76Å
324	R	78.6	Confident	83	Confident	117 Å²	117	71.3 Å²	71.3	44%	0.442	33%	0.33	S	S	.	.	H	α-helix	trans	-56.9	-48	175.6	-179.7	-178.6	174.6	-171.2	-1.8	111.2	T217 R320 V321 R326 L327 L328	T217-R324 HydrophobicContact CG2-CB 4.32Å; R320-R324 WeakPolarHBondContact O-CB 3.33Å; R320-R324 PolarHBondContact O-N 2.85Å; V321-R324 PolarHBondContact O-N 3.3Å; R324-R326 VanDerWaalsContact C-N 3.32Å; R324-R326 PolarHBondContact O-N 3.38Å; R324-L327 PolarHBondContact O-N 3.31Å; R324-L327 VanDerWaalsContact O-N 3.15Å; R324-L328 HydrophobicContact CG-CD1 3.96Å; R324-L328 HydrophobicContact CG-CG 4.28Å; R324-L328 WeakPolarHBondContact O-CG 3.34Å; R324-L328 PolarHBondContact O-N 3.31Å
325	N	83.9	Confident	82.4	Confident	85 Å²	85	74.8 Å²	74.8	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-38.5	-179.1	-71.1	-5.5	0	0	0	112.1	V321 L323 K329	V321-N325 WeakPolarHBondContact O-CB 3.48Å; V321-N325 PolarHBondContact O-N 3.23Å; V321-N325 PolarHBondContact O-OD1 3Å; L323-N325 VanDerWaalsContact C-N 3.35Å; L323-N325 PolarHBondContact O-N 3.42Å; N325-K329 WeakPolarHBondContact O-CB 3.47Å; N325-K329 PolarHBondContact O-N 3.44Å
326	R	83.3	Confident	82.1	Confident	78 Å²	78	77.8 Å²	77.8	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-46	172.9	-77.4	179	-73.8	165.4	-5.5	111.9	Y141 D322 L323 R324 K329 Y330	Y141-R326 PolarHBondContact OH-NH1 3.26Å; D322-R326 WeakPolarHBondContact O-CG 3.45Å; D322-R326 PolarHBondContact O-N 3.25Å; D322-R326 PolarHBondContact O-NE 2.83Å; L323-R326 PolarHBondContact O-N 3.04Å; R324-R326 VanDerWaalsContact C-N 3.32Å; R324-R326 PolarHBondContact O-N 3.38Å; R326-K329 WeakPolarHBondContact O-CB 3.02Å; R326-K329 PolarHBondContact O-N 2.98Å; R326-Y330 HydrophobicContact CB-CE2 4.49Å; R326-Y330 WeakPolarHBondContact O-CD2 3.44Å; R326-Y330 PolarHBondContact O-N 2.7Å
327	L	81.7	Confident	82	Confident	32 Å²	32	73.9 Å²	73.9	17%	0.168	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-44.4	179.9	-67.8	171.2	0	0	0	111.8	T217 M222 V223 L323 R324 K329 Y330 R331	T217-L327 WeakPolarHBondContact O-CD1 3.22Å; M222-L327 HydrophobicContact CE-CB 3.74Å; M222-L327 HydrophobicContact CE-CD2 3.54Å; M222-L327 HydrophobicContact CE-CG 4.18Å; V223-L327 HydrophobicContact CG2-CD1 4.43Å; V223-L327 HydrophobicContact CG2-CD2 4.17Å; L323-L327 HydrophobicContact CD1-CD1 4.38Å; L323-L327 HydrophobicContact CD1-CG 4.37Å; L323-L327 HydrophobicContact CG-CD1 4.14Å; L323-L327 WeakPolarHBondContact O-CG 3.32Å; L323-L327 PolarHBondContact O-N 2.76Å; R324-L327 PolarHBondContact O-N 3.31Å; R324-L327 VanDerWaalsContact O-N 3.15Å; L327-K329 VanDerWaalsContact C-N 3.32Å; L327-K329 PolarHBondContact O-N 3.14Å; L327-Y330 PolarHBondContact O-N 3.13Å; L327-Y330 VanDerWaalsContact O-N 3.12Å; L327-R331 PolarHBondContact O-N 3.08Å
328	L	83.4	Confident	82	Confident	61 Å²	61	72.7 Å²	72.7	32%	0.319	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-44.1	174.7	-72.1	176.1	0	0	0	111.4	R324 Y330 R331 F332	R324-L328 HydrophobicContact CG-CD1 3.96Å; R324-L328 HydrophobicContact CG-CG 4.28Å; R324-L328 WeakPolarHBondContact O-CG 3.34Å; R324-L328 PolarHBondContact O-N 3.31Å; L328-Y330 VanDerWaalsContact C-N 3.27Å; L328-Y330 PolarHBondContact O-N 3.05Å; L328-R331 WeakPolarHBondContact O-CB 2.96Å; L328-R331 PolarHBondContact O-N 3.21Å; L328-R331 VanDerWaalsContact O-N 3.11Å; L328-F332 HydrophobicContact CB-CD2 4.32Å; L328-F332 HydrophobicContact CB-CE2 4.26Å; L328-F332 WeakPolarHBondContact O-CD2 3.48Å; L328-F332 PolarHBondContact O-N 3.47Å
329	K	86.6	Confident	82.4	Confident	86 Å²	86	73.7 Å²	73.7	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-56.1	-41	175.5	-177	177.3	178.4	171.4	0	112.4	N325 R326 L327 L333	N325-K329 WeakPolarHBondContact O-CB 3.47Å; N325-K329 PolarHBondContact O-N 3.44Å; R326-K329 WeakPolarHBondContact O-CB 3.02Å; R326-K329 PolarHBondContact O-N 2.98Å; L327-K329 VanDerWaalsContact C-N 3.32Å; L327-K329 PolarHBondContact O-N 3.14Å; K329-L333 WeakPolarHBondContact O-CB 3.22Å; K329-L333 PolarHBondContact O-N 3.17Å
330	Y	83.5	Confident	83	Confident	57 Å²	57	68.6 Å²	68.6	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-69.7	-40.5	176.2	-61.9	-48.5	0	0	0	112.3	R239 R326 L327 L328 L333 A334	R239-Y330 VanDerWaalsContact NH1-CE2 3.33Å; R326-Y330 HydrophobicContact CB-CE2 4.49Å; R326-Y330 WeakPolarHBondContact O-CD2 3.44Å; R326-Y330 PolarHBondContact O-N 2.7Å; L327-Y330 PolarHBondContact O-N 3.13Å; L327-Y330 VanDerWaalsContact O-N 3.12Å; L328-Y330 VanDerWaalsContact C-N 3.27Å; L328-Y330 PolarHBondContact O-N 3.05Å; Y330-L333 PolarHBondContact O-N 2.98Å; Y330-A334 WeakPolarHBondContact O-CB 3.34Å; Y330-A334 PolarHBondContact O-N 2.98Å
331	R	82.6	Confident	83.5	Confident	95 Å²	95	67.3 Å²	67.3	36%	0.358	32%	0.321	S	S	.	.	H	α-helix	trans	-58.6	-49.2	174.2	-172	172.3	172.9	151.7	-3.2	111.3	M222 L327 L328 L333 A334 Q335	M222-R331 HydrophobicContact SD-CB 3.65Å; M222-R331 HydrophobicContact SD-CG 4.33Å; L327-R331 PolarHBondContact O-N 3.08Å; L328-R331 WeakPolarHBondContact O-CB 2.96Å; L328-R331 PolarHBondContact O-N 3.21Å; L328-R331 VanDerWaalsContact O-N 3.11Å; R331-L333 VanDerWaalsContact C-N 3.32Å; R331-L333 PolarHBondContact O-N 3.49Å; R331-A334 PolarHBondContact O-N 3.28Å; R331-Q335 HydrophobicContact CG-CG 4.45Å; R331-Q335 WeakPolarHBondContact O-CB 3.48Å; R331-Q335 VanDerWaalsContact O-CG 3.31Å; R331-Q335 WeakPolarHBondContact O-CG 3.49Å; R331-Q335 PolarHBondContact O-N 3.12Å
332	F	85.5	Confident	84.1	Confident	108 Å²	108	67.1 Å²	67.1	47%	0.474	32%	0.315	S	S	.	.	H	α-helix	trans	-60	-42.7	177	-80.2	-66.1	0	0	0	111.8	L328 Q335 F336	L328-F332 HydrophobicContact CB-CD2 4.32Å; L328-F332 HydrophobicContact CB-CE2 4.26Å; L328-F332 WeakPolarHBondContact O-CD2 3.48Å; L328-F332 PolarHBondContact O-N 3.47Å; F332-Q335 PolarHBondContact O-N 3.01Å; F332-F336 VanDerWaalsContact O-CB 3.22Å; F332-F336 WeakPolarHBondContact O-CB 3.48Å; F332-F336 PolarHBondContact O-N 3.11Å
333	L	85.4	Confident	84.7	Confident	30 Å²	30	66.5 Å²	66.5	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-43.9	176.3	-177.4	61.4	0	0	0	111.8	L65 M69 I235 K329 Y330 R331 F336 L337	L65-L333 HydrophobicContact CD2-CD1 4.3Å; M69-L333 HydrophobicContact CE-CD2 4.28Å; M69-L333 HydrophobicContact SD-CD2 4.21Å; I235-L333 HydrophobicContact CD1-CB 4.33Å; I235-L333 HydrophobicContact CD1-CD2 4.26Å; I235-L333 HydrophobicContact CD1-CG 4.07Å; I235-L333 HydrophobicContact CG1-CD2 4.43Å; K329-L333 WeakPolarHBondContact O-CB 3.22Å; K329-L333 PolarHBondContact O-N 3.17Å; Y330-L333 PolarHBondContact O-N 2.98Å; R331-L333 VanDerWaalsContact C-N 3.32Å; R331-L333 PolarHBondContact O-N 3.49Å; L333-F336 PolarHBondContact O-N 3.3Å; L333-L337 HydrophobicContact CD1-CD1 4.46Å; L333-L337 HydrophobicContact CD1-CG 4.44Å; L333-L337 HydrophobicContact CG-CD1 4.29Å; L333-L337 WeakPolarHBondContact O-CB 3.35Å; L333-L337 VanDerWaalsContact O-CG 3.3Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 2.67Å
334	A	83.7	Confident	85.3	Confident	3 Å²	3	68.6 Å²	68.6	3%	0.025	33%	0.328	C	S	.	.	H	α-helix	trans	-62.9	-47.5	177.4	0	0	0	0	0	111.7	T231 E232 I235 Y330 R331 F336 L337 N338	T231-A334 PolarHBondContact OG1-O 2.92Å; E232-A334 HydrophobicContact CG-CB 3.84Å; I235-A334 HydrophobicContact CD1-CB 3.63Å; Y330-A334 WeakPolarHBondContact O-CB 3.34Å; Y330-A334 PolarHBondContact O-N 2.98Å; R331-A334 PolarHBondContact O-N 3.28Å; A334-F336 VanDerWaalsContact C-N 3.34Å; A334-F336 PolarHBondContact O-N 2.94Å; A334-L337 PolarHBondContact O-N 3.21Å; A334-N338 WeakPolarHBondContact O-CB 3.47Å; A334-N338 PolarHBondContact O-N 3.36Å; A334-N338 PolarHBondContact O-ND2 2.88Å
335	Q	83.7	Confident	85.8	Confident	87 Å²	87	69.3 Å²	69.3	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-42.4	177.6	-72.4	177.1	-14.7	0	0	111.7	R331 F332 N338 F339	R331-Q335 HydrophobicContact CG-CG 4.45Å; R331-Q335 WeakPolarHBondContact O-CB 3.48Å; R331-Q335 VanDerWaalsContact O-CG 3.31Å; R331-Q335 WeakPolarHBondContact O-CG 3.49Å; R331-Q335 PolarHBondContact O-N 3.12Å; F332-Q335 PolarHBondContact O-N 3.01Å; Q335-N338 PolarHBondContact O-N 3.47Å; Q335-F339 WeakPolarHBondContact O-CB 3.48Å; Q335-F339 PolarHBondContact O-N 3.16Å
336	F	88.2	Confident	86.2	Confident	78 Å²	78	70.2 Å²	70.2	34%	0.342	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.6	178.4	-95	0	0	0	112.2	Y58 F332 L333 A334 F339 S340	Y58-F336 HydrophobicContact CD1-CE2 4.3Å; F332-F336 VanDerWaalsContact O-CB 3.22Å; F332-F336 WeakPolarHBondContact O-CB 3.48Å; F332-F336 PolarHBondContact O-N 3.11Å; L333-F336 PolarHBondContact O-N 3.3Å; A334-F336 VanDerWaalsContact C-N 3.34Å; A334-F336 PolarHBondContact O-N 2.94Å; F336-F339 PolarHBondContact O-N 2.88Å; F336-S340 WeakPolarHBondContact O-CB 3.3Å; F336-S340 PolarHBondContact O-N 2.94Å; F336-S340 PolarHBondContact O-OG 3.23Å
337	L	85.2	Confident	86.7	Confident	49 Å²	49	75 Å²	75	26%	0.257	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-41.2	175.9	-71.7	173.7	0	0	0	111.6	T231 I235 L333 A334 F339 S340 L341	T231-L337 HydrophobicContact CG2-CB 3.65Å; I235-L337 HydrophobicContact CD1-CD1 4.22Å; I235-L337 HydrophobicContact CG1-CD1 4.19Å; L333-L337 HydrophobicContact CD1-CD1 4.46Å; L333-L337 HydrophobicContact CD1-CG 4.44Å; L333-L337 HydrophobicContact CG-CD1 4.29Å; L333-L337 WeakPolarHBondContact O-CB 3.35Å; L333-L337 VanDerWaalsContact O-CG 3.3Å; L333-L337 WeakPolarHBondContact O-CG 3.43Å; L333-L337 PolarHBondContact O-N 2.67Å; A334-L337 PolarHBondContact O-N 3.21Å; L337-F339 PolarHBondContact O-N 3.28Å; L337-S340 PolarHBondContact O-N 2.89Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.32Å; L337-L341 WeakPolarHBondContact O-CG 3.44Å; L337-L341 PolarHBondContact O-N 2.93Å
338	N	83.5	Confident	87.1	Confident	55 Å²	55	79.1 Å²	79.1	29%	0.294	37%	0.374	S	S	.	.	H	α-helix	trans	-60.1	-47.8	176	-79.4	-29.6	0	0	0	110.5	T231 A334 Q335 S340 L341 M342	T231-N338 VanDerWaalsContact CB-OD1 3.32Å; T231-N338 WeakPolarHBondContact CB-OD1 3.14Å; T231-N338 HydrophobicContact CG2-CB 4.46Å; T231-N338 WeakPolarHBondContact CG2-OD1 2.94Å; T231-N338 PolarHBondContact OG1-ND2 3.07Å; T231-N338 PolarHBondContact OG1-OD1 3.21Å; A334-N338 WeakPolarHBondContact O-CB 3.47Å; A334-N338 PolarHBondContact O-N 3.36Å; A334-N338 PolarHBondContact O-ND2 2.88Å; Q335-N338 PolarHBondContact O-N 3.47Å; N338-S340 VanDerWaalsContact C-N 3.35Å; N338-S340 PolarHBondContact O-N 3.29Å; N338-L341 PolarHBondContact O-N 3.25Å; N338-M342 WeakPolarHBondContact O-CB 3.38Å; N338-M342 PolarHBondContact O-N 3.48Å
339	F	87.2	Confident	87.4	Confident	68 Å²	68	78.8 Å²	78.8	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-41.7	178.7	-171.9	-107.8	0	0	0	112	L24 I28 Q335 F336 L337 M342 I343	L24-F339 HydrophobicContact CD2-CZ 3.91Å; I28-F339 HydrophobicContact CD1-CE2 4.17Å; Q335-F339 WeakPolarHBondContact O-CB 3.48Å; Q335-F339 PolarHBondContact O-N 3.16Å; F336-F339 PolarHBondContact O-N 2.88Å; L337-F339 PolarHBondContact O-N 3.28Å; F339-M342 HydrophobicContact CD2-CE 3.64Å; F339-M342 HydrophobicContact CE2-CE 3.73Å; F339-M342 PolarHBondContact O-N 3.06Å; F339-I343 HydrophobicContact CD1-CD1 3.74Å; F339-I343 HydrophobicContact CD1-CG1 4.49Å; F339-I343 HydrophobicContact CE1-CD1 3.22Å; F339-I343 HydrophobicContact CE1-CG1 4.19Å; F339-I343 HydrophobicContact CE2-CD1 4.42Å; F339-I343 HydrophobicContact CZ-CD1 3.61Å; F339-I343 HydrophobicContact CZ-CG1 4.27Å; F339-I343 WeakPolarHBondContact O-CG1 3.49Å; F339-I343 PolarHBondContact O-N 3.35Å
340	S	88.9	Confident	87.5	Confident	38 Å²	38	78.9 Å²	78.9	27%	0.266	38%	0.376	S	S	.	.	H	α-helix	trans	-65.4	-40.2	177.8	-59.8	0	0	0	0	112.5	F336 L337 N338 S344	F336-S340 WeakPolarHBondContact O-CB 3.3Å; F336-S340 PolarHBondContact O-N 2.94Å; F336-S340 PolarHBondContact O-OG 3.23Å; L337-S340 PolarHBondContact O-N 2.89Å; N338-S340 VanDerWaalsContact C-N 3.35Å; N338-S340 PolarHBondContact O-N 3.29Å; S340-S344 WeakPolarHBondContact O-CB 3.39Å; S340-S344 PolarHBondContact O-N 3.23Å; S340-S344 PolarHBondContact O-OG 2.76Å
341	L	86.1	Confident	87.9	Confident	82 Å²	82	82.2 Å²	82.2	43%	0.429	39%	0.388	S	S	.	.	H	α-helix	trans	-65.4	-41.8	174.3	-75.3	170.7	0	0	0	111.2	F230 T231 L337 N338 S344 F345	F230-L341 HydrophobicContact CD1-CD1 3.93Å; F230-L341 HydrophobicContact CE1-CD1 3.9Å; T231-L341 HydrophobicContact CG2-CD1 3.61Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.32Å; L337-L341 WeakPolarHBondContact O-CG 3.44Å; L337-L341 PolarHBondContact O-N 2.93Å; N338-L341 PolarHBondContact O-N 3.25Å; L341-S344 PolarHBondContact O-N 2.92Å; L341-F345 WeakPolarHBondContact O-CB 3.35Å; L341-F345 PolarHBondContact O-N 3.3Å
342	M	88.2	Confident	88.3	Confident	86 Å²	86	82.1 Å²	82.1	42%	0.424	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-46.4	176.3	-174.2	-177.9	71.1	0	0	111.6	N338 F339 F345 L346	N338-M342 WeakPolarHBondContact O-CB 3.38Å; N338-M342 PolarHBondContact O-N 3.48Å; F339-M342 HydrophobicContact CD2-CE 3.64Å; F339-M342 HydrophobicContact CE2-CE 3.73Å; F339-M342 PolarHBondContact O-N 3.06Å; M342-F345 PolarHBondContact O-N 3.48Å; M342-L346 HydrophobicContact CG-CD1 4.35Å; M342-L346 WeakPolarHBondContact O-CG 3.37Å; M342-L346 PolarHBondContact O-N 3.21Å
343	I	91.7	Very high	88.5	Confident	74 Å²	74	83.2 Å²	83.2	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-61.6	-45.9	175.5	-71.3	177.3	0	0	0	111	F339 F345 L346 W347	F339-I343 HydrophobicContact CD1-CD1 3.74Å; F339-I343 HydrophobicContact CD1-CG1 4.49Å; F339-I343 HydrophobicContact CE1-CD1 3.22Å; F339-I343 HydrophobicContact CE1-CG1 4.19Å; F339-I343 HydrophobicContact CE2-CD1 4.42Å; F339-I343 HydrophobicContact CZ-CD1 3.61Å; F339-I343 HydrophobicContact CZ-CG1 4.27Å; F339-I343 WeakPolarHBondContact O-CG1 3.49Å; F339-I343 PolarHBondContact O-N 3.35Å; I343-F345 VanDerWaalsContact C-N 3.28Å; I343-F345 PolarHBondContact O-N 2.95Å; I343-L346 PolarHBondContact O-N 3.34Å; I343-W347 WeakPolarHBondContact O-CB 3.39Å; I343-W347 PolarHBondContact O-N 2.86Å
344	S	89.8	Confident	88.8	Confident	71 Å²	71	85.8 Å²	85.8	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-59.7	-41.2	179.1	-59.5	0	0	0	0	111.5	S340 L341 W347 F348	S340-S344 WeakPolarHBondContact O-CB 3.39Å; S340-S344 PolarHBondContact O-N 3.23Å; S340-S344 PolarHBondContact O-OG 2.76Å; L341-S344 PolarHBondContact O-N 2.92Å; S344-W347 PolarHBondContact O-N 3.4Å; S344-F348 WeakPolarHBondContact O-CB 3.32Å; S344-F348 PolarHBondContact O-N 3.39Å
345	F	90.4	Very high	88.8	Confident	132 Å²	132	91.3 Å²	91.3	58%	0.579	46%	0.459	S	S	*	.	H	α-helix	trans	-65.3	-46.6	175.9	179.2	-103.6	0	0	0	112.2	L341 M342 I343 W347 F348 V349	L341-F345 WeakPolarHBondContact O-CB 3.35Å; L341-F345 PolarHBondContact O-N 3.3Å; M342-F345 PolarHBondContact O-N 3.48Å; I343-F345 VanDerWaalsContact C-N 3.28Å; I343-F345 PolarHBondContact O-N 2.95Å; F345-W347 VanDerWaalsContact C-N 3.3Å; F345-W347 PolarHBondContact O-N 3.45Å; F345-F348 PolarHBondContact O-N 2.89Å; F345-V349 HydrophobicContact CD1-CG2 4.34Å; F345-V349 HydrophobicContact CD2-CG2 4.49Å; F345-V349 HydrophobicContact CE1-CG2 3.91Å; F345-V349 HydrophobicContact CE2-CG2 4.08Å; F345-V349 HydrophobicContact CZ-CG2 3.77Å; F345-V349 WeakPolarHBondContact O-CG2 3.42Å; F345-V349 PolarHBondContact O-N 3.35Å
346	L	91.5	Very high	89	Confident	104 Å²	104	91.5 Å²	91.5	55%	0.545	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-39.2	176.7	-69.9	173.6	0	0	0	111.9	M342 I343 H350	M342-L346 HydrophobicContact CG-CD1 4.35Å; M342-L346 WeakPolarHBondContact O-CG 3.37Å; M342-L346 PolarHBondContact O-N 3.21Å; I343-L346 PolarHBondContact O-N 3.34Å; L346-H350 WeakPolarHBondContact O-CB 3.39Å; L346-H350 PolarHBondContact O-N 2.89Å
347	W	93.1	Very high	89.1	Confident	178 Å²	178	92.2 Å²	92.2	67%	0.674	47%	0.468	S	S	*	.	H	α-helix	trans	-66.6	-41.5	175.9	-169.8	78.7	0	0	0	111.9	I343 S344 F345 H350 Y351	I343-W347 WeakPolarHBondContact O-CB 3.39Å; I343-W347 PolarHBondContact O-N 2.86Å; S344-W347 PolarHBondContact O-N 3.4Å; F345-W347 VanDerWaalsContact C-N 3.3Å; F345-W347 PolarHBondContact O-N 3.45Å; W347-H350 PolarHBondContact O-N 2.93Å; W347-Y351 WeakPolarHBondContact O-CB 3.39Å; W347-Y351 PolarHBondContact O-N 3.26Å
348	F	90.9	Very high	89.3	Confident	120 Å²	120	94.6 Å²	94.6	53%	0.526	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-47.1	174.4	177.9	-103.2	0	0	0	112.1	S344 F345 H350 Y351 I352	S344-F348 WeakPolarHBondContact O-CB 3.32Å; S344-F348 PolarHBondContact O-N 3.39Å; F345-F348 PolarHBondContact O-N 2.89Å; F348-H350 VanDerWaalsContact C-N 3.32Å; F348-H350 PolarHBondContact O-N 3.03Å; F348-Y351 WeakPolarHBondContact O-CB 3.47Å; F348-Y351 PolarHBondContact O-N 3Å; F348-I352 HydrophobicContact CD1-CG1 4.48Å; F348-I352 HydrophobicContact CE1-CG1 4.09Å; F348-I352 HydrophobicContact CE2-CD1 4.26Å; F348-I352 HydrophobicContact CE2-CG1 4.2Å; F348-I352 HydrophobicContact CZ-CD1 4.1Å; F348-I352 HydrophobicContact CZ-CG1 3.94Å; F348-I352 WeakPolarHBondContact O-CG1 3.47Å; F348-I352 PolarHBondContact O-N 3.03Å
349	V	90.2	Very high	89.6	Confident	53 Å²	53	96.9 Å²	96.9	32%	0.321	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-43.1	175.7	171.4	0	0	0	0	110.9	F345 Y351 I352 I353	F345-V349 HydrophobicContact CD1-CG2 4.34Å; F345-V349 HydrophobicContact CD2-CG2 4.49Å; F345-V349 HydrophobicContact CE1-CG2 3.91Å; F345-V349 HydrophobicContact CE2-CG2 4.08Å; F345-V349 HydrophobicContact CZ-CG2 3.77Å; F345-V349 WeakPolarHBondContact O-CG2 3.42Å; F345-V349 PolarHBondContact O-N 3.35Å; V349-Y351 PolarHBondContact O-N 3.18Å; V349-I352 PolarHBondContact O-N 3.41Å; V349-I353 HydrophobicContact CG1-CD1 3.7Å; V349-I353 HydrophobicContact CG1-CG1 4.46Å; V349-I353 VanDerWaalsContact O-CG1 3.3Å; V349-I353 WeakPolarHBondContact O-CG1 3.3Å; V349-I353 PolarHBondContact O-N 3.43Å
350	H	88.4	Confident	89.8	Confident	89 Å²	89	98.8 Å²	98.8	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-47.1	175.7	-176.9	63	0	0	0	111.8	L346 W347 F348 I352 I353 T354	L346-H350 WeakPolarHBondContact O-CB 3.39Å; L346-H350 PolarHBondContact O-N 2.89Å; W347-H350 PolarHBondContact O-N 2.93Å; F348-H350 VanDerWaalsContact C-N 3.32Å; F348-H350 PolarHBondContact O-N 3.03Å; H350-I352 VanDerWaalsContact C-N 3.33Å; H350-I352 PolarHBondContact O-N 3.36Å; H350-I353 PolarHBondContact O-N 3.48Å; H350-T354 VanDerWaalsContact CE1-CG2 3.47Å; H350-T354 WeakPolarHBondContact CE1-CG2 3.37Å; H350-T354 WeakPolarHBondContact O-CG2 3.48Å; H350-T354 PolarHBondContact O-N 3.01Å; H350-T354 PolarHBondContact O-OG1 3.23Å
351	Y	90.9	Very high	89.9	Confident	126 Å²	126	102.8 Å²	102.8	49%	0.494	52%	0.518	S	S	.	.	H	α-helix	trans	-57.6	-44.6	178.4	177.2	-96.2	0	0	0	112.1	W347 F348 V349 T354 S355	W347-Y351 WeakPolarHBondContact O-CB 3.39Å; W347-Y351 PolarHBondContact O-N 3.26Å; F348-Y351 WeakPolarHBondContact O-CB 3.47Å; F348-Y351 PolarHBondContact O-N 3Å; V349-Y351 PolarHBondContact O-N 3.18Å; Y351-T354 PolarHBondContact O-N 3.02Å; Y351-T354 PolarHBondContact O-OG1 3.36Å; Y351-S355 WeakPolarHBondContact O-CB 3.37Å; Y351-S355 PolarHBondContact O-N 3.28Å; Y351-S355 PolarHBondContact O-OG 2.71Å
352	I	90.9	Very high	90.1	Very high	94 Å²	94	104.3 Å²	104.3	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-37.2	177.4	-65.1	-65.9	0	0	0	112.1	F348 V349 H350 T354	F348-I352 HydrophobicContact CD1-CG1 4.48Å; F348-I352 HydrophobicContact CE1-CG1 4.09Å; F348-I352 HydrophobicContact CE2-CD1 4.26Å; F348-I352 HydrophobicContact CE2-CG1 4.2Å; F348-I352 HydrophobicContact CZ-CD1 4.1Å; F348-I352 HydrophobicContact CZ-CG1 3.94Å; F348-I352 WeakPolarHBondContact O-CG1 3.47Å; F348-I352 PolarHBondContact O-N 3.03Å; V349-I352 PolarHBondContact O-N 3.41Å; H350-I352 VanDerWaalsContact C-N 3.33Å; H350-I352 PolarHBondContact O-N 3.36Å; I352-T354 VanDerWaalsContact C-N 3.35Å
353	I	91.1	Very high	90.3	Very high	130 Å²	130	105.7 Å²	105.7	67%	0.667	53%	0.533	S	S	*	.	H	α-helix	trans	-72.8	-29.6	178.8	-67.9	168.1	0	0	0	111.9	V349 H350	V349-I353 HydrophobicContact CG1-CD1 3.7Å; V349-I353 HydrophobicContact CG1-CG1 4.46Å; V349-I353 VanDerWaalsContact O-CG1 3.3Å; V349-I353 WeakPolarHBondContact O-CG1 3.3Å; V349-I353 PolarHBondContact O-N 3.43Å; H350-I353 PolarHBondContact O-N 3.48Å
354	T	90.7	Very high	90.2	Very high	84 Å²	84	108.3 Å²	108.3	52%	0.515	55%	0.545	S	S	.	.	H	α-helix	trans	-94.3	-9.5	-178.3	57.6	0	0	0	0	115	H350 Y351 I352	H350-T354 VanDerWaalsContact CE1-CG2 3.47Å; H350-T354 WeakPolarHBondContact CE1-CG2 3.37Å; H350-T354 WeakPolarHBondContact O-CG2 3.48Å; H350-T354 PolarHBondContact O-N 3.01Å; H350-T354 PolarHBondContact O-OG1 3.23Å; Y351-T354 PolarHBondContact O-N 3.02Å; Y351-T354 PolarHBondContact O-OG1 3.36Å; I352-T354 VanDerWaalsContact C-N 3.35Å
355	S	83.9	Confident	90.2	Very high	119 Å²	119	111.7 Å²	111.7	83%	0.832	55%	0.55	S	S	*	.			trans	-92.6	0	173.3	-54.7	0	0	0	0	109.6	Y351	Y351-S355 WeakPolarHBondContact O-CB 3.37Å; Y351-S355 PolarHBondContact O-N 3.28Å; Y351-S355 PolarHBondContact O-OG 2.71Å

Retrieved 355 of 355 residues in 88.9 ms (Link to these results)

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